*HEADER    OXIDOREDUCTASE                          05-DEC-03   1RQM              
*TITLE     SOLUTION STRUCTURE OF THE K18G/R82E ALICYCLOBACILLUS                  
*TITLE    2 ACIDOCALDARIUS THIOREDOXIN MUTANT                                    
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: THIOREDOXIN;                                               
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 SYNONYM: TRX;                                                        
*COMPND   5 ENGINEERED: YES;                                                     
*COMPND   6 MUTATION: YES                                                        
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: ALICYCLOBACILLUS ACIDOCALDARIUS;                
*SOURCE   3 ORGANISM_COMMON: BACTERIA;                                           
*SOURCE   4 GENE: TRXA;                                                          
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   7 EXPRESSION_SYSTEM_STRAIN: JM101;                                     
*SOURCE   8 EXPRESSION_SYSTEM_PLASMID: PTRC99A                                   
*KEYWDS    THIOREDOXIN FOLD, REDOX-ACTIVE CENTER                                 
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    M.LEONE, P.DI LELLO, O.OHLENSCHLAGER, E.M.PEDONE,                     
*AUTHOR   2 S.BARTOLUCCI, M.ROSSI, B.DI BLASIO, C.PEDONE, M.SAVIANO,             
*AUTHOR   3 C.ISERNIA, R.FATTORUSSO                                              
*THE AUTHOR HAD MANY PSUEDO Q ATOMS IN THE STRUCTURE WHICH ARE ROUTINLY REMOVED FROM 
*THE PDB FILE DURING PROCESSING. HOWEVER CONSTRAINTS FILE PROVIDED BY THE AUTHOR HAD
*MANY PSUEDO Q ATOMS AND ARE LEFT IN THE CONSTRAINTS FILE.
*REVDAT   1   22-JUN-04 1RQM    0                                                


  1 ALA  QB     50 VAL  QQG     9.12                
  1 ALA  QB     52 VAL  HN      6.53                
  2 THR  HN      2 THR  HB      4.17                
  2 THR  HA      3 MET  HN      3.11                
  2 THR  QG2     3 MET  HN      5.91                
  2 THR  QG2     5 LEU  QQD     9.13                
  3 MET  HN      3 MET  HA      2.90                
  3 MET  HN      3 MET  QB      3.83                
  3 MET  HN      3 MET  HG2     5.50                
  3 MET  HN      3 MET  HG3     5.50                
  3 MET  HN      3 MET  QG      5.07                
  3 MET  HN     52 VAL  HN      5.50                
  3 MET  HN     53 ALA  HA      3.67                
  3 MET  HN     53 ALA  QB      5.97                
  3 MET  HA      4 THR  HN      3.08                
  3 MET  QB     53 ALA  HA      6.38                
  3 MET  HG2     4 THR  HN      5.50                
  3 MET  HG3     4 THR  HN      5.50                
  3 MET  QG      4 THR  HN      5.01                
  4 THR  HN      4 THR  HB      2.90                
  4 THR  HN      4 THR  QG2     4.88                
  4 THR  HN      5 LEU  QQD     8.10                
  4 THR  HN     53 ALA  QB      6.53                
  4 THR  HA      4 THR  HB      2.96                
  4 THR  HA      4 THR  QG2     3.55                
  4 THR  HA      5 LEU  HN      2.74                
  4 THR  HA     54 LYS+ HN      3.52                
  4 THR  HB      5 LEU  HN      5.50                
  4 THR  QG2     5 LEU  HN      4.57                
  4 THR  QG2     5 LEU  HA      6.12                
  4 THR  QG2    55 LEU  HA      6.53                
  5 LEU  HN      5 LEU  QB      3.56                
  5 LEU  HN      5 LEU  HG      5.50                
  5 LEU  HN      5 LEU  QD1     6.40                
  5 LEU  HN      5 LEU  QD2     6.40                
  5 LEU  HN      5 LEU  QQD     5.79                
  5 LEU  HN     53 ALA  QB      5.72                
  5 LEU  HN     54 LYS+ HN      4.04                
  5 LEU  HA      5 LEU  HG      4.07                
  5 LEU  HA      5 LEU  QD1     5.07                
  5 LEU  HA      5 LEU  QD2     5.07                
  5 LEU  HA      5 LEU  QQD     4.03                
  5 LEU  HA      6 THR  HN      2.43                
  5 LEU  HB2     6 THR  HN      4.72                
  5 LEU  HB3     6 THR  HN      4.72                
  5 LEU  QB      6 THR  HN      4.21                
  5 LEU  QD1     6 THR  HN      6.53                
  5 LEU  QD1    10 PHE  QD      6.79                
  5 LEU  QD1    13 ALA  QB      6.19                
  5 LEU  QD1    53 ALA  HA      6.53                
  5 LEU  QD1    53 ALA  QB      6.19                
  5 LEU  QD1    60 ASN  HB2     9.67                
  5 LEU  QD1    60 ASN  HB3     9.67                
  5 LEU  QD2     6 THR  HN      6.53                
  5 LEU  QD2    10 PHE  QD      6.79                
  5 LEU  QD2    13 ALA  QB      6.19                
  5 LEU  QD2    53 ALA  HA      6.53                
  5 LEU  QD2    53 ALA  QB      6.19                
  5 LEU  QD2    60 ASN  HB2     9.67                
  5 LEU  QD2    60 ASN  HB3     9.67                
  5 LEU  QQD     6 THR  HN      5.41                
  5 LEU  QQD     7 ASP- HN      8.10                
  5 LEU  QQD     9 ASN  HN      8.10                
  5 LEU  QQD     9 ASN  QB      8.98                
  5 LEU  QQD    10 PHE  HN      8.10                
  5 LEU  QQD    10 PHE  QD      6.54                
  5 LEU  QQD    10 PHE  QE      8.89                
  5 LEU  QQD    11 GLN  HN      8.10                
  5 LEU  QQD    13 ALA  HA      8.04                
  5 LEU  QQD    13 ALA  QB      5.34                
  5 LEU  QQD    14 ILE  QG2     9.13                
  5 LEU  QQD    22 VAL  QQG    10.38                
  5 LEU  QQD    53 ALA  HA      6.27                
  5 LEU  QQD    54 LYS+ HN      8.10                
  5 LEU  QQD    55 LEU  QQD    10.70                
  5 LEU  QQD    60 ASN  QB      8.05                
  6 THR  HN      7 ASP- HN      3.79                
  6 THR  HN      8 ALA  QB      6.53                
  6 THR  HN      9 ASN  HN      4.54                
  6 THR  HN     10 PHE  HN      4.85                
  6 THR  HN     10 PHE  QB      6.38                
  6 THR  HA      9 ASN  HN      5.31                
  6 THR  QG2     8 ALA  HN      6.53                
  7 ASP- HN      7 ASP- QB      3.46                
  7 ASP- HN      8 ALA  HN      3.17                
  7 ASP- HN      8 ALA  QB      6.53                
  7 ASP- HN     55 LEU  QB      6.32                
  7 ASP- HA     10 PHE  HN      3.61                
  7 ASP- HA     10 PHE  HB2     3.42                
  7 ASP- HA     10 PHE  HB3     3.42                
  7 ASP- HA     10 PHE  QB      3.20                
  7 ASP- HB2    61 PRO  HD2     7.25                
  7 ASP- HB2    61 PRO  HD3     7.25                
  7 ASP- HB3    61 PRO  HD2     7.25                
  7 ASP- HB3    61 PRO  HD3     7.25                
  7 ASP- QB      8 ALA  HN      4.46                
  7 ASP- QB     10 PHE  HN      5.95                
  7 ASP- QB     60 ASN  HA      6.38                
  7 ASP- QB     61 PRO  QD      6.32                
  7 ASP- QB     62 GLU- QB      5.48                
  8 ALA  HN      8 ALA  HA      2.86                
  8 ALA  HN      9 ASN  HN      2.83                
  8 ALA  HA      9 ASN  HN      3.48                
  8 ALA  HA     11 GLN  QB      4.49                
  8 ALA  QB      9 ASN  HN      4.23                
  8 ALA  QB     10 PHE  HN      6.53                
  9 ASN  HN      9 ASN  HB2     3.48                
  9 ASN  HN      9 ASN  HB3     3.48                
  9 ASN  HN     10 PHE  HN      2.40                
  9 ASN  HN     10 PHE  HA      5.07                
  9 ASN  HN     10 PHE  QB      5.51                
  9 ASN  HN     11 GLN  HN      5.50                
  9 ASN  HA      9 ASN  HB2     2.93                
  9 ASN  HA      9 ASN  HB3     2.93                
  9 ASN  HA      9 ASN  QB      2.65                
  9 ASN  HA     12 GLN  HN      4.54                
  9 ASN  HA     12 GLN  QB      5.42                
  9 ASN  QB     13 ALA  HN      5.57                
 10 PHE  HN     10 PHE  HB2     2.96                
 10 PHE  HN     10 PHE  HB3     2.96                
 10 PHE  HN     10 PHE  QB      2.76                
 10 PHE  HN     11 GLN  HN      3.48                
 10 PHE  HN     12 GLN  HN      4.35                
 10 PHE  HN     13 ALA  QB      6.53                
 10 PHE  HA     13 ALA  HN      5.16                
 10 PHE  HA     13 ALA  QB      5.75                
 10 PHE  HA     14 ILE  HN      4.51                
 10 PHE  HB2    11 GLN  HN      4.79                
 10 PHE  HB3    11 GLN  HN      4.79                
 10 PHE  QB     11 GLN  HN      4.23                
 10 PHE  QB     14 ILE  QD1     7.41                
 10 PHE  QD     11 GLN  HN      7.56                
 10 PHE  QD     11 GLN  HA      7.25                
 10 PHE  QD     14 ILE  QG2     8.65                
 10 PHE  QD     14 ILE  QD1     7.41                
 10 PHE  QD     55 LEU  QQD    10.22                
 10 PHE  QD     69 ILE  QG2     8.65                
 10 PHE  QE     11 GLN  HA      7.62                
 10 PHE  QE     14 ILE  QG2     8.65                
 10 PHE  QE     14 ILE  QD1     7.44                
 10 PHE  QE     53 ALA  QB      8.65                
 10 PHE  QE     55 LEU  QQD    10.22                
 10 PHE  QE     62 GLU- QB      8.50                
 10 PHE  QE     76 ILE  QG1     8.50                
 10 PHE  QE     78 PHE  QE      9.00                
 10 PHE  QE     78 PHE  HZ      7.62                
 10 PHE  HZ     78 PHE  QE      7.31                
 10 PHE  HZ     78 PHE  HZ      4.97                
 11 GLN  HN     11 GLN  QB      3.90                
 11 GLN  HN     11 GLN  QG      5.29                
 11 GLN  HN     12 GLN  HN      4.14                
 11 GLN  HA     14 ILE  HN      4.17                
 11 GLN  HA     14 ILE  HB      4.66                
 11 GLN  HA     14 ILE  QG2     6.53                
 11 GLN  HA     14 ILE  QD1     4.39                
 11 GLN  HA     15 GLN  HN      5.50                
 11 GLN  QG     12 GLN  HN      6.38                
 11 GLN  QG     13 ALA  HN      6.38                
 11 GLN  QG     63 THR  HB      6.38                
 12 GLN  HN     12 GLN  QB      3.74                
 12 GLN  HN     12 GLN  QG      6.16                
 12 GLN  HN     13 ALA  HN      3.08                
 12 GLN  HN     13 ALA  QB      6.53                
 12 GLN  HN     14 ILE  HN      5.10                
 12 GLN  HA     15 GLN  QB      4.15                
 12 GLN  QB     13 ALA  HN      4.08                
 12 GLN  QG     13 ALA  HN      6.38                
 13 ALA  HN     13 ALA  HA      2.80                
 13 ALA  HN     14 ILE  HN      2.96                
 13 ALA  HN     14 ILE  QG2     6.53                
 13 ALA  HN     15 GLN  HN      5.13                
 13 ALA  QB     20 VAL  QG1     7.37                
 13 ALA  QB     20 VAL  QG2     7.37                
 13 ALA  QB     20 VAL  QQG     6.52                
 14 ILE  HN     14 ILE  HB      3.89                
 14 ILE  HN     14 ILE  QG2     4.73                
 14 ILE  HN     14 ILE  QG1     5.82                
 14 ILE  HN     14 ILE  QD1     5.60                
 14 ILE  HN     15 GLN  HN      3.42                
 14 ILE  HA     14 ILE  HB      2.86                
 14 ILE  HA     15 GLN  HN      3.39                
 14 ILE  HA     20 VAL  HN      5.50                
 14 ILE  HA     20 VAL  QQG     5.76                
 14 ILE  HB     15 GLN  HN      5.41                
 14 ILE  HB     78 PHE  HB2     5.50                
 14 ILE  HB     78 PHE  HB3     5.50                
 14 ILE  HB     78 PHE  QB      4.88                
 14 ILE  HB     81 GLY  QA      5.57                
 14 ILE  QG2    15 GLN  HN      6.53                
 14 ILE  QG2    20 VAL  HB      6.37                
 14 ILE  QG2    20 VAL  QQG     9.12                
 14 ILE  QG2    22 VAL  QQG     9.12                
 14 ILE  QG1    15 GLN  HN      6.38                
 14 ILE  QD1    15 GLN  HN      6.53                
 14 ILE  QD1    81 GLY  HA1     6.53                
 14 ILE  QD1    81 GLY  HA2     6.53                
 14 ILE  QD1    82 GLU- HN      6.53                
 15 GLN  HN     16 GLY  HN      3.33                
 15 GLN  HA     15 GLN  HB2     2.83                
 15 GLN  HA     15 GLN  HB3     2.83                
 15 GLN  HA     15 GLN  QB      2.57                
 15 GLN  HB2    16 GLY  HN      4.66                
 15 GLN  HB3    16 GLY  HN      4.66                
 16 GLY  HN     17 ASP- HN      4.54                
 16 GLY  HN     20 VAL  QQG     8.09                
 16 GLY  HA1    17 ASP- HN      3.02                
 16 GLY  HA2    17 ASP- HN      3.02                
 16 GLY  QA     18 GLY  HN      5.70                
 17 ASP- HN     17 ASP- QB      3.60                
 17 ASP- HN     18 GLY  HN      3.24                
 17 ASP- HB2    80 GLY  HA1     7.25                
 17 ASP- HB2    80 GLY  HA2     7.25                
 17 ASP- HB3    80 GLY  HA1     7.25                
 17 ASP- HB3    80 GLY  HA2     7.25                
 17 ASP- QB     80 GLY  QA      6.32                
 19 PRO  HA     20 VAL  HN      2.40                
 19 PRO  HA     79 LYS+ HB2     5.50                
 19 PRO  HA     79 LYS+ HB3     5.50                
 19 PRO  HA     79 LYS+ QB      5.25                
 19 PRO  HA    103 VAL  QQG     8.09                
 19 PRO  HB2    77 LEU  QQD     7.01                
 19 PRO  HB2   104 LEU  QD1     7.13                
 19 PRO  HB2   104 LEU  QD2     7.13                
 19 PRO  HB3    77 LEU  QQD     7.01                
 19 PRO  HB3   104 LEU  QD1     7.13                
 19 PRO  HB3   104 LEU  QD2     7.13                
 19 PRO  QB     77 LEU  QQD     6.59                
 19 PRO  QB    103 VAL  QQG     8.50                
 19 PRO  QB    104 LEU  QQD     6.04                
 20 VAL  HN     20 VAL  HB      2.86                
 20 VAL  HN     20 VAL  QQG     4.10                
 20 VAL  HN     78 PHE  HN      3.45                
 20 VAL  HA     21 LEU  HN      2.52                
 20 VAL  HA     51 THR  HN      4.88                
 20 VAL  HB     21 LEU  HN      5.50                
 20 VAL  HB     51 THR  QG2     5.60                
 20 VAL  HB     78 PHE  QB      4.36                
 20 VAL  HB     79 LYS+ QE      6.38                
 20 VAL  QG1    21 LEU  HN      4.76                
 20 VAL  QG1    51 THR  HN      6.53                
 20 VAL  QG2    21 LEU  HN      4.76                
 20 VAL  QG2    51 THR  HN      6.53                
 20 VAL  QQG    21 LEU  HN      4.38                
 20 VAL  QQG    21 LEU  HA      8.09                
 20 VAL  QQG    22 VAL  HN      6.88                
 20 VAL  QQG    51 THR  HN      5.40                
 20 VAL  QQG    51 THR  HA      7.53                
 20 VAL  QQG    51 THR  QG2     9.12                
 20 VAL  QQG    53 ALA  HN      7.28                
 20 VAL  QQG    53 ALA  QB      8.09                
 20 VAL  QQG    55 LEU  QQD    10.69                
 20 VAL  QQG    78 PHE  QD      9.99                
 20 VAL  QQG    79 LYS+ HA      8.09                
 21 LEU  HN     51 THR  HN      4.91                
 21 LEU  HN     52 VAL  HA      3.27                
 21 LEU  HN     52 VAL  QQG     8.09                
 21 LEU  HA     22 VAL  HN      2.40                
 21 LEU  HA     22 VAL  QQG     8.09                
 21 LEU  HA     76 ILE  HN      4.57                
 21 LEU  HA     77 LEU  HA      3.05                
 21 LEU  HA     77 LEU  QQD     6.83                
 21 LEU  HA     78 PHE  HN      4.32                
 21 LEU  QB     22 VAL  HN      6.38                
 21 LEU  QD1    42 PHE  QD      7.75                
 21 LEU  QD1    42 PHE  QE      7.29                
 21 LEU  QD1   104 LEU  QD1     9.89                
 21 LEU  QD1   104 LEU  QD2     9.89                
 21 LEU  QD2    42 PHE  QD      7.75                
 21 LEU  QD2    42 PHE  QE      7.29                
 21 LEU  QD2   104 LEU  QD1     9.89                
 21 LEU  QD2   104 LEU  QD2     9.89                
 21 LEU  QQD    39 LEU  QQD     9.73                
 21 LEU  QQD    42 PHE  QD      7.46                
 21 LEU  QQD    42 PHE  QE      6.63                
 21 LEU  QQD    75 LEU  HA      7.01                
 21 LEU  QQD    75 LEU  QQD     9.67                
 21 LEU  QQD    77 LEU  HA      7.42                
 21 LEU  QQD    77 LEU  QB      6.93                
 21 LEU  QQD   103 VAL  QQG     9.79                
 21 LEU  QQD   104 LEU  QQD     8.15                
 22 VAL  HN     22 VAL  HB      2.83                
 22 VAL  HN     22 VAL  QQG     3.99                
 22 VAL  HN     75 LEU  HA      4.26                
 22 VAL  HN     76 ILE  HN      3.05                
 22 VAL  HN     76 ILE  QG2     6.53                
 22 VAL  HN     78 PHE  HN      5.50                
 22 VAL  HN     78 PHE  QD      7.62                
 22 VAL  HA     23 ASP- HN      2.40                
 22 VAL  HA     53 ALA  HN      3.39                
 22 VAL  HA     54 LYS+ HA      5.47                
 22 VAL  HB     76 ILE  HN      4.97                
 22 VAL  HB     76 ILE  HB      3.79                
 22 VAL  QG1    24 PHE  QE      7.84                
 22 VAL  QG2    24 PHE  QE      7.84                
 22 VAL  QQG    23 ASP- HN      5.98                
 22 VAL  QQG    24 PHE  HN      8.09                
 22 VAL  QQG    24 PHE  HA      8.09                
 22 VAL  QQG    24 PHE  QD     10.02                
 22 VAL  QQG    24 PHE  QE      7.61                
 22 VAL  QQG    24 PHE  HZ      5.42                
 22 VAL  QQG    53 ALA  HN      8.09                
 22 VAL  QQG    53 ALA  QB      9.12                
 22 VAL  QQG    55 LEU  HN      7.34                
 22 VAL  QQG    55 LEU  QQD    10.69                
 22 VAL  QQG    57 VAL  QG2     8.84                
 22 VAL  QQG    75 LEU  HA      8.09                
 22 VAL  QQG    76 ILE  HN      8.09                
 22 VAL  QQG    78 PHE  QE      9.93                
 23 ASP- HN     23 ASP- HB2     3.02                
 23 ASP- HN     23 ASP- HB3     3.02                
 23 ASP- HN     23 ASP- QB      2.73                
 23 ASP- HN     25 TRP  HD1     5.50                
 23 ASP- HN     53 ALA  HN      3.33                
 23 ASP- HN     54 LYS+ HA      2.46                
 23 ASP- HN     55 LEU  QB      6.38                
 23 ASP- HA     24 PHE  HN      3.52                
 23 ASP- HA     75 LEU  HA      3.21                
 23 ASP- HB2    54 LYS+ HA      4.26                
 23 ASP- HB2    55 LEU  HN      4.60                
 23 ASP- HB3    54 LYS+ HA      4.26                
 23 ASP- HB3    55 LEU  HN      4.60                
 23 ASP- QB     54 LYS+ HA      4.04                
 23 ASP- QB     55 LEU  HN      4.44                
 24 PHE  HN     24 PHE  HB2     3.67                
 24 PHE  HN     24 PHE  HB3     3.67                
 24 PHE  HN     24 PHE  QB      3.26                
 24 PHE  HN     74 THR  HN      4.42                
 24 PHE  HN     74 THR  QG2     6.28                
 24 PHE  HN     75 LEU  HA      4.20                
 24 PHE  HA     54 LYS+ HA      5.50                
 24 PHE  HA     55 LEU  HN      3.67                
 24 PHE  HA     57 VAL  HN      4.60                
 24 PHE  HA     57 VAL  QG2     5.26                
 24 PHE  HB2    25 TRP  HN      4.35                
 24 PHE  HB2    57 VAL  QG1     6.53                
 24 PHE  HB2    57 VAL  QG2     5.13                
 24 PHE  HB2    69 ILE  QD1     6.53                
 24 PHE  HB2    72 ILE  QG2     6.50                
 24 PHE  HB2    74 THR  HN      4.54                
 24 PHE  HB2    74 THR  QG2     6.53                
 24 PHE  HB3    25 TRP  HN      4.35                
 24 PHE  HB3    57 VAL  QG1     6.53                
 24 PHE  HB3    57 VAL  QG2     5.13                
 24 PHE  HB3    69 ILE  QD1     6.53                
 24 PHE  HB3    72 ILE  QG2     6.50                
 24 PHE  HB3    74 THR  HN      4.54                
 24 PHE  HB3    74 THR  QG2     6.53                
 24 PHE  QB     25 TRP  HN      3.90                
 24 PHE  QB     57 VAL  QG2     4.62                
 24 PHE  QB     69 ILE  QG2     6.45                
 24 PHE  QB     72 ILE  QG2     6.35                
 24 PHE  QB     73 PRO  HA      6.38                
 24 PHE  QB     74 THR  HN      4.22                
 24 PHE  QB     74 THR  HB      5.64                
 24 PHE  QB     74 THR  QG2     6.14                
 24 PHE  QD     25 TRP  HA      7.59                
 24 PHE  QD     57 VAL  QG1     6.94                
 24 PHE  QD     57 VAL  QG2     6.26                
 24 PHE  QD     64 THR  HA      7.53                
 24 PHE  QD     64 THR  QG2     7.32                
 24 PHE  QD     69 ILE  QG2     6.70                
 24 PHE  QD     69 ILE  QG1     8.50                
 24 PHE  QD     69 ILE  QD1     7.75                
 24 PHE  QD     72 ILE  HA      7.62                
 24 PHE  QD     74 THR  HN      7.62                
 24 PHE  QD     74 THR  QG2     7.81                
 24 PHE  QD     75 LEU  HA      7.62                
 24 PHE  QD     76 ILE  HN      7.62                
 24 PHE  QE     57 VAL  QG2     8.40                
 24 PHE  QE     64 THR  HA      7.16                
 24 PHE  QE     64 THR  QG2     8.65                
 24 PHE  QE     69 ILE  QD1     8.65                
 24 PHE  QE     74 THR  QG2     8.65                
 24 PHE  QE     75 LEU  HN      7.62                
 24 PHE  QE     76 ILE  HN      7.62                
 24 PHE  HZ     57 VAL  QG2     5.04                
 24 PHE  HZ     64 THR  HA      5.47                
 24 PHE  HZ     69 ILE  QG2     6.53                
 24 PHE  HZ     69 ILE  QD1     6.53                
 25 TRP  HN     25 TRP  HB2     4.07                
 25 TRP  HN     25 TRP  HB3     4.07                
 25 TRP  HN     25 TRP  QB      3.88                
 25 TRP  HN     25 TRP  HD1     2.99                
 25 TRP  HN     55 LEU  HN      4.32                
 25 TRP  HN     56 ASN  HA      3.33                
 25 TRP  HN     57 VAL  HN      3.36                
 25 TRP  HN     57 VAL  QG1     6.53                
 25 TRP  HN     57 VAL  QG2     5.88                
 25 TRP  HA     25 TRP  HB2     3.02                
 25 TRP  HA     25 TRP  HB3     3.02                
 25 TRP  HA     25 TRP  HD1     4.97                
 25 TRP  HA     25 TRP  HE3     4.82                
 25 TRP  HA     26 ALA  HN      3.27                
 25 TRP  HA     73 PRO  HA      3.05                
 25 TRP  HB2    26 ALA  HN      4.14                
 25 TRP  HB3    26 ALA  HN      4.14                
 25 TRP  QB     25 TRP  HE3     3.68                
 25 TRP  QB     26 ALA  HN      3.61                
 25 TRP  QB     73 PRO  HA      5.57                
 25 TRP  HD1    54 LYS+ HA      4.94                
 25 TRP  HD1    54 LYS+ QB      6.04                
 25 TRP  HD1    54 LYS+ QD      6.38                
 25 TRP  HD1    55 LEU  HN      3.17                
 25 TRP  HD1    56 ASN  HA      4.51                
 25 TRP  HE3    32 CYSS HB2     5.50                
 25 TRP  HE3    32 CYSS HB3     5.50                
 25 TRP  HE3    32 CYSS QB      5.08                
 25 TRP  HE1    54 LYS+ HA      5.50                
 25 TRP  HE1    54 LYS+ QB      4.89                
 25 TRP  HE1    55 LEU  HN      5.50                
 25 TRP  HE1    55 LEU  HA      5.50                
 25 TRP  HE1    56 ASN  HN      5.50                
 25 TRP  HE1    56 ASN  HA      5.50                
 25 TRP  HE1    56 ASN  HB2     5.50                
 25 TRP  HE1    56 ASN  HB3     5.50                
 25 TRP  HE1    56 ASN  QB      4.75                
 25 TRP  HZ2    27 ALA  QB      6.53                
 25 TRP  HZ2    56 ASN  QB      5.92                
 26 ALA  HA     27 ALA  HN      2.86                
 26 ALA  HA     27 ALA  QB      6.53                
 26 ALA  HA     56 ASN  HA      5.50                
 26 ALA  HA     57 VAL  HN      4.26                
 26 ALA  HA     57 VAL  QG1     6.53                
 26 ALA  QB     27 ALA  HN      4.17                
 26 ALA  QB     28 TRP  HN      6.34                
 26 ALA  QB     28 TRP  HE3     4.08                
 26 ALA  QB     29 CYSS HB2     6.06                
 26 ALA  QB     29 CYSS HB3     6.06                
 26 ALA  QB     29 CYSS QB      5.89                
 26 ALA  QB     72 ILE  QG2     7.56                
 26 ALA  QB     72 ILE  QG1     6.38                
 27 ALA  HN     28 TRP  HN      3.17                
 27 ALA  HN     28 TRP  HE3     5.50                
 27 ALA  HA     29 CYSS HN      5.50                
 27 ALA  QB     29 CYSS HN      6.53                
 28 TRP  HN     28 TRP  HB2     4.04                
 28 TRP  HN     28 TRP  HB3     4.04                
 28 TRP  HN     28 TRP  QB      3.67                
 28 TRP  HN     29 CYSS HN      2.80                
 28 TRP  HA     28 TRP  HB2     2.65                
 28 TRP  HA     28 TRP  HB3     2.65                
 28 TRP  HA     28 TRP  HD1     5.50                
 28 TRP  HB2    28 TRP  HD1     3.92                
 28 TRP  HB3    28 TRP  HD1     3.92                
 28 TRP  HD1    29 CYSS HN      5.50                
 28 TRP  HZ3    57 VAL  QG2     6.53                
 28 TRP  HZ3    72 ILE  QG1     6.35                
 28 TRP  HZ3    72 ILE  QD1     4.92                
 28 TRP  HZ2    29 CYSS HA      5.00                
 28 TRP  HZ2    29 CYSS QB      6.38                
 28 TRP  HH2    29 CYSS HA      5.50                
 28 TRP  HH2    29 CYSS QB      6.38                
 28 TRP  HH2    72 ILE  QG1     6.01                
 28 TRP  HH2    72 ILE  QD1     6.47                
 29 CYSS HN     29 CYSS HB2     3.83                
 29 CYSS HN     29 CYSS HB3     3.83                
 29 CYSS HN     29 CYSS QB      3.51                
 29 CYSS HB2    32 CYSS HN      5.28                
 29 CYSS HB2    72 ILE  QD1     5.32                
 29 CYSS HB3    32 CYSS HN      5.28                
 29 CYSS HB3    72 ILE  QD1     5.32                
 29 CYSS QB     30 GLY  HN      5.79                
 29 CYSS QB     32 CYSS HN      4.79                
 29 CYSS QB     72 ILE  QD1     4.96                
 30 GLY  HN     31 PRO  QD      6.38                
 31 PRO  HA     33 ARG+ HN      4.66                
 31 PRO  HA     34 MET  HN      4.97                
 31 PRO  HA     34 MET  QB      3.74                
 31 PRO  HA     90 TYR  QD      7.64                
 31 PRO  HA     90 TYR  QE      7.63                
 31 PRO  HB2    32 CYSS HN      4.51                
 31 PRO  HB2    90 TYR  HB2     5.67                
 31 PRO  HB2    90 TYR  HB3     5.67                
 31 PRO  HB3    32 CYSS HN      4.51                
 31 PRO  HB3    90 TYR  HB2     5.67                
 31 PRO  HB3    90 TYR  HB3     5.67                
 31 PRO  QB     32 CYSS HN      3.89                
 31 PRO  QB     33 ARG+ HN      6.13                
 31 PRO  QB     90 TYR  HN      6.38                
 31 PRO  QB     90 TYR  QB      4.59                
 31 PRO  QG     73 PRO  QD      6.32                
 31 PRO  HD2    32 CYSS HN      5.50                
 31 PRO  HD3    32 CYSS HN      5.50                
 31 PRO  QD     32 CYSS HN      5.37                
 32 CYSS HN     32 CYSS HB2     3.83                
 32 CYSS HN     32 CYSS HB3     3.83                
 32 CYSS HN     34 MET  HN      4.69                
 32 CYSS HA     32 CYSS HB2     2.74                
 32 CYSS HA     32 CYSS HB3     2.74                
 32 CYSS HA     32 CYSS QB      2.53                
 32 CYSS HA     35 MET  HN      4.01                
 32 CYSS HA     35 MET  HB2     3.39                
 32 CYSS HA     35 MET  HB3     3.39                
 32 CYSS HA     35 MET  QB      3.12                
 32 CYSS QB     33 ARG+ HN      5.08                
 33 ARG+ HN     33 ARG+ HB2     3.27                
 33 ARG+ HN     33 ARG+ HB3     3.27                
 33 ARG+ HN     33 ARG+ QG      6.00                
 33 ARG+ HN     34 MET  HN      2.99                
 33 ARG+ HA     33 ARG+ HB2     2.99                
 33 ARG+ HA     33 ARG+ HB3     2.99                
 33 ARG+ HA     33 ARG+ HD2     5.00                
 33 ARG+ HA     33 ARG+ HD3     5.00                
 33 ARG+ HA     33 ARG+ QD      4.75                
 33 ARG+ HA     36 ALA  HN      3.79                
 33 ARG+ HA     36 ALA  QB      4.70                
 33 ARG+ HB2    33 ARG+ HD2     3.95                
 33 ARG+ HB2    33 ARG+ HD3     3.95                
 33 ARG+ HB3    33 ARG+ HD2     3.95                
 33 ARG+ HB3    33 ARG+ HD3     3.95                
 33 ARG+ QB     33 ARG+ QD      3.20                
 34 MET  HN     34 MET  HA      2.86                
 34 MET  HN     34 MET  QB      3.74                
 34 MET  HN     34 MET  QG      4.02                
 34 MET  HN     35 MET  HN      3.36                
 34 MET  HN     36 ALA  HN      5.41                
 34 MET  HA     34 MET  QG      3.98                
 34 MET  HA     34 MET  QE      6.53                
 34 MET  HA     36 ALA  HN      4.51                
 34 MET  HA     37 PRO  QB      5.08                
 34 MET  HA     90 TYR  QE      7.63                
 34 MET  QB     90 TYR  QD      7.86                
 34 MET  QB     90 TYR  QE      7.36                
 34 MET  QG     90 TYR  QE      6.84                
 34 MET  QE     90 TYR  QB      5.70                
 34 MET  QE     90 TYR  QD      8.26                
 34 MET  QE     90 TYR  QE      8.66                
 35 MET  HN     35 MET  HB2     2.96                
 35 MET  HN     35 MET  HB3     2.96                
 35 MET  HN     35 MET  HG2     4.88                
 35 MET  HN     35 MET  HG3     4.88                
 35 MET  HN     35 MET  QG      4.68                
 35 MET  HN     36 ALA  HN      2.80                
 35 MET  HN     36 ALA  QB      6.53                
 35 MET  HN     38 VAL  HN      4.51                
 35 MET  HA     35 MET  QG      3.92                
 35 MET  HA     38 VAL  HN      4.42                
 35 MET  HA     38 VAL  HB      2.77                
 35 MET  HA     38 VAL  QG1     3.77                
 35 MET  HA     39 LEU  QQD     8.10                
 35 MET  HA     90 TYR  QE      6.30                
 35 MET  HB2    36 ALA  HN      3.83                
 35 MET  HB2    39 LEU  QD1     6.53                
 35 MET  HB2    39 LEU  QD2     6.53                
 35 MET  HB2    90 TYR  QD      6.28                
 35 MET  HB2    90 TYR  QE      7.60                
 35 MET  HB3    36 ALA  HN      3.83                
 35 MET  HB3    39 LEU  QD1     6.53                
 35 MET  HB3    39 LEU  QD2     6.53                
 35 MET  HB3    90 TYR  QD      6.28                
 35 MET  HB3    90 TYR  QE      7.60                
 35 MET  QB     36 ALA  HN      3.51                
 35 MET  QB     39 LEU  QQD     5.73                
 35 MET  QB     90 TYR  QD      6.11                
 35 MET  QB     90 TYR  QE      6.73                
 35 MET  HG2    38 VAL  QG1     5.94                
 35 MET  HG2    90 TYR  HA      4.26                
 35 MET  HG2    90 TYR  QD      6.62                
 35 MET  HG3    38 VAL  QG1     5.94                
 35 MET  HG3    90 TYR  HA      4.26                
 35 MET  HG3    90 TYR  QD      6.62                
 35 MET  QG     38 VAL  QG1     5.64                
 35 MET  QG     90 TYR  HN      6.38                
 35 MET  QG     90 TYR  HA      4.00                
 35 MET  QG     90 TYR  QE      8.51                
 36 ALA  HN     36 ALA  QB      3.61                
 36 ALA  HN     37 PRO  QD      5.14                
 36 ALA  HN     38 VAL  HN      5.04                
 36 ALA  HA     38 VAL  HN      4.72                
 36 ALA  HA     39 LEU  HN      3.83                
 36 ALA  HA     39 LEU  HB2     3.89                
 36 ALA  HA     39 LEU  HB3     3.89                
 36 ALA  HA     39 LEU  QB      3.44                
 36 ALA  HA     39 LEU  HG      5.10                
 37 PRO  HA     40 GLU- HB2     3.27                
 37 PRO  HA     40 GLU- HB3     3.27                
 37 PRO  HA     40 GLU- QB      3.08                
 37 PRO  HG2    38 VAL  HN      4.23                
 37 PRO  HG3    38 VAL  HN      4.23                
 37 PRO  QG     38 VAL  HN      4.00                
 37 PRO  QG     39 LEU  HN      6.38                
 38 VAL  HN     38 VAL  HB      2.86                
 38 VAL  HN     38 VAL  QG1     3.99                
 38 VAL  HN     39 LEU  HN      2.83                
 38 VAL  HN     39 LEU  QB      6.38                
 38 VAL  HN     40 GLU- HN      4.26                
 38 VAL  HA     38 VAL  HB      2.80                
 38 VAL  HA     41 GLU- HN      4.66                
 38 VAL  HA     41 GLU- QB      4.42                
 38 VAL  QG1    39 LEU  HN      6.09                
 38 VAL  QG1    90 TYR  QD      8.36                
 38 VAL  QG1    90 TYR  QE      7.42                
 38 VAL  QG1    93 LYS+ HB2     6.31                
 38 VAL  QG2    39 LEU  HN      5.78                
 38 VAL  QG2    39 LEU  QQD     9.13                
 38 VAL  QG2    42 PHE  HN      6.43                
 38 VAL  QG2    92 PRO  QB      7.40                
 39 LEU  HN     39 LEU  HA      2.80                
 39 LEU  HN     39 LEU  HB2     3.36                
 39 LEU  HN     39 LEU  HB3     3.36                
 39 LEU  HN     39 LEU  QB      2.97                
 39 LEU  HN     39 LEU  HG      5.07                
 39 LEU  HN     39 LEU  QQD     7.29                
 39 LEU  HN     40 GLU- HN      3.08                
 39 LEU  HA     39 LEU  HG      3.36                
 39 LEU  HA     41 GLU- HN      5.10                
 39 LEU  HA     42 PHE  HN      3.95                
 39 LEU  HA     42 PHE  HB2     2.99                
 39 LEU  HA     42 PHE  HB3     2.80                
 39 LEU  HA     96 LEU  QD1     6.53                
 39 LEU  HA     96 LEU  QD2     6.53                
 39 LEU  HA     96 LEU  QQD     6.00                
 39 LEU  QD1    96 LEU  QD1     7.56                
 39 LEU  QD1    96 LEU  QD2     7.56                
 39 LEU  QD2    96 LEU  QD1     7.56                
 39 LEU  QD2    96 LEU  QD2     7.56                
 39 LEU  QQD    96 LEU  QQD     6.30                
 40 GLU- HN     40 GLU- HB2     3.39                
 40 GLU- HN     40 GLU- HB3     3.39                
 40 GLU- HN     40 GLU- QB      3.15                
 40 GLU- HN     40 GLU- QG      5.94                
 40 GLU- HN     41 GLU- HN      2.65                
 40 GLU- HA     43 ALA  QB      5.38                
 41 GLU- HN     41 GLU- HA      2.90                
 41 GLU- HN     41 GLU- QB      3.59                
 41 GLU- HN     41 GLU- QG      6.25                
 41 GLU- HN     42 PHE  HN      3.33                
 41 GLU- HN     43 ALA  HN      4.94                
 41 GLU- HA     44 GLU- QB      3.80                
 41 GLU- QB     42 PHE  HN      4.02                
 41 GLU- QB     93 LYS+ QD      7.25                
 41 GLU- QG     93 LYS+ QD      7.25                
 42 PHE  HN     42 PHE  HB2     2.86                
 42 PHE  HN     42 PHE  HB3     2.83                
 42 PHE  HN     43 ALA  HN      3.08                
 42 PHE  HN     44 GLU- HN      5.47                
 42 PHE  HA     42 PHE  HB2     2.71                
 42 PHE  HA     45 ALA  QB      4.33                
 42 PHE  HA     46 HIS+ HD2     4.91                
 42 PHE  HB2    43 ALA  HN      4.23                
 42 PHE  HB2    93 LYS+ QD      6.38                
 42 PHE  HB2    96 LEU  QD1     6.53                
 42 PHE  HB2    96 LEU  QD2     6.53                
 42 PHE  HB3    43 ALA  HN      4.17                
 42 PHE  HB3    93 LYS+ QD      6.38                
 42 PHE  HB3    96 LEU  QD1     6.53                
 42 PHE  HB3    96 LEU  QD2     6.53                
 42 PHE  QD     43 ALA  HA      6.88                
 42 PHE  QD     45 ALA  QB      8.65                
 42 PHE  QD     46 HIS+ QB      8.50                
 42 PHE  QD     46 HIS+ HD2     6.51                
 42 PHE  QD     50 VAL  QG1     8.65                
 42 PHE  QD     50 VAL  QG2     8.65                
 42 PHE  QD     50 VAL  QQG     8.24                
 42 PHE  QD     52 VAL  QG1     8.18                
 42 PHE  QD     52 VAL  QG2     8.18                
 42 PHE  QD     52 VAL  QQG     7.25                
 42 PHE  QD     75 LEU  QQD    10.22                
 42 PHE  QD     96 LEU  HA      7.62                
 42 PHE  QD     96 LEU  HB3     7.44                
 42 PHE  QD     96 LEU  QD1     8.53                
 42 PHE  QD     96 LEU  QD2     8.53                
 42 PHE  QD     96 LEU  QQD     8.30                
 42 PHE  QD     97 GLU- HB2     7.62                
 42 PHE  QD     97 GLU- HB3     7.62                
 42 PHE  QD     97 GLU- QG      8.50                
 42 PHE  QD    100 LEU  QB      8.50                
 42 PHE  QD    104 LEU  QQD    10.22                
 42 PHE  QE     43 ALA  HA      7.62                
 42 PHE  QE     46 HIS+ QB      8.41                
 42 PHE  QE     46 HIS+ HD2     7.62                
 42 PHE  QE     50 VAL  QG1     7.16                
 42 PHE  QE     50 VAL  QG2     7.16                
 42 PHE  QE     50 VAL  QQG     6.71                
 42 PHE  QE     52 VAL  QG1     7.94                
 42 PHE  QE     52 VAL  QG2     7.94                
 42 PHE  QE     52 VAL  QQG     7.22                
 42 PHE  QE     75 LEU  QQD     9.10                
 42 PHE  QE     96 LEU  HB2     7.09                
 42 PHE  QE     96 LEU  HB3     6.29                
 42 PHE  QE     96 LEU  QQD    10.22                
 42 PHE  QE     97 GLU- HA      6.10                
 42 PHE  QE     97 GLU- HB2     7.62                
 42 PHE  QE     97 GLU- HB3     7.62                
 42 PHE  QE     97 GLU- QG      7.88                
 42 PHE  QE     99 GLN  QB      8.50                
 42 PHE  QE    100 LEU  HB2     7.62                
 42 PHE  QE    100 LEU  HB3     7.62                
 42 PHE  QE    100 LEU  QB      7.46                
 42 PHE  QE    100 LEU  QQD     9.91                
 42 PHE  QE    104 LEU  QD1     8.49                
 42 PHE  QE    104 LEU  QD2     8.49                
 42 PHE  QE    104 LEU  QQD     7.78                
 42 PHE  HZ     46 HIS+ HD2     5.50                
 42 PHE  HZ     50 VAL  QG1     6.53                
 42 PHE  HZ     50 VAL  QG2     6.53                
 42 PHE  HZ     50 VAL  QQG     5.85                
 42 PHE  HZ     52 VAL  QQG     8.09                
 42 PHE  HZ     96 LEU  HB3     5.50                
 42 PHE  HZ     97 GLU- HA      5.50                
 42 PHE  HZ     97 GLU- QB      6.38                
 42 PHE  HZ    100 LEU  HB2     5.10                
 42 PHE  HZ    100 LEU  HB3     5.10                
 42 PHE  HZ    100 LEU  QB      4.60                
 42 PHE  HZ    100 LEU  QD1     5.88                
 42 PHE  HZ    100 LEU  QD2     5.88                
 42 PHE  HZ    100 LEU  QQD     4.96                
 42 PHE  HZ    104 LEU  QD1     5.19                
 42 PHE  HZ    104 LEU  QD2     5.19                
 42 PHE  HZ    104 LEU  QQD     4.68                
 43 ALA  HN     43 ALA  HA      2.77                
 43 ALA  HN     44 GLU- HN      3.33                
 43 ALA  HN     45 ALA  HN      5.28                
 43 ALA  HA     44 GLU- HN      3.55                
 43 ALA  HA     46 HIS+ HN      4.32                
 43 ALA  HA     46 HIS+ HD2     5.50                
 43 ALA  HA     52 VAL  QQG     6.01                
 43 ALA  QB     44 GLU- HN      4.20                
 43 ALA  QB     52 VAL  QG1     7.52                
 43 ALA  QB     52 VAL  QG2     7.52                
 43 ALA  QB     52 VAL  QQG     6.49                
 44 GLU- HN     44 GLU- HA      2.80                
 44 GLU- HN     44 GLU- QB      3.71                
 44 GLU- HN     44 GLU- HG2     4.66                
 44 GLU- HN     44 GLU- HG3     4.66                
 44 GLU- HN     44 GLU- QG      4.49                
 44 GLU- HN     45 ALA  HN      2.83                
 44 GLU- HN     45 ALA  QB      6.53                
 44 GLU- HA     44 GLU- HG2     3.33                
 44 GLU- HA     44 GLU- HG3     3.33                
 44 GLU- HA     44 GLU- QG      3.13                
 44 GLU- QB     45 ALA  HN      4.55                
 44 GLU- QG     45 ALA  HN      6.38                
 45 ALA  HN     46 HIS+ HN      2.99                
 45 ALA  HN     47 ALA  HN      5.50                
 45 ALA  HN     47 ALA  QB      6.53                
 45 ALA  HA     46 HIS+ HN      3.42                
 45 ALA  HA     47 ALA  HN      5.38                
 45 ALA  QB     46 HIS+ HN      4.39                
 45 ALA  QB     46 HIS+ HD2     5.60                
 45 ALA  QB     46 HIS+ HE1     6.53                
 45 ALA  QB     47 ALA  HN      6.53                
 46 HIS+ HN     46 HIS+ HB2     3.83                
 46 HIS+ HN     46 HIS+ HB3     3.83                
 46 HIS+ HN     46 HIS+ QB      3.55                
 46 HIS+ HN     46 HIS+ HD2     5.44                
 46 HIS+ HN     47 ALA  HN      4.35                
 46 HIS+ HN     47 ALA  QB      6.40                
 46 HIS+ HA     46 HIS+ HB2     2.71                
 46 HIS+ HA     46 HIS+ HB3     2.71                
 46 HIS+ HA     47 ALA  HN      3.24                
 46 HIS+ HA     47 ALA  QB      6.43                
 46 HIS+ HA     48 ASP- HN      4.38                
 46 HIS+ HA     49 LYS+ HN      5.10                
 46 HIS+ HA    104 LEU  QQD     8.10                
 46 HIS+ HB2    46 HIS+ HD2     3.95                
 46 HIS+ HB2    47 ALA  HN      4.66                
 46 HIS+ HB2    50 VAL  QG1     6.39                
 46 HIS+ HB2    50 VAL  QG2     6.39                
 46 HIS+ HB2   104 LEU  QD1     6.53                
 46 HIS+ HB2   104 LEU  QD2     6.53                
 46 HIS+ HB3    46 HIS+ HD2     3.95                
 46 HIS+ HB3    47 ALA  HN      4.66                
 46 HIS+ HB3    50 VAL  QG1     6.39                
 46 HIS+ HB3    50 VAL  QG2     6.39                
 46 HIS+ HB3   104 LEU  QD1     6.53                
 46 HIS+ HB3   104 LEU  QD2     6.53                
 46 HIS+ QB     47 ALA  HN      4.52                
 46 HIS+ QB     49 LYS+ HB3     5.14                
 46 HIS+ QB     49 LYS+ QG      7.26                
 46 HIS+ QB     50 VAL  QQG     4.82                
 46 HIS+ QB    104 LEU  QQD     6.06                
 46 HIS+ HD2    50 VAL  QG1     6.53                
 46 HIS+ HD2    50 VAL  QG2     6.53                
 46 HIS+ HD2    50 VAL  QQG     6.18                
 46 HIS+ HD2   104 LEU  QD1     6.53                
 46 HIS+ HD2   104 LEU  QD2     6.53                
 47 ALA  HN     47 ALA  HA      2.86                
 47 ALA  HN     47 ALA  QB      3.52                
 47 ALA  HN     48 ASP- HN      3.70                
 47 ALA  HN     50 VAL  HN      5.50                
 47 ALA  QB     48 ASP- HN      4.30                
 48 ASP- HN     49 LYS+ HN      2.71                
 48 ASP- HN     50 VAL  HN      4.35                
 48 ASP- HA     50 VAL  HN      4.11                
 49 LYS+ HN     49 LYS+ HB2     2.71                
 49 LYS+ HN     49 LYS+ HB3     2.83                
 49 LYS+ HN     49 LYS+ QG      4.61                
 49 LYS+ HA     49 LYS+ HB2     2.52                
 49 LYS+ HA     49 LYS+ QD      6.38                
 49 LYS+ HA     49 LYS+ QE      6.38                
 49 LYS+ HB2    49 LYS+ QD      3.49                
 49 LYS+ HB2    49 LYS+ QE      6.31                
 49 LYS+ HB3    49 LYS+ QE      4.70                
 49 LYS+ HB3    50 VAL  HN      4.07                
 49 LYS+ QG     50 VAL  HN      6.38                
 49 LYS+ QG    104 LEU  QD1     7.40                
 49 LYS+ QG    104 LEU  QD2     7.40                
 49 LYS+ QD    104 LEU  QB      4.53                
 50 VAL  HN     50 VAL  HB      3.95                
 50 VAL  HA     50 VAL  HB      2.71                
 50 VAL  HA    104 LEU  QQD     8.10                
 50 VAL  HB     51 THR  HN      3.76                
 50 VAL  QQG    52 VAL  QQG    10.68                
 50 VAL  QQG   104 LEU  QQD     9.72                
 51 THR  HN     51 THR  HA      2.77                
 51 THR  HN     51 THR  HB      3.24                
 51 THR  HA     51 THR  HB      2.83                
 51 THR  HA     51 THR  QG2     3.71                
 51 THR  HA     52 VAL  HN      2.62                
 51 THR  HB     52 VAL  HN      5.50                
 51 THR  QG2    52 VAL  HN      5.13                
 52 VAL  HN     52 VAL  HB      2.93                
 52 VAL  HA     52 VAL  HB      2.86                
 52 VAL  HA     53 ALA  HN      2.86                
 52 VAL  HB     53 ALA  HN      3.67                
 52 VAL  HB     53 ALA  HA      5.50                
 52 VAL  QQG    53 ALA  HN      6.04                
 52 VAL  QQG    53 ALA  HA      8.09                
 53 ALA  HA     54 LYS+ HN      2.65                
 53 ALA  HA     54 LYS+ QG      6.29                
 53 ALA  QB     54 LYS+ HN      4.11                
 54 LYS+ HN     54 LYS+ QG      5.08                
 54 LYS+ HN     55 LEU  HN      4.82                
 54 LYS+ HA     54 LYS+ HG2     4.17                
 54 LYS+ HA     54 LYS+ HG3     4.17                
 54 LYS+ HA     54 LYS+ QG      3.70                
 54 LYS+ HA     54 LYS+ QD      4.73                
 54 LYS+ HA     55 LEU  HN      2.40                
 54 LYS+ QB     55 LEU  HN      4.98                
 54 LYS+ QG     55 LEU  HN      5.95                
 55 LEU  HN     55 LEU  QB      3.61                
 55 LEU  HN     55 LEU  QD1     6.43                
 55 LEU  HN     55 LEU  QD2     6.43                
 55 LEU  HN     55 LEU  QQD     5.37                
 55 LEU  HA     56 ASN  HN      2.46                
 55 LEU  QB     56 ASN  HN      4.64                
 55 LEU  QD1    56 ASN  HN      6.00                
 55 LEU  QD2    56 ASN  HN      6.00                
 55 LEU  QQD    56 ASN  HN      5.39                
 55 LEU  QQD    64 THR  QG2     8.85                
 56 ASN  HN     56 ASN  HB2     2.86                
 56 ASN  HN     56 ASN  HB3     2.86                
 56 ASN  HN     59 GLU- HB3     4.26                
 56 ASN  HA     57 VAL  HN      2.49                
 57 VAL  HN     57 VAL  HA      2.86                
 57 VAL  HN     57 VAL  HB      3.24                
 57 VAL  HN     57 VAL  QG1     3.80                
 57 VAL  HN     57 VAL  QG2     4.73                
 57 VAL  HN     58 ASP- HN      3.21                
 57 VAL  HN     59 GLU- HN      4.57                
 57 VAL  HA     57 VAL  HB      2.43                
 57 VAL  HA     57 VAL  QG2     3.71                
 57 VAL  HA     58 ASP- QB      5.85                
 57 VAL  HA     59 GLU- HN      4.45                
 57 VAL  HA     60 ASN  HN      4.11                
 57 VAL  QG1    58 ASP- HN      4.36                
 57 VAL  QG1    59 GLU- HN      6.53                
 57 VAL  QG2    60 ASN  QB      7.38                
 57 VAL  QG2    69 ILE  QG2     7.56                
 58 ASP- HN     58 ASP- HB2     3.11                
 58 ASP- HN     58 ASP- HB3     3.11                
 58 ASP- HN     58 ASP- QB      2.91                
 58 ASP- HN     59 GLU- HN      2.83                
 58 ASP- HN     60 ASN  HN      4.17                
 58 ASP- HA     58 ASP- HB2     2.96                
 58 ASP- HA     58 ASP- HB3     2.96                
 58 ASP- HA     60 ASN  HN      4.85                
 58 ASP- HB2    59 GLU- HN      3.79                
 58 ASP- HB3    59 GLU- HN      3.79                
 58 ASP- QB     59 GLU- HN      3.57                
 59 GLU- HN     59 GLU- HB2     3.11                
 59 GLU- HN     59 GLU- HB3     2.90                
 59 GLU- HN     59 GLU- QG      5.04                
 59 GLU- HN     60 ASN  HN      2.93                
 59 GLU- HN     61 PRO  QD      6.38                
 59 GLU- HA     59 GLU- HB2     2.49                
 59 GLU- HA     59 GLU- HB3     2.96                
 59 GLU- HB2    60 ASN  HN      4.14                
 59 GLU- HB3    60 ASN  HN      3.95                
 59 GLU- QG     60 ASN  HN      6.38                
 59 GLU- QG     60 ASN  HA      4.98                
 59 GLU- QG     61 PRO  QD      5.24                
 60 ASN  HN     60 ASN  HB2     3.27                
 60 ASN  HN     60 ASN  HB3     3.27                
 60 ASN  HN     61 PRO  QD      5.30                
 60 ASN  HA     61 PRO  HD2     2.96                
 60 ASN  HA     61 PRO  HD3     2.96                
 60 ASN  HA     61 PRO  QD      2.62                
 60 ASN  HA     62 GLU- HN      5.10                
 61 PRO  HB2    65 SER  QB      4.95                
 61 PRO  HB3    65 SER  QB      4.95                
 61 PRO  QB     65 SER  QB      4.72                
 61 PRO  HD2    62 GLU- HN      5.50                
 61 PRO  HD3    62 GLU- HN      5.50                
 61 PRO  QD     62 GLU- HN      4.72                
 62 GLU- HN     62 GLU- HB2     3.64                
 62 GLU- HN     62 GLU- HB3     3.64                
 62 GLU- HN     62 GLU- QB      3.35                
 62 GLU- HN     62 GLU- HG2     5.50                
 62 GLU- HN     62 GLU- HG3     5.50                
 62 GLU- HN     64 THR  HN      5.50                
 62 GLU- HA     62 GLU- QB      2.73                
 62 GLU- HA     62 GLU- HG2     3.95                
 62 GLU- HA     62 GLU- HG3     3.95                
 62 GLU- HA     62 GLU- QG      3.74                
 62 GLU- HB2    63 THR  HN      5.47                
 62 GLU- HB3    63 THR  HN      5.47                
 62 GLU- HG2    63 THR  HN      5.50                
 62 GLU- HG3    63 THR  HN      5.50                
 63 THR  HN     63 THR  HA      2.62                
 63 THR  HN     64 THR  HN      3.08                
 63 THR  HA     64 THR  HN      3.36                
 63 THR  HA     66 GLN  HN      3.61                
 63 THR  HA     66 GLN  HB2     3.30                
 63 THR  HA     66 GLN  HB3     3.02                
 63 THR  HA     67 PHE  HN      5.50                
 63 THR  HB     64 THR  HN      3.92                
 63 THR  QG2    64 THR  HN      6.53                
 64 THR  HN     64 THR  HB      3.14                
 64 THR  HN     65 SER  HN      3.08                
 64 THR  HN     66 GLN  HN      4.26                
 64 THR  HA     64 THR  QG2     3.77                
 64 THR  HA     66 GLN  HN      5.19                
 64 THR  HA     67 PHE  HN      4.88                
 64 THR  HA     67 PHE  QB      6.38                
 64 THR  HA     69 ILE  QG2     4.39                
 64 THR  HA     69 ILE  QG1     4.58                
 64 THR  HA     69 ILE  QD1     5.41                
 64 THR  HB     65 SER  HN      2.99                
 64 THR  QG2    65 SER  HN      5.23                
 64 THR  QG2    65 SER  HA      6.53                
 64 THR  QG2    66 GLN  HN      6.53                
 65 SER  HN     65 SER  QB      3.87                
 65 SER  HN     66 GLN  HN      2.90                
 65 SER  HN     67 PHE  HN      4.63                
 65 SER  HA     67 PHE  HN      5.50                
 65 SER  HA     68 GLY  HN      4.01                
 65 SER  HA     69 ILE  HN      4.97                
 65 SER  QB     66 GLN  HN      4.36                
 65 SER  QB     67 PHE  HN      6.38                
 66 GLN  HN     66 GLN  HB2     2.62                
 66 GLN  HN     66 GLN  HB3     2.86                
 66 GLN  HN     67 PHE  HN      3.05                
 66 GLN  HN     68 GLY  HN      4.94                
 66 GLN  HA     66 GLN  HB2     2.77                
 66 GLN  HB2    67 PHE  HN      3.92                
 66 GLN  HB3    67 PHE  HN      3.98                
 66 GLN  QG     67 PHE  HN      6.38                
 67 PHE  HN     67 PHE  HB2     3.64                
 67 PHE  HN     67 PHE  HB3     3.64                
 67 PHE  HN     67 PHE  QB      3.42                
 67 PHE  HN     68 GLY  HN      2.96                
 67 PHE  HN     69 ILE  HN      3.98                
 67 PHE  HN     69 ILE  QG2     6.53                
 67 PHE  HN     69 ILE  QG1     6.38                
 67 PHE  HA     67 PHE  QB      2.74                
 67 PHE  HA     68 GLY  HN      3.64                
 67 PHE  HB2    69 ILE  QD1     6.16                
 67 PHE  HB2    76 ILE  QD1     4.95                
 67 PHE  HB3    69 ILE  QD1     6.16                
 67 PHE  HB3    76 ILE  QD1     4.95                
 67 PHE  QB     69 ILE  QD1     5.73                
 67 PHE  QB     76 ILE  QD1     4.64                
 67 PHE  QD     69 ILE  QD1     8.65                
 68 GLY  HN     68 GLY  HA1     2.83                
 68 GLY  HN     68 GLY  HA2     2.83                
 68 GLY  HN     68 GLY  QA      2.60                
 68 GLY  HN     69 ILE  HN      3.05                
 68 GLY  HN     69 ILE  QD1     6.53                
 69 ILE  HN     69 ILE  HB      2.86                
 69 ILE  HN     69 ILE  QG1     4.09                
 69 ILE  HN     69 ILE  QD1     5.16                
 69 ILE  HN     70 MET  HN      4.69                
 69 ILE  HA     69 ILE  QG2     3.52                
 69 ILE  HA     69 ILE  QD1     3.61                
 69 ILE  HA     70 MET  HN      2.46                
 69 ILE  HA     70 MET  HA      4.63                
 69 ILE  QG2    70 MET  HA      5.75                
 69 ILE  QG2    71 SER  HN      4.79                
 69 ILE  QG2    72 ILE  QD1     7.56                
 69 ILE  QG2    74 THR  HB      4.23                
 69 ILE  QG2    74 THR  QG2     6.19                
 69 ILE  QG2    78 PHE  QE      8.65                
 69 ILE  QG1    70 MET  HN      6.38                
 69 ILE  QD1    70 MET  HN      6.16                
 69 ILE  QD1    72 ILE  QG2     7.56                
 69 ILE  QD1    74 THR  QG2     5.54                
 69 ILE  QD1    76 ILE  QD1     7.31                
 69 ILE  QD1    86 GLN  QG      7.41                
 70 MET  HN     70 MET  HB2     3.67                
 70 MET  HN     70 MET  HB3     3.67                
 70 MET  HN     70 MET  QB      3.24                
 70 MET  HN     71 SER  HN      3.05                
 70 MET  HA     70 MET  HG2     4.26                
 70 MET  HA     70 MET  HG3     4.26                
 70 MET  HA     70 MET  QG      3.92                
 70 MET  HB2    71 SER  HN      4.72                
 70 MET  HB3    71 SER  HN      4.72                
 70 MET  QB     71 SER  HN      4.37                
 70 MET  QG     71 SER  QB      7.26                
 71 SER  HN     71 SER  HA      2.90                
 71 SER  HN     72 ILE  HN      4.94                
 71 SER  HA     72 ILE  HN      2.93                
 72 ILE  HN     72 ILE  HB      3.67                
 72 ILE  HN     72 ILE  HG12    4.72                
 72 ILE  HN     72 ILE  HG13    4.72                
 72 ILE  HN     72 ILE  QG1     4.30                
 72 ILE  HN     72 ILE  QD1     6.09                
 72 ILE  HN     74 THR  HN      5.13                
 72 ILE  HA     74 THR  HN      4.82                
 72 ILE  HB     74 THR  HN      5.50                
 72 ILE  HB     74 THR  HB      5.50                
 72 ILE  QG2    74 THR  HN      4.82                
 72 ILE  QG2    74 THR  HB      6.16                
 72 ILE  QG1    74 THR  HN      6.38                
 72 ILE  QD1    74 THR  HN      6.53                
 73 PRO  HA     74 THR  HN      2.59                
 73 PRO  HG2    89 GLY  HA1     6.35                
 73 PRO  HG2    89 GLY  HA2     6.35                
 73 PRO  HG3    89 GLY  HA1     6.35                
 73 PRO  HG3    89 GLY  HA2     6.35                
 73 PRO  QG     89 GLY  QA      4.83                
 73 PRO  QG     90 TYR  HN      6.38                
 74 THR  HN     74 THR  HB      3.21                
 74 THR  HA     75 LEU  HN      2.40                
 74 THR  HA     87 LEU  QB      6.38                
 74 THR  HA     88 ILE  HA      2.96                
 74 THR  HA     88 ILE  QG2     4.36                
 74 THR  HA     89 GLY  HN      3.83                
 74 THR  QG2    75 LEU  HN      4.11                
 74 THR  QG2    75 LEU  HA      5.26                
 74 THR  QG2    75 LEU  QQD     8.20                
 74 THR  QG2    76 ILE  HN      6.53                
 74 THR  QG2    76 ILE  QG2     7.56                
 74 THR  QG2    86 GLN  HA      6.53                
 74 THR  QG2    86 GLN  QG      6.76                
 74 THR  QG2    87 LEU  HN      5.69                
 74 THR  QG2    87 LEU  QQD     8.35                
 74 THR  QG2    88 ILE  HN      6.53                
 74 THR  QG2    88 ILE  HA      5.01                
 74 THR  QG2    88 ILE  QG2     5.82                
 75 LEU  HN     75 LEU  HB2     3.08                
 75 LEU  HN     75 LEU  HB3     3.08                
 75 LEU  HN     75 LEU  QB      2.74                
 75 LEU  HN     76 ILE  HN      4.69                
 75 LEU  HN     86 GLN  HA      4.63                
 75 LEU  HN     87 LEU  HN      2.80                
 75 LEU  HN     88 ILE  HA      3.98                
 75 LEU  HA     75 LEU  HG      3.42                
 75 LEU  HA     75 LEU  QD1     3.99                
 75 LEU  HA     75 LEU  QD2     3.99                
 75 LEU  HA     76 ILE  HN      2.49                
 75 LEU  HA     76 ILE  HA      4.97                
 75 LEU  HB2    87 LEU  QD1     7.06                
 75 LEU  HB2    87 LEU  QD2     7.06                
 75 LEU  HB2    96 LEU  QD1     6.17                
 75 LEU  HB2    96 LEU  QD2     6.17                
 75 LEU  HB3    87 LEU  QD1     7.06                
 75 LEU  HB3    87 LEU  QD2     7.06                
 75 LEU  HB3    96 LEU  QD1     6.17                
 75 LEU  HB3    96 LEU  QD2     6.17                
 75 LEU  QB     76 ILE  HN      4.99                
 75 LEU  QB     87 LEU  QQD     5.39                
 75 LEU  QB     96 LEU  QQD     5.00                
 75 LEU  QD1    96 LEU  QD1     9.33                
 75 LEU  QD1    96 LEU  QD2     9.33                
 75 LEU  QD2    96 LEU  QD1     9.33                
 75 LEU  QD2    96 LEU  QD2     9.33                
 75 LEU  QQD    76 ILE  HN      6.55                
 75 LEU  QQD    77 LEU  QB      8.67                
 75 LEU  QQD    77 LEU  HG      6.80                
 75 LEU  QQD    86 GLN  HA      8.10                
 75 LEU  QQD    96 LEU  HA      7.91                
 75 LEU  QQD    96 LEU  QQD     7.51                
 75 LEU  QQD   100 LEU  QQD     9.02                
 76 ILE  HN     76 ILE  HB      2.74                
 76 ILE  HN     76 ILE  QD1     6.19                
 76 ILE  HA     77 LEU  HN      2.52                
 76 ILE  HA     86 GLN  HA      2.93                
 76 ILE  HA     87 LEU  HN      3.76                
 76 ILE  HB     76 ILE  QD1     3.49                
 76 ILE  HB     77 LEU  HN      3.86                
 76 ILE  HB     78 PHE  QD      5.85                
 76 ILE  HB     78 PHE  QE      6.04                
 76 ILE  HB     78 PHE  HZ      5.50                
 76 ILE  QG2    77 LEU  HN      4.64                
 76 ILE  QG2    78 PHE  QD      8.65                
 76 ILE  QG2    78 PHE  QE      8.06                
 76 ILE  QG2    78 PHE  HZ      6.53                
 76 ILE  QG2    83 PRO  QG      7.40                
 76 ILE  QG2    84 VAL  HN      6.53                
 76 ILE  QG2    85 LYS+ HN      5.57                
 76 ILE  QG2    86 GLN  HN      6.53                
 76 ILE  QG2    86 GLN  HA      6.53                
 76 ILE  QG2    86 GLN  HB2     6.53                
 76 ILE  QG2    86 GLN  HB3     6.53                
 76 ILE  QG2    86 GLN  HG2     6.53                
 76 ILE  QG2    86 GLN  HG3     6.53                
 76 ILE  QG1    78 PHE  QD      8.50                
 76 ILE  QG1    78 PHE  QE      8.50                
 76 ILE  QG1    86 GLN  HG2     4.76                
 76 ILE  QG1    86 GLN  HG3     4.76                
 76 ILE  QG1    86 GLN  QG      3.99                
 76 ILE  QD1    77 LEU  HN      6.25                
 76 ILE  QD1    78 PHE  QE      8.15                
 76 ILE  QD1    78 PHE  HZ      6.53                
 76 ILE  QD1    86 GLN  HA      6.53                
 76 ILE  QD1    86 GLN  QG      7.41                
 77 LEU  HN     77 LEU  HB2     3.08                
 77 LEU  HN     77 LEU  HB3     3.08                
 77 LEU  HN     77 LEU  QB      2.84                
 77 LEU  HN     77 LEU  HG      5.19                
 77 LEU  HN     77 LEU  QQD     6.61                
 77 LEU  HN     78 PHE  HN      5.13                
 77 LEU  HN     84 VAL  HN      5.50                
 77 LEU  HN     85 LYS+ HN      3.17                
 77 LEU  HN     86 GLN  HA      3.95                
 77 LEU  HA     78 PHE  HN      2.71                
 77 LEU  HB2    78 PHE  HN      4.35                
 77 LEU  HB3    78 PHE  HN      4.35                
 77 LEU  QB     77 LEU  HG      2.59                
 77 LEU  QB     78 PHE  HN      4.15                
 77 LEU  QB     78 PHE  QE      8.50                
 77 LEU  QB     85 LYS+ QD      6.02                
 77 LEU  QB     87 LEU  QQD     8.36                
 77 LEU  HG     78 PHE  HN      4.82                
 77 LEU  HG    103 VAL  QQG     8.09                
 77 LEU  QQD    78 PHE  HA      7.23                
 77 LEU  QQD    79 LYS+ QE      8.51                
 77 LEU  QQD   100 LEU  QD1     8.13                
 77 LEU  QQD   100 LEU  QD2     8.13                
 77 LEU  QQD   100 LEU  QQD     7.57                
 78 PHE  HN     78 PHE  HB2     3.86                
 78 PHE  HN     78 PHE  HB3     3.86                
 78 PHE  HN     78 PHE  QB      3.57                
 78 PHE  HA     79 LYS+ HN      2.74                
 78 PHE  HA     83 PRO  HA      2.90                
 78 PHE  HA     84 VAL  HN      3.39                
 78 PHE  HB2    79 LYS+ HN      3.86                
 78 PHE  HB3    79 LYS+ HN      3.86                
 78 PHE  QB     79 LYS+ HN      3.57                
 78 PHE  QB     81 GLY  HN      5.57                
 78 PHE  QB     83 PRO  HA      6.16                
 78 PHE  QD     79 LYS+ HN      7.62                
 78 PHE  QD     82 GLU- HN      7.62                
 78 PHE  QD     83 PRO  HA      7.00                
 78 PHE  QD     83 PRO  QD      8.50                
 78 PHE  QE     83 PRO  HA      7.62                
 78 PHE  QE     83 PRO  HB2     7.62                
 78 PHE  QE     83 PRO  HB3     7.62                
 78 PHE  QE     83 PRO  QB      7.36                
 78 PHE  QE     83 PRO  HD2     7.62                
 78 PHE  QE     83 PRO  HD3     7.62                
 78 PHE  QE     83 PRO  QD      7.46                
 79 LYS+ HN     79 LYS+ HB2     4.07                
 79 LYS+ HN     79 LYS+ HB3     4.07                
 79 LYS+ HN     79 LYS+ QB      3.76                
 79 LYS+ HN     79 LYS+ QG      6.38                
 79 LYS+ HN     80 GLY  HN      4.48                
 79 LYS+ HN     82 GLU- HN      3.79                
 79 LYS+ HN     83 PRO  HA      4.14                
 79 LYS+ HN     84 VAL  QG1     6.53                
 79 LYS+ HN     84 VAL  QG2     6.53                
 79 LYS+ HN     84 VAL  QQG     5.85                
 79 LYS+ HA     79 LYS+ HB2     2.80                
 79 LYS+ HA     79 LYS+ HB3     2.80                
 79 LYS+ HA     79 LYS+ QB      2.57                
 79 LYS+ HA     79 LYS+ QE      6.38                
 79 LYS+ HA     80 GLY  HN      2.62                
 79 LYS+ HB2    80 GLY  HN      4.88                
 79 LYS+ HB3    80 GLY  HN      4.88                
 79 LYS+ QB     80 GLY  HN      4.68                
 79 LYS+ QG     80 GLY  HN      6.38                
 79 LYS+ QE    103 VAL  QQG     8.96                
 80 GLY  HN     81 GLY  HN      3.21                
 80 GLY  QA     82 GLU- HN      6.19                
 81 GLY  HN     82 GLU- HN      2.96                
 82 GLU- HN     82 GLU- HB2     3.48                
 82 GLU- HN     82 GLU- HB3     3.48                
 82 GLU- HN     82 GLU- QB      3.15                
 82 GLU- HN     82 GLU- QG      5.45                
 82 GLU- HA     83 PRO  HD2     2.99                
 82 GLU- HA     83 PRO  HD3     2.99                
 82 GLU- HA     83 PRO  QD      2.76                
 83 PRO  HA     84 VAL  HN      2.59                
 84 VAL  HN     84 VAL  HB      3.42                
 84 VAL  HN     84 VAL  QQG     4.31                
 84 VAL  HN     85 LYS+ HN      2.71                
 84 VAL  HA     84 VAL  HB      2.83                
 84 VAL  HA     85 LYS+ QG      6.38                
 84 VAL  HB     85 LYS+ HN      3.48                
 84 VAL  HB     85 LYS+ QB      5.70                
 84 VAL  HB     85 LYS+ QG      6.38                
 84 VAL  HB     85 LYS+ QE      5.60                
 84 VAL  QG1    85 LYS+ HN      5.72                
 84 VAL  QG2    85 LYS+ HN      5.72                
 84 VAL  QQG    85 LYS+ HN      4.88                
 84 VAL  QQG    85 LYS+ QG      7.17                
 84 VAL  QQG   103 VAL  HB      5.98                
 85 LYS+ HN     85 LYS+ HB2     4.17                
 85 LYS+ HN     85 LYS+ HB3     4.17                
 85 LYS+ HN     85 LYS+ QB      3.83                
 85 LYS+ HN     85 LYS+ QG      6.38                
 85 LYS+ HN     86 GLN  HN      4.63                
 85 LYS+ HA     85 LYS+ QD      6.38                
 85 LYS+ HA     85 LYS+ QE      6.38                
 85 LYS+ HA     86 GLN  HN      2.40                
 85 LYS+ HB2    85 LYS+ HE2     7.25                
 85 LYS+ HB2    85 LYS+ HE3     7.25                
 85 LYS+ HB2    99 GLN  QG      6.38                
 85 LYS+ HB3    85 LYS+ HE2     7.25                
 85 LYS+ HB3    85 LYS+ HE3     7.25                
 85 LYS+ HB3    99 GLN  QG      6.38                
 85 LYS+ QB     85 LYS+ QE      5.84                
 85 LYS+ QB     99 GLN  QG      5.79                
 85 LYS+ QG     86 GLN  HN      4.86                
 85 LYS+ QG     99 GLN  QG      7.25                
 85 LYS+ QG    100 LEU  QQD     6.80                
 85 LYS+ QD     99 GLN  QG      5.64                
 85 LYS+ QD    100 LEU  QQD     7.89                
 85 LYS+ HE2    87 LEU  QD1     8.28                
 85 LYS+ HE2    87 LEU  QD2     8.28                
 85 LYS+ HE2   103 VAL  QG1     8.28                
 85 LYS+ HE2   103 VAL  QG2     8.28                
 85 LYS+ HE3    87 LEU  QD1     8.28                
 85 LYS+ HE3    87 LEU  QD2     8.28                
 85 LYS+ HE3   103 VAL  QG1     8.28                
 85 LYS+ HE3   103 VAL  QG2     8.28                
 85 LYS+ QE     87 LEU  QQD     6.67                
 85 LYS+ QE    102 ASP- QB      7.19                
 85 LYS+ QE    103 VAL  QQG     7.24                
 86 GLN  HN     86 GLN  HB2     3.95                
 86 GLN  HN     86 GLN  HB3     3.95                
 86 GLN  HN     86 GLN  QB      3.31                
 86 GLN  HN     87 LEU  QD1     6.53                
 86 GLN  HN     87 LEU  QD2     6.53                
 86 GLN  HN     87 LEU  QQD     6.24                
 86 GLN  HA     87 LEU  HN      2.52                
 86 GLN  HA     87 LEU  QQD     8.10                
 86 GLN  HB2    87 LEU  HN      4.66                
 86 GLN  HB3    87 LEU  HN      4.66                
 86 GLN  QB     87 LEU  HN      4.08                
 86 GLN  QB     88 ILE  QG2     7.41                
 86 GLN  HG2    88 ILE  QG1     6.38                
 86 GLN  HG2    88 ILE  QD1     6.16                
 86 GLN  HG3    88 ILE  QG1     6.38                
 86 GLN  HG3    88 ILE  QD1     6.16                
 86 GLN  QG     88 ILE  QG2     5.02                
 86 GLN  QG     88 ILE  QG1     5.55                
 86 GLN  QG     88 ILE  QD1     5.72                
 87 LEU  HN     87 LEU  QB      3.48                
 87 LEU  HN     87 LEU  QD1     4.95                
 87 LEU  HN     87 LEU  QD2     4.95                
 87 LEU  HN     88 ILE  HN      4.57                
 87 LEU  HA     88 ILE  HN      2.74                
 87 LEU  QB     87 LEU  HG      2.59                
 87 LEU  QB     88 ILE  HN      5.17                
 87 LEU  HG     96 LEU  QD1     6.53                
 87 LEU  HG     96 LEU  QD2     6.53                
 87 LEU  QD1    91 GLN  QG      7.40                
 87 LEU  QD1    96 LEU  QD1     7.52                
 87 LEU  QD1    96 LEU  QD2     7.52                
 87 LEU  QD1    99 GLN  QG      6.47                
 87 LEU  QD2    91 GLN  QG      7.40                
 87 LEU  QD2    96 LEU  QD1     7.52                
 87 LEU  QD2    96 LEU  QD2     7.52                
 87 LEU  QD2    99 GLN  QG      6.47                
 87 LEU  QQD    96 LEU  QQD     6.85                
 87 LEU  QQD    99 GLN  QG      5.96                
 88 ILE  HN     88 ILE  QG2     4.73                
 88 ILE  HN     88 ILE  QG1     6.38                
 88 ILE  HN     89 GLY  HN      4.97                
 88 ILE  HA     88 ILE  HB      2.80                
 88 ILE  HA     89 GLY  HN      2.49                
 88 ILE  HB     89 GLY  HN      3.67                
 88 ILE  QG2    89 GLY  HN      4.54                
 88 ILE  QG1    89 GLY  HN      6.38                
 89 GLY  HA1    90 TYR  HN      2.93                
 89 GLY  HA2    90 TYR  HN      2.93                
 89 GLY  QA     90 TYR  HA      5.54                
 90 TYR  HN     90 TYR  HB2     3.52                
 90 TYR  HN     90 TYR  HB3     3.52                
 90 TYR  HN     90 TYR  QB      3.25                
 90 TYR  HA     90 TYR  HB2     2.96                
 90 TYR  HA     90 TYR  HB3     2.96                
 90 TYR  HA     90 TYR  QB      2.74                
 90 TYR  HA     91 GLN  HN      2.52                
 90 TYR  HB2    91 GLN  HN      4.85                
 90 TYR  HB3    91 GLN  HN      4.85                
 90 TYR  QD     91 GLN  HA      7.64                
 90 TYR  QD     92 PRO  QG      8.52                
 90 TYR  QD     92 PRO  HD2     7.17                
 90 TYR  QD     92 PRO  HD3     7.17                
 90 TYR  QE     91 GLN  HN      7.63                
 90 TYR  QE     91 GLN  HA      7.63                
 90 TYR  QE     92 PRO  HA      7.63                
 90 TYR  QE     92 PRO  QG      8.51                
 90 TYR  QE     92 PRO  HD2     7.63                
 90 TYR  QE     92 PRO  HD3     7.63                
 90 TYR  QE     92 PRO  QD      7.43                
 91 GLN  HN     91 GLN  HB2     3.67                
 91 GLN  HN     91 GLN  HB3     3.67                
 91 GLN  HN     91 GLN  QB      3.50                
 91 GLN  HN     91 GLN  QG      5.57                
 91 GLN  HN     92 PRO  QD      6.38                
 91 GLN  HA     92 PRO  HD2     2.86                
 91 GLN  HA     92 PRO  HD3     2.86                
 91 GLN  HA     92 PRO  QD      2.64                
 91 GLN  HA     96 LEU  QQD     8.10                
 91 GLN  HB2    92 PRO  HD2     5.50                
 91 GLN  HB2    92 PRO  HD3     5.50                
 91 GLN  HB2    95 GLN  HN      4.94                
 91 GLN  HB2    95 GLN  QG      4.83                
 91 GLN  HB2    96 LEU  QD1     8.28                
 91 GLN  HB2    96 LEU  QD2     8.28                
 91 GLN  HB3    92 PRO  HD2     5.50                
 91 GLN  HB3    92 PRO  HD3     5.50                
 91 GLN  HB3    95 GLN  HN      4.94                
 91 GLN  HB3    95 GLN  QG      4.83                
 91 GLN  HB3    96 LEU  QD1     8.28                
 91 GLN  HB3    96 LEU  QD2     8.28                
 91 GLN  QB     92 PRO  QD      4.79                
 91 GLN  QB     95 GLN  QG      4.20                
 91 GLN  QB     96 LEU  HN      6.38                
 91 GLN  QB     96 LEU  QQD     7.24                
 91 GLN  QB     99 GLN  QG      7.16                
 91 GLN  QG     96 LEU  QD1     7.40                
 91 GLN  QG     96 LEU  QD2     7.40                
 92 PRO  HA     93 LYS+ HN      2.55                
 92 PRO  HA     94 GLU- HN      5.34                
 92 PRO  HD2    95 GLN  HB2     7.22                
 92 PRO  HD2    95 GLN  HB3     7.22                
 92 PRO  HD2    95 GLN  QG      6.10                
 92 PRO  HD3    95 GLN  HB2     7.22                
 92 PRO  HD3    95 GLN  HB3     7.22                
 92 PRO  HD3    95 GLN  QG      6.10                
 92 PRO  QD     95 GLN  HN      6.38                
 92 PRO  QD     95 GLN  QB      5.49                
 92 PRO  QD     95 GLN  QG      5.60                
 93 LYS+ HN     93 LYS+ HB2     2.49                
 93 LYS+ HN     93 LYS+ HB3     3.33                
 93 LYS+ HN     93 LYS+ QG      5.88                
 93 LYS+ HN     93 LYS+ QD      4.95                
 93 LYS+ HN     94 GLU- HN      3.27                
 93 LYS+ HN     96 LEU  QQD     8.10                
 93 LYS+ HA     93 LYS+ QE      6.38                
 93 LYS+ HA     95 GLN  HN      4.69                
 93 LYS+ HA     96 LEU  HB2     3.48                
 93 LYS+ HA     96 LEU  HB3     3.11                
 93 LYS+ HA     97 GLU- QG      6.38                
 93 LYS+ HB2    93 LYS+ QE      6.04                
 93 LYS+ HB2    94 GLU- HN      3.02                
 93 LYS+ HB3    93 LYS+ QE      4.95                
 93 LYS+ HB3    94 GLU- HN      3.02                
 93 LYS+ QG     97 GLU- QG      7.25                
 93 LYS+ QD     94 GLU- HN      6.38                
 93 LYS+ QD     96 LEU  QD1     6.63                
 93 LYS+ QD     96 LEU  QD2     6.63                
 94 GLU- HN     94 GLU- QB      3.65                
 94 GLU- HN     94 GLU- HG2     5.28                
 94 GLU- HN     94 GLU- HG3     5.28                
 94 GLU- HN     94 GLU- QG      4.66                
 94 GLU- HN     95 GLN  HN      3.02                
 94 GLU- HA     94 GLU- HG2     3.48                
 94 GLU- HA     94 GLU- HG3     3.48                
 94 GLU- HA     94 GLU- QG      3.05                
 94 GLU- HA     96 LEU  HN      5.10                
 94 GLU- HA     97 GLU- HN      4.69                
 94 GLU- HA     97 GLU- QB      4.02                
 94 GLU- HA     97 GLU- QG      6.38                
 95 GLN  HN     95 GLN  QG      4.92                
 95 GLN  HN     96 LEU  HN      2.65                
 95 GLN  HN     97 GLU- HN      4.14                
 95 GLN  HN     99 GLN  HN      5.47                
 95 GLN  HA     98 ALA  HN      3.55                
 95 GLN  HA     98 ALA  QB      3.77                
 95 GLN  HA     99 GLN  HN      5.13                
 95 GLN  HB2    96 LEU  HN      3.36                
 95 GLN  HB3    96 LEU  HN      3.36                
 95 GLN  QG     96 LEU  HN      6.38                
 96 LEU  HN     96 LEU  HB2     2.93                
 96 LEU  HN     96 LEU  HB3     2.80                
 96 LEU  HN     96 LEU  QQD     7.20                
 96 LEU  HN     97 GLU- HN      2.99                
 96 LEU  HN     98 ALA  HN      3.83                
 96 LEU  HN    100 LEU  QQD     8.10                
 96 LEU  HA     96 LEU  HB2     2.74                
 96 LEU  HA     96 LEU  HB3     2.86                
 96 LEU  HA     96 LEU  QD1     4.92                
 96 LEU  HA     96 LEU  QD2     4.92                
 96 LEU  HA     98 ALA  HN      5.50                
 96 LEU  HA     99 GLN  HB2     4.14                
 96 LEU  HA     99 GLN  HB3     4.14                
 96 LEU  HA     99 GLN  QB      3.76                
 96 LEU  HA    100 LEU  QB      4.86                
 96 LEU  HA    100 LEU  QD1     6.53                
 96 LEU  HA    100 LEU  QD2     6.53                
 96 LEU  HA    100 LEU  QQD     5.75                
 96 LEU  HB2    97 GLU- HN      3.64                
 96 LEU  HB2    98 ALA  HN      5.19                
 96 LEU  HB3    97 GLU- HN      3.61                
 96 LEU  HB3    98 ALA  HN      5.50                
 96 LEU  QD1   100 LEU  HB2     8.28                
 96 LEU  QD1   100 LEU  HB3     8.28                
 96 LEU  QD2   100 LEU  HB2     8.28                
 96 LEU  QD2   100 LEU  HB3     8.28                
 96 LEU  QQD    97 GLU- HN      8.10                
 96 LEU  QQD    97 GLU- QB      8.98                
 96 LEU  QQD    99 GLN  QB      8.98                
 96 LEU  QQD   100 LEU  QB      6.52                
 97 GLU- HN     97 GLU- HB2     3.24                
 97 GLU- HN     97 GLU- HB3     3.24                
 97 GLU- HN     97 GLU- QB      2.81                
 97 GLU- HN     97 GLU- QG      4.89                
 97 GLU- HN     98 ALA  HN      2.96                
 97 GLU- HN     98 ALA  QB      6.53                
 97 GLU- HN     99 GLN  HN      4.48                
 97 GLU- HA     97 GLU- HB2     2.99                
 97 GLU- HA     97 GLU- HB3     2.99                
 97 GLU- HA    100 LEU  HB2     4.38                
 97 GLU- HA    100 LEU  HB3     4.38                
 97 GLU- HA    100 LEU  QB      4.23                
 97 GLU- HB2   104 LEU  QD1     8.28                
 97 GLU- HB2   104 LEU  QD2     8.28                
 97 GLU- HB3   104 LEU  QD1     8.28                
 97 GLU- HB3   104 LEU  QD2     8.28                
 97 GLU- QB     98 ALA  HN      3.78                
 97 GLU- QB    104 LEU  QQD     7.24                
 97 GLU- QG    104 LEU  QQD     8.97                
 98 ALA  HN     98 ALA  HA      2.93                
 98 ALA  HN     98 ALA  QB      3.58                
 98 ALA  HN     99 GLN  HN      2.96                
 98 ALA  HA    101 ALA  HN      3.45                
 98 ALA  HA    101 ALA  QB      3.61                
 99 GLN  HN     99 GLN  QG      4.45                
 99 GLN  HN    100 LEU  HN      2.83                
 99 GLN  HN    101 ALA  HN      4.38                
 99 GLN  HA     99 GLN  QB      2.73                
 99 GLN  HA    100 LEU  HN      3.64                
 99 GLN  HA    100 LEU  QQD     8.10                
 99 GLN  HA    102 ASP- HN      5.50                
 99 GLN  HB2   100 LEU  HN      3.76                
 99 GLN  HB2   100 LEU  QD1     8.68                
 99 GLN  HB2   100 LEU  QD2     8.68                
 99 GLN  HB3   100 LEU  HN      3.76                
 99 GLN  HB3   100 LEU  QD1     8.68                
 99 GLN  HB3   100 LEU  QD2     8.68                
 99 GLN  QB    100 LEU  HN      3.38                
 99 GLN  QB    100 LEU  QQD     6.90                
 99 GLN  QG    100 LEU  HN      6.38                
100 LEU  HN    100 LEU  HB2     3.08                
100 LEU  HN    100 LEU  HB3     3.08                
100 LEU  HN    100 LEU  QD1     5.35                
100 LEU  HN    100 LEU  QD2     5.35                
100 LEU  HN    100 LEU  QQD     4.99                
100 LEU  HN    101 ALA  HN      2.74                
100 LEU  HA    100 LEU  HB2     2.90                
100 LEU  HA    100 LEU  HB3     2.90                
100 LEU  HA    100 LEU  QB      2.70                
100 LEU  HA    100 LEU  HG      2.80                
100 LEU  HA    100 LEU  QD1     5.35                
100 LEU  HA    100 LEU  QD2     5.35                
100 LEU  HA    101 ALA  HN      3.39                
100 LEU  HA    102 ASP- HN      3.89                
100 LEU  HA    103 VAL  HN      4.07                
100 LEU  HA    103 VAL  HB      5.50                
100 LEU  QB    101 ALA  HN      5.42                
100 LEU  QB    103 VAL  HN      5.54                
100 LEU  QQD   101 ALA  HN      8.10                
100 LEU  QQD   102 ASP- HN      8.10                
100 LEU  QQD   103 VAL  HN      8.10                
100 LEU  QQD   103 VAL  HB      7.73                
100 LEU  QQD   103 VAL  QQG    10.69                
100 LEU  QQD   104 LEU  HN      8.10                
101 ALA  HN    101 ALA  HA      2.83                
101 ALA  HN    101 ALA  QB      3.55                
101 ALA  HN    102 ASP- HN      3.27                
101 ALA  HN    103 VAL  HN      4.51                
101 ALA  HN    104 LEU  HN      4.85                
101 ALA  HN    104 LEU  QQD     8.10                
101 ALA  HA    102 ASP- HN      3.61                
101 ALA  HA    103 VAL  HN      4.72                
101 ALA  HA    104 LEU  HN      3.55                
101 ALA  HA    104 LEU  HB2     3.33                
101 ALA  HA    104 LEU  HB3     3.33                
101 ALA  HA    104 LEU  QB      2.93                
101 ALA  HA    104 LEU  HG      4.82                
101 ALA  HA    104 LEU  QQD     5.96                
101 ALA  HA    105 GLN  HN      5.10                
101 ALA  QB    102 ASP- HN      4.14                
101 ALA  QB    104 LEU  QQD     9.13                
102 ASP- HN    102 ASP- HA      2.90                
102 ASP- HN    103 VAL  HN      2.80                
102 ASP- HN    103 VAL  QQG     7.53                
102 ASP- HN    104 LEU  HN      4.07                
102 ASP- HA    102 ASP- HB2     3.02                
102 ASP- HA    102 ASP- HB3     3.02                
102 ASP- HA    103 VAL  HN      3.48                
102 ASP- HA    105 GLN  HN      4.23                
102 ASP- HA    105 GLN  HB2     3.70                
102 ASP- HA    105 GLN  HB3     3.70                
102 ASP- HA    105 GLN  QB      3.33                
102 ASP- HB2   103 VAL  QG1     8.28                
102 ASP- HB2   103 VAL  QG2     8.28                
102 ASP- HB3   103 VAL  QG1     8.28                
102 ASP- HB3   103 VAL  QG2     8.28                
102 ASP- QB    103 VAL  QQG     7.24                
103 VAL  HN    103 VAL  HB      3.33                
103 VAL  HN    103 VAL  QQG     4.01                
103 VAL  HN    104 LEU  HN      2.55                
103 VAL  HN    104 LEU  QB      4.61                
103 VAL  HN    104 LEU  QQD     8.10                
103 VAL  HA    103 VAL  HB      2.83                
103 VAL  HA    104 LEU  QD1     6.53                
103 VAL  HA    104 LEU  QD2     6.53                
103 VAL  HB    104 LEU  HN      4.45                
103 VAL  HB    104 LEU  QD1     6.53                
103 VAL  HB    104 LEU  QD2     6.53                
103 VAL  QG1   104 LEU  QD1    10.68                
103 VAL  QG1   104 LEU  QD2    10.68                
103 VAL  QG2   104 LEU  QD1    10.68                
103 VAL  QG2   104 LEU  QD2    10.68                
103 VAL  QQG   104 LEU  HN      6.35                
103 VAL  QQG   104 LEU  QQD     8.15                
103 VAL  QQG   105 GLN  HN      8.09                
104 LEU  HN    104 LEU  HB2     3.33                
104 LEU  HN    104 LEU  HB3     3.33                
104 LEU  HN    104 LEU  QB      2.96                
104 LEU  HN    104 LEU  QQD     6.52                
104 LEU  HN    105 GLN  HN      2.40                
104 LEU  HN    105 GLN  QB      6.35                
104 LEU  HB2   104 LEU  HG      2.59                
104 LEU  HB2   105 GLN  HN      4.35                
104 LEU  HB3   104 LEU  HG      2.59                
104 LEU  HB3   105 GLN  HN      4.35                
104 LEU  QB    104 LEU  HG      2.34                
104 LEU  QB    105 GLN  HN      4.14                
104 LEU  QQD   105 GLN  HN      8.10                
105 GLN  HN    105 GLN  HB2     3.45                
105 GLN  HN    105 GLN  HB3     3.45                
105 GLN  HN    105 GLN  QB      3.09                
105 GLN  HN    105 GLN  QG      5.54                
105 GLN  HA    105 GLN  HB2     2.90                
105 GLN  HA    105 GLN  HB3     2.90                
105 GLN  HA    105 GLN  QB      2.62                



  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    ALA   1           H        ALA   1  -9.735   5.046   9.722
    2   2H    ALA   1          2HN       ALA   1 -11.108   5.507   8.932
    3   3H    ALA   1          3HN       ALA   1 -11.164   4.322  10.089
    4    HA   ALA   1           HA       ALA   1 -11.316   3.387   7.910
    5   1HB   ALA   1          1HB       ALA   1  -8.529   4.576   7.552
    6   2HB   ALA   1          2HB       ALA   1  -9.398   3.562   6.384
    7   3HB   ALA   1          3HB       ALA   1 -10.018   5.163   6.769
    8    H    THR   2           H        THR   2  -9.533   1.587   7.138
    9    HA   THR   2           HA       THR   2  -8.919  -0.222   9.191
   10    HB   THR   2           HB       THR   2  -7.738   0.122   6.430
   11    HG1  THR   2           1HG      THR   2  -9.658  -0.137   5.653
   12   1HG2  THR   2          1HG2      THR   2  -8.260  -2.397   8.056
   13   2HG2  THR   2          2HG2      THR   2  -7.970  -2.414   6.304
   14   3HG2  THR   2          3HG2      THR   2  -6.707  -1.830   7.377
   15    H    MET   3           H        MET   3  -6.391  -1.097   9.134
   16    HA   MET   3           HA       MET   3  -4.391   0.898   9.182
   17   1HB   MET   3          1HB       MET   3  -5.881   0.733  11.577
   18   2HB   MET   3          2HB       MET   3  -4.501  -0.298  11.906
   19   1HG   MET   3          1HG       MET   3  -4.463   2.601  10.973
   20   2HG   MET   3          2HG       MET   3  -4.123   2.019  12.602
   21   1HE   MET   3          1HE       MET   3  -2.254   4.089  11.199
   22   2HE   MET   3          2HE       MET   3  -1.905   3.393  12.799
   23   3HE   MET   3          3HE       MET   3  -0.644   3.417  11.547
   24    H    THR   4           H        THR   4  -2.485  -0.577  10.671
   25    HA   THR   4           HA       THR   4  -1.500  -2.455   9.077
   26    HB   THR   4           HB       THR   4  -1.339  -2.436  12.087
   27    HG1  THR   4           1HG      THR   4   0.304  -0.934  11.747
   28   1HG2  THR   4          1HG2      THR   4  -0.147  -4.394  11.094
   29   2HG2  THR   4          2HG2      THR   4   0.789  -3.283  10.072
   30   3HG2  THR   4          3HG2      THR   4   0.964  -3.237  11.834
   31    H    LEU   5           H        LEU   5  -1.575  -4.639   8.703
   32    HA   LEU   5           HA       LEU   5  -3.483  -6.396  10.120
   33   1HB   LEU   5          1HB       LEU   5  -4.779  -6.916   8.343
   34   2HB   LEU   5          2HB       LEU   5  -4.732  -5.169   8.374
   35    HG   LEU   5           HG       LEU   5  -3.364  -7.060   6.408
   36   1HD1  LEU   5          1HD1      LEU   5  -5.480  -4.873   6.173
   37   2HD1  LEU   5          2HD1      LEU   5  -4.813  -5.796   4.812
   38   3HD1  LEU   5          3HD1      LEU   5  -5.750  -6.612   6.078
   39   1HD2  LEU   5          1HD2      LEU   5  -2.604  -4.946   5.229
   40   2HD2  LEU   5          2HD2      LEU   5  -2.977  -4.058   6.731
   41   3HD2  LEU   5          3HD2      LEU   5  -1.742  -5.320   6.717
   42    H    THR   6           H        THR   6  -3.395  -8.709   9.002
   43    HA   THR   6           HA       THR   6  -0.653  -9.367   8.343
   44    HB   THR   6           HB       THR   6  -1.021  -9.661  10.785
   45    HG1  THR   6           1HG      THR   6   0.426 -11.023  10.077
   46   1HG2  THR   6          1HG2      THR   6  -3.463 -10.139  10.828
   47   2HG2  THR   6          2HG2      THR   6  -3.163 -11.695  10.012
   48   3HG2  THR   6          3HG2      THR   6  -2.515 -11.398  11.635
   49    H    ASP   7           H        ASP   7  -0.997 -11.796   8.011
   50    HA   ASP   7           HA       ASP   7  -1.557 -11.805   5.296
   51   1HB   ASP   7          1HB       ASP   7   0.031 -13.338   6.319
   52   2HB   ASP   7          2HB       ASP   7  -1.268 -14.244   7.084
   53    H    ALA   8           H        ALA   8  -3.484 -13.717   7.598
   54    HA   ALA   8           HA       ALA   8  -5.589 -14.379   5.803
   55   1HB   ALA   8          1HB       ALA   8  -5.615 -14.024   8.852
   56   2HB   ALA   8          2HB       ALA   8  -6.788 -14.969   7.909
   57   3HB   ALA   8          3HB       ALA   8  -5.087 -15.496   8.000
   58    H    ASN   9           H        ASN   9  -4.960 -11.301   7.219
   59    HA   ASN   9           HA       ASN   9  -7.805 -10.490   6.835
   60   1HB   ASN   9          1HB       ASN   9  -6.831 -10.104   9.093
   61   2HB   ASN   9          2HB       ASN   9  -5.676  -9.008   8.331
   62   1HD2  ASN   9          1HD2      ASN   9  -9.291  -9.597   8.557
   63   2HD2  ASN   9          2HD2      ASN   9  -9.641  -7.879   8.520
   64    H    PHE  10           H        PHE  10  -4.590 -10.202   5.485
   65    HA   PHE  10           HA       PHE  10  -4.718  -7.874   3.956
   66   1HB   PHE  10          1HB       PHE  10  -2.816  -9.493   4.104
   67   2HB   PHE  10          2HB       PHE  10  -3.713 -10.621   3.102
   68    HD1  PHE  10           1HD      PHE  10  -4.104 -10.202   0.681
   69    HD2  PHE  10           2HD      PHE  10  -1.597  -7.629   3.100
   70    HE1  PHE  10           1HE      PHE  10  -3.115  -9.246  -1.355
   71    HE2  PHE  10           2HE      PHE  10  -0.601  -6.717   1.062
   72    HZ   PHE  10           HZ       PHE  10  -1.357  -7.504  -1.187
   73    H    GLN  11           H        GLN  11  -5.898 -11.098   3.064
   74    HA   GLN  11           HA       GLN  11  -7.407 -10.520   0.757
   75   1HB   GLN  11          1HB       GLN  11  -7.444 -12.620   2.963
   76   2HB   GLN  11          2HB       GLN  11  -8.721 -12.643   1.752
   77   1HG   GLN  11          1HG       GLN  11  -5.739 -12.672   1.152
   78   2HG   GLN  11          2HG       GLN  11  -6.786 -14.097   1.185
   79   1HE2  GLN  11          1HE2      GLN  11  -5.254 -13.435  -1.065
   80   2HE2  GLN  11          2HE2      GLN  11  -6.324 -12.937  -2.386
   81    H    GLN  12           H        GLN  12  -8.607 -10.645   4.148
   82    HA   GLN  12           HA       GLN  12 -11.288  -9.948   3.450
   83   1HB   GLN  12          1HB       GLN  12  -9.772  -9.609   6.071
   84   2HB   GLN  12          2HB       GLN  12 -11.519  -9.445   5.898
   85   1HG   GLN  12          1HG       GLN  12 -11.749 -11.789   5.282
   86   2HG   GLN  12          2HG       GLN  12  -9.995 -12.014   5.279
   87   1HE2  GLN  12          1HE2      GLN  12  -9.008 -12.630   7.209
   88   2HE2  GLN  12          2HE2      GLN  12  -9.870 -12.621   8.759
   89    H    ALA  13           H        ALA  13  -8.423  -7.929   3.879
   90    HA   ALA  13           HA       ALA  13  -9.972  -5.479   3.926
   91   1HB   ALA  13          1HB       ALA  13  -7.834  -4.344   3.589
   92   2HB   ALA  13          2HB       ALA  13  -7.737  -5.518   4.914
   93   3HB   ALA  13          3HB       ALA  13  -7.014  -5.896   3.336
   94    H    ILE  14           H        ILE  14  -7.815  -7.044   1.462
   95    HA   ILE  14           HA       ILE  14  -8.457  -5.186  -0.520
   96    HB   ILE  14           HB       ILE  14  -7.426  -6.703  -2.125
   97   1HG1  ILE  14          1HG1      ILE  14  -6.791  -8.727  -0.046
   98   2HG1  ILE  14          2HG1      ILE  14  -8.285  -8.875  -0.988
   99   1HG2  ILE  14          1HG2      ILE  14  -5.888  -6.496   0.507
  100   2HG2  ILE  14          2HG2      ILE  14  -5.182  -6.688  -1.098
  101   3HG2  ILE  14          3HG2      ILE  14  -6.064  -5.208  -0.696
  102   1HD1  ILE  14          1HD1      ILE  14  -6.966  -8.859  -3.077
  103   2HD1  ILE  14          2HD1      ILE  14  -5.465  -8.729  -2.131
  104   3HD1  ILE  14          3HD1      ILE  14  -6.477 -10.175  -1.995
  105    H    GLN  15           H        GLN  15 -10.290  -7.999   0.294
  106    HA   GLN  15           HA       GLN  15 -11.910  -8.153  -2.045
  107   1HB   GLN  15          1HB       GLN  15 -13.450  -9.460  -0.729
  108   2HB   GLN  15          2HB       GLN  15 -11.788  -9.905  -0.369
  109   1HG   GLN  15          1HG       GLN  15 -12.877  -9.950   1.685
  110   2HG   GLN  15          2HG       GLN  15 -11.915  -8.476   1.682
  111   1HE2  GLN  15          1HE2      GLN  15 -13.062  -7.205   3.131
  112   2HE2  GLN  15          2HE2      GLN  15 -14.771  -6.794   2.895
  113    H    GLY  16           H        GLY  16 -11.901  -5.647   0.435
  114   1HA   GLY  16          1HA       GLY  16 -14.647  -5.084   0.528
  115   2HA   GLY  16          2HA       GLY  16 -13.321  -4.005   0.996
  116    H    ASP  17           H        ASP  17 -15.832  -3.366  -0.314
  117    HA   ASP  17           HA       ASP  17 -15.198  -2.659  -3.095
  118   1HB   ASP  17          1HB       ASP  17 -17.390  -3.663  -2.511
  119   2HB   ASP  17          2HB       ASP  17 -17.771  -2.238  -1.538
  120    H    GLY  18           H        GLY  18 -13.452  -1.439  -1.630
  121   1HA   GLY  18          1HA       GLY  18 -13.968   1.343  -2.292
  122   2HA   GLY  18          2HA       GLY  18 -13.771   1.090  -0.545
  123    HA   PRO  19           HA       PRO  19  -9.643   1.371  -2.982
  124   1HB   PRO  19          1HB       PRO  19  -8.708   3.798  -1.933
  125   2HB   PRO  19          2HB       PRO  19  -9.599   3.621  -3.457
  126   1HG   PRO  19          1HG       PRO  19 -10.713   4.338  -0.754
  127   2HG   PRO  19          2HG       PRO  19 -11.065   5.093  -2.338
  128   1HD   PRO  19          1HD       PRO  19 -12.731   3.291  -1.200
  129   2HD   PRO  19          2HD       PRO  19 -12.441   3.263  -2.964
  130    H    VAL  20           H        VAL  20  -8.830  -0.348  -1.873
  131    HA   VAL  20           HA       VAL  20  -7.846   0.032   0.887
  132    HB   VAL  20           HB       VAL  20  -8.290  -2.424  -0.833
  133   1HG1  VAL  20          1HG1      VAL  20  -6.883  -2.306   1.884
  134   2HG1  VAL  20          2HG1      VAL  20  -7.496  -3.776   1.113
  135   3HG1  VAL  20          3HG1      VAL  20  -6.183  -2.879   0.357
  136   1HG2  VAL  20          1HG2      VAL  20  -9.343  -1.531   1.889
  137   2HG2  VAL  20          2HG2      VAL  20 -10.220  -1.403   0.359
  138   3HG2  VAL  20          3HG2      VAL  20  -9.811  -2.991   1.001
  139    H    LEU  21           H        LEU  21  -6.075   1.151   0.856
  140    HA   LEU  21           HA       LEU  21  -3.901   0.650  -1.084
  141   1HB   LEU  21          1HB       LEU  21  -4.562   2.928  -0.239
  142   2HB   LEU  21          2HB       LEU  21  -3.998   2.456   1.357
  143    HG   LEU  21           HG       LEU  21  -2.257   2.592  -1.119
  144   1HD1  LEU  21          1HD1      LEU  21  -3.152   4.741  -0.388
  145   2HD1  LEU  21          2HD1      LEU  21  -2.611   4.446   1.279
  146   3HD1  LEU  21          3HD1      LEU  21  -1.420   4.654  -0.009
  147   1HD2  LEU  21          1HD2      LEU  21  -0.426   2.640   0.742
  148   2HD2  LEU  21          2HD2      LEU  21  -1.653   1.903   1.785
  149   3HD2  LEU  21          3HD2      LEU  21  -1.120   1.081   0.312
  150    H    VAL  22           H        VAL  22  -2.664  -1.097  -0.737
  151    HA   VAL  22           HA       VAL  22  -2.354  -2.126   2.025
  152    HB   VAL  22           HB       VAL  22  -3.140  -3.421  -0.358
  153   1HG1  VAL  22          1HG1      VAL  22  -0.393  -4.417   0.452
  154   2HG1  VAL  22          2HG1      VAL  22  -1.533  -5.204  -0.665
  155   3HG1  VAL  22          3HG1      VAL  22  -0.819  -3.659  -1.102
  156   1HG2  VAL  22          1HG2      VAL  22  -2.219  -4.603   2.285
  157   2HG2  VAL  22          2HG2      VAL  22  -3.831  -3.938   1.940
  158   3HG2  VAL  22          3HG2      VAL  22  -3.278  -5.377   1.079
  159    H    ASP  23           H        ASP  23  -0.507  -1.551   2.994
  160    HA   ASP  23           HA       ASP  23   1.471  -0.125   1.310
  161   1HB   ASP  23          1HB       ASP  23  -0.037   0.575   3.600
  162   2HB   ASP  23          2HB       ASP  23   1.579   0.271   4.219
  163    H    PHE  24           H        PHE  24   2.939  -1.681   0.696
  164    HA   PHE  24           HA       PHE  24   3.762  -3.782   2.601
  165   1HB   PHE  24          1HB       PHE  24   4.268  -3.272  -0.329
  166   2HB   PHE  24          2HB       PHE  24   5.111  -4.498   0.568
  167    HD1  PHE  24           1HD      PHE  24   3.790  -6.210   1.857
  168    HD2  PHE  24           2HD      PHE  24   2.187  -3.906  -1.404
  169    HE1  PHE  24           1HE      PHE  24   2.408  -8.144   1.186
  170    HE2  PHE  24           2HE      PHE  24   0.753  -5.829  -2.039
  171    HZ   PHE  24           HZ       PHE  24   0.983  -8.009  -0.802
  172    H    TRP  25           H        TRP  25   5.326  -3.337   3.926
  173    HA   TRP  25           HA       TRP  25   7.783  -2.014   2.951
  174   1HB   TRP  25          1HB       TRP  25   8.088  -0.857   5.030
  175   2HB   TRP  25          2HB       TRP  25   6.513  -0.408   4.405
  176    HD1  TRP  25           HD       TRP  25   4.357  -1.696   5.638
  177    HE1  TRP  25           1HE      TRP  25   4.067  -2.496   8.053
  178    HE3  TRP  25           3HE      TRP  25   9.245  -1.506   7.157
  179    HZ2  TRP  25           2HZ      TRP  25   5.798  -3.276  10.278
  180    HZ3  TRP  25           3HZ      TRP  25   9.890  -2.278   9.412
  181    HH2  TRP  25           HH       TRP  25   8.181  -3.205  10.964
  182    H    ALA  26           H        ALA  26   9.527  -2.745   4.990
  183    HA   ALA  26           HA       ALA  26   8.816  -5.354   6.007
  184   1HB   ALA  26          1HB       ALA  26  11.353  -5.169   4.346
  185   2HB   ALA  26          2HB       ALA  26  10.581  -6.602   5.027
  186   3HB   ALA  26          3HB       ALA  26   9.839  -5.755   3.658
  187    H    ALA  27           H        ALA  27  10.261  -6.016   7.623
  188    HA   ALA  27           HA       ALA  27  11.211  -4.098   9.348
  189   1HB   ALA  27          1HB       ALA  27  11.964  -7.038   9.180
  190   2HB   ALA  27          2HB       ALA  27  12.087  -6.008  10.626
  191   3HB   ALA  27          3HB       ALA  27  10.497  -6.370   9.933
  192    H    TRP  28           H        TRP  28  12.918  -4.675   6.530
  193    HA   TRP  28           HA       TRP  28  15.443  -3.767   7.823
  194   1HB   TRP  28          1HB       TRP  28  16.711  -5.432   7.131
  195   2HB   TRP  28          2HB       TRP  28  15.224  -6.349   7.116
  196    HD1  TRP  28           HD       TRP  28  18.031  -5.164   5.030
  197    HE1  TRP  28           1HE      TRP  28  17.765  -5.727   2.552
  198    HE3  TRP  28           3HE      TRP  28  13.163  -6.804   5.075
  199    HZ2  TRP  28           2HZ      TRP  28  15.652  -6.546   0.770
  200    HZ3  TRP  28           3HZ      TRP  28  12.037  -7.420   2.941
  201    HH2  TRP  28           HH       TRP  28  13.284  -7.261   0.795
  202    H    CYS  29           H        CYS  29  13.240  -3.293   5.122
  203    HA   CYS  29           HA       CYS  29  15.290  -2.696   3.223
  204   1HB   CYS  29          1HB       CYS  29  13.295  -1.755   1.877
  205   2HB   CYS  29          2HB       CYS  29  13.509  -3.462   2.159
  206    H    GLY  30           H        GLY  30  16.652  -1.077   3.844
  207   1HA   GLY  30          1HA       GLY  30  16.604   1.296   4.931
  208   2HA   GLY  30          2HA       GLY  30  17.351   1.122   3.345
  209    HA   PRO  31           HA       PRO  31  14.494   4.004   1.648
  210   1HB   PRO  31          1HB       PRO  31  13.198   2.932  -0.540
  211   2HB   PRO  31          2HB       PRO  31  14.928   3.398  -0.517
  212   1HG   PRO  31          1HG       PRO  31  13.733   0.644  -0.086
  213   2HG   PRO  31          2HG       PRO  31  15.106   1.103  -1.142
  214   1HD   PRO  31          1HD       PRO  31  15.506   0.070   1.324
  215   2HD   PRO  31          2HD       PRO  31  16.553   1.385   0.717
  216    H    CYS  32           H        CYS  32  12.850   0.876   2.378
  217    HA   CYS  32           HA       CYS  32  10.214   2.130   2.353
  218   1HB   CYS  32          1HB       CYS  32   9.317   0.116   3.017
  219   2HB   CYS  32          2HB       CYS  32  10.632  -0.351   1.951
  220    H    ARG  33           H        ARG  33  12.810   1.561   4.732
  221    HA   ARG  33           HA       ARG  33  11.337   2.431   7.025
  222   1HB   ARG  33          1HB       ARG  33  13.586   1.273   6.958
  223   2HB   ARG  33          2HB       ARG  33  14.303   2.800   6.497
  224   1HG   ARG  33          1HG       ARG  33  12.659   2.924   8.980
  225   2HG   ARG  33          2HG       ARG  33  13.968   1.755   9.042
  226   1HD   ARG  33          1HD       ARG  33  14.866   3.720   9.903
  227   2HD   ARG  33          2HD       ARG  33  15.574   3.552   8.290
  228    HE   ARG  33           HE       ARG  33  13.156   5.089   8.219
  229   1HH1  ARG  33          2HH2      ARG  33  16.543   5.502   9.147
  230   2HH1  ARG  33          1HH2      ARG  33  16.596   7.195   8.782
  231   1HH2  ARG  33          2HH1      ARG  33  13.182   7.261   7.744
  232   2HH2  ARG  33          1HH1      ARG  33  14.596   8.240   7.963
  233    H    MET  34           H        MET  34  12.517   4.274   4.277
  234    HA   MET  34           HA       MET  34  12.149   6.845   5.673
  235   1HB   MET  34          1HB       MET  34  13.261   6.063   2.944
  236   2HB   MET  34          2HB       MET  34  13.124   7.729   3.507
  237   1HG   MET  34          1HG       MET  34  14.817   7.503   5.078
  238   2HG   MET  34          2HG       MET  34  14.626   5.761   5.227
  239   1HE   MET  34          1HE       MET  34  14.901   7.241   1.529
  240   2HE   MET  34          2HE       MET  34  15.610   8.508   2.564
  241   3HE   MET  34          3HE       MET  34  16.642   7.568   1.460
  242    H    MET  35           H        MET  35  10.636   4.765   3.285
  243    HA   MET  35           HA       MET  35   8.773   6.791   2.405
  244   1HB   MET  35          1HB       MET  35   9.621   4.709   1.066
  245   2HB   MET  35          2HB       MET  35   8.369   3.825   1.955
  246   1HG   MET  35          1HG       MET  35   6.724   5.517   1.117
  247   2HG   MET  35          2HG       MET  35   8.022   6.350   0.277
  248   1HE   MET  35          1HE       MET  35   5.471   5.653  -1.187
  249   2HE   MET  35          2HE       MET  35   6.888   6.336  -2.008
  250   3HE   MET  35          3HE       MET  35   6.059   4.919  -2.702
  251    H    ALA  36           H        ALA  36   8.753   4.008   4.741
  252    HA   ALA  36           HA       ALA  36   6.071   3.972   5.402
  253   1HB   ALA  36          1HB       ALA  36   7.604   2.337   6.273
  254   2HB   ALA  36          2HB       ALA  36   8.471   3.559   7.224
  255   3HB   ALA  36          3HB       ALA  36   6.792   3.141   7.627
  256    HA   PRO  37           HA       PRO  37   6.399   7.681   8.388
  257   1HB   PRO  37          1HB       PRO  37   8.510   9.464   8.122
  258   2HB   PRO  37          2HB       PRO  37   8.449   8.112   9.300
  259   1HG   PRO  37          1HG       PRO  37   9.787   8.194   6.611
  260   2HG   PRO  37          2HG       PRO  37  10.438   7.567   8.155
  261   1HD   PRO  37          1HD       PRO  37   9.400   5.894   6.311
  262   2HD   PRO  37          2HD       PRO  37   9.109   5.624   8.048
  263    H    VAL  38           H        VAL  38   7.679   8.009   4.971
  264    HA   VAL  38           HA       VAL  38   6.246  10.497   4.582
  265    HB   VAL  38           HB       VAL  38   7.973   8.786   3.069
  266   1HG1  VAL  38          1HG1      VAL  38   5.546   9.663   1.469
  267   2HG1  VAL  38          2HG1      VAL  38   7.073   9.076   0.792
  268   3HG1  VAL  38          3HG1      VAL  38   6.081   7.997   1.762
  269   1HG2  VAL  38          1HG2      VAL  38   8.412  11.100   3.576
  270   2HG2  VAL  38          2HG2      VAL  38   8.368  10.888   1.818
  271   3HG2  VAL  38          3HG2      VAL  38   6.999  11.623   2.645
  272    H    LEU  39           H        LEU  39   5.376   7.067   4.317
  273    HA   LEU  39           HA       LEU  39   2.824   7.434   3.188
  274   1HB   LEU  39          1HB       LEU  39   4.246   5.124   4.520
  275   2HB   LEU  39          2HB       LEU  39   2.664   4.990   3.796
  276    HG   LEU  39           HG       LEU  39   5.022   5.961   2.189
  277   1HD1  LEU  39          1HD1      LEU  39   5.629   3.751   3.055
  278   2HD1  LEU  39          2HD1      LEU  39   4.059   3.102   2.558
  279   3HD1  LEU  39          3HD1      LEU  39   5.224   3.619   1.334
  280   1HD2  LEU  39          1HD2      LEU  39   2.909   6.444   1.144
  281   2HD2  LEU  39          2HD2      LEU  39   3.755   5.165   0.268
  282   3HD2  LEU  39          3HD2      LEU  39   2.406   4.740   1.337
  283    H    GLU  40           H        GLU  40   3.980   8.027   6.343
  284    HA   GLU  40           HA       GLU  40   1.531   7.349   7.793
  285   1HB   GLU  40          1HB       GLU  40   3.855   7.289   8.737
  286   2HB   GLU  40          2HB       GLU  40   3.918   9.051   8.640
  287   1HG   GLU  40          1HG       GLU  40   2.308   9.340  10.322
  288   2HG   GLU  40          2HG       GLU  40   1.641   7.711  10.108
  289    H    GLU  41           H        GLU  41   3.229  10.314   6.634
  290    HA   GLU  41           HA       GLU  41   1.023  12.112   6.998
  291   1HB   GLU  41          1HB       GLU  41   3.430  12.722   6.559
  292   2HB   GLU  41          2HB       GLU  41   3.218  12.161   4.903
  293   1HG   GLU  41          1HG       GLU  41   1.247  13.904   4.811
  294   2HG   GLU  41          2HG       GLU  41   1.994  14.585   6.266
  295    H    PHE  42           H        PHE  42   2.017  10.027   4.187
  296    HA   PHE  42           HA       PHE  42  -0.280  10.703   2.589
  297   1HB   PHE  42          1HB       PHE  42   1.855   9.427   1.846
  298   2HB   PHE  42          2HB       PHE  42   1.056   8.006   2.543
  299    HD1  PHE  42           1HD      PHE  42   0.890  10.462  -0.232
  300    HD2  PHE  42           2HD      PHE  42  -0.849   6.933   1.544
  301    HE1  PHE  42           1HE      PHE  42  -0.581  10.165  -2.209
  302    HE2  PHE  42           2HE      PHE  42  -2.393   6.753  -0.389
  303    HZ   PHE  42           HZ       PHE  42  -2.304   8.372  -2.220
  304    H    ALA  43           H        ALA  43  -0.157   8.643   5.501
  305    HA   ALA  43           HA       ALA  43  -2.727   7.522   4.821
  306   1HB   ALA  43          1HB       ALA  43  -2.820   6.728   7.117
  307   2HB   ALA  43          2HB       ALA  43  -1.250   6.323   6.401
  308   3HB   ALA  43          3HB       ALA  43  -1.388   7.672   7.550
  309    H    GLU  44           H        GLU  44  -1.532  10.050   7.034
  310    HA   GLU  44           HA       GLU  44  -3.974  10.917   8.034
  311   1HB   GLU  44          1HB       GLU  44  -1.730  11.482   8.893
  312   2HB   GLU  44          2HB       GLU  44  -1.490  12.595   7.537
  313   1HG   GLU  44          1HG       GLU  44  -3.411  13.955   8.291
  314   2HG   GLU  44          2HG       GLU  44  -3.760  12.787   9.571
  315    H    ALA  45           H        ALA  45  -2.274  12.089   5.149
  316    HA   ALA  45           HA       ALA  45  -3.677  14.382   4.626
  317   1HB   ALA  45          1HB       ALA  45  -1.602  13.705   3.484
  318   2HB   ALA  45          2HB       ALA  45  -2.495  12.463   2.574
  319   3HB   ALA  45          3HB       ALA  45  -2.837  14.187   2.306
  320    H    HIS  46           H        HIS  46  -4.913  11.203   3.996
  321    HA   HIS  46           HA       HIS  46  -7.507  12.338   3.233
  322   1HB   HIS  46          1HB       HIS  46  -7.555  10.598   1.258
  323   2HB   HIS  46          2HB       HIS  46  -6.860  12.206   1.069
  324    HD1  HIS  46           1HD      HIS  46  -4.793  11.870  -0.713
  325    HD2  HIS  46           2HD      HIS  46  -4.996   9.096   2.560
  326    HE1  HIS  46           1HE      HIS  46  -2.709  10.624  -0.650
  327    HE2  HIS  46           2HE      HIS  46  -2.781   8.989   1.363
  328    H    ALA  47           H        ALA  47  -6.583  11.146   5.588
  329    HA   ALA  47           HA       ALA  47  -6.368   8.533   5.884
  330   1HB   ALA  47          1HB       ALA  47  -5.971  10.238   7.618
  331   2HB   ALA  47          2HB       ALA  47  -7.719  10.378   7.893
  332   3HB   ALA  47          3HB       ALA  47  -6.870   8.859   8.259
  333    H    ASP  48           H        ASP  48  -9.600   9.887   5.466
  334    HA   ASP  48           HA       ASP  48 -10.665   7.137   5.927
  335   1HB   ASP  48          1HB       ASP  48 -11.256   9.278   7.515
  336   2HB   ASP  48          2HB       ASP  48 -12.549   9.397   6.324
  337    H    LYS  49           H        LYS  49  -9.945   9.171   3.475
  338    HA   LYS  49           HA       LYS  49 -12.323   8.554   1.807
  339   1HB   LYS  49          1HB       LYS  49 -10.991  10.671   1.465
  340   2HB   LYS  49          2HB       LYS  49  -9.603   9.671   1.008
  341   1HG   LYS  49          1HG       LYS  49 -10.928   8.710  -0.870
  342   2HG   LYS  49          2HG       LYS  49 -12.288   9.752  -0.457
  343   1HD   LYS  49          1HD       LYS  49  -9.593  11.024  -1.020
  344   2HD   LYS  49          2HD       LYS  49 -10.480  10.289  -2.350
  345   1HE   LYS  49          1HE       LYS  49 -11.018  12.572  -2.391
  346   2HE   LYS  49          2HE       LYS  49 -12.454  11.694  -1.860
  347   1HZ   LYS  49          1HZ       LYS  49 -11.942  12.338   0.402
  348   2HZ   LYS  49          2HZ       LYS  49 -10.577  13.131  -0.089
  349   3HZ   LYS  49          3HZ       LYS  49 -12.057  13.675  -0.553
  350    H    VAL  50           H        VAL  50  -9.157   7.245   2.704
  351    HA   VAL  50           HA       VAL  50  -9.601   4.933   0.904
  352    HB   VAL  50           HB       VAL  50  -7.159   4.845   0.529
  353   1HG1  VAL  50          1HG1      VAL  50  -8.714   5.945  -1.114
  354   2HG1  VAL  50          2HG1      VAL  50  -8.319   7.505  -0.393
  355   3HG1  VAL  50          3HG1      VAL  50  -7.048   6.537  -1.185
  356   1HG2  VAL  50          1HG2      VAL  50  -5.717   6.799   0.895
  357   2HG2  VAL  50          2HG2      VAL  50  -7.037   7.662   1.709
  358   3HG2  VAL  50          3HG2      VAL  50  -6.331   6.210   2.446
  359    H    THR  51           H        THR  51  -9.015   2.914   1.755
  360    HA   THR  51           HA       THR  51  -8.431   2.745   4.587
  361    HB   THR  51           HB       THR  51  -9.086   0.873   2.420
  362    HG1  THR  51           1HG      THR  51 -10.549   1.214   3.931
  363   1HG2  THR  51          1HG2      THR  51  -7.067   0.074   4.553
  364   2HG2  THR  51          2HG2      THR  51  -8.138  -1.098   3.769
  365   3HG2  THR  51          3HG2      THR  51  -6.955  -0.167   2.833
  366    H    VAL  52           H        VAL  52  -6.316   2.597   5.357
  367    HA   VAL  52           HA       VAL  52  -4.203   2.002   3.410
  368    HB   VAL  52           HB       VAL  52  -3.693   3.600   5.843
  369   1HG1  VAL  52          1HG1      VAL  52  -2.032   3.383   3.328
  370   2HG1  VAL  52          2HG1      VAL  52  -1.576   4.174   4.835
  371   3HG1  VAL  52          3HG1      VAL  52  -1.771   2.417   4.796
  372   1HG2  VAL  52          1HG2      VAL  52  -4.276   4.682   3.043
  373   2HG2  VAL  52          2HG2      VAL  52  -5.109   5.120   4.551
  374   3HG2  VAL  52          3HG2      VAL  52  -3.441   5.632   4.284
  375    H    ALA  53           H        ALA  53  -3.134   0.292   4.008
  376    HA   ALA  53           HA       ALA  53  -3.691  -1.078   6.598
  377   1HB   ALA  53          1HB       ALA  53  -4.353  -3.069   5.303
  378   2HB   ALA  53          2HB       ALA  53  -5.457  -1.711   5.068
  379   3HB   ALA  53          3HB       ALA  53  -4.264  -2.125   3.803
  380    H    LYS  54           H        LYS  54  -1.621  -0.887   7.196
  381    HA   LYS  54           HA       LYS  54   0.560  -1.275   5.266
  382   1HB   LYS  54          1HB       LYS  54   0.711  -0.576   8.247
  383   2HB   LYS  54          2HB       LYS  54   1.999  -0.389   7.051
  384   1HG   LYS  54          1HG       LYS  54   0.591   1.339   5.876
  385   2HG   LYS  54          2HG       LYS  54  -0.625   1.189   7.139
  386   1HD   LYS  54          1HD       LYS  54   0.923   1.986   8.818
  387   2HD   LYS  54          2HD       LYS  54   2.263   2.021   7.664
  388   1HE   LYS  54          1HE       LYS  54  -0.294   3.642   7.276
  389   2HE   LYS  54          2HE       LYS  54   1.082   4.250   8.206
  390   1HZ   LYS  54          1HZ       LYS  54   1.227   3.476   5.328
  391   2HZ   LYS  54          2HZ       LYS  54   1.171   5.013   5.912
  392   3HZ   LYS  54          3HZ       LYS  54   2.452   4.049   6.248
  393    H    LEU  55           H        LEU  55   2.116  -3.020   5.311
  394    HA   LEU  55           HA       LEU  55   2.234  -4.628   7.700
  395   1HB   LEU  55          1HB       LEU  55   1.683  -6.756   6.782
  396   2HB   LEU  55          2HB       LEU  55   0.344  -5.669   6.760
  397    HG   LEU  55           HG       LEU  55   0.103  -6.967   4.891
  398   1HD1  LEU  55          1HD1      LEU  55   1.357  -4.483   3.678
  399   2HD1  LEU  55          2HD1      LEU  55   0.150  -5.548   2.953
  400   3HD1  LEU  55          3HD1      LEU  55  -0.286  -4.566   4.359
  401   1HD2  LEU  55          1HD2      LEU  55   1.724  -7.528   3.264
  402   2HD2  LEU  55          2HD2      LEU  55   2.930  -6.430   3.969
  403   3HD2  LEU  55          3HD2      LEU  55   2.409  -7.880   4.852
  404    H    ASN  56           H        ASN  56   3.864  -6.119   7.789
  405    HA   ASN  56           HA       ASN  56   6.313  -5.466   6.341
  406   1HB   ASN  56          1HB       ASN  56   6.505  -5.827   8.717
  407   2HB   ASN  56          2HB       ASN  56   5.573  -7.328   8.645
  408   1HD2  ASN  56          1HD2      ASN  56   6.597  -9.267   7.919
  409   2HD2  ASN  56          2HD2      ASN  56   8.343  -9.339   7.705
  410    H    VAL  57           H        VAL  57   6.426  -6.283   4.356
  411    HA   VAL  57           HA       VAL  57   4.662  -7.905   3.158
  412    HB   VAL  57           HB       VAL  57   6.252  -6.325   2.156
  413   1HG1  VAL  57          1HG1      VAL  57   8.313  -8.575   2.139
  414   2HG1  VAL  57          2HG1      VAL  57   8.509  -6.925   1.539
  415   3HG1  VAL  57          3HG1      VAL  57   8.332  -7.226   3.275
  416   1HG2  VAL  57          1HG2      VAL  57   6.373  -8.987   0.722
  417   2HG2  VAL  57          2HG2      VAL  57   4.975  -7.906   0.725
  418   3HG2  VAL  57          3HG2      VAL  57   6.503  -7.363   0.021
  419    H    ASP  58           H        ASP  58   7.741  -9.187   4.505
  420    HA   ASP  58           HA       ASP  58   7.721 -11.692   3.490
  421   1HB   ASP  58          1HB       ASP  58   8.542 -10.543   6.156
  422   2HB   ASP  58          2HB       ASP  58   9.155 -12.017   5.438
  423    H    GLU  59           H        GLU  59   5.759 -10.337   6.047
  424    HA   GLU  59           HA       GLU  59   5.111 -12.846   7.397
  425   1HB   GLU  59          1HB       GLU  59   5.121 -10.609   8.499
  426   2HB   GLU  59          2HB       GLU  59   3.724 -10.162   7.500
  427   1HG   GLU  59          1HG       GLU  59   2.401 -11.993   8.469
  428   2HG   GLU  59          2HG       GLU  59   3.786 -12.498   9.443
  429    H    ASN  60           H        ASN  60   3.942 -11.075   4.601
  430    HA   ASN  60           HA       ASN  60   1.563 -12.895   4.445
  431   1HB   ASN  60          1HB       ASN  60   0.742 -10.633   4.831
  432   2HB   ASN  60          2HB       ASN  60   1.764  -9.996   3.535
  433   1HD2  ASN  60          1HD2      ASN  60   0.849 -10.025   1.316
  434   2HD2  ASN  60          2HD2      ASN  60  -0.513 -11.057   0.982
  435    HA   PRO  61           HA       PRO  61   4.209 -13.689   0.757
  436   1HB   PRO  61          1HB       PRO  61   3.840 -16.431   0.718
  437   2HB   PRO  61          2HB       PRO  61   5.170 -15.597   1.558
  438   1HG   PRO  61          1HG       PRO  61   2.562 -16.639   2.698
  439   2HG   PRO  61          2HG       PRO  61   4.201 -16.760   3.406
  440   1HD   PRO  61          1HD       PRO  61   2.359 -14.883   4.208
  441   2HD   PRO  61          2HD       PRO  61   4.088 -14.526   4.218
  442    H    GLU  62           H        GLU  62   0.946 -14.577   1.858
  443    HA   GLU  62           HA       GLU  62  -0.055 -15.666  -0.522
  444   1HB   GLU  62          1HB       GLU  62  -0.945 -15.685   1.902
  445   2HB   GLU  62          2HB       GLU  62  -1.698 -14.129   1.524
  446   1HG   GLU  62          1HG       GLU  62  -2.125 -16.794   0.083
  447   2HG   GLU  62          2HG       GLU  62  -3.231 -16.064   1.245
  448    H    THR  63           H        THR  63  -0.422 -14.738  -2.405
  449    HA   THR  63           HA       THR  63  -0.816 -13.382  -4.101
  450    HB   THR  63           HB       THR  63  -2.453 -12.117  -1.911
  451    HG1  THR  63           1HG      THR  63  -3.008 -14.208  -2.699
  452   1HG2  THR  63          1HG2      THR  63  -2.541 -11.373  -4.843
  453   2HG2  THR  63          2HG2      THR  63  -3.744 -10.925  -3.611
  454   3HG2  THR  63          3HG2      THR  63  -2.097 -10.278  -3.503
  455    H    THR  64           H        THR  64   0.850 -11.980  -1.504
  456    HA   THR  64           HA       THR  64   2.248  -9.803  -2.715
  457    HB   THR  64           HB       THR  64   3.112 -12.014  -0.825
  458    HG1  THR  64           1HG      THR  64   2.495 -10.840   0.705
  459   1HG2  THR  64          1HG2      THR  64   4.868 -10.679   0.041
  460   2HG2  THR  64          2HG2      THR  64   5.137 -10.816  -1.704
  461   3HG2  THR  64          3HG2      THR  64   4.451  -9.321  -1.010
  462    H    SER  65           H        SER  65   3.030 -13.333  -2.580
  463    HA   SER  65           HA       SER  65   5.211 -13.225  -4.366
  464   1HB   SER  65          1HB       SER  65   4.706 -15.078  -2.817
  465   2HB   SER  65          2HB       SER  65   3.272 -15.504  -3.760
  466    HG   SER  65           HG       SER  65   5.982 -15.572  -4.633
  467    H    GLN  66           H        GLN  66   1.713 -13.630  -5.029
  468    HA   GLN  66           HA       GLN  66   1.948 -14.282  -7.756
  469   1HB   GLN  66          1HB       GLN  66  -0.077 -14.619  -6.377
  470   2HB   GLN  66          2HB       GLN  66  -0.338 -12.884  -6.307
  471   1HG   GLN  66          1HG       GLN  66  -1.823 -13.959  -7.932
  472   2HG   GLN  66          2HG       GLN  66  -0.792 -12.757  -8.686
  473   1HE2  GLN  66          1HE2      GLN  66   1.127 -13.563  -9.964
  474   2HE2  GLN  66          2HE2      GLN  66   0.952 -15.155 -10.723
  475    H    PHE  67           H        PHE  67   1.654 -11.034  -6.196
  476    HA   PHE  67           HA       PHE  67   1.701  -9.818  -8.903
  477   1HB   PHE  67          1HB       PHE  67   1.019  -8.697  -6.180
  478   2HB   PHE  67          2HB       PHE  67   1.146  -7.719  -7.639
  479    HD1  PHE  67           1HD      PHE  67  -0.153  -8.762  -9.782
  480    HD2  PHE  67           2HD      PHE  67  -1.195  -9.354  -5.641
  481    HE1  PHE  67           1HE      PHE  67  -2.455  -9.373 -10.452
  482    HE2  PHE  67           2HE      PHE  67  -3.523  -9.925  -6.326
  483    HZ   PHE  67           HZ       PHE  67  -4.139  -9.979  -8.723
  484    H    GLY  68           H        GLY  68   4.119 -11.044  -7.415
  485   1HA   GLY  68          1HA       GLY  68   6.357 -10.745  -7.740
  486   2HA   GLY  68          2HA       GLY  68   5.985  -9.303  -8.695
  487    H    ILE  69           H        ILE  69   4.910  -9.643  -5.343
  488    HA   ILE  69           HA       ILE  69   6.014  -7.024  -4.820
  489    HB   ILE  69           HB       ILE  69   4.385  -8.868  -3.095
  490   1HG1  ILE  69          1HG1      ILE  69   3.136  -8.559  -5.137
  491   2HG1  ILE  69          2HG1      ILE  69   2.365  -7.725  -3.814
  492   1HG2  ILE  69          1HG2      ILE  69   4.499  -5.839  -2.938
  493   2HG2  ILE  69          2HG2      ILE  69   3.649  -6.983  -1.885
  494   3HG2  ILE  69          3HG2      ILE  69   5.391  -6.935  -1.867
  495   1HD1  ILE  69          1HD1      ILE  69   3.047  -5.584  -4.645
  496   2HD1  ILE  69          2HD1      ILE  69   4.164  -6.311  -5.835
  497   3HD1  ILE  69          3HD1      ILE  69   2.414  -6.502  -6.005
  498    H    MET  70           H        MET  70   8.192  -8.039  -5.150
  499    HA   MET  70           HA       MET  70   9.402  -8.338  -2.416
  500   1HB   MET  70          1HB       MET  70   9.706 -10.304  -3.925
  501   2HB   MET  70          2HB       MET  70  10.553  -9.262  -5.076
  502   1HG   MET  70          1HG       MET  70  12.344  -8.880  -3.446
  503   2HG   MET  70          2HG       MET  70  11.422  -9.713  -2.193
  504   1HE   MET  70          1HE       MET  70  13.505 -10.016  -5.483
  505   2HE   MET  70          2HE       MET  70  13.492 -11.765  -5.806
  506   3HE   MET  70          3HE       MET  70  12.009 -10.815  -6.027
  507    H    SER  71           H        SER  71   8.657  -6.117  -4.696
  508    HA   SER  71           HA       SER  71  11.238  -4.768  -4.933
  509   1HB   SER  71          1HB       SER  71   9.749  -5.039  -6.900
  510   2HB   SER  71          2HB       SER  71   8.480  -4.123  -6.060
  511    HG   SER  71           HG       SER  71  10.118  -2.447  -5.869
  512    H    ILE  72           H        ILE  72   9.844  -4.880  -2.282
  513    HA   ILE  72           HA       ILE  72   8.408  -2.595  -1.856
  514    HB   ILE  72           HB       ILE  72   8.585  -2.990   0.543
  515   1HG1  ILE  72          1HG1      ILE  72  10.887  -3.765   0.753
  516   2HG1  ILE  72          2HG1      ILE  72   9.694  -4.774   1.554
  517   1HG2  ILE  72          1HG2      ILE  72   7.406  -5.092   0.525
  518   2HG2  ILE  72          2HG2      ILE  72   6.912  -4.064  -0.819
  519   3HG2  ILE  72          3HG2      ILE  72   7.967  -5.450  -1.122
  520   1HD1  ILE  72          1HD1      ILE  72  11.272  -6.245   0.647
  521   2HD1  ILE  72          2HD1      ILE  72   9.903  -6.378  -0.455
  522   3HD1  ILE  72          3HD1      ILE  72  11.332  -5.405  -0.906
  523    HA   PRO  73           HA       PRO  73   8.063  -0.942   0.210
  524   1HB   PRO  73          1HB       PRO  73   7.523   1.661  -0.271
  525   2HB   PRO  73          2HB       PRO  73   8.593   1.110   1.038
  526   1HG   PRO  73          1HG       PRO  73   9.393   2.107  -1.712
  527   2HG   PRO  73          2HG       PRO  73  10.097   2.567  -0.130
  528   1HD   PRO  73          1HD       PRO  73  11.237   0.682  -1.749
  529   2HD   PRO  73          2HD       PRO  73  11.282   0.530   0.026
  530    H    THR  74           H        THR  74   6.198  -1.510  -0.684
  531    HA   THR  74           HA       THR  74   5.567  -0.722  -3.487
  532    HB   THR  74           HB       THR  74   5.059  -3.441  -2.209
  533    HG1  THR  74           1HG      THR  74   6.583  -4.189  -3.566
  534   1HG2  THR  74          1HG2      THR  74   4.586  -4.033  -4.676
  535   2HG2  THR  74          2HG2      THR  74   3.317  -3.187  -3.767
  536   3HG2  THR  74          3HG2      THR  74   4.332  -2.308  -4.919
  537    H    LEU  75           H        LEU  75   3.324  -0.411  -3.931
  538    HA   LEU  75           HA       LEU  75   1.455  -0.150  -1.614
  539   1HB   LEU  75          1HB       LEU  75   2.784   1.849  -1.875
  540   2HB   LEU  75          2HB       LEU  75   2.330   2.002  -3.559
  541    HG   LEU  75           HG       LEU  75   0.170   1.754  -1.451
  542   1HD1  LEU  75          1HD1      LEU  75   1.880   4.164  -2.078
  543   2HD1  LEU  75          2HD1      LEU  75   0.306   4.281  -1.255
  544   3HD1  LEU  75          3HD1      LEU  75   1.631   3.368  -0.511
  545   1HD2  LEU  75          1HD2      LEU  75  -1.021   3.356  -2.983
  546   2HD2  LEU  75          2HD2      LEU  75   0.330   3.198  -4.122
  547   3HD2  LEU  75          3HD2      LEU  75  -0.681   1.796  -3.716
  548    H    ILE  76           H        ILE  76  -0.108  -1.584  -2.333
  549    HA   ILE  76           HA       ILE  76  -0.879  -1.401  -5.223
  550    HB   ILE  76           HB       ILE  76  -1.698  -3.601  -3.328
  551   1HG1  ILE  76          1HG1      ILE  76   0.534  -3.705  -5.409
  552   2HG1  ILE  76          2HG1      ILE  76   0.727  -3.829  -3.659
  553   1HG2  ILE  76          1HG2      ILE  76  -2.404  -4.699  -5.474
  554   2HG2  ILE  76          2HG2      ILE  76  -3.237  -3.191  -5.232
  555   3HG2  ILE  76          3HG2      ILE  76  -1.874  -3.271  -6.370
  556   1HD1  ILE  76          1HD1      ILE  76   0.800  -6.065  -4.368
  557   2HD1  ILE  76          2HD1      ILE  76  -0.843  -5.891  -3.785
  558   3HD1  ILE  76          3HD1      ILE  76  -0.507  -5.868  -5.534
  559    H    LEU  77           H        LEU  77  -2.968  -0.806  -5.651
  560    HA   LEU  77           HA       LEU  77  -4.675  -0.058  -3.334
  561   1HB   LEU  77          1HB       LEU  77  -3.712   1.776  -4.835
  562   2HB   LEU  77          2HB       LEU  77  -4.779   1.161  -6.093
  563    HG   LEU  77           HG       LEU  77  -5.786   3.022  -5.096
  564   1HD1  LEU  77          1HD1      LEU  77  -7.354   1.090  -5.485
  565   2HD1  LEU  77          2HD1      LEU  77  -7.249   0.731  -3.746
  566   3HD1  LEU  77          3HD1      LEU  77  -7.913   2.264  -4.290
  567   1HD2  LEU  77          1HD2      LEU  77  -5.531   1.776  -2.346
  568   2HD2  LEU  77          2HD2      LEU  77  -4.506   3.080  -2.972
  569   3HD2  LEU  77          3HD2      LEU  77  -6.237   3.350  -2.715
  570    H    PHE  78           H        PHE  78  -6.225  -1.412  -3.148
  571    HA   PHE  78           HA       PHE  78  -7.236  -3.043  -5.452
  572   1HB   PHE  78          1HB       PHE  78  -7.060  -3.653  -2.475
  573   2HB   PHE  78          2HB       PHE  78  -7.999  -4.618  -3.578
  574    HD1  PHE  78           1HD      PHE  78  -7.035  -6.270  -5.022
  575    HD2  PHE  78           2HD      PHE  78  -4.568  -3.787  -2.500
  576    HE1  PHE  78           1HE      PHE  78  -5.201  -7.913  -5.209
  577    HE2  PHE  78           2HE      PHE  78  -2.764  -5.482  -2.633
  578    HZ   PHE  78           HZ       PHE  78  -3.059  -7.531  -4.009
  579    H    LYS  79           H        LYS  79  -9.499  -3.657  -5.404
  580    HA   LYS  79           HA       LYS  79 -11.131  -3.102  -3.187
  581   1HB   LYS  79          1HB       LYS  79 -12.916  -1.842  -4.126
  582   2HB   LYS  79          2HB       LYS  79 -11.477  -0.863  -4.142
  583   1HG   LYS  79          1HG       LYS  79 -12.540  -2.329  -6.608
  584   2HG   LYS  79          2HG       LYS  79 -13.064  -0.732  -6.141
  585   1HD   LYS  79          1HD       LYS  79 -10.225  -1.522  -6.900
  586   2HD   LYS  79          2HD       LYS  79 -11.360  -0.595  -7.870
  587   1HE   LYS  79          1HE       LYS  79 -10.099   0.260  -5.229
  588   2HE   LYS  79          2HE       LYS  79  -9.733   0.904  -6.832
  589   1HZ   LYS  79          1HZ       LYS  79 -12.338   1.133  -5.476
  590   2HZ   LYS  79          2HZ       LYS  79 -11.235   2.349  -5.627
  591   3HZ   LYS  79          3HZ       LYS  79 -11.986   1.738  -6.960
  592    H    GLY  80           H        GLY  80 -13.052  -4.471  -3.345
  593   1HA   GLY  80          1HA       GLY  80 -14.282  -6.275  -4.139
  594   2HA   GLY  80          2HA       GLY  80 -13.873  -5.743  -5.769
  595    H    GLY  81           H        GLY  81 -11.116  -6.455  -3.724
  596   1HA   GLY  81          1HA       GLY  81  -9.645  -8.214  -3.708
  597   2HA   GLY  81          2HA       GLY  81 -10.697  -9.153  -4.771
  598    H    GLU  82           H        GLU  82 -10.488  -6.174  -6.324
  599    HA   GLU  82           HA       GLU  82  -8.509  -7.290  -8.177
  600   1HB   GLU  82          1HB       GLU  82 -10.786  -6.795  -8.965
  601   2HB   GLU  82          2HB       GLU  82 -10.566  -5.086  -8.555
  602   1HG   GLU  82          1HG       GLU  82  -8.655  -4.955 -10.147
  603   2HG   GLU  82          2HG       GLU  82  -8.845  -6.671 -10.516
  604    HA   PRO  83           HA       PRO  83  -5.821  -3.821  -6.837
  605   1HB   PRO  83          1HB       PRO  83  -3.550  -4.547  -8.125
  606   2HB   PRO  83          2HB       PRO  83  -4.145  -5.385  -6.660
  607   1HG   PRO  83          1HG       PRO  83  -4.447  -6.264  -9.532
  608   2HG   PRO  83          2HG       PRO  83  -3.978  -7.222  -8.095
  609   1HD   PRO  83          1HD       PRO  83  -6.549  -7.110  -9.118
  610   2HD   PRO  83          2HD       PRO  83  -6.189  -7.440  -7.398
  611    H    VAL  84           H        VAL  84  -6.667  -1.983  -7.875
  612    HA   VAL  84           HA       VAL  84  -6.910  -1.848 -10.763
  613    HB   VAL  84           HB       VAL  84  -7.313   0.621 -10.138
  614   1HG1  VAL  84          1HG1      VAL  84  -9.677   0.121  -9.555
  615   2HG1  VAL  84          2HG1      VAL  84  -9.082  -0.941 -10.837
  616   3HG1  VAL  84          3HG1      VAL  84  -9.215  -1.564  -9.187
  617   1HG2  VAL  84          1HG2      VAL  84  -8.051   1.203  -7.969
  618   2HG2  VAL  84          2HG2      VAL  84  -7.818  -0.451  -7.361
  619   3HG2  VAL  84          3HG2      VAL  84  -6.421   0.548  -7.814
  620    H    LYS  85           H        LYS  85  -4.535  -0.738  -8.366
  621    HA   LYS  85           HA       LYS  85  -2.604  -0.356 -10.495
  622   1HB   LYS  85          1HB       LYS  85  -2.025   2.042  -9.603
  623   2HB   LYS  85          2HB       LYS  85  -3.251   1.775 -10.828
  624   1HG   LYS  85          1HG       LYS  85  -5.035   1.954  -9.090
  625   2HG   LYS  85          2HG       LYS  85  -3.792   2.357  -7.892
  626   1HD   LYS  85          1HD       LYS  85  -3.259   4.402  -9.035
  627   2HD   LYS  85          2HD       LYS  85  -4.143   3.933 -10.487
  628   1HE   LYS  85          1HE       LYS  85  -5.489   4.361  -7.790
  629   2HE   LYS  85          2HE       LYS  85  -5.284   5.634  -8.998
  630   1HZ   LYS  85          1HZ       LYS  85  -6.801   3.134  -9.475
  631   2HZ   LYS  85          2HZ       LYS  85  -7.454   4.653  -9.260
  632   3HZ   LYS  85          3HZ       LYS  85  -6.598   4.349 -10.569
  633    H    GLN  86           H        GLN  86  -0.398   0.110  -9.668
  634    HA   GLN  86           HA       GLN  86   0.172  -0.778  -6.952
  635   1HB   GLN  86          1HB       GLN  86  -0.093  -2.871  -7.941
  636   2HB   GLN  86          2HB       GLN  86   0.658  -2.387  -9.467
  637   1HG   GLN  86          1HG       GLN  86   2.853  -2.477  -8.569
  638   2HG   GLN  86          2HG       GLN  86   2.301  -2.576  -6.910
  639   1HE2  GLN  86          1HE2      GLN  86   4.067  -4.507  -8.533
  640   2HE2  GLN  86          2HE2      GLN  86   3.252  -6.050  -8.309
  641    H    LEU  87           H        LEU  87   1.854   0.363  -6.281
  642    HA   LEU  87           HA       LEU  87   3.628   1.781  -8.219
  643   1HB   LEU  87          1HB       LEU  87   2.345   2.659  -5.602
  644   2HB   LEU  87          2HB       LEU  87   3.744   3.465  -6.292
  645    HG   LEU  87           HG       LEU  87   2.459   4.134  -8.248
  646   1HD1  LEU  87          1HD1      LEU  87   0.683   2.543  -8.565
  647   2HD1  LEU  87          2HD1      LEU  87   0.109   2.732  -6.886
  648   3HD1  LEU  87          3HD1      LEU  87  -0.113   4.025  -8.082
  649   1HD2  LEU  87          1HD2      LEU  87   0.962   5.730  -7.005
  650   2HD2  LEU  87          2HD2      LEU  87   1.319   4.807  -5.531
  651   3HD2  LEU  87          3HD2      LEU  87   2.632   5.613  -6.423
  652    H    ILE  88           H        ILE  88   5.831   1.995  -7.435
  653    HA   ILE  88           HA       ILE  88   6.643   0.371  -5.139
  654    HB   ILE  88           HB       ILE  88   8.361  -0.745  -6.677
  655   1HG1  ILE  88          1HG1      ILE  88   6.383   0.076  -8.863
  656   2HG1  ILE  88          2HG1      ILE  88   8.070   0.574  -8.715
  657   1HG2  ILE  88          1HG2      ILE  88   6.928  -2.638  -7.080
  658   2HG2  ILE  88          2HG2      ILE  88   6.462  -1.853  -5.582
  659   3HG2  ILE  88          3HG2      ILE  88   5.471  -1.614  -7.042
  660   1HD1  ILE  88          1HD1      ILE  88   7.916  -1.138 -10.392
  661   2HD1  ILE  88          2HD1      ILE  88   8.712  -1.867  -8.974
  662   3HD1  ILE  88          3HD1      ILE  88   6.998  -2.208  -9.328
  663    H    GLY  89           H        GLY  89   8.655   0.881  -4.378
  664   1HA   GLY  89          1HA       GLY  89  10.684   1.980  -4.183
  665   2HA   GLY  89          2HA       GLY  89  10.436   2.765  -5.754
  666    H    TYR  90           H        TYR  90  11.439   4.267  -3.736
  667    HA   TYR  90           HA       TYR  90   9.431   5.540  -2.123
  668   1HB   TYR  90          1HB       TYR  90  11.715   5.152  -1.368
  669   2HB   TYR  90          2HB       TYR  90  12.314   6.239  -2.611
  670    HD1  TYR  90           1HD      TYR  90  13.497   7.112  -0.508
  671    HD2  TYR  90           2HD      TYR  90   9.254   7.626  -1.187
  672    HE1  TYR  90           1HE      TYR  90  13.441   9.010   1.099
  673    HE2  TYR  90           2HE      TYR  90   9.217   9.473   0.362
  674    HH   TYR  90           HH       TYR  90  10.428  10.606   2.086
  675    H    GLN  91           H        GLN  91   8.028   6.020  -4.028
  676    HA   GLN  91           HA       GLN  91   8.627   8.379  -5.605
  677   1HB   GLN  91          1HB       GLN  91   5.812   7.528  -4.828
  678   2HB   GLN  91          2HB       GLN  91   6.332   8.425  -6.219
  679   1HG   GLN  91          1HG       GLN  91   6.849   5.467  -5.758
  680   2HG   GLN  91          2HG       GLN  91   5.710   6.186  -6.890
  681   1HE2  GLN  91          1HE2      GLN  91   8.215   4.375  -7.345
  682   2HE2  GLN  91          2HE2      GLN  91   9.115   5.346  -8.509
  683    HA   PRO  92           HA       PRO  92   7.713  11.294  -2.209
  684   1HB   PRO  92          1HB       PRO  92   7.556  13.641  -3.614
  685   2HB   PRO  92          2HB       PRO  92   9.111  12.815  -3.294
  686   1HG   PRO  92          1HG       PRO  92   7.388  12.641  -5.782
  687   2HG   PRO  92          2HG       PRO  92   9.146  12.977  -5.687
  688   1HD   PRO  92          1HD       PRO  92   8.208  10.464  -6.177
  689   2HD   PRO  92          2HD       PRO  92   9.644  10.724  -5.147
  690    H    LYS  93           H        LYS  93   5.886  12.761  -1.643
  691    HA   LYS  93           HA       LYS  93   3.346  11.653  -2.052
  692   1HB   LYS  93          1HB       LYS  93   4.505  14.116  -0.807
  693   2HB   LYS  93          2HB       LYS  93   2.883  14.322  -1.420
  694   1HG   LYS  93          1HG       LYS  93   2.649  13.658   0.840
  695   2HG   LYS  93          2HG       LYS  93   2.122  12.322  -0.161
  696   1HD   LYS  93          1HD       LYS  93   3.547  10.953   0.897
  697   2HD   LYS  93          2HD       LYS  93   4.924  11.871   0.298
  698   1HE   LYS  93          1HE       LYS  93   3.366  12.394   2.849
  699   2HE   LYS  93          2HE       LYS  93   4.961  11.661   2.746
  700   1HZ   LYS  93          1HZ       LYS  93   5.699  13.889   1.781
  701   2HZ   LYS  93          2HZ       LYS  93   4.156  14.437   2.228
  702   3HZ   LYS  93          3HZ       LYS  93   5.100  13.969   3.355
  703    H    GLU  94           H        GLU  94   4.838  14.440  -3.726
  704    HA   GLU  94           HA       GLU  94   2.557  15.141  -5.227
  705   1HB   GLU  94          1HB       GLU  94   5.535  15.514  -5.745
  706   2HB   GLU  94          2HB       GLU  94   4.269  16.399  -6.600
  707   1HG   GLU  94          1HG       GLU  94   3.663  17.668  -4.714
  708   2HG   GLU  94          2HG       GLU  94   4.369  16.533  -3.568
  709    H    GLN  95           H        GLN  95   4.598  12.329  -5.660
  710    HA   GLN  95           HA       GLN  95   3.858  12.127  -8.529
  711   1HB   GLN  95          1HB       GLN  95   6.276  11.875  -7.609
  712   2HB   GLN  95          2HB       GLN  95   5.750  10.378  -6.909
  713   1HG   GLN  95          1HG       GLN  95   6.786   9.848  -9.005
  714   2HG   GLN  95          2HG       GLN  95   5.057   9.583  -9.217
  715   1HE2  GLN  95          1HE2      GLN  95   3.924  10.894 -10.803
  716   2HE2  GLN  95          2HE2      GLN  95   4.805  12.082 -11.758
  717    H    LEU  96           H        LEU  96   3.927  10.479  -5.403
  718    HA   LEU  96           HA       LEU  96   2.422   8.182  -6.011
  719   1HB   LEU  96          1HB       LEU  96   3.876   8.938  -3.966
  720   2HB   LEU  96          2HB       LEU  96   2.335   9.447  -3.311
  721    HG   LEU  96           HG       LEU  96   2.679   6.675  -4.482
  722   1HD1  LEU  96          1HD1      LEU  96   3.414   7.404  -1.642
  723   2HD1  LEU  96          2HD1      LEU  96   3.396   5.776  -2.373
  724   3HD1  LEU  96          3HD1      LEU  96   4.538   6.991  -2.956
  725   1HD2  LEU  96          1HD2      LEU  96   0.376   7.537  -3.721
  726   2HD2  LEU  96          2HD2      LEU  96   0.910   5.994  -3.052
  727   3HD2  LEU  96          3HD2      LEU  96   1.027   7.460  -2.067
  728    H    GLU  97           H        GLU  97   1.262  11.281  -4.471
  729    HA   GLU  97           HA       GLU  97  -1.479  10.463  -4.565
  730   1HB   GLU  97          1HB       GLU  97  -0.411  12.247  -3.052
  731   2HB   GLU  97          2HB       GLU  97  -0.344  13.264  -4.472
  732   1HG   GLU  97          1HG       GLU  97  -2.157  13.982  -3.180
  733   2HG   GLU  97          2HG       GLU  97  -2.816  13.253  -4.638
  734    H    ALA  98           H        ALA  98   0.670  11.794  -6.984
  735    HA   ALA  98           HA       ALA  98  -1.499  12.745  -8.720
  736   1HB   ALA  98          1HB       ALA  98   1.443  12.224  -9.329
  737   2HB   ALA  98          2HB       ALA  98   0.264  12.949 -10.440
  738   3HB   ALA  98          3HB       ALA  98   0.685  13.785  -8.936
  739    H    GLN  99           H        GLN  99   0.712   9.894  -8.712
  740    HA   GLN  99           HA       GLN  99  -0.537   8.544 -10.910
  741   1HB   GLN  99          1HB       GLN  99   1.740   8.115  -9.975
  742   2HB   GLN  99          2HB       GLN  99   1.020   7.471  -8.512
  743   1HG   GLN  99          1HG       GLN  99   1.747   5.646  -9.913
  744   2HG   GLN  99          2HG       GLN  99  -0.014   5.627  -9.839
  745   1HE2  GLN  99          1HE2      GLN  99   2.801   6.539 -11.935
  746   2HE2  GLN  99          2HE2      GLN  99   1.854   6.420 -13.414
  747    H    LEU 100           H        LEU 100  -1.036   8.378  -7.394
  748    HA   LEU 100           HA       LEU 100  -3.179   6.437  -7.573
  749   1HB   LEU 100          1HB       LEU 100  -1.395   7.180  -5.606
  750   2HB   LEU 100          2HB       LEU 100  -2.867   7.969  -5.077
  751    HG   LEU 100           HG       LEU 100  -3.970   5.634  -5.304
  752   1HD1  LEU 100          1HD1      LEU 100  -2.223   4.636  -6.808
  753   2HD1  LEU 100          2HD1      LEU 100  -1.022   4.833  -5.520
  754   3HD1  LEU 100          3HD1      LEU 100  -2.381   3.718  -5.310
  755   1HD2  LEU 100          1HD2      LEU 100  -1.632   6.034  -3.367
  756   2HD2  LEU 100          2HD2      LEU 100  -3.322   6.535  -3.121
  757   3HD2  LEU 100          3HD2      LEU 100  -2.916   4.824  -3.181
  758    H    ALA 101           H        ALA 101  -3.173   9.782  -8.207
  759    HA   ALA 101           HA       ALA 101  -5.435  10.818  -7.022
  760   1HB   ALA 101          1HB       ALA 101  -4.585  11.242  -9.919
  761   2HB   ALA 101          2HB       ALA 101  -5.652  12.290  -8.968
  762   3HB   ALA 101          3HB       ALA 101  -3.952  12.132  -8.514
  763    H    ASP 102           H        ASP 102  -5.261   8.532  -9.676
  764    HA   ASP 102           HA       ASP 102  -8.002   8.607 -10.517
  765   1HB   ASP 102          1HB       ASP 102  -6.133   7.933 -11.944
  766   2HB   ASP 102          2HB       ASP 102  -5.706   6.632 -10.846
  767    H    VAL 103           H        VAL 103  -7.017   7.810  -7.533
  768    HA   VAL 103           HA       VAL 103  -9.686   6.578  -7.277
  769    HB   VAL 103           HB       VAL 103  -7.548   4.941  -6.882
  770   1HG1  VAL 103          1HG1      VAL 103  -8.212   5.896  -4.074
  771   2HG1  VAL 103          2HG1      VAL 103  -7.304   4.462  -4.495
  772   3HG1  VAL 103          3HG1      VAL 103  -6.654   6.041  -4.932
  773   1HG2  VAL 103          1HG2      VAL 103 -10.218   4.778  -5.463
  774   2HG2  VAL 103          2HG2      VAL 103  -9.893   4.308  -7.147
  775   3HG2  VAL 103          3HG2      VAL 103  -9.118   3.419  -5.829
  776    H    LEU 104           H        LEU 104  -7.571   9.057  -6.353
  777    HA   LEU 104           HA       LEU 104  -8.929   9.639  -3.811
  778   1HB   LEU 104          1HB       LEU 104  -6.485  10.609  -5.316
  779   2HB   LEU 104          2HB       LEU 104  -7.188  11.640  -4.168
  780    HG   LEU 104           HG       LEU 104  -5.591  10.701  -2.882
  781   1HD1  LEU 104          1HD1      LEU 104  -7.628  10.087  -1.690
  782   2HD1  LEU 104          2HD1      LEU 104  -7.605   8.488  -2.495
  783   3HD1  LEU 104          3HD1      LEU 104  -6.298   8.958  -1.386
  784   1HD2  LEU 104          1HD2      LEU 104  -4.662   9.260  -4.592
  785   2HD2  LEU 104          2HD2      LEU 104  -4.694   8.435  -3.036
  786   3HD2  LEU 104          3HD2      LEU 104  -5.909   8.023  -4.275
  787    H    GLN 105           H        GLN 105  -8.946  10.479  -7.166
  788    HA   GLN 105           HA       GLN 105 -10.148  13.028  -7.210
  789   1HB   GLN 105          2HB       GLN 105  -8.959  11.892  -9.086
  790   2HB   GLN 105          3HB       GLN 105 -10.257  10.708  -9.134
  791   1HG   GLN 105          2HG       GLN 105 -11.865  12.536  -9.748
  792   2HG   GLN 105          3HG       GLN 105 -10.539  13.702  -9.657
  793   1HE2  GLN 105          1HE2      GLN 105 -11.119  10.457 -11.206
  794   2HE2  GLN 105          2HE2      GLN 105 -10.442  10.946 -12.756
  Start of MODEL    2
    1   1H    ALA   1           H        ALA   1 -10.725   6.340   9.083
    2   2H    ALA   1          2HN       ALA   1  -9.177   6.419   9.692
    3   3H    ALA   1          3HN       ALA   1  -9.459   6.596   8.072
    4    HA   ALA   1           HA       ALA   1 -10.183   4.163   9.510
    5   1HB   ALA   1          1HB       ALA   1 -10.103   3.146   7.313
    6   2HB   ALA   1          2HB       ALA   1 -11.098   4.604   7.214
    7   3HB   ALA   1          3HB       ALA   1  -9.433   4.638   6.594
    8    H    THR   2           H        THR   2  -8.140   2.728   7.756
    9    HA   THR   2           HA       THR   2  -6.120   2.039   7.706
   10    HB   THR   2           HB       THR   2  -5.245   4.580   9.093
   11    HG1  THR   2           1HG      THR   2  -5.154   5.354   7.113
   12   1HG2  THR   2          1HG2      THR   2  -3.464   2.959   9.321
   13   2HG2  THR   2          2HG2      THR   2  -3.642   2.451   7.630
   14   3HG2  THR   2          3HG2      THR   2  -3.039   4.077   8.027
   15    H    MET   3           H        MET   3  -4.777   0.575   8.734
   16    HA   MET   3           HA       MET   3  -4.777   0.253  11.603
   17   1HB   MET   3          1HB       MET   3  -7.033  -0.635  10.712
   18   2HB   MET   3          2HB       MET   3  -6.116  -1.884   9.873
   19   1HG   MET   3          1HG       MET   3  -5.295  -2.746  12.012
   20   2HG   MET   3          2HG       MET   3  -6.037  -1.400  12.883
   21   1HE   MET   3          1HE       MET   3  -8.999  -1.136  11.771
   22   2HE   MET   3          2HE       MET   3  -9.815  -2.268  12.868
   23   3HE   MET   3          3HE       MET   3  -8.532  -1.206  13.489
   24    H    THR   4           H        THR   4  -3.453  -1.928  12.060
   25    HA   THR   4           HA       THR   4  -1.293  -2.378  10.171
   26    HB   THR   4           HB       THR   4  -2.123  -4.130  12.482
   27    HG1  THR   4           1HG      THR   4  -0.607  -1.747  12.665
   28   1HG2  THR   4          1HG2      THR   4   0.350  -4.380  12.779
   29   2HG2  THR   4          2HG2      THR   4  -0.206  -4.982  11.218
   30   3HG2  THR   4          3HG2      THR   4   0.605  -3.402  11.316
   31    H    LEU   5           H        LEU   5  -0.976  -4.627   9.161
   32    HA   LEU   5           HA       LEU   5  -3.464  -6.213   8.878
   33   1HB   LEU   5          1HB       LEU   5  -2.550  -4.466   6.883
   34   2HB   LEU   5          2HB       LEU   5  -1.749  -5.964   6.490
   35    HG   LEU   5           HG       LEU   5  -3.946  -7.132   6.419
   36   1HD1  LEU   5          1HD1      LEU   5  -6.007  -5.862   6.370
   37   2HD1  LEU   5          2HD1      LEU   5  -5.218  -5.546   7.918
   38   3HD1  LEU   5          3HD1      LEU   5  -5.150  -4.344   6.625
   39   1HD2  LEU   5          1HD2      LEU   5  -4.763  -5.777   4.334
   40   2HD2  LEU   5          2HD2      LEU   5  -3.372  -4.737   4.633
   41   3HD2  LEU   5          3HD2      LEU   5  -3.129  -6.464   4.305
   42    H    THR   6           H        THR   6  -2.964  -8.405   7.817
   43    HA   THR   6           HA       THR   6  -0.382  -9.406   7.952
   44    HB   THR   6           HB       THR   6  -1.164 -11.402   9.297
   45    HG1  THR   6           1HG      THR   6  -2.881 -11.177  10.640
   46   1HG2  THR   6          1HG2      THR   6   0.308  -9.635  10.296
   47   2HG2  THR   6          2HG2      THR   6  -1.143  -8.860  10.970
   48   3HG2  THR   6          3HG2      THR   6  -0.691 -10.502  11.476
   49    H    ASP   7           H        ASP   7  -0.720 -11.630   7.003
   50    HA   ASP   7           HA       ASP   7  -1.778 -11.707   4.498
   51   1HB   ASP   7          1HB       ASP   7  -1.112 -13.906   6.441
   52   2HB   ASP   7          2HB       ASP   7  -2.107 -14.368   5.070
   53    H    ALA   8           H        ALA   8  -3.494 -13.322   7.162
   54    HA   ALA   8           HA       ALA   8  -5.858 -13.820   5.639
   55   1HB   ALA   8          1HB       ALA   8  -5.609 -13.462   8.665
   56   2HB   ALA   8          2HB       ALA   8  -6.956 -14.249   7.815
   57   3HB   ALA   8          3HB       ALA   8  -5.337 -14.978   7.771
   58    H    ASN   9           H        ASN   9  -4.854 -10.913   7.338
   59    HA   ASN   9           HA       ASN   9  -7.487  -9.686   7.230
   60   1HB   ASN   9          1HB       ASN   9  -4.803  -8.758   8.187
   61   2HB   ASN   9          2HB       ASN   9  -6.183  -7.685   8.024
   62   1HD2  ASN   9          1HD2      ASN   9  -4.625  -9.808  10.192
   63   2HD2  ASN   9          2HD2      ASN   9  -5.995  -9.943  11.301
   64    H    PHE  10           H        PHE  10  -4.702 -10.003   5.143
   65    HA   PHE  10           HA       PHE  10  -4.936  -7.711   3.517
   66   1HB   PHE  10          1HB       PHE  10  -3.187  -9.654   3.619
   67   2HB   PHE  10          2HB       PHE  10  -4.223 -10.449   2.448
   68    HD1  PHE  10           1HD      PHE  10  -1.296  -8.610   2.759
   69    HD2  PHE  10           2HD      PHE  10  -4.903  -8.735   0.355
   70    HE1  PHE  10           1HE      PHE  10  -0.159  -7.475   0.975
   71    HE2  PHE  10           2HE      PHE  10  -3.722  -7.624  -1.458
   72    HZ   PHE  10           HZ       PHE  10  -1.327  -6.950  -1.184
   73    H    GLN  11           H        GLN  11  -6.333 -10.969   3.013
   74    HA   GLN  11           HA       GLN  11  -8.237 -10.218   1.024
   75   1HB   GLN  11          1HB       GLN  11  -8.095 -12.495   3.056
   76   2HB   GLN  11          2HB       GLN  11  -9.416 -12.354   1.882
   77   1HG   GLN  11          1HG       GLN  11  -7.853 -12.438   0.009
   78   2HG   GLN  11          2HG       GLN  11  -6.475 -12.431   1.117
   79   1HE2  GLN  11          1HE2      GLN  11  -5.538 -14.404   0.971
   80   2HE2  GLN  11          2HE2      GLN  11  -6.406 -15.943   1.112
   81    H    GLN  12           H        GLN  12  -8.631 -10.427   4.632
   82    HA   GLN  12           HA       GLN  12 -11.361  -9.792   4.652
   83   1HB   GLN  12          1HB       GLN  12 -10.020 -10.574   6.608
   84   2HB   GLN  12          2HB       GLN  12  -9.325  -8.942   6.740
   85   1HG   GLN  12          1HG       GLN  12 -11.358  -7.969   7.395
   86   2HG   GLN  12          2HG       GLN  12 -12.310  -9.319   6.779
   87   1HE2  GLN  12          1HE2      GLN  12  -9.447  -9.220   9.261
   88   2HE2  GLN  12          2HE2      GLN  12 -10.474 -10.070  10.379
   89    H    ALA  13           H        ALA  13  -8.570  -7.528   4.415
   90    HA   ALA  13           HA       ALA  13 -10.228  -5.188   4.401
   91   1HB   ALA  13          1HB       ALA  13  -7.875  -5.099   5.072
   92   2HB   ALA  13          2HB       ALA  13  -7.362  -5.599   3.445
   93   3HB   ALA  13          3HB       ALA  13  -8.178  -4.038   3.690
   94    H    ILE  14           H        ILE  14  -8.423  -6.908   1.747
   95    HA   ILE  14           HA       ILE  14  -9.437  -5.097  -0.199
   96    HB   ILE  14           HB       ILE  14  -8.358  -6.427  -1.860
   97   1HG1  ILE  14          1HG1      ILE  14  -7.373  -8.517   0.023
   98   2HG1  ILE  14          2HG1      ILE  14  -8.943  -8.722  -0.754
   99   1HG2  ILE  14          1HG2      ILE  14  -6.052  -6.253  -1.058
  100   2HG2  ILE  14          2HG2      ILE  14  -7.020  -4.884  -0.505
  101   3HG2  ILE  14          3HG2      ILE  14  -6.608  -6.190   0.620
  102   1HD1  ILE  14          1HD1      ILE  14  -7.867  -8.471  -2.974
  103   2HD1  ILE  14          2HD1      ILE  14  -6.283  -8.301  -2.177
  104   3HD1  ILE  14          3HD1      ILE  14  -7.187  -9.820  -2.040
  105    H    GLN  15           H        GLN  15 -11.218  -7.499   1.205
  106    HA   GLN  15           HA       GLN  15 -12.430  -9.038  -0.560
  107   1HB   GLN  15          1HB       GLN  15 -14.407  -9.092   0.842
  108   2HB   GLN  15          2HB       GLN  15 -12.937  -9.065   1.808
  109   1HG   GLN  15          1HG       GLN  15 -13.286  -6.652   2.298
  110   2HG   GLN  15          2HG       GLN  15 -14.746  -6.657   1.301
  111   1HE2  GLN  15          1HE2      GLN  15 -13.407  -7.534   4.433
  112   2HE2  GLN  15          2HE2      GLN  15 -14.960  -8.075   5.102
  113    H    GLY  16           H        GLY  16 -13.384  -5.535  -0.365
  114   1HA   GLY  16          1HA       GLY  16 -13.780  -5.183  -2.967
  115   2HA   GLY  16          2HA       GLY  16 -15.322  -5.937  -2.532
  116    H    ASP  17           H        ASP  17 -15.792  -3.823  -3.524
  117    HA   ASP  17           HA       ASP  17 -16.862  -1.922  -3.641
  118   1HB   ASP  17          1HB       ASP  17 -18.200  -2.776  -1.804
  119   2HB   ASP  17          2HB       ASP  17 -17.066  -2.115  -0.620
  120    H    GLY  18           H        GLY  18 -14.678  -1.788  -0.966
  121   1HA   GLY  18          1HA       GLY  18 -14.543   1.145  -1.176
  122   2HA   GLY  18          2HA       GLY  18 -13.870   0.181   0.142
  123    HA   PRO  19           HA       PRO  19 -10.313   1.365  -2.819
  124   1HB   PRO  19          1HB       PRO  19  -9.580   3.877  -2.082
  125   2HB   PRO  19          2HB       PRO  19 -10.774   3.572  -3.367
  126   1HG   PRO  19          1HG       PRO  19 -11.331   4.216  -0.466
  127   2HG   PRO  19          2HG       PRO  19 -12.078   4.945  -1.922
  128   1HD   PRO  19          1HD       PRO  19 -13.253   2.941  -0.478
  129   2HD   PRO  19          2HD       PRO  19 -13.435   3.047  -2.256
  130    H    VAL  20           H        VAL  20  -9.545  -0.280  -1.541
  131    HA   VAL  20           HA       VAL  20  -8.257   0.367   1.066
  132    HB   VAL  20           HB       VAL  20  -8.687  -2.215  -0.505
  133   1HG1  VAL  20          1HG1      VAL  20  -7.710  -3.422   1.434
  134   2HG1  VAL  20          2HG1      VAL  20  -6.508  -2.457   0.588
  135   3HG1  VAL  20          3HG1      VAL  20  -7.180  -1.873   2.129
  136   1HG2  VAL  20          1HG2      VAL  20 -10.666  -1.367   0.722
  137   2HG2  VAL  20          2HG2      VAL  20 -10.051  -2.850   1.438
  138   3HG2  VAL  20          3HG2      VAL  20  -9.710  -1.297   2.221
  139    H    LEU  21           H        LEU  21  -5.964   0.346   1.218
  140    HA   LEU  21           HA       LEU  21  -4.516  -0.712  -1.071
  141   1HB   LEU  21          1HB       LEU  21  -2.915   1.093  -1.211
  142   2HB   LEU  21          2HB       LEU  21  -4.536   1.613  -1.637
  143    HG   LEU  21           HG       LEU  21  -3.799   2.090   1.163
  144   1HD1  LEU  21          1HD1      LEU  21  -2.441   3.743  -0.970
  145   2HD1  LEU  21          2HD1      LEU  21  -2.363   3.981   0.790
  146   3HD1  LEU  21          3HD1      LEU  21  -1.642   2.541   0.075
  147   1HD2  LEU  21          1HD2      LEU  21  -5.911   2.956   0.176
  148   2HD2  LEU  21          2HD2      LEU  21  -4.886   4.243   0.820
  149   3HD2  LEU  21          3HD2      LEU  21  -4.964   3.960  -0.935
  150    H    VAL  22           H        VAL  22  -2.189  -0.992  -0.544
  151    HA   VAL  22           HA       VAL  22  -1.871  -1.825   2.314
  152    HB   VAL  22           HB       VAL  22  -1.308  -3.283  -0.295
  153   1HG1  VAL  22          1HG1      VAL  22  -0.252  -5.071   1.088
  154   2HG1  VAL  22          2HG1      VAL  22   0.706  -3.603   1.014
  155   3HG1  VAL  22          3HG1      VAL  22  -0.239  -3.941   2.472
  156   1HG2  VAL  22          1HG2      VAL  22  -2.891  -4.011   2.216
  157   2HG2  VAL  22          2HG2      VAL  22  -3.574  -3.571   0.638
  158   3HG2  VAL  22          3HG2      VAL  22  -2.656  -5.069   0.812
  159    H    ASP  23           H        ASP  23   0.009  -1.201   3.290
  160    HA   ASP  23           HA       ASP  23   2.184   0.005   1.649
  161   1HB   ASP  23          1HB       ASP  23   1.181   1.111   3.783
  162   2HB   ASP  23          2HB       ASP  23   1.913  -0.163   4.688
  163    H    PHE  24           H        PHE  24   3.330  -1.712   0.820
  164    HA   PHE  24           HA       PHE  24   3.970  -4.070   2.511
  165   1HB   PHE  24          1HB       PHE  24   4.380  -3.345  -0.375
  166   2HB   PHE  24          2HB       PHE  24   5.275  -4.644   0.346
  167    HD1  PHE  24           1HD      PHE  24   2.284  -3.923  -1.445
  168    HD2  PHE  24           2HD      PHE  24   3.988  -6.462   1.591
  169    HE1  PHE  24           1HE      PHE  24   0.817  -5.791  -2.168
  170    HE2  PHE  24           2HE      PHE  24   2.613  -8.351   0.792
  171    HZ   PHE  24           HZ       PHE  24   1.131  -8.075  -1.127
  172    H    TRP  25           H        TRP  25   5.570  -3.733   3.830
  173    HA   TRP  25           HA       TRP  25   8.022  -2.325   2.920
  174   1HB   TRP  25          1HB       TRP  25   8.206  -1.151   4.976
  175   2HB   TRP  25          2HB       TRP  25   6.572  -0.894   4.432
  176    HD1  TRP  25           HD       TRP  25   4.651  -2.315   5.787
  177    HE1  TRP  25           1HE      TRP  25   4.574  -3.124   8.224
  178    HE3  TRP  25           3HE      TRP  25   9.617  -1.895   6.910
  179    HZ2  TRP  25           2HZ      TRP  25   6.478  -3.620  10.378
  180    HZ3  TRP  25           3HZ      TRP  25  10.461  -2.516   9.158
  181    HH2  TRP  25           HH       TRP  25   8.905  -3.395  10.888
  182    H    ALA  26           H        ALA  26   9.889  -3.081   4.758
  183    HA   ALA  26           HA       ALA  26   9.392  -5.808   5.661
  184   1HB   ALA  26          1HB       ALA  26  11.258  -6.791   4.526
  185   2HB   ALA  26          2HB       ALA  26  10.275  -6.022   3.272
  186   3HB   ALA  26          3HB       ALA  26  11.758  -5.236   3.823
  187    H    ALA  27           H        ALA  27  10.773  -6.405   7.320
  188    HA   ALA  27           HA       ALA  27  11.740  -4.391   8.968
  189   1HB   ALA  27          1HB       ALA  27  12.514  -7.336   8.977
  190   2HB   ALA  27          2HB       ALA  27  12.674  -6.203  10.335
  191   3HB   ALA  27          3HB       ALA  27  11.062  -6.629   9.729
  192    H    TRP  28           H        TRP  28  13.579  -5.931   6.374
  193    HA   TRP  28           HA       TRP  28  16.119  -4.949   7.552
  194   1HB   TRP  28          1HB       TRP  28  17.174  -6.643   6.592
  195   2HB   TRP  28          2HB       TRP  28  15.595  -7.389   6.590
  196    HD1  TRP  28           HD       TRP  28  18.345  -6.114   4.406
  197    HE1  TRP  28           1HE      TRP  28  17.867  -6.436   1.919
  198    HE3  TRP  28           3HE      TRP  28  13.496  -7.741   4.718
  199    HZ2  TRP  28           2HZ      TRP  28  15.580  -7.030   0.250
  200    HZ3  TRP  28           3HZ      TRP  28  12.181  -8.125   2.645
  201    HH2  TRP  28           HH       TRP  28  13.198  -7.696   0.423
  202    H    CYS  29           H        CYS  29  13.850  -3.689   5.443
  203    HA   CYS  29           HA       CYS  29  15.326  -3.291   3.073
  204   1HB   CYS  29          1HB       CYS  29  13.465  -1.977   2.368
  205   2HB   CYS  29          2HB       CYS  29  12.816  -3.227   3.428
  206    H    GLY  30           H        GLY  30  15.746  -1.095   2.076
  207   1HA   GLY  30          1HA       GLY  30  16.951   0.885   3.941
  208   2HA   GLY  30          2HA       GLY  30  17.157   0.839   2.192
  209    HA   PRO  31           HA       PRO  31  14.335   4.079   1.880
  210   1HB   PRO  31          1HB       PRO  31  12.912   3.621  -0.467
  211   2HB   PRO  31          2HB       PRO  31  14.613   4.179  -0.376
  212   1HG   PRO  31          1HG       PRO  31  13.575   1.359  -0.766
  213   2HG   PRO  31          2HG       PRO  31  14.884   2.195  -1.661
  214   1HD   PRO  31          1HD       PRO  31  15.445   0.479   0.351
  215   2HD   PRO  31          2HD       PRO  31  16.378   1.998   0.176
  216    H    CYS  32           H        CYS  32  12.750   0.910   1.909
  217    HA   CYS  32           HA       CYS  32  10.111   1.974   2.155
  218   1HB   CYS  32          1HB       CYS  32   9.353  -0.114   2.435
  219   2HB   CYS  32          2HB       CYS  32  10.909  -0.517   1.730
  220    H    ARG  33           H        ARG  33  12.737   1.757   4.459
  221    HA   ARG  33           HA       ARG  33  11.124   2.116   6.825
  222   1HB   ARG  33          1HB       ARG  33  13.456   1.123   6.611
  223   2HB   ARG  33          2HB       ARG  33  14.049   2.762   6.328
  224   1HG   ARG  33          1HG       ARG  33  13.351   3.440   8.583
  225   2HG   ARG  33          2HG       ARG  33  12.611   1.840   8.854
  226   1HD   ARG  33          1HD       ARG  33  14.806   0.758   8.569
  227   2HD   ARG  33          2HD       ARG  33  15.557   2.332   8.224
  228    HE   ARG  33           HE       ARG  33  14.281   2.551  10.707
  229   1HH1  ARG  33          2HH2      ARG  33  16.942   0.702   9.313
  230   2HH1  ARG  33          1HH2      ARG  33  17.868   0.592  10.769
  231   1HH2  ARG  33          2HH1      ARG  33  15.483   2.421  12.688
  232   2HH2  ARG  33          1HH1      ARG  33  16.997   1.598  12.739
  233    H    MET  34           H        MET  34  12.088   4.241   4.271
  234    HA   MET  34           HA       MET  34  11.558   6.667   5.850
  235   1HB   MET  34          1HB       MET  34  12.567   6.205   2.997
  236   2HB   MET  34          2HB       MET  34  12.331   7.793   3.715
  237   1HG   MET  34          1HG       MET  34  14.171   7.576   5.141
  238   2HG   MET  34          2HG       MET  34  14.162   5.816   5.077
  239   1HE   MET  34          1HE       MET  34  14.865   9.067   2.910
  240   2HE   MET  34          2HE       MET  34  15.627   8.352   1.471
  241   3HE   MET  34          3HE       MET  34  13.905   8.071   1.789
  242    H    MET  35           H        MET  35  10.432   4.767   3.078
  243    HA   MET  35           HA       MET  35   8.302   6.475   2.329
  244   1HB   MET  35          1HB       MET  35   9.391   4.597   0.991
  245   2HB   MET  35          2HB       MET  35   8.415   3.465   1.923
  246   1HG   MET  35          1HG       MET  35   7.519   3.981  -0.296
  247   2HG   MET  35          2HG       MET  35   6.414   4.483   0.963
  248   1HE   MET  35          1HE       MET  35   5.243   5.564  -1.176
  249   2HE   MET  35          2HE       MET  35   5.964   6.853  -2.159
  250   3HE   MET  35          3HE       MET  35   6.603   5.196  -2.237
  251    H    ALA  36           H        ALA  36   8.407   3.605   4.584
  252    HA   ALA  36           HA       ALA  36   5.606   3.470   4.918
  253   1HB   ALA  36          1HB       ALA  36   7.808   2.711   6.887
  254   2HB   ALA  36          2HB       ALA  36   6.095   2.251   7.017
  255   3HB   ALA  36          3HB       ALA  36   7.062   1.677   5.649
  256    HA   PRO  37           HA       PRO  37   5.679   6.774   8.335
  257   1HB   PRO  37          1HB       PRO  37   7.811   8.550   8.461
  258   2HB   PRO  37          2HB       PRO  37   7.574   7.125   9.519
  259   1HG   PRO  37          1HG       PRO  37   9.325   7.404   7.105
  260   2HG   PRO  37          2HG       PRO  37   9.665   6.553   8.630
  261   1HD   PRO  37          1HD       PRO  37   8.885   5.216   6.387
  262   2HD   PRO  37          2HD       PRO  37   8.404   4.684   8.014
  263    H    VAL  38           H        VAL  38   7.434   7.648   5.192
  264    HA   VAL  38           HA       VAL  38   6.027  10.147   5.048
  265    HB   VAL  38           HB       VAL  38   7.953   8.775   3.503
  266   1HG1  VAL  38          1HG1      VAL  38   7.347   9.152   1.193
  267   2HG1  VAL  38          2HG1      VAL  38   6.292   7.948   1.939
  268   3HG1  VAL  38          3HG1      VAL  38   5.693   9.587   1.662
  269   1HG2  VAL  38          1HG2      VAL  38   6.778  11.547   3.298
  270   2HG2  VAL  38          2HG2      VAL  38   8.173  11.021   4.235
  271   3HG2  VAL  38          3HG2      VAL  38   8.256  11.005   2.467
  272    H    LEU  39           H        LEU  39   5.081   6.880   4.105
  273    HA   LEU  39           HA       LEU  39   2.641   7.498   2.820
  274   1HB   LEU  39          1HB       LEU  39   3.900   5.022   4.055
  275   2HB   LEU  39          2HB       LEU  39   2.310   4.986   3.375
  276    HG   LEU  39           HG       LEU  39   4.853   5.645   1.852
  277   1HD1  LEU  39          1HD1      LEU  39   4.622   3.276   2.405
  278   2HD1  LEU  39          2HD1      LEU  39   2.964   3.256   1.785
  279   3HD1  LEU  39          3HD1      LEU  39   4.329   3.498   0.676
  280   1HD2  LEU  39          1HD2      LEU  39   3.390   5.455  -0.183
  281   2HD2  LEU  39          2HD2      LEU  39   2.003   5.684   0.895
  282   3HD2  LEU  39          3HD2      LEU  39   3.270   6.944   0.750
  283    H    GLU  40           H        GLU  40   3.560   7.614   6.189
  284    HA   GLU  40           HA       GLU  40   0.901   6.919   7.163
  285   1HB   GLU  40          1HB       GLU  40   3.397   6.839   8.302
  286   2HB   GLU  40          2HB       GLU  40   2.856   8.398   8.896
  287   1HG   GLU  40          1HG       GLU  40   2.156   6.854  10.544
  288   2HG   GLU  40          2HG       GLU  40   0.676   7.114   9.611
  289    H    GLU  41           H        GLU  41   2.794   9.844   6.466
  290    HA   GLU  41           HA       GLU  41   0.786  11.762   7.240
  291   1HB   GLU  41          1HB       GLU  41   2.756  11.928   4.956
  292   2HB   GLU  41          2HB       GLU  41   1.969  13.291   5.738
  293   1HG   GLU  41          1HG       GLU  41   3.258  12.869   7.801
  294   2HG   GLU  41          2HG       GLU  41   4.009  11.444   7.069
  295    H    PHE  42           H        PHE  42   1.463   9.964   4.224
  296    HA   PHE  42           HA       PHE  42  -0.779  10.912   2.663
  297   1HB   PHE  42          1HB       PHE  42   1.190   9.718   1.739
  298   2HB   PHE  42          2HB       PHE  42   0.719   8.274   2.609
  299    HD1  PHE  42           1HD      PHE  42  -1.123   6.849   1.896
  300    HD2  PHE  42           2HD      PHE  42   0.027  10.363  -0.344
  301    HE1  PHE  42           1HE      PHE  42  -2.490   6.089  -0.045
  302    HE2  PHE  42           2HE      PHE  42  -1.259   9.538  -2.288
  303    HZ   PHE  42           HZ       PHE  42  -2.623   7.478  -2.082
  304    H    ALA  43           H        ALA  43  -0.481   8.050   4.895
  305    HA   ALA  43           HA       ALA  43  -3.084   7.132   4.591
  306   1HB   ALA  43          1HB       ALA  43  -2.808   6.052   6.744
  307   2HB   ALA  43          2HB       ALA  43  -1.228   6.018   5.927
  308   3HB   ALA  43          3HB       ALA  43  -1.541   7.176   7.230
  309    H    GLU  44           H        GLU  44  -1.905   9.581   6.912
  310    HA   GLU  44           HA       GLU  44  -4.393  10.197   8.102
  311   1HB   GLU  44          1HB       GLU  44  -2.212  10.755   9.029
  312   2HB   GLU  44          2HB       GLU  44  -1.910  11.921   7.746
  313   1HG   GLU  44          1HG       GLU  44  -4.481  12.360   9.198
  314   2HG   GLU  44          2HG       GLU  44  -3.068  12.415  10.233
  315    H    ALA  45           H        ALA  45  -2.694  11.858   5.408
  316    HA   ALA  45           HA       ALA  45  -4.335  14.021   5.214
  317   1HB   ALA  45          1HB       ALA  45  -3.337  14.360   2.965
  318   2HB   ALA  45          2HB       ALA  45  -2.132  13.835   4.155
  319   3HB   ALA  45          3HB       ALA  45  -2.775  12.674   2.966
  320    H    HIS  46           H        HIS  46  -5.171  10.909   3.981
  321    HA   HIS  46           HA       HIS  46  -7.822  11.969   3.265
  322   1HB   HIS  46          1HB       HIS  46  -7.760  10.401   1.183
  323   2HB   HIS  46          2HB       HIS  46  -7.098  12.025   1.118
  324    HD1  HIS  46           1HD      HIS  46  -4.906  11.995  -0.475
  325    HD2  HIS  46           2HD      HIS  46  -5.272   8.771   2.330
  326    HE1  HIS  46           1HE      HIS  46  -2.858  10.688  -0.573
  327    HE2  HIS  46           2HE      HIS  46  -3.034   8.694   1.018
  328    H    ALA  47           H        ALA  47  -6.907  10.659   5.589
  329    HA   ALA  47           HA       ALA  47  -7.395   7.890   5.689
  330   1HB   ALA  47          1HB       ALA  47  -6.359   9.221   7.520
  331   2HB   ALA  47          2HB       ALA  47  -7.915  10.007   7.831
  332   3HB   ALA  47          3HB       ALA  47  -7.714   8.264   8.114
  333    H    ASP  48           H        ASP  48  -9.720  10.280   4.921
  334    HA   ASP  48           HA       ASP  48 -12.040   8.785   5.867
  335   1HB   ASP  48          1HB       ASP  48 -13.247  10.781   5.106
  336   2HB   ASP  48          2HB       ASP  48 -11.935  11.266   6.180
  337    H    LYS  49           H        LYS  49 -10.682  10.111   2.817
  338    HA   LYS  49           HA       LYS  49 -12.652   8.828   1.192
  339   1HB   LYS  49          1HB       LYS  49 -11.311  10.833   0.558
  340   2HB   LYS  49          2HB       LYS  49  -9.886   9.807   0.359
  341   1HG   LYS  49          1HG       LYS  49 -10.940   8.582  -1.465
  342   2HG   LYS  49          2HG       LYS  49 -12.479   9.405  -1.203
  343   1HD   LYS  49          1HD       LYS  49  -9.893  10.791  -2.036
  344   2HD   LYS  49          2HD       LYS  49 -11.110  10.220  -3.181
  345   1HE   LYS  49          1HE       LYS  49 -12.808  11.710  -2.180
  346   2HE   LYS  49          2HE       LYS  49 -11.638  12.239  -0.961
  347   1HZ   LYS  49          1HZ       LYS  49 -11.805  12.985  -3.791
  348   2HZ   LYS  49          2HZ       LYS  49 -11.313  13.871  -2.491
  349   3HZ   LYS  49          3HZ       LYS  49 -10.319  12.757  -3.206
  350    H    VAL  50           H        VAL  50  -9.708   7.537   2.593
  351    HA   VAL  50           HA       VAL  50 -10.135   5.001   1.145
  352    HB   VAL  50           HB       VAL  50  -7.811   4.761   0.500
  353   1HG1  VAL  50          1HG1      VAL  50  -8.800   7.413  -0.587
  354   2HG1  VAL  50          2HG1      VAL  50  -7.720   6.253  -1.389
  355   3HG1  VAL  50          3HG1      VAL  50  -9.422   5.849  -1.099
  356   1HG2  VAL  50          1HG2      VAL  50  -6.726   6.240   2.219
  357   2HG2  VAL  50          2HG2      VAL  50  -6.162   6.538   0.565
  358   3HG2  VAL  50          3HG2      VAL  50  -7.322   7.646   1.312
  359    H    THR  51           H        THR  51  -8.624   3.245   2.062
  360    HA   THR  51           HA       THR  51  -7.584   3.944   4.668
  361    HB   THR  51           HB       THR  51  -9.659   2.704   5.088
  362    HG1  THR  51           1HG      THR  51  -7.220   1.393   5.792
  363   1HG2  THR  51          1HG2      THR  51  -9.634   1.211   3.106
  364   2HG2  THR  51          2HG2      THR  51  -8.285   0.308   3.837
  365   3HG2  THR  51          3HG2      THR  51  -9.865   0.361   4.650
  366    H    VAL  52           H        VAL  52  -5.470   3.419   4.834
  367    HA   VAL  52           HA       VAL  52  -4.452   1.400   2.935
  368    HB   VAL  52           HB       VAL  52  -3.225   3.498   2.912
  369   1HG1  VAL  52          1HG1      VAL  52  -1.785   4.236   4.695
  370   2HG1  VAL  52          2HG1      VAL  52  -3.480   4.285   5.203
  371   3HG1  VAL  52          3HG1      VAL  52  -2.407   2.980   5.773
  372   1HG2  VAL  52          1HG2      VAL  52  -1.022   2.665   2.902
  373   2HG2  VAL  52          2HG2      VAL  52  -1.377   1.419   4.099
  374   3HG2  VAL  52          3HG2      VAL  52  -2.052   1.299   2.461
  375    H    ALA  53           H        ALA  53  -2.880  -0.052   4.089
  376    HA   ALA  53           HA       ALA  53  -3.098  -0.174   6.916
  377   1HB   ALA  53          1HB       ALA  53  -5.024  -1.658   6.360
  378   2HB   ALA  53          2HB       ALA  53  -3.958  -2.639   5.329
  379   3HB   ALA  53          3HB       ALA  53  -3.697  -2.564   7.097
  380    H    LYS  54           H        LYS  54  -1.276  -1.456   7.764
  381    HA   LYS  54           HA       LYS  54   0.854  -1.516   5.668
  382   1HB   LYS  54          1HB       LYS  54   1.223  -1.056   8.647
  383   2HB   LYS  54          2HB       LYS  54   2.426  -0.829   7.375
  384   1HG   LYS  54          1HG       LYS  54   1.102   1.107   6.486
  385   2HG   LYS  54          2HG       LYS  54  -0.102   0.831   7.749
  386   1HD   LYS  54          1HD       LYS  54   1.073   2.391   8.845
  387   2HD   LYS  54          2HD       LYS  54   1.979   1.004   9.383
  388   1HE   LYS  54          1HE       LYS  54   3.527   2.709   8.826
  389   2HE   LYS  54          2HE       LYS  54   3.690   1.472   7.554
  390   1HZ   LYS  54          1HZ       LYS  54   3.555   3.938   6.919
  391   2HZ   LYS  54          2HZ       LYS  54   2.691   2.879   6.030
  392   3HZ   LYS  54          3HZ       LYS  54   1.956   3.837   7.261
  393    H    LEU  55           H        LEU  55   2.174  -3.222   5.415
  394    HA   LEU  55           HA       LEU  55   2.335  -5.175   7.617
  395   1HB   LEU  55          1HB       LEU  55   1.706  -7.107   6.291
  396   2HB   LEU  55          2HB       LEU  55   0.414  -5.962   6.521
  397    HG   LEU  55           HG       LEU  55   1.527  -5.163   4.038
  398   1HD1  LEU  55          1HD1      LEU  55   1.572  -7.207   2.714
  399   2HD1  LEU  55          2HD1      LEU  55   2.832  -7.284   3.963
  400   3HD1  LEU  55          3HD1      LEU  55   1.304  -8.194   4.148
  401   1HD2  LEU  55          1HD2      LEU  55  -0.833  -6.985   4.651
  402   2HD2  LEU  55          2HD2      LEU  55  -0.847  -5.197   4.546
  403   3HD2  LEU  55          3HD2      LEU  55  -0.557  -6.176   3.106
  404    H    ASN  56           H        ASN  56   3.931  -6.562   7.620
  405    HA   ASN  56           HA       ASN  56   6.417  -5.851   6.275
  406   1HB   ASN  56          1HB       ASN  56   6.384  -6.253   8.656
  407   2HB   ASN  56          2HB       ASN  56   5.571  -7.801   8.448
  408   1HD2  ASN  56          1HD2      ASN  56   7.130  -8.995   9.560
  409   2HD2  ASN  56          2HD2      ASN  56   8.762  -9.230   8.909
  410    H    VAL  57           H        VAL  57   6.706  -6.638   4.281
  411    HA   VAL  57           HA       VAL  57   4.989  -8.408   3.019
  412    HB   VAL  57           HB       VAL  57   6.365  -6.542   2.125
  413   1HG1  VAL  57          1HG1      VAL  57   8.592  -8.616   1.838
  414   2HG1  VAL  57          2HG1      VAL  57   8.639  -6.950   1.292
  415   3HG1  VAL  57          3HG1      VAL  57   8.582  -7.304   3.027
  416   1HG2  VAL  57          1HG2      VAL  57   6.419  -7.296  -0.083
  417   2HG2  VAL  57          2HG2      VAL  57   6.688  -8.987   0.390
  418   3HG2  VAL  57          3HG2      VAL  57   5.125  -8.227   0.691
  419    H    ASP  58           H        ASP  58   8.152  -9.081   4.446
  420    HA   ASP  58           HA       ASP  58   8.691 -11.611   3.233
  421   1HB   ASP  58          1HB       ASP  58  10.369 -10.132   4.233
  422   2HB   ASP  58          2HB       ASP  58   9.601 -10.307   5.810
  423    H    GLU  59           H        GLU  59   7.105 -10.595   6.138
  424    HA   GLU  59           HA       GLU  59   6.629 -13.168   7.394
  425   1HB   GLU  59          1HB       GLU  59   7.003 -11.235   8.693
  426   2HB   GLU  59          2HB       GLU  59   5.881 -10.283   7.739
  427   1HG   GLU  59          1HG       GLU  59   4.004 -11.718   8.759
  428   2HG   GLU  59          2HG       GLU  59   5.225 -12.236   9.931
  429    H    ASN  60           H        ASN  60   4.817 -10.994   5.148
  430    HA   ASN  60           HA       ASN  60   2.417 -12.650   5.433
  431   1HB   ASN  60          1HB       ASN  60   2.890  -9.729   4.768
  432   2HB   ASN  60          2HB       ASN  60   1.377 -10.572   4.636
  433   1HD2  ASN  60          1HD2      ASN  60   3.677  -9.213   6.797
  434   2HD2  ASN  60          2HD2      ASN  60   2.894  -9.553   8.344
  435    HA   PRO  61           HA       PRO  61   3.911 -13.617   1.207
  436   1HB   PRO  61          1HB       PRO  61   3.553 -16.328   1.265
  437   2HB   PRO  61          2HB       PRO  61   4.997 -15.490   1.895
  438   1HG   PRO  61          1HG       PRO  61   2.581 -16.437   3.476
  439   2HG   PRO  61          2HG       PRO  61   4.317 -16.683   3.843
  440   1HD   PRO  61          1HD       PRO  61   2.877 -14.673   4.986
  441   2HD   PRO  61          2HD       PRO  61   4.589 -14.459   4.541
  442    H    GLU  62           H        GLU  62   1.243 -15.766   2.285
  443    HA   GLU  62           HA       GLU  62  -0.040 -16.901   0.834
  444   1HB   GLU  62          1HB       GLU  62  -2.188 -16.085   1.004
  445   2HB   GLU  62          2HB       GLU  62  -1.323 -15.644   2.463
  446   1HG   GLU  62          1HG       GLU  62  -1.318 -13.311   1.857
  447   2HG   GLU  62          2HG       GLU  62  -1.780 -13.667   0.192
  448    H    THR  63           H        THR  63   0.528 -13.837  -0.794
  449    HA   THR  63           HA       THR  63   0.446 -14.973  -3.364
  450    HB   THR  63           HB       THR  63  -1.869 -13.283  -2.391
  451    HG1  THR  63           1HG      THR  63  -1.625 -15.726  -2.564
  452   1HG2  THR  63          1HG2      THR  63  -1.235 -13.760  -5.327
  453   2HG2  THR  63          2HG2      THR  63  -2.767 -13.147  -4.681
  454   3HG2  THR  63          3HG2      THR  63  -1.299 -12.177  -4.502
  455    H    THR  64           H        THR  64   1.486 -12.571  -1.188
  456    HA   THR  64           HA       THR  64   2.547 -10.490  -2.573
  457    HB   THR  64           HB       THR  64   3.645 -12.426  -0.511
  458    HG1  THR  64           1HG      THR  64   2.737 -11.082   0.916
  459   1HG2  THR  64          1HG2      THR  64   5.239 -10.797   0.231
  460   2HG2  THR  64          2HG2      THR  64   5.601 -11.255  -1.433
  461   3HG2  THR  64          3HG2      THR  64   4.796  -9.706  -1.099
  462    H    SER  65           H        SER  65   4.100 -13.756  -2.307
  463    HA   SER  65           HA       SER  65   6.129 -13.081  -4.185
  464   1HB   SER  65          1HB       SER  65   6.320 -14.835  -2.404
  465   2HB   SER  65          2HB       SER  65   5.224 -15.864  -3.352
  466    HG   SER  65           HG       SER  65   6.830 -15.362  -5.131
  467    H    GLN  66           H        GLN  66   2.817 -13.989  -4.817
  468    HA   GLN  66           HA       GLN  66   3.384 -15.308  -7.373
  469   1HB   GLN  66          1HB       GLN  66   1.392 -15.790  -5.808
  470   2HB   GLN  66          2HB       GLN  66   0.741 -14.240  -6.309
  471   1HG   GLN  66          1HG       GLN  66  -0.331 -15.874  -7.654
  472   2HG   GLN  66          2HG       GLN  66   0.817 -15.073  -8.718
  473   1HE2  GLN  66          1HE2      GLN  66  -0.050 -18.125  -7.137
  474   2HE2  GLN  66          2HE2      GLN  66   1.225 -19.054  -7.916
  475    H    PHE  67           H        PHE  67   2.646 -12.055  -6.096
  476    HA   PHE  67           HA       PHE  67   2.447 -10.963  -8.852
  477   1HB   PHE  67          1HB       PHE  67   1.755  -9.961  -6.092
  478   2HB   PHE  67          2HB       PHE  67   2.016  -8.824  -7.407
  479    HD1  PHE  67           1HD      PHE  67   0.004 -11.867  -6.522
  480    HD2  PHE  67           2HD      PHE  67   0.263  -8.268  -8.877
  481    HE1  PHE  67           1HE      PHE  67  -2.339 -12.187  -7.273
  482    HE2  PHE  67           2HE      PHE  67  -2.080  -8.587  -9.618
  483    HZ   PHE  67           HZ       PHE  67  -3.386 -10.545  -8.819
  484    H    GLY  68           H        GLY  68   4.981 -12.004  -7.184
  485   1HA   GLY  68          1HA       GLY  68   7.219 -11.528  -7.263
  486   2HA   GLY  68          2HA       GLY  68   6.850 -10.269  -8.450
  487    H    ILE  69           H        ILE  69   5.335 -10.154  -5.262
  488    HA   ILE  69           HA       ILE  69   6.311  -7.453  -4.947
  489    HB   ILE  69           HB       ILE  69   4.472  -9.166  -3.254
  490   1HG1  ILE  69          1HG1      ILE  69   3.613  -8.850  -5.518
  491   2HG1  ILE  69          2HG1      ILE  69   2.620  -8.049  -4.323
  492   1HG2  ILE  69          1HG2      ILE  69   5.040  -6.201  -3.074
  493   2HG2  ILE  69          2HG2      ILE  69   3.552  -6.965  -2.489
  494   3HG2  ILE  69          3HG2      ILE  69   5.077  -7.447  -1.799
  495   1HD1  ILE  69          1HD1      ILE  69   3.615  -5.870  -4.938
  496   2HD1  ILE  69          2HD1      ILE  69   4.643  -6.668  -6.150
  497   3HD1  ILE  69          3HD1      ILE  69   2.879  -6.677  -6.330
  498    H    MET  70           H        MET  70   8.532  -8.152  -4.887
  499    HA   MET  70           HA       MET  70   9.381  -8.264  -2.013
  500   1HB   MET  70          1HB       MET  70  10.087 -10.208  -3.657
  501   2HB   MET  70          2HB       MET  70  11.194  -9.006  -4.315
  502   1HG   MET  70          1HG       MET  70  12.592  -9.862  -2.768
  503   2HG   MET  70          2HG       MET  70  11.799  -8.739  -1.678
  504   1HE   MET  70          1HE       MET  70   8.874 -10.453  -1.246
  505   2HE   MET  70          2HE       MET  70   9.350 -11.205   0.287
  506   3HE   MET  70          3HE       MET  70   9.771  -9.508  -0.030
  507    H    SER  71           H        SER  71   8.841  -6.201  -4.565
  508    HA   SER  71           HA       SER  71  11.257  -4.631  -4.607
  509   1HB   SER  71          1HB       SER  71   9.586  -3.358  -6.220
  510   2HB   SER  71          2HB       SER  71  10.255  -4.926  -6.673
  511    HG   SER  71           HG       SER  71   8.004  -4.871  -7.006
  512    H    ILE  72           H        ILE  72  10.332  -4.659  -1.950
  513    HA   ILE  72           HA       ILE  72   8.505  -2.553  -1.551
  514    HB   ILE  72           HB       ILE  72   8.849  -2.687   0.782
  515   1HG1  ILE  72          1HG1      ILE  72  11.226  -3.050   1.017
  516   2HG1  ILE  72          2HG1      ILE  72  10.240  -4.152   1.951
  517   1HG2  ILE  72          1HG2      ILE  72   7.896  -4.838   1.085
  518   2HG2  ILE  72          2HG2      ILE  72   7.340  -4.171  -0.453
  519   3HG2  ILE  72          3HG2      ILE  72   8.572  -5.432  -0.462
  520   1HD1  ILE  72          1HD1      ILE  72  11.753  -4.823  -0.596
  521   2HD1  ILE  72          2HD1      ILE  72  12.127  -5.340   1.052
  522   3HD1  ILE  72          3HD1      ILE  72  10.671  -5.957   0.258
  523    HA   PRO  73           HA       PRO  73   8.110  -0.757   0.262
  524   1HB   PRO  73          1HB       PRO  73   7.424   1.789  -0.409
  525   2HB   PRO  73          2HB       PRO  73   8.486   1.375   0.953
  526   1HG   PRO  73          1HG       PRO  73   9.244   2.298  -1.822
  527   2HG   PRO  73          2HG       PRO  73   9.971   2.813  -0.274
  528   1HD   PRO  73          1HD       PRO  73  11.101   0.934  -1.928
  529   2HD   PRO  73          2HD       PRO  73  11.296   0.886  -0.159
  530    H    THR  74           H        THR  74   6.348  -1.590  -0.688
  531    HA   THR  74           HA       THR  74   5.711  -0.788  -3.485
  532    HB   THR  74           HB       THR  74   4.998  -3.478  -2.267
  533    HG1  THR  74           1HG      THR  74   7.326  -2.740  -3.631
  534   1HG2  THR  74          1HG2      THR  74   4.704  -2.286  -5.016
  535   2HG2  THR  74          2HG2      THR  74   4.787  -4.027  -4.761
  536   3HG2  THR  74          3HG2      THR  74   3.497  -3.073  -4.000
  537    H    LEU  75           H        LEU  75   3.551  -0.367  -3.896
  538    HA   LEU  75           HA       LEU  75   1.682  -0.208  -1.593
  539   1HB   LEU  75          1HB       LEU  75   2.924   1.948  -2.011
  540   2HB   LEU  75          2HB       LEU  75   2.202   1.986  -3.602
  541    HG   LEU  75           HG       LEU  75   0.261   1.523  -1.361
  542   1HD1  LEU  75          1HD1      LEU  75   1.685   4.185  -1.687
  543   2HD1  LEU  75          2HD1      LEU  75   0.221   3.912  -0.720
  544   3HD1  LEU  75          3HD1      LEU  75   1.732   3.109  -0.272
  545   1HD2  LEU  75          1HD2      LEU  75  -1.064   3.121  -2.667
  546   2HD2  LEU  75          2HD2      LEU  75   0.310   3.411  -3.752
  547   3HD2  LEU  75          3HD2      LEU  75  -0.470   1.813  -3.699
  548    H    ILE  76           H        ILE  76  -0.275  -1.242  -2.335
  549    HA   ILE  76           HA       ILE  76  -0.835  -1.103  -5.245
  550    HB   ILE  76           HB       ILE  76  -1.415  -3.506  -3.514
  551   1HG1  ILE  76          1HG1      ILE  76   0.859  -3.206  -5.520
  552   2HG1  ILE  76          2HG1      ILE  76   0.996  -3.454  -3.776
  553   1HG2  ILE  76          1HG2      ILE  76  -1.590  -3.107  -6.545
  554   2HG2  ILE  76          2HG2      ILE  76  -2.020  -4.597  -5.680
  555   3HG2  ILE  76          3HG2      ILE  76  -2.975  -3.160  -5.431
  556   1HD1  ILE  76          1HD1      ILE  76   0.133  -5.458  -5.864
  557   2HD1  ILE  76          2HD1      ILE  76   1.395  -5.577  -4.627
  558   3HD1  ILE  76          3HD1      ILE  76  -0.304  -5.666  -4.151
  559    H    LEU  77           H        LEU  77  -2.994  -0.676  -5.687
  560    HA   LEU  77           HA       LEU  77  -4.750  -0.026  -3.396
  561   1HB   LEU  77          1HB       LEU  77  -4.036   1.263  -5.989
  562   2HB   LEU  77          2HB       LEU  77  -5.750   0.998  -5.795
  563    HG   LEU  77           HG       LEU  77  -5.592   2.073  -3.511
  564   1HD1  LEU  77          1HD1      LEU  77  -3.619   3.492  -3.113
  565   2HD1  LEU  77          2HD1      LEU  77  -3.061   1.830  -3.372
  566   3HD1  LEU  77          3HD1      LEU  77  -2.919   2.985  -4.682
  567   1HD2  LEU  77          1HD2      LEU  77  -4.930   3.704  -5.963
  568   2HD2  LEU  77          2HD2      LEU  77  -6.554   3.257  -5.388
  569   3HD2  LEU  77          3HD2      LEU  77  -5.561   4.377  -4.440
  570    H    PHE  78           H        PHE  78  -6.802  -0.854  -3.374
  571    HA   PHE  78           HA       PHE  78  -7.587  -2.787  -5.473
  572   1HB   PHE  78          1HB       PHE  78  -7.837  -3.167  -2.462
  573   2HB   PHE  78          2HB       PHE  78  -8.368  -4.291  -3.697
  574    HD1  PHE  78           1HD      PHE  78  -5.352  -2.745  -2.115
  575    HD2  PHE  78           2HD      PHE  78  -6.872  -5.957  -4.563
  576    HE1  PHE  78           1HE      PHE  78  -3.168  -3.887  -1.968
  577    HE2  PHE  78           2HE      PHE  78  -4.687  -7.111  -4.392
  578    HZ   PHE  78           HZ       PHE  78  -2.814  -6.060  -3.136
  579    H    LYS  79           H        LYS  79  -9.851  -2.960  -5.755
  580    HA   LYS  79           HA       LYS  79 -11.635  -2.248  -3.726
  581   1HB   LYS  79          1HB       LYS  79 -13.085  -0.668  -4.885
  582   2HB   LYS  79          2HB       LYS  79 -11.571   0.047  -4.421
  583   1HG   LYS  79          1HG       LYS  79 -12.177  -0.915  -7.254
  584   2HG   LYS  79          2HG       LYS  79 -12.561   0.696  -6.675
  585   1HD   LYS  79          1HD       LYS  79  -9.790  -0.496  -6.989
  586   2HD   LYS  79          2HD       LYS  79 -10.522   0.774  -7.948
  587   1HE   LYS  79          1HE       LYS  79  -9.804   0.997  -4.993
  588   2HE   LYS  79          2HE       LYS  79  -8.846   1.630  -6.332
  589   1HZ   LYS  79          1HZ       LYS  79 -10.212   3.345  -5.379
  590   2HZ   LYS  79          2HZ       LYS  79 -10.702   3.053  -6.922
  591   3HZ   LYS  79          3HZ       LYS  79 -11.587   2.481  -5.657
  592    H    GLY  80           H        GLY  80 -13.915  -2.845  -4.511
  593   1HA   GLY  80          1HA       GLY  80 -15.304  -4.429  -5.469
  594   2HA   GLY  80          2HA       GLY  80 -14.396  -4.142  -6.950
  595    H    GLY  81           H        GLY  81 -12.289  -5.393  -4.526
  596   1HA   GLY  81          1HA       GLY  81 -11.708  -7.610  -3.986
  597   2HA   GLY  81          2HA       GLY  81 -12.688  -8.212  -5.318
  598    H    GLU  82           H        GLU  82 -10.918  -5.507  -6.504
  599    HA   GLU  82           HA       GLU  82  -8.944  -7.366  -7.708
  600   1HB   GLU  82          1HB       GLU  82 -10.900  -6.852  -9.108
  601   2HB   GLU  82          2HB       GLU  82 -10.570  -5.121  -8.956
  602   1HG   GLU  82          1HG       GLU  82  -8.397  -5.433 -10.113
  603   2HG   GLU  82          2HG       GLU  82  -8.691  -7.175 -10.207
  604    HA   PRO  83           HA       PRO  83  -6.015  -4.024  -6.662
  605   1HB   PRO  83          1HB       PRO  83  -3.802  -4.969  -7.986
  606   2HB   PRO  83          2HB       PRO  83  -4.351  -5.603  -6.417
  607   1HG   PRO  83          1HG       PRO  83  -4.829  -6.754  -9.169
  608   2HG   PRO  83          2HG       PRO  83  -4.386  -7.615  -7.663
  609   1HD   PRO  83          1HD       PRO  83  -6.955  -7.459  -8.628
  610   2HD   PRO  83          2HD       PRO  83  -6.590  -7.569  -6.881
  611    H    VAL  84           H        VAL  84  -6.264  -2.063  -7.780
  612    HA   VAL  84           HA       VAL  84  -6.641  -2.132 -10.688
  613    HB   VAL  84           HB       VAL  84  -6.852   0.395 -10.257
  614   1HG1  VAL  84          1HG1      VAL  84  -9.232   0.133  -9.739
  615   2HG1  VAL  84          2HG1      VAL  84  -8.710  -1.147 -10.830
  616   3HG1  VAL  84          3HG1      VAL  84  -8.937  -1.514  -9.113
  617   1HG2  VAL  84          1HG2      VAL  84  -5.970   0.475  -7.957
  618   2HG2  VAL  84          2HG2      VAL  84  -7.587   1.161  -8.115
  619   3HG2  VAL  84          3HG2      VAL  84  -7.383  -0.449  -7.393
  620    H    LYS  85           H        LYS  85  -4.188  -0.821  -8.353
  621    HA   LYS  85           HA       LYS  85  -2.265  -0.690 -10.511
  622   1HB   LYS  85          1HB       LYS  85  -1.895   1.679 -10.543
  623   2HB   LYS  85          2HB       LYS  85  -3.563   1.336 -10.962
  624   1HG   LYS  85          1HG       LYS  85  -4.084   1.894  -8.442
  625   2HG   LYS  85          2HG       LYS  85  -2.473   2.619  -8.444
  626   1HD   LYS  85          1HD       LYS  85  -4.910   3.397 -10.106
  627   2HD   LYS  85          2HD       LYS  85  -4.043   4.382  -8.914
  628   1HE   LYS  85          1HE       LYS  85  -2.037   4.368 -10.422
  629   2HE   LYS  85          2HE       LYS  85  -2.966   3.439 -11.609
  630   1HZ   LYS  85          1HZ       LYS  85  -3.621   6.198 -10.719
  631   2HZ   LYS  85          2HZ       LYS  85  -2.887   5.783 -12.098
  632   3HZ   LYS  85          3HZ       LYS  85  -4.503   5.376 -11.781
  633    H    GLN  86           H        GLN  86  -0.166   0.248  -9.763
  634    HA   GLN  86           HA       GLN  86   0.414  -0.424  -6.952
  635   1HB   GLN  86          1HB       GLN  86   0.741  -2.464  -8.225
  636   2HB   GLN  86          2HB       GLN  86   1.567  -1.593  -9.516
  637   1HG   GLN  86          1HG       GLN  86   3.477  -1.125  -7.984
  638   2HG   GLN  86          2HG       GLN  86   2.700  -2.067  -6.722
  639   1HE2  GLN  86          1HE2      GLN  86   2.356  -4.474  -7.220
  640   2HE2  GLN  86          2HE2      GLN  86   3.494  -5.196  -8.348
  641    H    LEU  87           H        LEU  87   2.251   0.627  -6.138
  642    HA   LEU  87           HA       LEU  87   4.015   2.111  -7.976
  643   1HB   LEU  87          1HB       LEU  87   3.051   3.012  -5.215
  644   2HB   LEU  87          2HB       LEU  87   4.605   3.487  -5.835
  645    HG   LEU  87           HG       LEU  87   3.182   5.275  -6.174
  646   1HD1  LEU  87          1HD1      LEU  87   3.347   3.979  -8.906
  647   2HD1  LEU  87          2HD1      LEU  87   3.438   5.704  -8.481
  648   3HD1  LEU  87          3HD1      LEU  87   4.762   4.611  -8.029
  649   1HD2  LEU  87          1HD2      LEU  87   1.230   3.548  -7.741
  650   2HD2  LEU  87          2HD2      LEU  87   0.998   4.089  -6.063
  651   3HD2  LEU  87          3HD2      LEU  87   1.109   5.274  -7.385
  652    H    ILE  88           H        ILE  88   6.207   2.021  -7.312
  653    HA   ILE  88           HA       ILE  88   6.991   0.316  -5.107
  654    HB   ILE  88           HB       ILE  88   8.725  -0.742  -6.693
  655   1HG1  ILE  88          1HG1      ILE  88   6.645   0.012  -8.813
  656   2HG1  ILE  88          2HG1      ILE  88   8.313   0.589  -8.722
  657   1HG2  ILE  88          1HG2      ILE  88   5.833  -1.642  -6.950
  658   2HG2  ILE  88          2HG2      ILE  88   7.279  -2.655  -7.098
  659   3HG2  ILE  88          3HG2      ILE  88   6.902  -1.927  -5.549
  660   1HD1  ILE  88          1HD1      ILE  88   9.063  -1.815  -9.011
  661   2HD1  ILE  88          2HD1      ILE  88   7.355  -2.237  -9.314
  662   3HD1  ILE  88          3HD1      ILE  88   8.187  -1.120 -10.398
  663    H    GLY  89           H        GLY  89   8.749   1.199  -4.161
  664   1HA   GLY  89          1HA       GLY  89  10.840   2.371  -4.139
  665   2HA   GLY  89          2HA       GLY  89  10.395   3.219  -5.627
  666    H    TYR  90           H        TYR  90  11.399   4.731  -3.682
  667    HA   TYR  90           HA       TYR  90   9.365   5.822  -1.885
  668   1HB   TYR  90          1HB       TYR  90  11.647   5.537  -1.108
  669   2HB   TYR  90          2HB       TYR  90  12.249   6.547  -2.407
  670    HD1  TYR  90           1HD      TYR  90  12.180   8.984  -2.246
  671    HD2  TYR  90           2HD      TYR  90  10.387   6.532   0.803
  672    HE1  TYR  90           1HE      TYR  90  11.991  10.959  -0.788
  673    HE2  TYR  90           2HE      TYR  90  10.171   8.517   2.281
  674    HH   TYR  90           HH       TYR  90  11.308  11.763   1.303
  675    H    GLN  91           H        GLN  91   7.831   6.494  -3.551
  676    HA   GLN  91           HA       GLN  91   8.662   8.715  -5.297
  677   1HB   GLN  91          1HB       GLN  91   5.788   7.835  -4.968
  678   2HB   GLN  91          2HB       GLN  91   6.575   8.579  -6.331
  679   1HG   GLN  91          1HG       GLN  91   6.915   5.690  -5.438
  680   2HG   GLN  91          2HG       GLN  91   6.093   6.277  -6.874
  681   1HE2  GLN  91          1HE2      GLN  91   7.456   7.343  -8.616
  682   2HE2  GLN  91          2HE2      GLN  91   9.140   6.840  -8.699
  683    HA   PRO  92           HA       PRO  92   7.392  11.568  -2.037
  684   1HB   PRO  92          1HB       PRO  92   7.293  13.946  -3.400
  685   2HB   PRO  92          2HB       PRO  92   8.829  13.137  -2.956
  686   1HG   PRO  92          1HG       PRO  92   7.362  13.027  -5.601
  687   2HG   PRO  92          2HG       PRO  92   9.103  13.331  -5.317
  688   1HD   PRO  92          1HD       PRO  92   8.150  10.854  -5.982
  689   2HD   PRO  92          2HD       PRO  92   9.525  11.053  -4.854
  690    H    LYS  93           H        LYS  93   5.460  12.904  -1.515
  691    HA   LYS  93           HA       LYS  93   3.070  11.591  -2.243
  692   1HB   LYS  93          1HB       LYS  93   3.881  13.969  -0.603
  693   2HB   LYS  93          2HB       LYS  93   2.262  14.016  -1.251
  694   1HG   LYS  93          1HG       LYS  93   2.159  12.927   0.929
  695   2HG   LYS  93          2HG       LYS  93   1.804  11.743  -0.320
  696   1HD   LYS  93          1HD       LYS  93   3.268  10.615   1.179
  697   2HD   LYS  93          2HD       LYS  93   4.267  11.010  -0.198
  698   1HE   LYS  93          1HE       LYS  93   5.605  11.631   1.617
  699   2HE   LYS  93          2HE       LYS  93   4.906  13.184   1.136
  700   1HZ   LYS  93          1HZ       LYS  93   4.763  12.717   3.589
  701   2HZ   LYS  93          2HZ       LYS  93   3.277  12.917   2.900
  702   3HZ   LYS  93          3HZ       LYS  93   3.869  11.415   3.275
  703    H    GLU  94           H        GLU  94   4.344  14.696  -3.425
  704    HA   GLU  94           HA       GLU  94   2.189  15.304  -5.113
  705   1HB   GLU  94          1HB       GLU  94   4.099  16.782  -4.437
  706   2HB   GLU  94          2HB       GLU  94   5.186  15.842  -5.464
  707   1HG   GLU  94          1HG       GLU  94   3.949  16.608  -7.476
  708   2HG   GLU  94          2HG       GLU  94   2.819  17.500  -6.443
  709    H    GLN  95           H        GLN  95   4.463  12.636  -5.549
  710    HA   GLN  95           HA       GLN  95   3.864  12.489  -8.449
  711   1HB   GLN  95          1HB       GLN  95   6.238  12.249  -7.488
  712   2HB   GLN  95          2HB       GLN  95   5.723  10.774  -6.725
  713   1HG   GLN  95          1HG       GLN  95   6.891  10.310  -8.833
  714   2HG   GLN  95          2HG       GLN  95   5.230   9.726  -8.866
  715   1HE2  GLN  95          1HE2      GLN  95   6.520  13.105  -9.489
  716   2HE2  GLN  95          2HE2      GLN  95   5.860  13.131 -11.115
  717    H    LEU  96           H        LEU  96   3.879  10.680  -5.446
  718    HA   LEU  96           HA       LEU  96   2.338   8.404  -6.281
  719   1HB   LEU  96          1HB       LEU  96   3.772   8.841  -4.188
  720   2HB   LEU  96          2HB       LEU  96   2.294   9.455  -3.488
  721    HG   LEU  96           HG       LEU  96   2.103   6.791  -4.878
  722   1HD1  LEU  96          1HD1      LEU  96   2.991   5.559  -2.947
  723   2HD1  LEU  96          2HD1      LEU  96   4.235   6.539  -3.722
  724   3HD1  LEU  96          3HD1      LEU  96   3.498   7.095  -2.197
  725   1HD2  LEU  96          1HD2      LEU  96   1.061   7.697  -2.170
  726   2HD2  LEU  96          2HD2      LEU  96   0.168   7.851  -3.700
  727   3HD2  LEU  96          3HD2      LEU  96   0.588   6.244  -3.075
  728    H    GLU  97           H        GLU  97   1.120  11.326  -4.517
  729    HA   GLU  97           HA       GLU  97  -1.586  10.448  -4.829
  730   1HB   GLU  97          1HB       GLU  97  -0.524  12.026  -3.080
  731   2HB   GLU  97          2HB       GLU  97  -0.711  13.302  -4.289
  732   1HG   GLU  97          1HG       GLU  97  -3.025  13.291  -4.188
  733   2HG   GLU  97          2HG       GLU  97  -3.117  11.567  -3.809
  734    H    ALA  98           H        ALA  98   0.622  11.963  -7.042
  735    HA   ALA  98           HA       ALA  98  -1.534  13.045  -8.742
  736   1HB   ALA  98          1HB       ALA  98   1.417  12.603  -9.326
  737   2HB   ALA  98          2HB       ALA  98   0.242  13.299 -10.453
  738   3HB   ALA  98          3HB       ALA  98   0.601  14.135  -8.940
  739    H    GLN  99           H        GLN  99   0.729  10.236  -8.830
  740    HA   GLN  99           HA       GLN  99  -0.377   8.878 -11.032
  741   1HB   GLN  99          1HB       GLN  99   1.728   8.259  -9.848
  742   2HB   GLN  99          2HB       GLN  99   0.808   7.738  -8.452
  743   1HG   GLN  99          1HG       GLN  99   1.599   5.871  -9.929
  744   2HG   GLN  99          2HG       GLN  99  -0.117   5.871  -9.557
  745   1HE2  GLN  99          1HE2      GLN  99   2.028   7.351 -12.132
  746   2HE2  GLN  99          2HE2      GLN  99   0.967   6.834 -13.436
  747    H    LEU 100           H        LEU 100  -1.296   8.790  -7.612
  748    HA   LEU 100           HA       LEU 100  -3.469   6.901  -8.030
  749   1HB   LEU 100          1HB       LEU 100  -1.788   7.875  -5.886
  750   2HB   LEU 100          2HB       LEU 100  -3.427   8.104  -5.425
  751    HG   LEU 100           HG       LEU 100  -3.801   5.628  -5.945
  752   1HD1  LEU 100          1HD1      LEU 100  -1.963   5.320  -7.595
  753   2HD1  LEU 100          2HD1      LEU 100  -0.787   5.738  -6.332
  754   3HD1  LEU 100          3HD1      LEU 100  -1.727   4.232  -6.222
  755   1HD2  LEU 100          1HD2      LEU 100  -1.751   6.633  -3.952
  756   2HD2  LEU 100          2HD2      LEU 100  -3.430   6.098  -3.669
  757   3HD2  LEU 100          3HD2      LEU 100  -2.129   4.933  -3.998
  758    H    ALA 101           H        ALA 101  -3.388  10.183  -8.711
  759    HA   ALA 101           HA       ALA 101  -5.490  11.273  -7.243
  760   1HB   ALA 101          1HB       ALA 101  -5.669  12.922  -9.091
  761   2HB   ALA 101          2HB       ALA 101  -3.978  12.619  -8.665
  762   3HB   ALA 101          3HB       ALA 101  -4.673  11.881 -10.126
  763    H    ASP 102           H        ASP 102  -5.690   9.093 -10.057
  764    HA   ASP 102           HA       ASP 102  -8.423   9.694 -10.752
  765   1HB   ASP 102          1HB       ASP 102  -8.134   7.572 -12.117
  766   2HB   ASP 102          2HB       ASP 102  -6.820   8.713 -12.383
  767    H    VAL 103           H        VAL 103  -7.051   7.877  -8.098
  768    HA   VAL 103           HA       VAL 103  -9.747   6.947  -7.413
  769    HB   VAL 103           HB       VAL 103  -8.316   5.106  -6.292
  770   1HG1  VAL 103          1HG1      VAL 103  -9.931   4.773  -8.176
  771   2HG1  VAL 103          2HG1      VAL 103  -8.609   5.063  -9.312
  772   3HG1  VAL 103          3HG1      VAL 103  -8.549   3.655  -8.240
  773   1HG2  VAL 103          1HG2      VAL 103  -6.340   4.364  -7.551
  774   2HG2  VAL 103          2HG2      VAL 103  -6.323   5.859  -8.453
  775   3HG2  VAL 103          3HG2      VAL 103  -6.069   5.902  -6.695
  776    H    LEU 104           H        LEU 104  -7.759   9.376  -6.757
  777    HA   LEU 104           HA       LEU 104  -8.762   9.461  -3.995
  778   1HB   LEU 104          1HB       LEU 104  -6.053  10.030  -5.155
  779   2HB   LEU 104          2HB       LEU 104  -6.658  11.222  -4.076
  780    HG   LEU 104           HG       LEU 104  -5.291   9.791  -2.797
  781   1HD1  LEU 104          1HD1      LEU 104  -6.747   8.931  -1.075
  782   2HD1  LEU 104          2HD1      LEU 104  -7.466  10.429  -1.727
  783   3HD1  LEU 104          3HD1      LEU 104  -8.113   8.837  -2.178
  784   1HD2  LEU 104          1HD2      LEU 104  -5.381   7.801  -4.360
  785   2HD2  LEU 104          2HD2      LEU 104  -5.398   7.425  -2.621
  786   3HD2  LEU 104          3HD2      LEU 104  -6.891   7.334  -3.566
  787    H    GLN 105           H        GLN 105  -9.041  10.799  -7.067
  788    HA   GLN 105           HA       GLN 105  -9.876  13.430  -6.595
  789   1HB   GLN 105          2HB       GLN 105  -9.518  12.400  -8.812
  790   2HB   GLN 105          3HB       GLN 105 -10.876  11.332  -8.520
  791   1HG   GLN 105          2HG       GLN 105 -12.380  13.361  -8.360
  792   2HG   GLN 105          3HG       GLN 105 -10.976  14.385  -8.671
  793   1HE2  GLN 105          1HE2      GLN 105 -13.612  12.976 -10.155
  794   2HE2  GLN 105          2HE2      GLN 105 -12.974  12.913 -11.799
  Start of MODEL    3
    1   1H    ALA   1           H        ALA   1  -5.407   4.735   7.550
    2   2H    ALA   1          2HN       ALA   1  -4.743   3.820   8.753
    3   3H    ALA   1          3HN       ALA   1  -5.013   3.150   7.269
    4    HA   ALA   1           HA       ALA   1  -7.044   4.082   9.160
    5   1HB   ALA   1          1HB       ALA   1  -7.368   2.804   6.441
    6   2HB   ALA   1          2HB       ALA   1  -8.690   3.152   7.578
    7   3HB   ALA   1          3HB       ALA   1  -7.766   4.487   6.857
    8    H    THR   2           H        THR   2  -6.778   0.994   7.233
    9    HA   THR   2           HA       THR   2  -7.390  -0.549   9.477
   10    HB   THR   2           HB       THR   2  -6.042  -1.604   6.985
   11    HG1  THR   2           1HG      THR   2  -8.768  -0.945   7.063
   12   1HG2  THR   2          1HG2      THR   2  -7.765  -3.379   7.123
   13   2HG2  THR   2          2HG2      THR   2  -6.799  -3.303   8.602
   14   3HG2  THR   2          3HG2      THR   2  -8.435  -2.618   8.586
   15    H    MET   3           H        MET   3  -4.542   0.808   8.734
   16    HA   MET   3           HA       MET   3  -2.463   0.823   9.728
   17   1HB   MET   3          1HB       MET   3  -4.392   0.774  11.637
   18   2HB   MET   3          2HB       MET   3  -3.476  -0.618  12.160
   19   1HG   MET   3          1HG       MET   3  -2.441   2.214  11.685
   20   2HG   MET   3          2HG       MET   3  -2.822   1.502  13.245
   21   1HE   MET   3          1HE       MET   3   1.007   2.017  13.541
   22   2HE   MET   3          2HE       MET   3  -0.160   3.073  12.715
   23   3HE   MET   3          3HE       MET   3  -0.590   2.308  14.263
   24    H    THR   4           H        THR   4  -1.730  -1.427  11.725
   25    HA   THR   4           HA       THR   4  -0.091  -2.849   9.829
   26    HB   THR   4           HB       THR   4  -0.421  -3.383  12.777
   27    HG1  THR   4           1HG      THR   4   0.273  -1.321  12.488
   28   1HG2  THR   4          1HG2      THR   4   1.809  -4.084  10.803
   29   2HG2  THR   4          2HG2      THR   4   1.873  -4.335  12.563
   30   3HG2  THR   4          3HG2      THR   4   0.710  -5.241  11.582
   31    H    LEU   5           H        LEU   5  -0.596  -4.619   8.737
   32    HA   LEU   5           HA       LEU   5  -3.052  -6.186   9.391
   33   1HB   LEU   5          1HB       LEU   5  -3.599  -4.336   8.014
   34   2HB   LEU   5          2HB       LEU   5  -2.202  -4.545   6.981
   35    HG   LEU   5           HG       LEU   5  -4.127  -6.831   7.030
   36   1HD1  LEU   5          1HD1      LEU   5  -4.869  -4.250   5.627
   37   2HD1  LEU   5          2HD1      LEU   5  -5.714  -5.803   5.516
   38   3HD1  LEU   5          3HD1      LEU   5  -5.685  -4.932   7.053
   39   1HD2  LEU   5          1HD2      LEU   5  -3.650  -6.707   4.575
   40   2HD2  LEU   5          2HD2      LEU   5  -2.638  -5.295   4.857
   41   3HD2  LEU   5          3HD2      LEU   5  -2.187  -6.875   5.552
   42    H    THR   6           H        THR   6  -3.191  -8.239   7.960
   43    HA   THR   6           HA       THR   6  -0.719  -9.533   7.406
   44    HB   THR   6           HB       THR   6  -1.467 -11.397   8.893
   45    HG1  THR   6           1HG      THR   6  -3.028 -10.922  10.478
   46   1HG2  THR   6          1HG2      THR   6  -1.208  -8.881  10.592
   47   2HG2  THR   6          2HG2      THR   6  -0.725 -10.536  11.009
   48   3HG2  THR   6          3HG2      THR   6   0.162  -9.630   9.769
   49    H    ASP   7           H        ASP   7  -1.410 -11.528   6.358
   50    HA   ASP   7           HA       ASP   7  -2.961 -10.965   4.173
   51   1HB   ASP   7          1HB       ASP   7  -1.314 -12.616   3.955
   52   2HB   ASP   7          2HB       ASP   7  -2.144 -13.711   5.070
   53    H    ALA   8           H        ALA   8  -4.066 -12.890   6.972
   54    HA   ALA   8           HA       ALA   8  -6.624 -13.579   5.951
   55   1HB   ALA   8          1HB       ALA   8  -5.796 -13.061   8.843
   56   2HB   ALA   8          2HB       ALA   8  -7.244 -13.944   8.315
   57   3HB   ALA   8          3HB       ALA   8  -5.634 -14.606   7.972
   58    H    ASN   9           H        ASN   9  -5.448 -10.482   7.085
   59    HA   ASN   9           HA       ASN   9  -8.157  -9.307   7.209
   60   1HB   ASN   9          1HB       ASN   9  -5.414  -8.287   7.920
   61   2HB   ASN   9          2HB       ASN   9  -6.878  -7.330   7.969
   62   1HD2  ASN   9          1HD2      ASN   9  -4.873  -9.643   9.759
   63   2HD2  ASN   9          2HD2      ASN   9  -6.043  -9.776  11.066
   64    H    PHE  10           H        PHE  10  -5.099  -9.316   5.371
   65    HA   PHE  10           HA       PHE  10  -5.490  -7.306   3.467
   66   1HB   PHE  10          1HB       PHE  10  -3.440  -8.781   3.793
   67   2HB   PHE  10          2HB       PHE  10  -4.331 -10.067   3.005
   68    HD1  PHE  10           1HD      PHE  10  -2.275  -7.140   2.417
   69    HD2  PHE  10           2HD      PHE  10  -4.822 -10.127   0.622
   70    HE1  PHE  10           1HE      PHE  10  -1.200  -6.781   0.242
   71    HE2  PHE  10           2HE      PHE  10  -3.820  -9.662  -1.553
   72    HZ   PHE  10           HZ       PHE  10  -1.993  -7.997  -1.780
   73    H    GLN  11           H        GLN  11  -6.359 -10.802   3.078
   74    HA   GLN  11           HA       GLN  11  -7.685 -10.429   0.603
   75   1HB   GLN  11          1HB       GLN  11  -8.104 -12.547   2.767
   76   2HB   GLN  11          2HB       GLN  11  -8.782 -12.621   1.135
   77   1HG   GLN  11          1HG       GLN  11  -6.422 -12.494   0.219
   78   2HG   GLN  11          2HG       GLN  11  -5.818 -12.630   1.874
   79   1HE2  GLN  11          1HE2      GLN  11  -5.147 -14.784   2.352
   80   2HE2  GLN  11          2HE2      GLN  11  -5.973 -16.166   1.645
   81    H    GLN  12           H        GLN  12  -9.067 -10.382   3.913
   82    HA   GLN  12           HA       GLN  12 -11.769  -9.968   2.981
   83   1HB   GLN  12          1HB       GLN  12 -10.468  -9.542   5.716
   84   2HB   GLN  12          2HB       GLN  12 -12.203  -9.402   5.400
   85   1HG   GLN  12          1HG       GLN  12 -12.263 -11.759   4.616
   86   2HG   GLN  12          2HG       GLN  12 -10.549 -11.934   5.007
   87   1HE2  GLN  12          1HE2      GLN  12  -9.885 -11.839   7.281
   88   2HE2  GLN  12          2HE2      GLN  12 -11.099 -12.106   8.546
   89    H    ALA  13           H        ALA  13  -9.101  -7.682   3.595
   90    HA   ALA  13           HA       ALA  13 -10.821  -5.384   3.350
   91   1HB   ALA  13          1HB       ALA  13  -8.729  -4.136   3.114
   92   2HB   ALA  13          2HB       ALA  13  -8.639  -5.249   4.488
   93   3HB   ALA  13          3HB       ALA  13  -7.803  -5.644   2.973
   94    H    ILE  14           H        ILE  14  -8.434  -6.977   1.146
   95    HA   ILE  14           HA       ILE  14  -8.966  -5.232  -0.985
   96    HB   ILE  14           HB       ILE  14  -7.642  -6.687  -2.369
   97   1HG1  ILE  14          1HG1      ILE  14  -6.998  -8.683  -0.297
   98   2HG1  ILE  14          2HG1      ILE  14  -8.505  -8.911  -1.196
   99   1HG2  ILE  14          1HG2      ILE  14  -5.537  -6.509  -1.187
  100   2HG2  ILE  14          2HG2      ILE  14  -6.552  -5.134  -0.718
  101   3HG2  ILE  14          3HG2      ILE  14  -6.349  -6.494   0.381
  102   1HD1  ILE  14          1HD1      ILE  14  -7.264  -8.850  -3.319
  103   2HD1  ILE  14          2HD1      ILE  14  -5.748  -8.558  -2.446
  104   3HD1  ILE  14          3HD1      ILE  14  -6.612 -10.097  -2.239
  105    H    GLN  15           H        GLN  15 -10.719  -8.079  -0.138
  106    HA   GLN  15           HA       GLN  15 -12.065  -8.486  -2.631
  107   1HB   GLN  15          1HB       GLN  15 -13.688  -9.767  -1.363
  108   2HB   GLN  15          2HB       GLN  15 -12.051 -10.132  -0.843
  109   1HG   GLN  15          1HG       GLN  15 -13.313 -10.096   1.112
  110   2HG   GLN  15          2HG       GLN  15 -12.392  -8.597   1.105
  111   1HE2  GLN  15          1HE2      GLN  15 -13.702  -7.322   2.409
  112   2HE2  GLN  15          2HE2      GLN  15 -15.385  -6.947   1.987
  113    H    GLY  16           H        GLY  16 -12.409  -5.856  -0.293
  114   1HA   GLY  16          1HA       GLY  16 -15.187  -5.331  -0.800
  115   2HA   GLY  16          2HA       GLY  16 -14.022  -4.318   0.073
  116    H    ASP  17           H        ASP  17 -15.818  -2.998  -1.439
  117    HA   ASP  17           HA       ASP  17 -14.939  -2.555  -4.179
  118   1HB   ASP  17          1HB       ASP  17 -16.872  -1.086  -4.233
  119   2HB   ASP  17          2HB       ASP  17 -17.333  -2.600  -3.450
  120    H    GLY  18           H        GLY  18 -14.377  -1.135  -1.035
  121   1HA   GLY  18          1HA       GLY  18 -13.843   1.536  -1.904
  122   2HA   GLY  18          2HA       GLY  18 -13.429   0.846  -0.329
  123    HA   PRO  19           HA       PRO  19  -9.502   1.270  -3.020
  124   1HB   PRO  19          1HB       PRO  19  -8.535   3.769  -2.132
  125   2HB   PRO  19          2HB       PRO  19  -9.465   3.526  -3.624
  126   1HG   PRO  19          1HG       PRO  19 -10.468   4.332  -0.917
  127   2HG   PRO  19          2HG       PRO  19 -10.908   5.030  -2.504
  128   1HD   PRO  19          1HD       PRO  19 -12.473   3.282  -1.135
  129   2HD   PRO  19          2HD       PRO  19 -12.378   3.230  -2.920
  130    H    VAL  20           H        VAL  20  -8.943  -0.492  -1.675
  131    HA   VAL  20           HA       VAL  20  -7.759   0.017   0.983
  132    HB   VAL  20           HB       VAL  20  -7.838  -2.441  -0.828
  133   1HG1  VAL  20          1HG1      VAL  20  -6.992  -3.686   1.198
  134   2HG1  VAL  20          2HG1      VAL  20  -5.794  -2.586   0.520
  135   3HG1  VAL  20          3HG1      VAL  20  -6.681  -2.127   1.993
  136   1HG2  VAL  20          1HG2      VAL  20 -10.006  -1.789   0.262
  137   2HG2  VAL  20          2HG2      VAL  20  -9.375  -3.353   0.770
  138   3HG2  VAL  20          3HG2      VAL  20  -9.210  -1.957   1.844
  139    H    LEU  21           H        LEU  21  -5.645   0.463   1.266
  140    HA   LEU  21           HA       LEU  21  -3.774   0.084  -1.054
  141   1HB   LEU  21          1HB       LEU  21  -3.720   2.313   1.007
  142   2HB   LEU  21          2HB       LEU  21  -2.354   1.850   0.005
  143    HG   LEU  21           HG       LEU  21  -3.730   2.421  -2.045
  144   1HD1  LEU  21          1HD1      LEU  21  -5.614   4.059  -1.623
  145   2HD1  LEU  21          2HD1      LEU  21  -6.030   2.434  -1.103
  146   3HD1  LEU  21          3HD1      LEU  21  -5.544   3.628   0.102
  147   1HD2  LEU  21          1HD2      LEU  21  -2.025   3.934  -1.120
  148   2HD2  LEU  21          2HD2      LEU  21  -3.415   4.885  -1.616
  149   3HD2  LEU  21          3HD2      LEU  21  -3.149   4.491   0.107
  150    H    VAL  22           H        VAL  22  -2.023  -1.146  -0.565
  151    HA   VAL  22           HA       VAL  22  -1.566  -1.782   2.327
  152    HB   VAL  22           HB       VAL  22  -1.173  -3.616  -0.066
  153   1HG1  VAL  22          1HG1      VAL  22  -0.672  -5.290   1.712
  154   2HG1  VAL  22          2HG1      VAL  22   0.520  -4.005   1.674
  155   3HG1  VAL  22          3HG1      VAL  22  -0.735  -4.006   2.935
  156   1HG2  VAL  22          1HG2      VAL  22  -3.232  -3.655   2.195
  157   2HG2  VAL  22          2HG2      VAL  22  -3.561  -3.382   0.470
  158   3HG2  VAL  22          3HG2      VAL  22  -2.990  -4.954   1.007
  159    H    ASP  23           H        ASP  23   0.167  -0.799   3.023
  160    HA   ASP  23           HA       ASP  23   2.532  -0.222   1.372
  161   1HB   ASP  23          1HB       ASP  23   1.916   1.046   3.456
  162   2HB   ASP  23          2HB       ASP  23   2.201  -0.362   4.377
  163    H    PHE  24           H        PHE  24   3.566  -1.961   0.563
  164    HA   PHE  24           HA       PHE  24   4.141  -4.306   2.304
  165   1HB   PHE  24          1HB       PHE  24   4.786  -3.687  -0.579
  166   2HB   PHE  24          2HB       PHE  24   5.299  -5.130   0.273
  167    HD1  PHE  24           1HD      PHE  24   2.777  -3.893  -1.903
  168    HD2  PHE  24           2HD      PHE  24   3.420  -6.464   1.486
  169    HE1  PHE  24           1HE      PHE  24   0.959  -5.374  -2.690
  170    HE2  PHE  24           2HE      PHE  24   1.597  -7.963   0.699
  171    HZ   PHE  24           HZ       PHE  24   0.493  -7.521  -1.407
  172    H    TRP  25           H        TRP  25   5.677  -3.835   3.692
  173    HA   TRP  25           HA       TRP  25   8.200  -2.649   2.727
  174   1HB   TRP  25          1HB       TRP  25   8.512  -1.410   4.747
  175   2HB   TRP  25          2HB       TRP  25   6.940  -0.942   4.118
  176    HD1  TRP  25           HD       TRP  25   4.794  -2.178   5.373
  177    HE1  TRP  25           1HE      TRP  25   4.473  -2.994   7.770
  178    HE3  TRP  25           3HE      TRP  25   9.655  -1.931   6.945
  179    HZ2  TRP  25           2HZ      TRP  25   6.175  -3.604  10.085
  180    HZ3  TRP  25           3HZ      TRP  25  10.268  -2.603   9.242
  181    HH2  TRP  25           HH       TRP  25   8.545  -3.471  10.805
  182    H    ALA  26           H        ALA  26   9.866  -3.361   4.783
  183    HA   ALA  26           HA       ALA  26   9.005  -5.697   6.172
  184   1HB   ALA  26          1HB       ALA  26  11.311  -5.952   4.183
  185   2HB   ALA  26          2HB       ALA  26  10.843  -7.161   5.390
  186   3HB   ALA  26          3HB       ALA  26   9.746  -6.789   4.055
  187    H    ALA  27           H        ALA  27  10.523  -6.168   7.872
  188    HA   ALA  27           HA       ALA  27  12.027  -4.061   8.936
  189   1HB   ALA  27          1HB       ALA  27  11.198  -5.992  10.212
  190   2HB   ALA  27          2HB       ALA  27  12.378  -7.048   9.399
  191   3HB   ALA  27          3HB       ALA  27  12.935  -5.746  10.476
  192    H    TRP  28           H        TRP  28  13.034  -6.083   6.278
  193    HA   TRP  28           HA       TRP  28  15.873  -5.527   6.742
  194   1HB   TRP  28          1HB       TRP  28  16.208  -7.383   5.711
  195   2HB   TRP  28          2HB       TRP  28  14.499  -7.568   5.452
  196    HD1  TRP  28           HD       TRP  28  17.639  -6.167   3.760
  197    HE1  TRP  28           1HE      TRP  28  17.328  -6.026   1.229
  198    HE3  TRP  28           3HE      TRP  28  12.804  -7.847   3.440
  199    HZ2  TRP  28           2HZ      TRP  28  15.141  -6.255  -0.657
  200    HZ3  TRP  28           3HZ      TRP  28  11.627  -7.854   1.281
  201    HH2  TRP  28           HH       TRP  28  12.768  -6.944  -0.761
  202    H    CYS  29           H        CYS  29  13.239  -4.068   4.803
  203    HA   CYS  29           HA       CYS  29  15.056  -3.204   2.719
  204   1HB   CYS  29          1HB       CYS  29  13.155  -1.938   1.814
  205   2HB   CYS  29          2HB       CYS  29  12.876  -3.647   2.068
  206    H    GLY  30           H        GLY  30  15.423  -0.908   2.142
  207   1HA   GLY  30          1HA       GLY  30  16.158   0.682   4.520
  208   2HA   GLY  30          2HA       GLY  30  16.790   0.863   2.890
  209    HA   PRO  31           HA       PRO  31  14.342   4.394   2.238
  210   1HB   PRO  31          1HB       PRO  31  13.307   4.193  -0.309
  211   2HB   PRO  31          2HB       PRO  31  15.038   4.480   0.059
  212   1HG   PRO  31          1HG       PRO  31  13.664   1.854  -0.577
  213   2HG   PRO  31          2HG       PRO  31  15.176   2.508  -1.286
  214   1HD   PRO  31          1HD       PRO  31  15.252   0.709   0.721
  215   2HD   PRO  31          2HD       PRO  31  16.392   2.089   0.717
  216    H    CYS  32           H        CYS  32  12.622   1.417   2.047
  217    HA   CYS  32           HA       CYS  32   9.925   2.324   2.056
  218   1HB   CYS  32          1HB       CYS  32   9.443   0.250   3.229
  219   2HB   CYS  32          2HB       CYS  32  10.585  -0.038   1.922
  220    H    ARG  33           H        ARG  33  12.421   2.394   4.646
  221    HA   ARG  33           HA       ARG  33  10.546   3.197   6.684
  222   1HB   ARG  33          1HB       ARG  33  12.789   2.054   6.978
  223   2HB   ARG  33          2HB       ARG  33  13.546   3.620   6.657
  224   1HG   ARG  33          1HG       ARG  33  12.478   4.591   8.635
  225   2HG   ARG  33          2HG       ARG  33  11.487   3.132   8.858
  226   1HD   ARG  33          1HD       ARG  33  13.533   1.803   9.262
  227   2HD   ARG  33          2HD       ARG  33  14.523   3.269   9.063
  228    HE   ARG  33           HE       ARG  33  12.593   3.856  10.993
  229   1HH1  ARG  33          2HH2      ARG  33  15.297   1.615  10.685
  230   2HH1  ARG  33          1HH2      ARG  33  15.640   1.518  12.379
  231   1HH2  ARG  33          2HH1      ARG  33  13.007   3.751  13.267
  232   2HH2  ARG  33          1HH1      ARG  33  14.290   2.775  13.878
  233    H    MET  34           H        MET  34  11.871   4.955   4.007
  234    HA   MET  34           HA       MET  34  11.281   7.554   5.257
  235   1HB   MET  34          1HB       MET  34  12.585   6.775   2.611
  236   2HB   MET  34          2HB       MET  34  12.204   8.431   3.085
  237   1HG   MET  34          1HG       MET  34  13.617   8.132   5.129
  238   2HG   MET  34          2HG       MET  34  14.111   6.550   4.524
  239   1HE   MET  34          1HE       MET  34  14.565   6.944   1.415
  240   2HE   MET  34          2HE       MET  34  16.268   7.448   1.382
  241   3HE   MET  34          3HE       MET  34  15.752   6.162   2.493
  242    H    MET  35           H        MET  35   9.877   5.097   3.273
  243    HA   MET  35           HA       MET  35   7.954   6.856   1.956
  244   1HB   MET  35          1HB       MET  35   8.961   4.507   1.080
  245   2HB   MET  35          2HB       MET  35   7.611   3.866   2.028
  246   1HG   MET  35          1HG       MET  35   6.254   5.776   0.734
  247   2HG   MET  35          2HG       MET  35   7.599   5.683  -0.388
  248   1HE   MET  35          1HE       MET  35   4.919   3.821  -2.461
  249   2HE   MET  35          2HE       MET  35   4.915   5.376  -1.591
  250   3HE   MET  35          3HE       MET  35   6.333   4.894  -2.552
  251    H    ALA  36           H        ALA  36   8.122   4.459   4.650
  252    HA   ALA  36           HA       ALA  36   5.515   4.427   5.481
  253   1HB   ALA  36          1HB       ALA  36   8.025   4.450   7.202
  254   2HB   ALA  36          2HB       ALA  36   6.402   3.977   7.754
  255   3HB   ALA  36          3HB       ALA  36   7.214   3.048   6.480
  256    HA   PRO  37           HA       PRO  37   5.667   8.517   7.921
  257   1HB   PRO  37          1HB       PRO  37   7.619  10.399   7.426
  258   2HB   PRO  37          2HB       PRO  37   7.707   9.168   8.722
  259   1HG   PRO  37          1HG       PRO  37   8.937   9.068   5.963
  260   2HG   PRO  37          2HG       PRO  37   9.708   8.676   7.532
  261   1HD   PRO  37          1HD       PRO  37   8.729   6.719   5.944
  262   2HD   PRO  37          2HD       PRO  37   8.537   6.634   7.715
  263    H    VAL  38           H        VAL  38   6.837   8.466   4.462
  264    HA   VAL  38           HA       VAL  38   5.288  10.809   3.770
  265    HB   VAL  38           HB       VAL  38   7.018   8.917   2.471
  266   1HG1  VAL  38          1HG1      VAL  38   4.577   9.607   0.807
  267   2HG1  VAL  38          2HG1      VAL  38   6.102   8.913   0.207
  268   3HG1  VAL  38          3HG1      VAL  38   5.094   7.980   1.312
  269   1HG2  VAL  38          1HG2      VAL  38   5.997  11.656   1.669
  270   2HG2  VAL  38          2HG2      VAL  38   7.426  11.303   2.662
  271   3HG2  VAL  38          3HG2      VAL  38   7.402  10.820   0.962
  272    H    LEU  39           H        LEU  39   4.610   7.340   3.980
  273    HA   LEU  39           HA       LEU  39   1.933   7.408   3.063
  274   1HB   LEU  39          1HB       LEU  39   3.780   5.472   4.348
  275   2HB   LEU  39          2HB       LEU  39   2.094   5.239   4.756
  276    HG   LEU  39           HG       LEU  39   1.464   5.065   2.413
  277   1HD1  LEU  39          1HD1      LEU  39   4.427   5.403   1.815
  278   2HD1  LEU  39          2HD1      LEU  39   3.217   4.863   0.643
  279   3HD1  LEU  39          3HD1      LEU  39   3.133   6.506   1.304
  280   1HD2  LEU  39          1HD2      LEU  39   3.880   3.334   3.110
  281   2HD2  LEU  39          2HD2      LEU  39   2.241   3.129   3.758
  282   3HD2  LEU  39          3HD2      LEU  39   2.550   2.900   2.021
  283    H    GLU  40           H        GLU  40   3.367   8.050   6.253
  284    HA   GLU  40           HA       GLU  40   0.871   7.975   7.681
  285   1HB   GLU  40          1HB       GLU  40   3.171   7.825   8.662
  286   2HB   GLU  40          2HB       GLU  40   3.393   9.552   8.359
  287   1HG   GLU  40          1HG       GLU  40   1.646  10.132   9.909
  288   2HG   GLU  40          2HG       GLU  40   1.055   8.466   9.975
  289    H    GLU  41           H        GLU  41   2.753  10.635   6.153
  290    HA   GLU  41           HA       GLU  41   0.794  12.682   6.547
  291   1HB   GLU  41          1HB       GLU  41   3.224  12.945   5.864
  292   2HB   GLU  41          2HB       GLU  41   2.769  12.413   4.245
  293   1HG   GLU  41          1HG       GLU  41   1.088  14.361   4.227
  294   2HG   GLU  41          2HG       GLU  41   1.842  14.915   5.722
  295    H    PHE  42           H        PHE  42   1.260  10.329   3.878
  296    HA   PHE  42           HA       PHE  42  -0.971  11.077   2.255
  297   1HB   PHE  42          1HB       PHE  42   0.945   9.423   1.734
  298   2HB   PHE  42          2HB       PHE  42   0.058   8.262   2.704
  299    HD1  PHE  42           1HD      PHE  42   0.066  10.163  -0.489
  300    HD2  PHE  42           2HD      PHE  42  -1.951   7.187   1.908
  301    HE1  PHE  42           1HE      PHE  42  -1.268   9.488  -2.450
  302    HE2  PHE  42           2HE      PHE  42  -3.346   6.597  -0.058
  303    HZ   PHE  42           HZ       PHE  42  -2.958   7.694  -2.252
  304    H    ALA  43           H        ALA  43  -0.836   8.663   4.956
  305    HA   ALA  43           HA       ALA  43  -3.535   7.952   4.837
  306   1HB   ALA  43          1HB       ALA  43  -1.687   8.048   7.258
  307   2HB   ALA  43          2HB       ALA  43  -3.230   7.179   7.167
  308   3HB   ALA  43          3HB       ALA  43  -1.874   6.685   6.131
  309    H    GLU  44           H        GLU  44  -1.963  10.544   6.770
  310    HA   GLU  44           HA       GLU  44  -4.311  11.495   8.016
  311   1HB   GLU  44          1HB       GLU  44  -2.016  12.109   8.676
  312   2HB   GLU  44          2HB       GLU  44  -1.826  13.056   7.191
  313   1HG   GLU  44          1HG       GLU  44  -3.667  14.555   7.894
  314   2HG   GLU  44          2HG       GLU  44  -3.949  13.560   9.327
  315    H    ALA  45           H        ALA  45  -2.793  12.565   4.942
  316    HA   ALA  45           HA       ALA  45  -4.393  14.751   4.465
  317   1HB   ALA  45          1HB       ALA  45  -3.654  14.573   2.106
  318   2HB   ALA  45          2HB       ALA  45  -2.325  14.248   3.238
  319   3HB   ALA  45          3HB       ALA  45  -3.133  12.899   2.399
  320    H    HIS  46           H        HIS  46  -5.400  11.472   3.959
  321    HA   HIS  46           HA       HIS  46  -8.119  12.327   3.300
  322   1HB   HIS  46          1HB       HIS  46  -8.066  10.662   1.298
  323   2HB   HIS  46          2HB       HIS  46  -7.484  12.314   1.098
  324    HD1  HIS  46           1HD      HIS  46  -5.306  12.273  -0.540
  325    HD2  HIS  46           2HD      HIS  46  -5.554   9.138   2.357
  326    HE1  HIS  46           1HE      HIS  46  -3.369  10.793  -0.887
  327    HE2  HIS  46           2HE      HIS  46  -3.438   8.937   0.854
  328    H    ALA  47           H        ALA  47  -7.379  11.341   5.634
  329    HA   ALA  47           HA       ALA  47  -7.102   8.596   5.986
  330   1HB   ALA  47          1HB       ALA  47  -6.704  10.348   7.717
  331   2HB   ALA  47          2HB       ALA  47  -8.459  10.597   7.852
  332   3HB   ALA  47          3HB       ALA  47  -7.741   9.040   8.320
  333    H    ASP  48           H        ASP  48 -10.002  10.224   5.020
  334    HA   ASP  48           HA       ASP  48 -11.830   8.149   5.973
  335   1HB   ASP  48          1HB       ASP  48 -13.526   9.791   5.270
  336   2HB   ASP  48          2HB       ASP  48 -12.363  10.556   6.347
  337    H    LYS  49           H        LYS  49 -10.871   9.801   2.955
  338    HA   LYS  49           HA       LYS  49 -12.612   8.299   1.326
  339   1HB   LYS  49          1HB       LYS  49 -11.606  10.480   0.732
  340   2HB   LYS  49          2HB       LYS  49 -10.034   9.697   0.490
  341   1HG   LYS  49          1HG       LYS  49 -10.866   8.411  -1.379
  342   2HG   LYS  49          2HG       LYS  49 -12.535   8.906  -1.071
  343   1HD   LYS  49          1HD       LYS  49 -10.307  10.842  -1.839
  344   2HD   LYS  49          2HD       LYS  49 -11.348  10.015  -3.009
  345   1HE   LYS  49          1HE       LYS  49 -13.350  11.007  -1.775
  346   2HE   LYS  49          2HE       LYS  49 -12.189  12.017  -0.882
  347   1HZ   LYS  49          1HZ       LYS  49 -12.981  13.211  -2.854
  348   2HZ   LYS  49          2HZ       LYS  49 -11.403  12.782  -3.125
  349   3HZ   LYS  49          3HZ       LYS  49 -12.582  11.970  -3.837
  350    H    VAL  50           H        VAL  50  -9.516   7.259   2.600
  351    HA   VAL  50           HA       VAL  50  -9.656   4.857   0.866
  352    HB   VAL  50           HB       VAL  50  -7.305   4.955   0.308
  353   1HG1  VAL  50          1HG1      VAL  50  -7.319   6.644  -1.390
  354   2HG1  VAL  50          2HG1      VAL  50  -8.963   6.030  -1.252
  355   3HG1  VAL  50          3HG1      VAL  50  -8.566   7.587  -0.531
  356   1HG2  VAL  50          1HG2      VAL  50  -5.908   6.932   0.633
  357   2HG2  VAL  50          2HG2      VAL  50  -7.234   7.757   1.478
  358   3HG2  VAL  50          3HG2      VAL  50  -6.452   6.345   2.212
  359    H    THR  51           H        THR  51  -8.624   2.923   1.695
  360    HA   THR  51           HA       THR  51  -8.142   3.230   4.541
  361    HB   THR  51           HB       THR  51 -10.248   2.219   4.026
  362    HG1  THR  51           1HG      THR  51  -8.603   0.410   5.444
  363   1HG2  THR  51          1HG2      THR  51  -9.610   0.802   2.106
  364   2HG2  THR  51          2HG2      THR  51  -8.692  -0.242   3.228
  365   3HG2  THR  51          3HG2      THR  51 -10.451  -0.073   3.402
  366    H    VAL  52           H        VAL  52  -6.081   3.719   4.316
  367    HA   VAL  52           HA       VAL  52  -4.150   1.970   3.037
  368    HB   VAL  52           HB       VAL  52  -3.370   3.917   5.131
  369   1HG1  VAL  52          1HG1      VAL  52  -1.616   2.549   4.065
  370   2HG1  VAL  52          2HG1      VAL  52  -2.086   3.181   2.475
  371   3HG1  VAL  52          3HG1      VAL  52  -1.402   4.263   3.703
  372   1HG2  VAL  52          1HG2      VAL  52  -4.904   5.316   3.858
  373   2HG2  VAL  52          2HG2      VAL  52  -3.257   5.755   3.417
  374   3HG2  VAL  52          3HG2      VAL  52  -4.216   4.734   2.323
  375    H    ALA  53           H        ALA  53  -2.898   0.410   3.913
  376    HA   ALA  53           HA       ALA  53  -2.967  -0.175   6.801
  377   1HB   ALA  53          1HB       ALA  53  -3.292  -2.520   6.344
  378   2HB   ALA  53          2HB       ALA  53  -4.591  -1.677   5.475
  379   3HB   ALA  53          3HB       ALA  53  -3.179  -2.273   4.590
  380    H    LYS  54           H        LYS  54  -1.074  -1.694   7.271
  381    HA   LYS  54           HA       LYS  54   0.977  -1.690   5.176
  382   1HB   LYS  54          1HB       LYS  54   2.760  -0.920   6.635
  383   2HB   LYS  54          2HB       LYS  54   1.510   0.316   6.501
  384   1HG   LYS  54          1HG       LYS  54   0.639  -0.320   8.745
  385   2HG   LYS  54          2HG       LYS  54   1.912  -1.557   8.875
  386   1HD   LYS  54          1HD       LYS  54   3.651   0.214   8.629
  387   2HD   LYS  54          2HD       LYS  54   2.387   1.431   8.474
  388   1HE   LYS  54          1HE       LYS  54   3.277   1.522  10.694
  389   2HE   LYS  54          2HE       LYS  54   1.606   0.951  10.777
  390   1HZ   LYS  54          1HZ       LYS  54   2.329  -1.207  11.261
  391   2HZ   LYS  54          2HZ       LYS  54   3.897  -0.906  10.788
  392   3HZ   LYS  54          3HZ       LYS  54   3.283  -0.251  12.169
  393    H    LEU  55           H        LEU  55   2.377  -3.346   5.140
  394    HA   LEU  55           HA       LEU  55   2.227  -5.255   7.395
  395   1HB   LEU  55          1HB       LEU  55   1.421  -7.089   6.239
  396   2HB   LEU  55          2HB       LEU  55   0.341  -5.759   5.905
  397    HG   LEU  55           HG       LEU  55   1.612  -5.546   3.622
  398   1HD1  LEU  55          1HD1      LEU  55   3.472  -7.032   3.883
  399   2HD1  LEU  55          2HD1      LEU  55   2.467  -8.308   4.597
  400   3HD1  LEU  55          3HD1      LEU  55   2.337  -7.933   2.883
  401   1HD2  LEU  55          1HD2      LEU  55  -0.696  -6.287   3.870
  402   2HD2  LEU  55          2HD2      LEU  55   0.120  -7.311   2.681
  403   3HD2  LEU  55          3HD2      LEU  55  -0.173  -7.925   4.321
  404    H    ASN  56           H        ASN  56   3.896  -6.634   7.619
  405    HA   ASN  56           HA       ASN  56   6.411  -5.849   6.318
  406   1HB   ASN  56          1HB       ASN  56   6.376  -6.033   8.756
  407   2HB   ASN  56          2HB       ASN  56   5.704  -7.663   8.681
  408   1HD2  ASN  56          1HD2      ASN  56   7.095  -9.421   8.028
  409   2HD2  ASN  56          2HD2      ASN  56   8.842  -9.238   8.094
  410    H    VAL  57           H        VAL  57   6.469  -6.742   4.302
  411    HA   VAL  57           HA       VAL  57   4.823  -8.854   3.549
  412    HB   VAL  57           HB       VAL  57   5.761  -6.899   2.286
  413   1HG1  VAL  57          1HG1      VAL  57   7.711  -7.381   0.794
  414   2HG1  VAL  57          2HG1      VAL  57   8.164  -7.296   2.510
  415   3HG1  VAL  57          3HG1      VAL  57   8.030  -8.861   1.689
  416   1HG2  VAL  57          1HG2      VAL  57   5.775  -9.418   0.673
  417   2HG2  VAL  57          2HG2      VAL  57   4.281  -8.698   1.321
  418   3HG2  VAL  57          3HG2      VAL  57   5.285  -7.785   0.197
  419    H    ASP  58           H        ASP  58   8.203  -9.034   4.632
  420    HA   ASP  58           HA       ASP  58   8.952 -11.565   3.878
  421   1HB   ASP  58          1HB       ASP  58   9.514  -9.603   6.103
  422   2HB   ASP  58          2HB       ASP  58  10.325 -11.137   6.030
  423    H    GLU  59           H        GLU  59   6.661 -10.520   6.295
  424    HA   GLU  59           HA       GLU  59   6.760 -13.064   7.858
  425   1HB   GLU  59          1HB       GLU  59   6.729 -11.130   9.240
  426   2HB   GLU  59          2HB       GLU  59   5.549 -10.345   8.226
  427   1HG   GLU  59          1HG       GLU  59   3.899 -12.233   9.039
  428   2HG   GLU  59          2HG       GLU  59   5.076 -12.422  10.333
  429    H    ASN  60           H        ASN  60   4.790 -11.174   5.562
  430    HA   ASN  60           HA       ASN  60   2.627 -13.192   5.716
  431   1HB   ASN  60          1HB       ASN  60   2.728 -10.228   5.810
  432   2HB   ASN  60          2HB       ASN  60   1.536 -10.896   4.716
  433   1HD2  ASN  60          1HD2      ASN  60   2.351 -10.488   8.266
  434   2HD2  ASN  60          2HD2      ASN  60   0.968 -11.417   8.720
  435    HA   PRO  61           HA       PRO  61   4.464 -13.521   1.494
  436   1HB   PRO  61          1HB       PRO  61   4.867 -16.203   1.374
  437   2HB   PRO  61          2HB       PRO  61   5.978 -15.108   2.242
  438   1HG   PRO  61          1HG       PRO  61   3.688 -16.748   3.406
  439   2HG   PRO  61          2HG       PRO  61   5.387 -16.668   3.979
  440   1HD   PRO  61          1HD       PRO  61   3.436 -15.133   5.109
  441   2HD   PRO  61          2HD       PRO  61   5.090 -14.516   4.868
  442    H    GLU  62           H        GLU  62   1.565 -14.766   3.005
  443    HA   GLU  62           HA       GLU  62   0.577 -16.037   0.598
  444   1HB   GLU  62          1HB       GLU  62  -0.217 -16.617   2.914
  445   2HB   GLU  62          2HB       GLU  62  -0.996 -15.040   2.997
  446   1HG   GLU  62          1HG       GLU  62  -2.549 -16.929   2.386
  447   2HG   GLU  62          2HG       GLU  62  -2.527 -15.626   1.204
  448    H    THR  63           H        THR  63  -0.890 -15.219  -0.766
  449    HA   THR  63           HA       THR  63  -1.545 -13.951  -2.380
  450    HB   THR  63           HB       THR  63  -2.254 -11.682  -0.523
  451    HG1  THR  63           1HG      THR  63  -3.190 -13.188   0.690
  452   1HG2  THR  63          1HG2      THR  63  -2.823 -11.459  -2.909
  453   2HG2  THR  63          2HG2      THR  63  -3.573 -13.071  -2.920
  454   3HG2  THR  63          3HG2      THR  63  -4.315 -11.767  -1.988
  455    H    THR  64           H        THR  64   0.706 -12.437  -0.362
  456    HA   THR  64           HA       THR  64   2.105 -10.559  -1.976
  457    HB   THR  64           HB       THR  64   2.842 -12.563   0.147
  458    HG1  THR  64           1HG      THR  64   2.658 -11.026   1.496
  459   1HG2  THR  64          1HG2      THR  64   4.769 -10.521  -0.967
  460   2HG2  THR  64          2HG2      THR  64   5.006 -11.516   0.485
  461   3HG2  THR  64          3HG2      THR  64   4.923 -12.283  -1.099
  462    H    SER  65           H        SER  65   2.731 -14.124  -1.545
  463    HA   SER  65           HA       SER  65   4.433 -14.229  -3.834
  464   1HB   SER  65          1HB       SER  65   4.567 -15.758  -1.874
  465   2HB   SER  65          2HB       SER  65   3.029 -16.495  -2.365
  466    HG   SER  65           HG       SER  65   4.197 -16.733  -4.496
  467    H    GLN  66           H        GLN  66   0.973 -14.029  -3.757
  468    HA   GLN  66           HA       GLN  66   0.629 -15.583  -6.213
  469   1HB   GLN  66          1HB       GLN  66  -1.082 -15.582  -4.427
  470   2HB   GLN  66          2HB       GLN  66  -1.319 -13.854  -4.637
  471   1HG   GLN  66          1HG       GLN  66  -3.090 -15.152  -5.730
  472   2HG   GLN  66          2HG       GLN  66  -2.222 -14.110  -6.847
  473   1HE2  GLN  66          1HE2      GLN  66  -0.552 -15.164  -8.297
  474   2HE2  GLN  66          2HE2      GLN  66  -0.892 -16.839  -8.777
  475    H    PHE  67           H        PHE  67   0.726 -12.123  -5.154
  476    HA   PHE  67           HA       PHE  67   0.354 -11.294  -7.980
  477   1HB   PHE  67          1HB       PHE  67   0.394  -9.787  -5.365
  478   2HB   PHE  67          2HB       PHE  67   0.379  -8.981  -6.931
  479    HD1  PHE  67           1HD      PHE  67  -1.676 -10.026  -4.318
  480    HD2  PHE  67           2HD      PHE  67  -1.522  -9.898  -8.625
  481    HE1  PHE  67           1HE      PHE  67  -4.164 -10.090  -4.420
  482    HE2  PHE  67           2HE      PHE  67  -3.998  -9.987  -8.714
  483    HZ   PHE  67           HZ       PHE  67  -5.322 -10.086  -6.610
  484    H    GLY  68           H        GLY  68   2.983 -12.451  -6.458
  485   1HA   GLY  68          1HA       GLY  68   5.211 -12.379  -7.057
  486   2HA   GLY  68          2HA       GLY  68   4.756 -11.315  -8.396
  487    H    ILE  69           H        ILE  69   4.179 -10.707  -4.960
  488    HA   ILE  69           HA       ILE  69   5.061  -7.985  -5.161
  489    HB   ILE  69           HB       ILE  69   4.150  -9.751  -2.883
  490   1HG1  ILE  69          1HG1      ILE  69   2.405  -9.630  -4.510
  491   2HG1  ILE  69          2HG1      ILE  69   1.946  -8.644  -3.142
  492   1HG2  ILE  69          1HG2      ILE  69   3.589  -7.889  -1.582
  493   2HG2  ILE  69          2HG2      ILE  69   5.290  -7.738  -2.001
  494   3HG2  ILE  69          3HG2      ILE  69   4.089  -6.725  -2.827
  495   1HD1  ILE  69          1HD1      ILE  69   2.618  -6.598  -4.436
  496   2HD1  ILE  69          2HD1      ILE  69   2.962  -7.642  -5.836
  497   3HD1  ILE  69          3HD1      ILE  69   1.321  -7.537  -5.183
  498    H    MET  70           H        MET  70   7.207  -8.271  -5.830
  499    HA   MET  70           HA       MET  70   9.207  -8.767  -3.667
  500   1HB   MET  70          1HB       MET  70   8.755 -10.707  -5.272
  501   2HB   MET  70          2HB       MET  70   9.385  -9.680  -6.558
  502   1HG   MET  70          1HG       MET  70  11.252 -10.939  -5.956
  503   2HG   MET  70          2HG       MET  70  11.508  -9.455  -5.055
  504   1HE   MET  70          1HE       MET  70   9.466 -12.870  -4.555
  505   2HE   MET  70          2HE       MET  70  11.143 -13.236  -5.026
  506   3HE   MET  70          3HE       MET  70  10.566 -13.647  -3.396
  507    H    SER  71           H        SER  71   8.472  -6.193  -4.110
  508    HA   SER  71           HA       SER  71  10.880  -4.988  -5.268
  509   1HB   SER  71          1HB       SER  71   8.138  -4.493  -6.499
  510   2HB   SER  71          2HB       SER  71   9.577  -3.503  -6.823
  511    HG   SER  71           HG       SER  71  10.045  -6.198  -7.079
  512    H    ILE  72           H        ILE  72  10.055  -5.045  -2.578
  513    HA   ILE  72           HA       ILE  72   8.457  -2.825  -2.002
  514    HB   ILE  72           HB       ILE  72   8.989  -3.178   0.330
  515   1HG1  ILE  72          1HG1      ILE  72  10.868  -5.393  -0.582
  516   2HG1  ILE  72          2HG1      ILE  72  11.367  -3.838   0.104
  517   1HG2  ILE  72          1HG2      ILE  72   7.777  -5.181   0.505
  518   2HG2  ILE  72          2HG2      ILE  72   7.260  -4.465  -1.018
  519   3HG2  ILE  72          3HG2      ILE  72   8.403  -5.825  -1.036
  520   1HD1  ILE  72          1HD1      ILE  72   9.840  -6.054   1.483
  521   2HD1  ILE  72          2HD1      ILE  72  11.382  -5.308   1.938
  522   3HD1  ILE  72          3HD1      ILE  72   9.885  -4.393   2.114
  523    HA   PRO  73           HA       PRO  73   8.306  -1.161   0.016
  524   1HB   PRO  73          1HB       PRO  73   7.806   1.485  -0.483
  525   2HB   PRO  73          2HB       PRO  73   8.791   0.881   0.860
  526   1HG   PRO  73          1HG       PRO  73   9.679   1.929  -1.834
  527   2HG   PRO  73          2HG       PRO  73  10.396   2.303  -0.242
  528   1HD   PRO  73          1HD       PRO  73  11.488   0.462  -1.942
  529   2HD   PRO  73          2HD       PRO  73  11.513   0.205  -0.175
  530    H    THR  74           H        THR  74   6.416  -1.731  -0.914
  531    HA   THR  74           HA       THR  74   5.774  -0.708  -3.646
  532    HB   THR  74           HB       THR  74   4.922  -3.413  -2.570
  533    HG1  THR  74           1HG      THR  74   7.257  -2.748  -3.953
  534   1HG2  THR  74          1HG2      THR  74   4.333  -3.941  -4.830
  535   2HG2  THR  74          2HG2      THR  74   3.494  -2.463  -4.331
  536   3HG2  THR  74          3HG2      THR  74   4.899  -2.344  -5.391
  537    H    LEU  75           H        LEU  75   3.697   0.036  -3.883
  538    HA   LEU  75           HA       LEU  75   1.778  -0.113  -1.604
  539   1HB   LEU  75          1HB       LEU  75   2.883   2.140  -1.773
  540   2HB   LEU  75          2HB       LEU  75   2.235   2.283  -3.388
  541    HG   LEU  75           HG       LEU  75   0.242   1.440  -1.316
  542   1HD1  LEU  75          1HD1      LEU  75   1.352   4.269  -1.342
  543   2HD1  LEU  75          2HD1      LEU  75  -0.029   3.685  -0.385
  544   3HD1  LEU  75          3HD1      LEU  75   1.580   3.062  -0.064
  545   1HD2  LEU  75          1HD2      LEU  75   0.035   3.640  -3.406
  546   2HD2  LEU  75          2HD2      LEU  75  -0.209   1.940  -3.810
  547   3HD2  LEU  75          3HD2      LEU  75  -1.270   2.691  -2.652
  548    H    ILE  76           H        ILE  76   0.102  -1.334  -2.405
  549    HA   ILE  76           HA       ILE  76  -0.575  -0.905  -5.273
  550    HB   ILE  76           HB       ILE  76  -0.829  -3.530  -3.799
  551   1HG1  ILE  76          1HG1      ILE  76   1.206  -2.499  -5.783
  552   2HG1  ILE  76          2HG1      ILE  76   1.453  -3.319  -4.238
  553   1HG2  ILE  76          1HG2      ILE  76  -2.644  -3.154  -5.460
  554   2HG2  ILE  76          2HG2      ILE  76  -1.419  -2.826  -6.713
  555   3HG2  ILE  76          3HG2      ILE  76  -1.571  -4.431  -5.969
  556   1HD1  ILE  76          1HD1      ILE  76   0.613  -4.570  -6.870
  557   2HD1  ILE  76          2HD1      ILE  76   2.097  -4.832  -5.947
  558   3HD1  ILE  76          3HD1      ILE  76   0.542  -5.415  -5.303
  559    H    LEU  77           H        LEU  77  -2.675  -0.658  -5.683
  560    HA   LEU  77           HA       LEU  77  -4.417  -0.252  -3.322
  561   1HB   LEU  77          1HB       LEU  77  -3.770   1.773  -4.687
  562   2HB   LEU  77          2HB       LEU  77  -4.722   1.110  -6.014
  563    HG   LEU  77           HG       LEU  77  -5.708   1.787  -3.210
  564   1HD1  LEU  77          1HD1      LEU  77  -6.233   3.172  -5.844
  565   2HD1  LEU  77          2HD1      LEU  77  -6.804   3.675  -4.223
  566   3HD1  LEU  77          3HD1      LEU  77  -5.087   3.724  -4.605
  567   1HD2  LEU  77          1HD2      LEU  77  -8.027   1.734  -4.515
  568   2HD2  LEU  77          2HD2      LEU  77  -7.193   0.550  -5.504
  569   3HD2  LEU  77          3HD2      LEU  77  -7.365   0.282  -3.767
  570    H    PHE  78           H        PHE  78  -6.059  -1.629  -3.193
  571    HA   PHE  78           HA       PHE  78  -6.715  -3.333  -5.561
  572   1HB   PHE  78          1HB       PHE  78  -6.761  -4.109  -2.640
  573   2HB   PHE  78          2HB       PHE  78  -7.185  -5.146  -3.989
  574    HD1  PHE  78           1HD      PHE  78  -5.495  -6.266  -5.330
  575    HD2  PHE  78           2HD      PHE  78  -4.390  -3.634  -2.096
  576    HE1  PHE  78           1HE      PHE  78  -3.209  -7.220  -5.334
  577    HE2  PHE  78           2HE      PHE  78  -2.126  -4.632  -2.064
  578    HZ   PHE  78           HZ       PHE  78  -1.520  -6.412  -3.699
  579    H    LYS  79           H        LYS  79  -8.860  -4.093  -5.723
  580    HA   LYS  79           HA       LYS  79 -10.733  -3.832  -3.619
  581   1HB   LYS  79          1HB       LYS  79 -12.462  -2.528  -4.922
  582   2HB   LYS  79          2HB       LYS  79 -11.140  -1.602  -4.236
  583   1HG   LYS  79          1HG       LYS  79 -10.053  -1.456  -6.484
  584   2HG   LYS  79          2HG       LYS  79 -11.343  -2.463  -7.160
  585   1HD   LYS  79          1HD       LYS  79 -11.852  -0.162  -7.667
  586   2HD   LYS  79          2HD       LYS  79 -13.005  -0.743  -6.457
  587   1HE   LYS  79          1HE       LYS  79 -11.256   0.278  -4.731
  588   2HE   LYS  79          2HE       LYS  79 -10.678   1.187  -6.134
  589   1HZ   LYS  79          1HZ       LYS  79 -13.391   1.119  -4.985
  590   2HZ   LYS  79          2HZ       LYS  79 -12.364   2.411  -4.944
  591   3HZ   LYS  79          3HZ       LYS  79 -13.034   1.938  -6.382
  592    H    GLY  80           H        GLY  80 -12.722  -5.017  -4.198
  593   1HA   GLY  80          1HA       GLY  80 -13.825  -6.798  -5.156
  594   2HA   GLY  80          2HA       GLY  80 -13.225  -6.221  -6.715
  595    H    GLY  81           H        GLY  81 -10.770  -7.080  -4.377
  596   1HA   GLY  81          1HA       GLY  81  -9.466  -8.983  -4.159
  597   2HA   GLY  81          2HA       GLY  81 -10.365  -9.791  -5.443
  598    H    GLU  82           H        GLU  82  -9.629  -6.779  -6.893
  599    HA   GLU  82           HA       GLU  82  -7.186  -7.926  -8.037
  600   1HB   GLU  82          1HB       GLU  82  -7.906  -6.771 -10.052
  601   2HB   GLU  82          2HB       GLU  82  -9.027  -8.034  -9.543
  602   1HG   GLU  82          1HG       GLU  82 -10.632  -6.384  -8.794
  603   2HG   GLU  82          2HG       GLU  82  -9.470  -5.065  -9.015
  604    HA   PRO  83           HA       PRO  83  -5.318  -3.912  -7.101
  605   1HB   PRO  83          1HB       PRO  83  -3.063  -4.041  -8.595
  606   2HB   PRO  83          2HB       PRO  83  -3.330  -5.105  -7.178
  607   1HG   PRO  83          1HG       PRO  83  -3.719  -5.802 -10.095
  608   2HG   PRO  83          2HG       PRO  83  -2.882  -6.743  -8.822
  609   1HD   PRO  83          1HD       PRO  83  -5.515  -7.165  -9.555
  610   2HD   PRO  83          2HD       PRO  83  -4.894  -7.483  -7.908
  611    H    VAL  84           H        VAL  84  -5.960  -1.885  -7.986
  612    HA   VAL  84           HA       VAL  84  -6.585  -1.723 -10.855
  613    HB   VAL  84           HB       VAL  84  -6.795   0.762 -10.186
  614   1HG1  VAL  84          1HG1      VAL  84  -8.701  -0.703 -10.773
  615   2HG1  VAL  84          2HG1      VAL  84  -8.773  -1.291  -9.102
  616   3HG1  VAL  84          3HG1      VAL  84  -9.142   0.412  -9.470
  617   1HG2  VAL  84          1HG2      VAL  84  -5.779   0.652  -7.947
  618   2HG2  VAL  84          2HG2      VAL  84  -7.433   1.287  -7.925
  619   3HG2  VAL  84          3HG2      VAL  84  -7.133  -0.386  -7.427
  620    H    LYS  85           H        LYS  85  -4.016  -0.653  -8.567
  621    HA   LYS  85           HA       LYS  85  -2.079  -0.613 -10.656
  622   1HB   LYS  85          1HB       LYS  85  -1.483   1.826 -10.494
  623   2HB   LYS  85          2HB       LYS  85  -2.937   1.455 -11.393
  624   1HG   LYS  85          1HG       LYS  85  -4.358   2.193  -9.540
  625   2HG   LYS  85          2HG       LYS  85  -2.926   2.470  -8.515
  626   1HD   LYS  85          1HD       LYS  85  -2.078   4.147 -10.058
  627   2HD   LYS  85          2HD       LYS  85  -3.382   3.831 -11.219
  628   1HE   LYS  85          1HE       LYS  85  -3.853   4.797  -8.381
  629   2HE   LYS  85          2HE       LYS  85  -3.631   5.890  -9.758
  630   1HZ   LYS  85          1HZ       LYS  85  -5.609   5.122 -10.746
  631   2HZ   LYS  85          2HZ       LYS  85  -5.824   3.907  -9.602
  632   3HZ   LYS  85          3HZ       LYS  85  -5.894   5.571  -9.306
  633    H    GLN  86           H        GLN  86  -0.011   0.393  -9.868
  634    HA   GLN  86           HA       GLN  86   0.567  -0.295  -7.053
  635   1HB   GLN  86          1HB       GLN  86   0.932  -2.311  -8.288
  636   2HB   GLN  86          2HB       GLN  86   1.607  -1.445  -9.666
  637   1HG   GLN  86          1HG       GLN  86   3.659  -0.944  -8.426
  638   2HG   GLN  86          2HG       GLN  86   3.009  -1.724  -6.980
  639   1HE2  GLN  86          1HE2      GLN  86   4.182  -3.681  -6.757
  640   2HE2  GLN  86          2HE2      GLN  86   4.455  -4.767  -8.115
  641    H    LEU  87           H        LEU  87   2.319   0.808  -6.215
  642    HA   LEU  87           HA       LEU  87   4.074   2.411  -7.977
  643   1HB   LEU  87          1HB       LEU  87   3.095   2.991  -5.146
  644   2HB   LEU  87          2HB       LEU  87   4.625   3.595  -5.713
  645    HG   LEU  87           HG       LEU  87   3.087   5.346  -5.831
  646   1HD1  LEU  87          1HD1      LEU  87   3.344   4.432  -8.706
  647   2HD1  LEU  87          2HD1      LEU  87   3.429   6.083  -8.034
  648   3HD1  LEU  87          3HD1      LEU  87   4.740   4.925  -7.735
  649   1HD2  LEU  87          1HD2      LEU  87   1.033   5.398  -7.076
  650   2HD2  LEU  87          2HD2      LEU  87   1.261   3.743  -7.660
  651   3HD2  LEU  87          3HD2      LEU  87   0.967   4.042  -5.932
  652    H    ILE  88           H        ILE  88   6.279   2.203  -7.380
  653    HA   ILE  88           HA       ILE  88   7.041   0.269  -5.333
  654    HB   ILE  88           HB       ILE  88   8.784  -0.610  -6.925
  655   1HG1  ILE  88          1HG1      ILE  88   8.420   1.068  -8.785
  656   2HG1  ILE  88          2HG1      ILE  88   8.633  -0.617  -9.216
  657   1HG2  ILE  88          1HG2      ILE  88   7.326  -2.379  -7.852
  658   2HG2  ILE  88          2HG2      ILE  88   7.045  -2.025  -6.142
  659   3HG2  ILE  88          3HG2      ILE  88   5.906  -1.428  -7.368
  660   1HD1  ILE  88          1HD1      ILE  88   5.970   0.863  -9.275
  661   2HD1  ILE  88          2HD1      ILE  88   6.976   0.401 -10.648
  662   3HD1  ILE  88          3HD1      ILE  88   6.212  -0.855  -9.670
  663    H    GLY  89           H        GLY  89   8.969   0.814  -4.406
  664   1HA   GLY  89          1HA       GLY  89  10.929   1.987  -3.986
  665   2HA   GLY  89          2HA       GLY  89  10.748   2.875  -5.510
  666    H    TYR  90           H        TYR  90  11.541   4.296  -3.375
  667    HA   TYR  90           HA       TYR  90   9.333   5.554  -1.962
  668   1HB   TYR  90          1HB       TYR  90  11.422   5.398  -0.834
  669   2HB   TYR  90          2HB       TYR  90  12.279   6.151  -2.179
  670    HD1  TYR  90           1HD      TYR  90   9.499   6.843   0.249
  671    HD2  TYR  90           2HD      TYR  90  12.720   8.480  -2.085
  672    HE1  TYR  90           1HE      TYR  90   9.075   9.079   1.243
  673    HE2  TYR  90           2HE      TYR  90  12.326  10.706  -1.095
  674    HH   TYR  90           HH       TYR  90  11.058  11.940   0.452
  675    H    GLN  91           H        GLN  91   7.944   6.200  -3.675
  676    HA   GLN  91           HA       GLN  91   8.845   8.580  -5.184
  677   1HB   GLN  91          1HB       GLN  91   5.955   7.706  -5.042
  678   2HB   GLN  91          2HB       GLN  91   6.812   8.610  -6.257
  679   1HG   GLN  91          1HG       GLN  91   7.080   5.618  -5.810
  680   2HG   GLN  91          2HG       GLN  91   6.238   6.444  -7.123
  681   1HE2  GLN  91          1HE2      GLN  91   8.732   4.518  -7.080
  682   2HE2  GLN  91          2HE2      GLN  91   9.872   5.476  -8.024
  683    HA   PRO  92           HA       PRO  92   7.693  10.841  -1.492
  684   1HB   PRO  92          1HB       PRO  92   7.598  13.425  -2.410
  685   2HB   PRO  92          2HB       PRO  92   9.123  12.502  -2.247
  686   1HG   PRO  92          1HG       PRO  92   7.436  12.882  -4.741
  687   2HG   PRO  92          2HG       PRO  92   9.204  13.122  -4.559
  688   1HD   PRO  92          1HD       PRO  92   8.172  10.799  -5.547
  689   2HD   PRO  92          2HD       PRO  92   9.609  10.792  -4.482
  690    H    LYS  93           H        LYS  93   5.959  12.224  -0.618
  691    HA   LYS  93           HA       LYS  93   3.442  11.291  -0.968
  692   1HB   LYS  93          1HB       LYS  93   4.697  13.376   0.529
  693   2HB   LYS  93          2HB       LYS  93   3.324  14.146  -0.220
  694   1HG   LYS  93          1HG       LYS  93   3.119  11.517   1.278
  695   2HG   LYS  93          2HG       LYS  93   2.907  13.065   2.063
  696   1HD   LYS  93          1HD       LYS  93   1.221  12.621  -0.381
  697   2HD   LYS  93          2HD       LYS  93   0.919  11.574   0.983
  698   1HE   LYS  93          1HE       LYS  93  -0.599  13.464   1.001
  699   2HE   LYS  93          2HE       LYS  93   0.415  13.421   2.447
  700   1HZ   LYS  93          1HZ       LYS  93   1.712  15.175   1.647
  701   2HZ   LYS  93          2HZ       LYS  93   1.027  15.144   0.130
  702   3HZ   LYS  93          3HZ       LYS  93   0.168  15.636   1.454
  703    H    GLU  94           H        GLU  94   4.685  14.231  -2.444
  704    HA   GLU  94           HA       GLU  94   2.457  15.139  -3.858
  705   1HB   GLU  94          1HB       GLU  94   4.607  16.326  -3.559
  706   2HB   GLU  94          2HB       GLU  94   5.393  15.207  -4.678
  707   1HG   GLU  94          1HG       GLU  94   3.920  15.997  -6.512
  708   2HG   GLU  94          2HG       GLU  94   3.077  17.067  -5.381
  709    H    GLN  95           H        GLN  95   4.761  12.538  -4.865
  710    HA   GLN  95           HA       GLN  95   3.720  12.371  -7.570
  711   1HB   GLN  95          1HB       GLN  95   6.100  11.657  -6.298
  712   2HB   GLN  95          2HB       GLN  95   5.264  10.124  -6.362
  713   1HG   GLN  95          1HG       GLN  95   6.018  11.913  -8.692
  714   2HG   GLN  95          2HG       GLN  95   6.717  10.350  -8.277
  715   1HE2  GLN  95          1HE2      GLN  95   5.627   8.401  -8.972
  716   2HE2  GLN  95          2HE2      GLN  95   4.221   8.497 -10.042
  717    H    LEU  96           H        LEU  96   3.431  10.779  -4.375
  718    HA   LEU  96           HA       LEU  96   1.974   8.495  -5.234
  719   1HB   LEU  96          1HB       LEU  96   3.230   9.417  -2.961
  720   2HB   LEU  96          2HB       LEU  96   1.555   9.536  -2.520
  721    HG   LEU  96           HG       LEU  96   3.010   7.062  -3.570
  722   1HD1  LEU  96          1HD1      LEU  96   1.973   7.705  -0.775
  723   2HD1  LEU  96          2HD1      LEU  96   2.749   6.191  -1.282
  724   3HD1  LEU  96          3HD1      LEU  96   3.677   7.698  -1.291
  725   1HD2  LEU  96          1HD2      LEU  96   0.564   7.008  -4.183
  726   2HD2  LEU  96          2HD2      LEU  96   1.060   5.730  -3.082
  727   3HD2  LEU  96          3HD2      LEU  96   0.178   7.128  -2.453
  728    H    GLU  97           H        GLU  97   0.859  11.626  -3.742
  729    HA   GLU  97           HA       GLU  97  -1.933  11.037  -4.091
  730   1HB   GLU  97          1HB       GLU  97  -0.233  13.286  -3.265
  731   2HB   GLU  97          2HB       GLU  97  -1.584  13.828  -4.214
  732   1HG   GLU  97          1HG       GLU  97  -1.765  12.066  -1.734
  733   2HG   GLU  97          2HG       GLU  97  -1.857  13.822  -1.704
  734    H    ALA  98           H        ALA  98   0.558  12.563  -6.240
  735    HA   ALA  98           HA       ALA  98  -1.369  13.343  -8.216
  736   1HB   ALA  98          1HB       ALA  98   0.540  13.477  -9.773
  737   2HB   ALA  98          2HB       ALA  98   0.916  14.243  -8.221
  738   3HB   ALA  98          3HB       ALA  98   1.575  12.634  -8.605
  739    H    GLN  99           H        GLN  99   0.683  10.392  -8.052
  740    HA   GLN  99           HA       GLN  99  -0.322   9.228 -10.427
  741   1HB   GLN  99          1HB       GLN  99   1.737   8.636  -8.864
  742   2HB   GLN  99          2HB       GLN  99   0.595   7.613  -8.008
  743   1HG   GLN  99          1HG       GLN  99   1.665   6.178  -9.524
  744   2HG   GLN  99          2HG       GLN  99   0.144   6.518 -10.337
  745   1HE2  GLN  99          1HE2      GLN  99   0.242   7.666 -12.380
  746   2HE2  GLN  99          2HE2      GLN  99   1.786   8.162 -13.063
  747    H    LEU 100           H        LEU 100  -1.643   9.204  -7.183
  748    HA   LEU 100           HA       LEU 100  -3.726   7.248  -7.958
  749   1HB   LEU 100          1HB       LEU 100  -2.080   7.737  -5.636
  750   2HB   LEU 100          2HB       LEU 100  -3.733   7.934  -5.199
  751    HG   LEU 100           HG       LEU 100  -4.146   5.606  -6.206
  752   1HD1  LEU 100          1HD1      LEU 100  -1.097   5.496  -6.117
  753   2HD1  LEU 100          2HD1      LEU 100  -2.193   4.186  -6.601
  754   3HD1  LEU 100          3HD1      LEU 100  -2.006   5.629  -7.622
  755   1HD2  LEU 100          1HD2      LEU 100  -3.918   5.907  -3.792
  756   2HD2  LEU 100          2HD2      LEU 100  -2.995   4.460  -4.253
  757   3HD2  LEU 100          3HD2      LEU 100  -2.143   5.972  -3.919
  758    H    ALA 101           H        ALA 101  -3.465  10.572  -8.115
  759    HA   ALA 101           HA       ALA 101  -5.571  11.658  -6.765
  760   1HB   ALA 101          1HB       ALA 101  -5.586  13.398  -8.528
  761   2HB   ALA 101          2HB       ALA 101  -3.936  12.943  -8.077
  762   3HB   ALA 101          3HB       ALA 101  -4.639  12.337  -9.591
  763    H    ASP 102           H        ASP 102  -5.827   9.613  -9.601
  764    HA   ASP 102           HA       ASP 102  -8.516  10.311 -10.419
  765   1HB   ASP 102          1HB       ASP 102  -8.362   8.280 -11.781
  766   2HB   ASP 102          2HB       ASP 102  -6.825   9.146 -11.878
  767    H    VAL 103           H        VAL 103  -7.389   8.428  -7.711
  768    HA   VAL 103           HA       VAL 103 -10.244   7.625  -7.250
  769    HB   VAL 103           HB       VAL 103  -8.382   5.825  -7.523
  770   1HG1  VAL 103          1HG1      VAL 103  -7.900   6.248  -4.579
  771   2HG1  VAL 103          2HG1      VAL 103  -7.039   5.253  -5.786
  772   3HG1  VAL 103          3HG1      VAL 103  -6.861   6.977  -5.820
  773   1HG2  VAL 103          1HG2      VAL 103 -10.681   5.324  -6.825
  774   2HG2  VAL 103          2HG2      VAL 103  -9.488   4.308  -5.992
  775   3HG2  VAL 103          3HG2      VAL 103 -10.248   5.670  -5.136
  776    H    LEU 104           H        LEU 104  -7.880   9.851  -6.276
  777    HA   LEU 104           HA       LEU 104  -9.071  10.207  -3.611
  778   1HB   LEU 104          1HB       LEU 104  -6.566  11.129  -5.028
  779   2HB   LEU 104          2HB       LEU 104  -7.193  12.081  -3.766
  780    HG   LEU 104           HG       LEU 104  -5.770  10.854  -2.531
  781   1HD1  LEU 104          1HD1      LEU 104  -7.932  10.095  -1.609
  782   2HD1  LEU 104          2HD1      LEU 104  -7.832   8.651  -2.662
  783   3HD1  LEU 104          3HD1      LEU 104  -6.613   8.929  -1.391
  784   1HD2  LEU 104          1HD2      LEU 104  -4.927   8.619  -3.014
  785   2HD2  LEU 104          2HD2      LEU 104  -6.085   8.463  -4.355
  786   3HD2  LEU 104          3HD2      LEU 104  -4.796   9.695  -4.413
  787    H    GLN 105           H        GLN 105  -9.381  11.313  -6.827
  788    HA   GLN 105           HA       GLN 105 -10.526  13.820  -6.658
  789   1HB   GLN 105          2HB       GLN 105 -10.118  12.580  -8.719
  790   2HB   GLN 105          3HB       GLN 105 -11.357  11.416  -8.275
  791   1HG   GLN 105          2HG       GLN 105 -13.106  13.148  -8.410
  792   2HG   GLN 105          3HG       GLN 105 -11.884  14.400  -8.661
  793   1HE2  GLN 105          1HE2      GLN 105 -10.406  14.018 -10.690
  794   2HE2  GLN 105          2HE2      GLN 105 -11.279  13.409 -12.096
  Start of MODEL    4
    1   1H    ALA   1           H        ALA   1 -12.515   2.071   6.761
    2   2H    ALA   1          2HN       ALA   1 -12.612   3.169   5.516
    3   3H    ALA   1          3HN       ALA   1 -11.502   1.926   5.490
    4    HA   ALA   1           HA       ALA   1 -10.436   3.988   6.014
    5   1HB   ALA   1          1HB       ALA   1 -12.229   3.903   8.473
    6   2HB   ALA   1          2HB       ALA   1 -10.902   5.051   8.181
    7   3HB   ALA   1          3HB       ALA   1 -12.335   5.077   7.136
    8    H    THR   2           H        THR   2  -8.691   4.055   7.704
    9    HA   THR   2           HA       THR   2  -7.287   1.826   7.218
   10    HB   THR   2           HB       THR   2  -5.693   2.731   9.008
   11    HG1  THR   2           1HG      THR   2  -7.560   3.596  10.220
   12   1HG2  THR   2          1HG2      THR   2  -5.198   4.752   7.773
   13   2HG2  THR   2          2HG2      THR   2  -5.700   3.484   6.651
   14   3HG2  THR   2          3HG2      THR   2  -6.832   4.777   7.053
   15    H    MET   3           H        MET   3  -6.439   0.031   8.205
   16    HA   MET   3           HA       MET   3  -7.055  -0.559  10.988
   17   1HB   MET   3          1HB       MET   3  -8.775  -1.717   9.408
   18   2HB   MET   3          2HB       MET   3  -7.411  -2.691   8.840
   19   1HG   MET   3          1HG       MET   3  -7.031  -3.376  11.257
   20   2HG   MET   3          2HG       MET   3  -8.509  -2.515  11.677
   21   1HE   MET   3          1HE       MET   3 -11.265  -4.720   9.949
   22   2HE   MET   3          2HE       MET   3 -10.927  -3.274  10.927
   23   3HE   MET   3          3HE       MET   3 -10.496  -3.308   9.199
   24    H    THR   4           H        THR   4  -5.442  -2.266  11.731
   25    HA   THR   4           HA       THR   4  -2.878  -2.227  10.255
   26    HB   THR   4           HB       THR   4  -3.719  -3.589  12.823
   27    HG1  THR   4           1HG      THR   4  -3.556  -1.198  12.612
   28   1HG2  THR   4          1HG2      THR   4  -0.938  -3.215  11.612
   29   2HG2  THR   4          2HG2      THR   4  -1.272  -3.803  13.254
   30   3HG2  THR   4          3HG2      THR   4  -1.777  -4.765  11.862
   31    H    LEU   5           H        LEU   5  -2.055  -4.185   9.275
   32    HA   LEU   5           HA       LEU   5  -4.046  -6.352   8.939
   33   1HB   LEU   5          1HB       LEU   5  -2.210  -5.352   6.755
   34   2HB   LEU   5          2HB       LEU   5  -3.382  -6.655   6.615
   35    HG   LEU   5           HG       LEU   5  -4.051  -3.734   7.071
   36   1HD1  LEU   5          1HD1      LEU   5  -3.068  -4.215   4.834
   37   2HD1  LEU   5          2HD1      LEU   5  -4.300  -5.451   4.560
   38   3HD1  LEU   5          3HD1      LEU   5  -4.778  -3.754   4.700
   39   1HD2  LEU   5          1HD2      LEU   5  -6.335  -4.223   6.536
   40   2HD2  LEU   5          2HD2      LEU   5  -5.961  -5.940   6.348
   41   3HD2  LEU   5          3HD2      LEU   5  -5.848  -5.170   7.943
   42    H    THR   6           H        THR   6  -2.881  -8.291   7.947
   43    HA   THR   6           HA       THR   6  -0.125  -8.663   8.637
   44    HB   THR   6           HB       THR   6  -2.203 -10.400  10.060
   45    HG1  THR   6           1HG      THR   6  -1.102  -7.990  10.746
   46   1HG2  THR   6          1HG2      THR   6   0.074 -11.464   9.656
   47   2HG2  THR   6          2HG2      THR   6   0.783 -10.157  10.626
   48   3HG2  THR   6          3HG2      THR   6  -0.369 -11.284  11.357
   49    H    ASP   7           H        ASP   7  -1.490 -11.707   8.477
   50    HA   ASP   7           HA       ASP   7  -1.309 -11.797   5.563
   51   1HB   ASP   7          1HB       ASP   7  -1.301 -14.261   5.989
   52   2HB   ASP   7          2HB       ASP   7  -0.003 -13.402   6.810
   53    H    ALA   8           H        ALA   8  -3.582 -13.243   7.949
   54    HA   ALA   8           HA       ALA   8  -5.646 -13.729   6.049
   55   1HB   ALA   8          1HB       ALA   8  -5.514 -14.777   8.288
   56   2HB   ALA   8          2HB       ALA   8  -5.846 -13.206   9.052
   57   3HB   ALA   8          3HB       ALA   8  -7.092 -13.983   8.052
   58    H    ASN   9           H        ASN   9  -4.864 -10.892   7.916
   59    HA   ASN   9           HA       ASN   9  -7.357  -9.449   7.528
   60   1HB   ASN   9          1HB       ASN   9  -4.757  -8.931   8.831
   61   2HB   ASN   9          2HB       ASN   9  -5.479  -7.539   8.003
   62   1HD2  ASN   9          1HD2      ASN   9  -5.953  -6.305  10.059
   63   2HD2  ASN   9          2HD2      ASN   9  -7.256  -6.966  11.003
   64    H    PHE  10           H        PHE  10  -4.364  -9.926   5.682
   65    HA   PHE  10           HA       PHE  10  -4.566  -7.564   4.070
   66   1HB   PHE  10          1HB       PHE  10  -2.488  -8.891   4.159
   67   2HB   PHE  10          2HB       PHE  10  -3.290 -10.245   3.393
   68    HD1  PHE  10           1HD      PHE  10  -1.883  -6.863   2.836
   69    HD2  PHE  10           2HD      PHE  10  -3.894 -10.221   1.019
   70    HE1  PHE  10           1HE      PHE  10  -1.283  -6.036   0.587
   71    HE2  PHE  10           2HE      PHE  10  -3.391  -9.309  -1.215
   72    HZ   PHE  10           HZ       PHE  10  -2.020  -7.247  -1.444
   73    H    GLN  11           H        GLN  11  -5.562 -10.941   3.406
   74    HA   GLN  11           HA       GLN  11  -7.060 -10.340   1.029
   75   1HB   GLN  11          1HB       GLN  11  -7.012 -12.623   3.031
   76   2HB   GLN  11          2HB       GLN  11  -8.237 -12.588   1.770
   77   1HG   GLN  11          1HG       GLN  11  -5.263 -12.316   1.156
   78   2HG   GLN  11          2HG       GLN  11  -6.079 -13.879   1.273
   79   1HE2  GLN  11          1HE2      GLN  11  -4.776 -12.442  -1.218
   80   2HE2  GLN  11          2HE2      GLN  11  -6.140 -12.516  -2.321
   81    H    GLN  12           H        GLN  12  -8.122 -10.625   4.506
   82    HA   GLN  12           HA       GLN  12 -10.821 -10.104   3.876
   83   1HB   GLN  12          1HB       GLN  12  -9.965 -11.120   5.965
   84   2HB   GLN  12          2HB       GLN  12  -9.415  -9.527   6.510
   85   1HG   GLN  12          1HG       GLN  12 -11.654  -8.703   6.676
   86   2HG   GLN  12          2HG       GLN  12 -12.304 -10.012   5.682
   87   1HE2  GLN  12          1HE2      GLN  12 -12.425 -12.211   6.616
   88   2HE2  GLN  12          2HE2      GLN  12 -12.500 -12.347   8.373
   89    H    ALA  13           H        ALA  13  -8.170  -7.819   3.939
   90    HA   ALA  13           HA       ALA  13  -9.972  -5.533   3.905
   91   1HB   ALA  13          1HB       ALA  13  -7.776  -5.230   4.877
   92   2HB   ALA  13          2HB       ALA  13  -6.981  -5.738   3.373
   93   3HB   ALA  13          3HB       ALA  13  -7.923  -4.234   3.419
   94    H    ILE  14           H        ILE  14  -7.720  -7.113   1.540
   95    HA   ILE  14           HA       ILE  14  -8.589  -5.389  -0.558
   96    HB   ILE  14           HB       ILE  14  -7.281  -6.710  -2.042
   97   1HG1  ILE  14          1HG1      ILE  14  -6.233  -8.710  -0.144
   98   2HG1  ILE  14          2HG1      ILE  14  -7.893  -9.001  -0.677
   99   1HG2  ILE  14          1HG2      ILE  14  -6.082  -5.130  -0.647
  100   2HG2  ILE  14          2HG2      ILE  14  -5.836  -6.359   0.611
  101   3HG2  ILE  14          3HG2      ILE  14  -5.073  -6.547  -0.970
  102   1HD1  ILE  14          1HD1      ILE  14  -5.490  -8.587  -2.489
  103   2HD1  ILE  14          2HD1      ILE  14  -6.360 -10.104  -2.199
  104   3HD1  ILE  14          3HD1      ILE  14  -7.168  -8.783  -3.051
  105    H    GLN  15           H        GLN  15 -10.032  -8.303   0.558
  106    HA   GLN  15           HA       GLN  15 -11.206  -9.462  -1.603
  107   1HB   GLN  15          1HB       GLN  15 -13.041 -10.189  -0.122
  108   2HB   GLN  15          2HB       GLN  15 -11.457 -10.371   0.620
  109   1HG   GLN  15          1HG       GLN  15 -11.835  -8.271   1.914
  110   2HG   GLN  15          2HG       GLN  15 -13.422  -8.098   1.171
  111   1HE2  GLN  15          1HE2      GLN  15 -14.471  -8.125   3.227
  112   2HE2  GLN  15          2HE2      GLN  15 -14.643  -9.644   4.100
  113    H    GLY  16           H        GLY  16 -12.313  -6.396  -0.159
  114   1HA   GLY  16          1HA       GLY  16 -12.955  -5.110  -2.292
  115   2HA   GLY  16          2HA       GLY  16 -14.413  -6.127  -2.237
  116    H    ASP  17           H        ASP  17 -13.840  -3.159  -1.889
  117    HA   ASP  17           HA       ASP  17 -15.698  -2.531   0.212
  118   1HB   ASP  17          1HB       ASP  17 -13.661  -2.934   1.495
  119   2HB   ASP  17          2HB       ASP  17 -12.708  -1.939   0.416
  120    H    GLY  18           H        GLY  18 -13.303  -0.221  -0.478
  121   1HA   GLY  18          1HA       GLY  18 -14.151   0.460  -3.233
  122   2HA   GLY  18          2HA       GLY  18 -14.151   1.717  -1.976
  123    HA   PRO  19           HA       PRO  19  -9.740   1.718  -3.408
  124   1HB   PRO  19          1HB       PRO  19  -8.951   4.064  -2.169
  125   2HB   PRO  19          2HB       PRO  19  -9.780   3.976  -3.723
  126   1HG   PRO  19          1HG       PRO  19 -11.019   4.474  -1.022
  127   2HG   PRO  19          2HG       PRO  19 -11.322   5.350  -2.553
  128   1HD   PRO  19          1HD       PRO  19 -12.968   3.416  -1.595
  129   2HD   PRO  19          2HD       PRO  19 -12.681   3.593  -3.355
  130    H    VAL  20           H        VAL  20  -9.140  -0.128  -2.253
  131    HA   VAL  20           HA       VAL  20  -8.292   0.112   0.566
  132    HB   VAL  20           HB       VAL  20  -8.291  -2.085  -1.524
  133   1HG1  VAL  20          1HG1      VAL  20  -7.229  -2.130   1.358
  134   2HG1  VAL  20          2HG1      VAL  20  -7.546  -3.592   0.413
  135   3HG1  VAL  20          3HG1      VAL  20  -6.299  -2.464  -0.122
  136   1HG2  VAL  20          1HG2      VAL  20 -10.497  -1.582  -0.459
  137   2HG2  VAL  20          2HG2      VAL  20  -9.912  -3.222  -0.179
  138   3HG2  VAL  20          3HG2      VAL  20  -9.795  -2.027   1.111
  139    H    LEU  21           H        LEU  21  -6.132   0.259   1.099
  140    HA   LEU  21           HA       LEU  21  -4.123   0.225  -1.065
  141   1HB   LEU  21          1HB       LEU  21  -4.829   2.561   0.703
  142   2HB   LEU  21          2HB       LEU  21  -3.131   2.318   0.298
  143    HG   LEU  21           HG       LEU  21  -5.271   2.441  -1.859
  144   1HD1  LEU  21          1HD1      LEU  21  -5.357   4.479  -0.449
  145   2HD1  LEU  21          2HD1      LEU  21  -3.644   4.779  -0.789
  146   3HD1  LEU  21          3HD1      LEU  21  -4.852   4.797  -2.106
  147   1HD2  LEU  21          1HD2      LEU  21  -3.366   2.980  -3.285
  148   2HD2  LEU  21          2HD2      LEU  21  -2.288   3.051  -1.862
  149   3HD2  LEU  21          3HD2      LEU  21  -2.970   1.519  -2.393
  150    H    VAL  22           H        VAL  22  -1.972  -0.125  -0.271
  151    HA   VAL  22           HA       VAL  22  -1.731  -1.014   2.546
  152    HB   VAL  22           HB       VAL  22  -1.794  -2.655   0.052
  153   1HG1  VAL  22          1HG1      VAL  22  -0.094  -4.293   0.808
  154   2HG1  VAL  22          2HG1      VAL  22   0.599  -2.778   0.257
  155   3HG1  VAL  22          3HG1      VAL  22   0.490  -3.120   1.993
  156   1HG2  VAL  22          1HG2      VAL  22  -2.394  -4.406   1.682
  157   2HG2  VAL  22          2HG2      VAL  22  -1.985  -3.308   3.015
  158   3HG2  VAL  22          3HG2      VAL  22  -3.349  -2.951   1.939
  159    H    ASP  23           H        ASP  23   0.196  -0.462   3.410
  160    HA   ASP  23           HA       ASP  23   2.482   0.276   1.622
  161   1HB   ASP  23          1HB       ASP  23   2.007   1.606   3.783
  162   2HB   ASP  23          2HB       ASP  23   2.340   0.190   4.672
  163    H    PHE  24           H        PHE  24   3.556  -1.459   0.879
  164    HA   PHE  24           HA       PHE  24   3.988  -3.845   2.606
  165   1HB   PHE  24          1HB       PHE  24   4.200  -3.279  -0.328
  166   2HB   PHE  24          2HB       PHE  24   5.160  -4.570   0.354
  167    HD1  PHE  24           1HD      PHE  24   3.677  -6.061   2.159
  168    HD2  PHE  24           2HD      PHE  24   2.357  -4.153  -1.485
  169    HE1  PHE  24           1HE      PHE  24   2.141  -7.941   1.718
  170    HE2  PHE  24           2HE      PHE  24   0.794  -6.009  -1.884
  171    HZ   PHE  24           HZ       PHE  24   0.809  -8.002  -0.317
  172    H    TRP  25           H        TRP  25   5.592  -3.522   3.837
  173    HA   TRP  25           HA       TRP  25   8.164  -2.448   2.854
  174   1HB   TRP  25          1HB       TRP  25   8.457  -1.007   4.711
  175   2HB   TRP  25          2HB       TRP  25   6.850  -0.650   4.122
  176    HD1  TRP  25           HD       TRP  25   4.855  -2.111   5.569
  177    HE1  TRP  25           1HE      TRP  25   4.695  -2.579   8.075
  178    HE3  TRP  25           3HE      TRP  25   9.647  -0.924   6.907
  179    HZ2  TRP  25           2HZ      TRP  25   6.460  -2.494  10.392
  180    HZ3  TRP  25           3HZ      TRP  25  10.362  -1.067   9.271
  181    HH2  TRP  25           HH       TRP  25   8.782  -1.869  11.018
  182    H    ALA  26           H        ALA  26   9.775  -2.928   4.988
  183    HA   ALA  26           HA       ALA  26   9.054  -5.160   6.602
  184   1HB   ALA  26          1HB       ALA  26  11.251  -5.498   4.500
  185   2HB   ALA  26          2HB       ALA  26  10.992  -6.587   5.887
  186   3HB   ALA  26          3HB       ALA  26   9.762  -6.456   4.632
  187    H    ALA  27           H        ALA  27  10.950  -5.509   8.167
  188    HA   ALA  27           HA       ALA  27  11.756  -3.016   9.163
  189   1HB   ALA  27          1HB       ALA  27  12.926  -5.764   9.762
  190   2HB   ALA  27          2HB       ALA  27  13.093  -4.310  10.771
  191   3HB   ALA  27          3HB       ALA  27  11.495  -5.038  10.533
  192    H    TRP  28           H        TRP  28  13.488  -5.068   6.854
  193    HA   TRP  28           HA       TRP  28  16.033  -3.808   7.461
  194   1HB   TRP  28          1HB       TRP  28  16.952  -5.608   6.696
  195   2HB   TRP  28          2HB       TRP  28  15.358  -6.301   6.643
  196    HD1  TRP  28           HD       TRP  28  18.248  -5.202   4.551
  197    HE1  TRP  28           1HE      TRP  28  17.905  -5.733   2.075
  198    HE3  TRP  28           3HE      TRP  28  13.313  -6.571   4.689
  199    HZ2  TRP  28           2HZ      TRP  28  15.743  -6.542   0.345
  200    HZ3  TRP  28           3HZ      TRP  28  12.109  -7.161   2.574
  201    HH2  TRP  28           HH       TRP  28  13.359  -7.159   0.416
  202    H    CYS  29           H        CYS  29  13.599  -3.375   4.900
  203    HA   CYS  29           HA       CYS  29  15.490  -2.706   2.905
  204   1HB   CYS  29          1HB       CYS  29  13.372  -1.939   1.632
  205   2HB   CYS  29          2HB       CYS  29  13.692  -3.613   1.996
  206    H    GLY  30           H        GLY  30  16.818  -1.037   3.242
  207   1HA   GLY  30          1HA       GLY  30  16.745   1.367   4.345
  208   2HA   GLY  30          2HA       GLY  30  17.460   1.149   2.747
  209    HA   PRO  31           HA       PRO  31  14.477   3.886   1.007
  210   1HB   PRO  31          1HB       PRO  31  13.172   2.690  -1.104
  211   2HB   PRO  31          2HB       PRO  31  14.886   3.204  -1.140
  212   1HG   PRO  31          1HG       PRO  31  13.781   0.436  -0.594
  213   2HG   PRO  31          2HG       PRO  31  15.132   0.898  -1.675
  214   1HD   PRO  31          1HD       PRO  31  15.551  -0.043   0.832
  215   2HD   PRO  31          2HD       PRO  31  16.591   1.241   0.153
  216    H    CYS  32           H        CYS  32  12.974   0.741   1.909
  217    HA   CYS  32           HA       CYS  32  10.310   1.873   1.823
  218   1HB   CYS  32          1HB       CYS  32   9.494  -0.154   2.603
  219   2HB   CYS  32          2HB       CYS  32  10.864  -0.624   1.614
  220    H    ARG  33           H        ARG  33  12.825   1.481   4.271
  221    HA   ARG  33           HA       ARG  33  11.331   2.488   6.461
  222   1HB   ARG  33          1HB       ARG  33  13.651   1.339   6.338
  223   2HB   ARG  33          2HB       ARG  33  14.291   2.954   6.018
  224   1HG   ARG  33          1HG       ARG  33  13.327   3.738   8.192
  225   2HG   ARG  33          2HG       ARG  33  12.711   2.105   8.495
  226   1HD   ARG  33          1HD       ARG  33  15.630   2.878   8.104
  227   2HD   ARG  33          2HD       ARG  33  14.857   2.606   9.673
  228    HE   ARG  33           HE       ARG  33  14.328   0.259   8.558
  229   1HH1  ARG  33          2HH2      ARG  33  17.392   2.025   8.477
  230   2HH1  ARG  33          1HH2      ARG  33  18.372   0.606   8.313
  231   1HH2  ARG  33          2HH1      ARG  33  15.584  -1.609   8.425
  232   2HH2  ARG  33          1HH1      ARG  33  17.301  -1.512   8.157
  233    H    MET  34           H        MET  34  12.383   4.238   3.624
  234    HA   MET  34           HA       MET  34  11.958   6.807   5.002
  235   1HB   MET  34          1HB       MET  34  13.164   6.163   2.277
  236   2HB   MET  34          2HB       MET  34  12.974   7.788   2.948
  237   1HG   MET  34          1HG       MET  34  14.405   7.130   4.883
  238   2HG   MET  34          2HG       MET  34  14.695   5.566   4.121
  239   1HE   MET  34          1HE       MET  34  16.106   5.170   1.989
  240   2HE   MET  34          2HE       MET  34  15.116   6.282   1.009
  241   3HE   MET  34          3HE       MET  34  16.883   6.443   1.023
  242    H    MET  35           H        MET  35  10.318   4.562   3.071
  243    HA   MET  35           HA       MET  35   8.538   6.550   1.815
  244   1HB   MET  35          1HB       MET  35   9.495   4.653   0.476
  245   2HB   MET  35          2HB       MET  35   8.588   3.522   1.483
  246   1HG   MET  35          1HG       MET  35   6.509   4.327   0.739
  247   2HG   MET  35          2HG       MET  35   7.177   5.825   0.095
  248   1HE   MET  35          1HE       MET  35   5.536   3.288  -2.749
  249   2HE   MET  35          2HE       MET  35   5.195   3.183  -1.009
  250   3HE   MET  35          3HE       MET  35   5.172   4.765  -1.830
  251    H    ALA  36           H        ALA  36   8.588   3.840   4.166
  252    HA   ALA  36           HA       ALA  36   5.847   3.761   4.787
  253   1HB   ALA  36          1HB       ALA  36   8.239   3.254   6.607
  254   2HB   ALA  36          2HB       ALA  36   6.552   2.794   6.942
  255   3HB   ALA  36          3HB       ALA  36   7.403   2.076   5.567
  256    HA   PRO  37           HA       PRO  37   6.323   7.272   8.021
  257   1HB   PRO  37          1HB       PRO  37   8.345   9.132   7.723
  258   2HB   PRO  37          2HB       PRO  37   8.435   7.698   8.793
  259   1HG   PRO  37          1HG       PRO  37   9.496   7.983   5.968
  260   2HG   PRO  37          2HG       PRO  37  10.346   7.339   7.411
  261   1HD   PRO  37          1HD       PRO  37   9.219   5.670   5.647
  262   2HD   PRO  37          2HD       PRO  37   9.051   5.347   7.389
  263    H    VAL  38           H        VAL  38   7.383   7.788   4.622
  264    HA   VAL  38           HA       VAL  38   5.973  10.292   4.342
  265    HB   VAL  38           HB       VAL  38   7.689   8.627   2.775
  266   1HG1  VAL  38          1HG1      VAL  38   6.820   9.076   0.487
  267   2HG1  VAL  38          2HG1      VAL  38   5.916   7.862   1.380
  268   3HG1  VAL  38          3HG1      VAL  38   5.249   9.490   1.197
  269   1HG2  VAL  38          1HG2      VAL  38   6.737  11.459   2.285
  270   2HG2  VAL  38          2HG2      VAL  38   8.065  10.975   3.357
  271   3HG2  VAL  38          3HG2      VAL  38   8.185  10.696   1.614
  272    H    LEU  39           H        LEU  39   5.131   6.865   3.791
  273    HA   LEU  39           HA       LEU  39   2.490   7.292   2.887
  274   1HB   LEU  39          1HB       LEU  39   4.183   5.003   3.776
  275   2HB   LEU  39          2HB       LEU  39   2.458   4.777   3.919
  276    HG   LEU  39           HG       LEU  39   2.064   5.131   1.596
  277   1HD1  LEU  39          1HD1      LEU  39   4.990   5.855   1.309
  278   2HD1  LEU  39          2HD1      LEU  39   3.911   5.501  -0.038
  279   3HD1  LEU  39          3HD1      LEU  39   3.599   6.911   0.974
  280   1HD2  LEU  39          1HD2      LEU  39   3.535   3.317   0.600
  281   2HD2  LEU  39          2HD2      LEU  39   4.482   3.347   2.094
  282   3HD2  LEU  39          3HD2      LEU  39   2.759   2.908   2.125
  283    H    GLU  40           H        GLU  40   3.851   7.228   6.156
  284    HA   GLU  40           HA       GLU  40   1.381   6.776   7.517
  285   1HB   GLU  40          1HB       GLU  40   4.012   6.920   8.288
  286   2HB   GLU  40          2HB       GLU  40   3.469   8.510   8.804
  287   1HG   GLU  40          1HG       GLU  40   3.127   7.157  10.675
  288   2HG   GLU  40          2HG       GLU  40   1.511   7.262   9.973
  289    H    GLU  41           H        GLU  41   3.126   9.771   6.626
  290    HA   GLU  41           HA       GLU  41   1.099  11.628   7.522
  291   1HB   GLU  41          1HB       GLU  41   3.496  12.205   6.953
  292   2HB   GLU  41          2HB       GLU  41   3.101  11.927   5.259
  293   1HG   GLU  41          1HG       GLU  41   1.178  13.754   5.779
  294   2HG   GLU  41          2HG       GLU  41   2.295  14.208   7.069
  295    H    PHE  42           H        PHE  42   1.755  10.069   4.344
  296    HA   PHE  42           HA       PHE  42  -0.389  11.193   2.890
  297   1HB   PHE  42          1HB       PHE  42   1.474   9.811   1.949
  298   2HB   PHE  42          2HB       PHE  42   0.762   8.396   2.708
  299    HD1  PHE  42           1HD      PHE  42  -0.164   6.928   1.154
  300    HD2  PHE  42           2HD      PHE  42  -0.547  11.185   0.522
  301    HE1  PHE  42           1HE      PHE  42  -1.509   6.512  -0.889
  302    HE2  PHE  42           2HE      PHE  42  -1.884  10.757  -1.500
  303    HZ   PHE  42           HZ       PHE  42  -2.429   8.436  -2.187
  304    H    ALA  43           H        ALA  43  -0.350   8.182   4.913
  305    HA   ALA  43           HA       ALA  43  -3.011   7.455   4.523
  306   1HB   ALA  43          1HB       ALA  43  -1.391   5.942   5.554
  307   2HB   ALA  43          2HB       ALA  43  -1.238   7.017   6.959
  308   3HB   ALA  43          3HB       ALA  43  -2.767   6.187   6.647
  309    H    GLU  44           H        GLU  44  -1.640   9.444   7.172
  310    HA   GLU  44           HA       GLU  44  -4.046  10.026   8.501
  311   1HB   GLU  44          1HB       GLU  44  -1.836  10.507   9.418
  312   2HB   GLU  44          2HB       GLU  44  -1.544  11.735   8.178
  313   1HG   GLU  44          1HG       GLU  44  -3.378  13.115   9.062
  314   2HG   GLU  44          2HG       GLU  44  -3.802  11.852  10.223
  315    H    ALA  45           H        ALA  45  -2.484  11.801   5.811
  316    HA   ALA  45           HA       ALA  45  -4.286  13.918   5.600
  317   1HB   ALA  45          1HB       ALA  45  -3.391  14.232   3.350
  318   2HB   ALA  45          2HB       ALA  45  -2.079  13.723   4.432
  319   3HB   ALA  45          3HB       ALA  45  -2.810  12.560   3.306
  320    H    HIS  46           H        HIS  46  -5.001  10.631   4.793
  321    HA   HIS  46           HA       HIS  46  -7.681  11.435   3.918
  322   1HB   HIS  46          1HB       HIS  46  -7.541   9.974   1.909
  323   2HB   HIS  46          2HB       HIS  46  -6.554  11.429   1.819
  324    HD1  HIS  46           1HD      HIS  46  -5.651   8.018   3.363
  325    HD2  HIS  46           2HD      HIS  46  -4.503  10.731   0.351
  326    HE1  HIS  46           1HE      HIS  46  -3.416   7.113   2.334
  327    HE2  HIS  46           2HE      HIS  46  -2.756   8.796   0.516
  328    H    ALA  47           H        ALA  47  -6.973  10.356   6.355
  329    HA   ALA  47           HA       ALA  47  -6.740   7.601   6.534
  330   1HB   ALA  47          1HB       ALA  47  -8.149   9.473   8.487
  331   2HB   ALA  47          2HB       ALA  47  -7.516   7.856   8.865
  332   3HB   ALA  47          3HB       ALA  47  -6.399   9.156   8.408
  333    H    ASP  48           H        ASP  48  -9.656   9.399   5.918
  334    HA   ASP  48           HA       ASP  48 -11.402   7.035   6.212
  335   1HB   ASP  48          1HB       ASP  48 -12.173   9.078   7.253
  336   2HB   ASP  48          2HB       ASP  48 -11.984   9.978   5.741
  337    H    LYS  49           H        LYS  49 -10.736   9.516   3.663
  338    HA   LYS  49           HA       LYS  49 -12.425   8.479   1.764
  339   1HB   LYS  49          1HB       LYS  49 -11.382  10.672   1.478
  340   2HB   LYS  49          2HB       LYS  49  -9.797   9.931   1.218
  341   1HG   LYS  49          1HG       LYS  49 -10.553   8.876  -0.835
  342   2HG   LYS  49          2HG       LYS  49 -12.210   9.409  -0.580
  343   1HD   LYS  49          1HD       LYS  49  -9.871  11.302  -1.114
  344   2HD   LYS  49          2HD       LYS  49 -10.804  10.506  -2.383
  345   1HE   LYS  49          1HE       LYS  49 -12.896  11.573  -1.470
  346   2HE   LYS  49          2HE       LYS  49 -11.867  12.496  -0.363
  347   1HZ   LYS  49          1HZ       LYS  49 -10.681  13.045  -2.680
  348   2HZ   LYS  49          2HZ       LYS  49 -12.122  12.797  -3.313
  349   3HZ   LYS  49          3HZ       LYS  49 -11.976  13.938  -2.162
  350    H    VAL  50           H        VAL  50  -9.317   7.052   2.626
  351    HA   VAL  50           HA       VAL  50  -9.903   4.904   0.712
  352    HB   VAL  50           HB       VAL  50  -7.609   4.689  -0.039
  353   1HG1  VAL  50          1HG1      VAL  50  -7.480   6.523  -1.596
  354   2HG1  VAL  50          2HG1      VAL  50  -9.198   6.172  -1.352
  355   3HG1  VAL  50          3HG1      VAL  50  -8.483   7.557  -0.545
  356   1HG2  VAL  50          1HG2      VAL  50  -7.100   7.269   1.476
  357   2HG2  VAL  50          2HG2      VAL  50  -6.347   5.692   1.809
  358   3HG2  VAL  50          3HG2      VAL  50  -5.964   6.567   0.312
  359    H    THR  51           H        THR  51  -9.337   2.857   1.472
  360    HA   THR  51           HA       THR  51  -8.829   2.879   4.331
  361    HB   THR  51           HB       THR  51 -10.924   2.008   3.461
  362    HG1  THR  51           1HG      THR  51  -9.495   0.071   4.876
  363   1HG2  THR  51          1HG2      THR  51 -11.109  -0.255   2.714
  364   2HG2  THR  51          2HG2      THR  51 -10.210   0.715   1.538
  365   3HG2  THR  51          3HG2      THR  51  -9.348  -0.422   2.620
  366    H    VAL  52           H        VAL  52  -6.742   3.495   3.945
  367    HA   VAL  52           HA       VAL  52  -4.860   1.640   2.696
  368    HB   VAL  52           HB       VAL  52  -4.425   3.933   2.488
  369   1HG1  VAL  52          1HG1      VAL  52  -5.371   4.843   4.595
  370   2HG1  VAL  52          2HG1      VAL  52  -3.937   4.216   5.456
  371   3HG1  VAL  52          3HG1      VAL  52  -3.766   5.459   4.213
  372   1HG2  VAL  52          1HG2      VAL  52  -2.455   2.410   2.559
  373   2HG2  VAL  52          2HG2      VAL  52  -2.116   4.110   2.905
  374   3HG2  VAL  52          3HG2      VAL  52  -2.174   2.947   4.230
  375    H    ALA  53           H        ALA  53  -2.969   0.762   3.866
  376    HA   ALA  53           HA       ALA  53  -3.128   0.547   6.743
  377   1HB   ALA  53          1HB       ALA  53  -3.110  -1.934   6.703
  378   2HB   ALA  53          2HB       ALA  53  -4.631  -1.340   6.008
  379   3HB   ALA  53          3HB       ALA  53  -3.330  -1.906   4.933
  380    H    LYS  54           H        LYS  54  -1.280  -1.153   7.379
  381    HA   LYS  54           HA       LYS  54   0.976  -0.988   5.542
  382   1HB   LYS  54          1HB       LYS  54   1.176   1.058   6.867
  383   2HB   LYS  54          2HB       LYS  54   0.912   0.161   8.377
  384   1HG   LYS  54          1HG       LYS  54   3.009  -0.923   8.233
  385   2HG   LYS  54          2HG       LYS  54   3.214  -0.475   6.542
  386   1HD   LYS  54          1HD       LYS  54   4.718   0.874   7.714
  387   2HD   LYS  54          2HD       LYS  54   3.418   1.959   7.259
  388   1HE   LYS  54          1HE       LYS  54   3.609   0.597   9.986
  389   2HE   LYS  54          2HE       LYS  54   4.400   2.142   9.634
  390   1HZ   LYS  54          1HZ       LYS  54   1.491   1.850   9.296
  391   2HZ   LYS  54          2HZ       LYS  54   2.216   2.353  10.701
  392   3HZ   LYS  54          3HZ       LYS  54   2.384   3.231   9.395
  393    H    LEU  55           H        LEU  55   2.147  -2.811   5.571
  394    HA   LEU  55           HA       LEU  55   2.119  -4.548   7.943
  395   1HB   LEU  55          1HB       LEU  55   1.234  -6.490   6.993
  396   2HB   LEU  55          2HB       LEU  55   0.040  -5.241   6.763
  397    HG   LEU  55           HG       LEU  55   1.967  -6.099   4.539
  398   1HD1  LEU  55          1HD1      LEU  55   0.690  -8.030   5.388
  399   2HD1  LEU  55          2HD1      LEU  55  -0.826  -7.159   5.116
  400   3HD1  LEU  55          3HD1      LEU  55   0.223  -7.583   3.739
  401   1HD2  LEU  55          1HD2      LEU  55   0.807  -3.974   4.096
  402   2HD2  LEU  55          2HD2      LEU  55   0.149  -5.253   3.073
  403   3HD2  LEU  55          3HD2      LEU  55  -0.753  -4.713   4.510
  404    H    ASN  56           H        ASN  56   3.565  -6.495   7.723
  405    HA   ASN  56           HA       ASN  56   5.986  -5.706   6.249
  406   1HB   ASN  56          1HB       ASN  56   6.378  -6.303   8.476
  407   2HB   ASN  56          2HB       ASN  56   5.319  -7.689   8.414
  408   1HD2  ASN  56          1HD2      ASN  56   6.861  -9.257   9.051
  409   2HD2  ASN  56          2HD2      ASN  56   8.206  -9.699   8.013
  410    H    VAL  57           H        VAL  57   6.446  -6.498   4.326
  411    HA   VAL  57           HA       VAL  57   4.646  -8.122   2.870
  412    HB   VAL  57           HB       VAL  57   6.195  -6.367   2.051
  413   1HG1  VAL  57          1HG1      VAL  57   8.490  -6.957   1.374
  414   2HG1  VAL  57          2HG1      VAL  57   8.303  -7.131   3.124
  415   3HG1  VAL  57          3HG1      VAL  57   8.319  -8.565   2.079
  416   1HG2  VAL  57          1HG2      VAL  57   6.509  -7.327  -0.136
  417   2HG2  VAL  57          2HG2      VAL  57   6.366  -8.968   0.515
  418   3HG2  VAL  57          3HG2      VAL  57   4.966  -7.875   0.541
  419    H    ASP  58           H        ASP  58   7.457  -9.046   4.806
  420    HA   ASP  58           HA       ASP  58   7.802 -11.711   3.699
  421   1HB   ASP  58          1HB       ASP  58   9.550 -10.448   4.857
  422   2HB   ASP  58          2HB       ASP  58   8.585 -10.430   6.318
  423    H    GLU  59           H        GLU  59   5.969 -10.254   6.249
  424    HA   GLU  59           HA       GLU  59   5.027 -12.607   7.621
  425   1HB   GLU  59          1HB       GLU  59   4.823 -10.919   9.068
  426   2HB   GLU  59          2HB       GLU  59   4.923  -9.720   7.813
  427   1HG   GLU  59          1HG       GLU  59   2.455  -9.967   7.396
  428   2HG   GLU  59          2HG       GLU  59   2.397 -11.002   8.829
  429    H    ASN  60           H        ASN  60   3.761 -10.607   5.022
  430    HA   ASN  60           HA       ASN  60   1.445 -12.500   4.718
  431   1HB   ASN  60          1HB       ASN  60   0.543 -10.348   5.061
  432   2HB   ASN  60          2HB       ASN  60   1.724  -9.596   3.979
  433   1HD2  ASN  60          1HD2      ASN  60  -0.642 -12.433   3.551
  434   2HD2  ASN  60          2HD2      ASN  60  -0.994 -11.858   1.918
  435    HA   PRO  61           HA       PRO  61   4.035 -13.411   1.015
  436   1HB   PRO  61          1HB       PRO  61   3.897 -16.137   1.111
  437   2HB   PRO  61          2HB       PRO  61   5.069 -15.189   2.076
  438   1HG   PRO  61          1HG       PRO  61   2.386 -16.299   2.969
  439   2HG   PRO  61          2HG       PRO  61   3.969 -16.428   3.801
  440   1HD   PRO  61          1HD       PRO  61   2.128 -14.516   4.469
  441   2HD   PRO  61          2HD       PRO  61   3.877 -14.183   4.523
  442    H    GLU  62           H        GLU  62   0.850 -14.403   2.154
  443    HA   GLU  62           HA       GLU  62  -0.143 -15.581  -0.251
  444   1HB   GLU  62          1HB       GLU  62  -1.566 -14.356   2.149
  445   2HB   GLU  62          2HB       GLU  62  -2.371 -15.220   0.829
  446   1HG   GLU  62          1HG       GLU  62  -0.970 -17.237   1.334
  447   2HG   GLU  62          2HG       GLU  62  -0.301 -16.386   2.735
  448    H    THR  63           H        THR  63  -0.529 -14.562  -2.073
  449    HA   THR  63           HA       THR  63  -1.447 -13.208  -3.613
  450    HB   THR  63           HB       THR  63  -1.640 -10.714  -1.988
  451    HG1  THR  63           1HG      THR  63  -2.427 -12.189  -0.615
  452   1HG2  THR  63          1HG2      THR  63  -2.313 -10.750  -4.365
  453   2HG2  THR  63          2HG2      THR  63  -3.497 -12.031  -4.019
  454   3HG2  THR  63          3HG2      THR  63  -3.702 -10.414  -3.318
  455    H    THR  64           H        THR  64   0.732 -11.848  -1.287
  456    HA   THR  64           HA       THR  64   2.284 -10.070  -2.728
  457    HB   THR  64           HB       THR  64   3.022 -12.074  -0.579
  458    HG1  THR  64           1HG      THR  64   2.361 -10.595   0.779
  459   1HG2  THR  64          1HG2      THR  64   4.481  -9.489  -1.095
  460   2HG2  THR  64          2HG2      THR  64   4.813 -10.706   0.144
  461   3HG2  THR  64          3HG2      THR  64   5.110 -11.090  -1.555
  462    H    SER  65           H        SER  65   3.061 -13.575  -2.211
  463    HA   SER  65           HA       SER  65   5.202 -13.667  -4.068
  464   1HB   SER  65          1HB       SER  65   4.706 -15.343  -2.288
  465   2HB   SER  65          2HB       SER  65   3.287 -15.880  -3.201
  466    HG   SER  65           HG       SER  65   6.013 -16.043  -3.983
  467    H    GLN  66           H        GLN  66   1.714 -14.267  -4.485
  468    HA   GLN  66           HA       GLN  66   1.740 -15.260  -7.104
  469   1HB   GLN  66          1HB       GLN  66  -0.111 -15.193  -5.282
  470   2HB   GLN  66          2HB       GLN  66  -0.516 -13.601  -5.925
  471   1HG   GLN  66          1HG       GLN  66  -0.852 -14.631  -8.184
  472   2HG   GLN  66          2HG       GLN  66  -0.513 -16.220  -7.484
  473   1HE2  GLN  66          1HE2      GLN  66  -3.072 -14.439  -8.527
  474   2HE2  GLN  66          2HE2      GLN  66  -4.265 -14.988  -7.356
  475    H    PHE  67           H        PHE  67   1.908 -11.861  -5.985
  476    HA   PHE  67           HA       PHE  67   1.760 -11.012  -8.840
  477   1HB   PHE  67          1HB       PHE  67   0.254 -10.144  -6.709
  478   2HB   PHE  67          2HB       PHE  67   1.507  -8.932  -6.765
  479    HD1  PHE  67           1HD      PHE  67  -1.531 -10.157  -8.276
  480    HD2  PHE  67           2HD      PHE  67   1.929  -7.679  -8.991
  481    HE1  PHE  67           1HE      PHE  67  -2.718  -9.027 -10.138
  482    HE2  PHE  67           2HE      PHE  67   0.754  -6.595 -10.880
  483    HZ   PHE  67           HZ       PHE  67  -1.585  -7.238 -11.437
  484    H    GLY  68           H        GLY  68   4.158 -12.093  -7.096
  485   1HA   GLY  68          1HA       GLY  68   6.417 -11.798  -7.235
  486   2HA   GLY  68          2HA       GLY  68   6.125 -10.619  -8.522
  487    H    ILE  69           H        ILE  69   4.811 -10.197  -5.271
  488    HA   ILE  69           HA       ILE  69   5.910  -7.528  -5.148
  489    HB   ILE  69           HB       ILE  69   4.227  -9.145  -3.237
  490   1HG1  ILE  69          1HG1      ILE  69   3.124  -8.846  -5.385
  491   2HG1  ILE  69          2HG1      ILE  69   2.281  -8.022  -4.098
  492   1HG2  ILE  69          1HG2      ILE  69   4.675  -6.147  -3.204
  493   2HG2  ILE  69          2HG2      ILE  69   3.466  -7.049  -2.259
  494   3HG2  ILE  69          3HG2      ILE  69   5.170  -7.320  -1.971
  495   1HD1  ILE  69          1HD1      ILE  69   3.129  -5.855  -4.834
  496   2HD1  ILE  69          2HD1      ILE  69   4.138  -6.621  -6.082
  497   3HD1  ILE  69          3HD1      ILE  69   2.367  -6.683  -6.190
  498    H    MET  70           H        MET  70   8.113  -8.294  -5.266
  499    HA   MET  70           HA       MET  70   9.264  -8.508  -2.505
  500   1HB   MET  70          1HB       MET  70   9.491 -10.517  -4.052
  501   2HB   MET  70          2HB       MET  70  10.562  -9.534  -5.057
  502   1HG   MET  70          1HG       MET  70  12.117  -9.275  -3.183
  503   2HG   MET  70          2HG       MET  70  10.998 -10.088  -2.089
  504   1HE   MET  70          1HE       MET  70  11.321 -13.817  -2.957
  505   2HE   MET  70          2HE       MET  70  10.692 -12.585  -1.843
  506   3HE   MET  70          3HE       MET  70  10.017 -12.733  -3.484
  507    H    SER  71           H        SER  71   8.640  -6.298  -4.790
  508    HA   SER  71           HA       SER  71  11.285  -5.069  -5.037
  509   1HB   SER  71          1HB       SER  71   9.799  -5.320  -7.012
  510   2HB   SER  71          2HB       SER  71   8.580  -4.302  -6.213
  511    HG   SER  71           HG       SER  71  10.301  -2.724  -6.043
  512    H    ILE  72           H        ILE  72   9.901  -5.070  -2.389
  513    HA   ILE  72           HA       ILE  72   8.535  -2.759  -1.980
  514    HB   ILE  72           HB       ILE  72   8.835  -3.079   0.445
  515   1HG1  ILE  72          1HG1      ILE  72  11.092  -3.967   0.572
  516   2HG1  ILE  72          2HG1      ILE  72   9.890  -4.920   1.426
  517   1HG2  ILE  72          1HG2      ILE  72   7.044  -4.072  -0.846
  518   2HG2  ILE  72          2HG2      ILE  72   7.996  -5.532  -1.134
  519   3HG2  ILE  72          3HG2      ILE  72   7.511  -5.078   0.520
  520   1HD1  ILE  72          1HD1      ILE  72   9.931  -6.487  -0.675
  521   2HD1  ILE  72          2HD1      ILE  72  11.453  -5.632  -1.051
  522   3HD1  ILE  72          3HD1      ILE  72  11.259  -6.517   0.468
  523    HA   PRO  73           HA       PRO  73   8.269  -1.059   0.110
  524   1HB   PRO  73          1HB       PRO  73   7.671   1.508  -0.493
  525   2HB   PRO  73          2HB       PRO  73   8.734   1.028   0.826
  526   1HG   PRO  73          1HG       PRO  73   9.500   1.940  -1.967
  527   2HG   PRO  73          2HG       PRO  73  10.252   2.441  -0.426
  528   1HD   PRO  73          1HD       PRO  73  11.330   0.516  -2.056
  529   2HD   PRO  73          2HD       PRO  73  11.470   0.415  -0.284
  530    H    THR  74           H        THR  74   6.368  -1.638  -0.704
  531    HA   THR  74           HA       THR  74   5.663  -0.837  -3.486
  532    HB   THR  74           HB       THR  74   5.084  -3.522  -2.174
  533    HG1  THR  74           1HG      THR  74   6.514  -4.314  -3.634
  534   1HG2  THR  74          1HG2      THR  74   3.280  -3.095  -3.680
  535   2HG2  THR  74          2HG2      THR  74   4.361  -2.404  -4.905
  536   3HG2  THR  74          3HG2      THR  74   4.422  -4.130  -4.554
  537    H    LEU  75           H        LEU  75   3.459  -0.478  -3.835
  538    HA   LEU  75           HA       LEU  75   1.640  -0.046  -1.546
  539   1HB   LEU  75          1HB       LEU  75   3.001   1.981  -1.937
  540   2HB   LEU  75          2HB       LEU  75   2.434   1.996  -3.570
  541    HG   LEU  75           HG       LEU  75   0.119   1.679  -1.793
  542   1HD1  LEU  75          1HD1      LEU  75   0.130   3.887  -0.721
  543   2HD1  LEU  75          2HD1      LEU  75   1.390   2.825  -0.093
  544   3HD1  LEU  75          3HD1      LEU  75   1.820   4.134  -1.228
  545   1HD2  LEU  75          1HD2      LEU  75   1.032   3.770  -3.773
  546   2HD2  LEU  75          2HD2      LEU  75  -0.052   2.379  -4.053
  547   3HD2  LEU  75          3HD2      LEU  75  -0.582   3.725  -3.028
  548    H    ILE  76           H        ILE  76  -0.044  -1.451  -2.282
  549    HA   ILE  76           HA       ILE  76  -0.660  -1.334  -5.206
  550    HB   ILE  76           HB       ILE  76  -1.558  -3.470  -3.297
  551   1HG1  ILE  76          1HG1      ILE  76   0.671  -3.724  -5.384
  552   2HG1  ILE  76          2HG1      ILE  76   0.908  -3.689  -3.649
  553   1HG2  ILE  76          1HG2      ILE  76  -2.284  -4.625  -5.395
  554   2HG2  ILE  76          2HG2      ILE  76  -3.077  -3.085  -5.215
  555   3HG2  ILE  76          3HG2      ILE  76  -1.719  -3.245  -6.345
  556   1HD1  ILE  76          1HD1      ILE  76   0.950  -5.974  -4.189
  557   2HD1  ILE  76          2HD1      ILE  76  -0.692  -5.750  -3.581
  558   3HD1  ILE  76          3HD1      ILE  76  -0.390  -5.850  -5.331
  559    H    LEU  77           H        LEU  77  -2.527  -0.589  -5.766
  560    HA   LEU  77           HA       LEU  77  -4.484   0.480  -3.792
  561   1HB   LEU  77          1HB       LEU  77  -3.360   1.936  -5.540
  562   2HB   LEU  77          2HB       LEU  77  -4.217   1.006  -6.771
  563    HG   LEU  77           HG       LEU  77  -5.367   2.869  -4.653
  564   1HD1  LEU  77          1HD1      LEU  77  -4.286   3.822  -6.696
  565   2HD1  LEU  77          2HD1      LEU  77  -5.446   2.939  -7.703
  566   3HD1  LEU  77          3HD1      LEU  77  -6.006   4.207  -6.598
  567   1HD2  LEU  77          1HD2      LEU  77  -7.012   1.111  -4.831
  568   2HD2  LEU  77          2HD2      LEU  77  -7.590   2.493  -5.751
  569   3HD2  LEU  77          3HD2      LEU  77  -6.891   1.097  -6.608
  570    H    PHE  78           H        PHE  78  -6.004  -0.937  -3.479
  571    HA   PHE  78           HA       PHE  78  -6.814  -2.856  -5.634
  572   1HB   PHE  78          1HB       PHE  78  -6.923  -3.203  -2.636
  573   2HB   PHE  78          2HB       PHE  78  -7.877  -4.178  -3.721
  574    HD1  PHE  78           1HD      PHE  78  -6.908  -5.982  -5.001
  575    HD2  PHE  78           2HD      PHE  78  -4.480  -3.488  -2.452
  576    HE1  PHE  78           1HE      PHE  78  -5.102  -7.672  -5.070
  577    HE2  PHE  78           2HE      PHE  78  -2.717  -5.221  -2.453
  578    HZ   PHE  78           HZ       PHE  78  -3.000  -7.304  -3.796
  579    H    LYS  79           H        LYS  79  -9.072  -3.152  -5.899
  580    HA   LYS  79           HA       LYS  79 -10.826  -2.029  -3.912
  581   1HB   LYS  79          1HB       LYS  79 -12.278  -0.711  -5.403
  582   2HB   LYS  79          2HB       LYS  79 -10.663  -0.037  -5.259
  583   1HG   LYS  79          1HG       LYS  79 -10.151  -1.301  -7.509
  584   2HG   LYS  79          2HG       LYS  79 -11.902  -1.498  -7.621
  585   1HD   LYS  79          1HD       LYS  79 -11.272   0.438  -8.879
  586   2HD   LYS  79          2HD       LYS  79 -12.130   1.017  -7.442
  587   1HE   LYS  79          1HE       LYS  79 -10.071   1.666  -6.355
  588   2HE   LYS  79          2HE       LYS  79  -9.094   0.758  -7.502
  589   1HZ   LYS  79          1HZ       LYS  79 -10.681   3.169  -8.163
  590   2HZ   LYS  79          2HZ       LYS  79  -9.047   3.117  -8.010
  591   3HZ   LYS  79          3HZ       LYS  79  -9.782   2.311  -9.239
  592    H    GLY  80           H        GLY  80 -12.818  -3.023  -3.906
  593   1HA   GLY  80          1HA       GLY  80 -14.191  -4.882  -4.069
  594   2HA   GLY  80          2HA       GLY  80 -14.223  -4.369  -5.714
  595    H    GLY  81           H        GLY  81 -11.385  -5.905  -4.031
  596   1HA   GLY  81          1HA       GLY  81 -10.702  -8.110  -4.127
  597   2HA   GLY  81          2HA       GLY  81 -11.847  -8.447  -5.413
  598    H    GLU  82           H        GLU  82 -10.295  -5.636  -6.457
  599    HA   GLU  82           HA       GLU  82  -8.431  -7.264  -8.095
  600   1HB   GLU  82          1HB       GLU  82 -10.502  -6.576  -9.214
  601   2HB   GLU  82          2HB       GLU  82 -10.156  -4.880  -8.842
  602   1HG   GLU  82          1HG       GLU  82  -8.049  -5.040 -10.195
  603   2HG   GLU  82          2HG       GLU  82  -8.444  -6.721 -10.573
  604    HA   PRO  83           HA       PRO  83  -5.399  -4.026  -6.907
  605   1HB   PRO  83          1HB       PRO  83  -3.246  -4.952  -8.295
  606   2HB   PRO  83          2HB       PRO  83  -3.819  -5.708  -6.782
  607   1HG   PRO  83          1HG       PRO  83  -4.349  -6.607  -9.618
  608   2HG   PRO  83          2HG       PRO  83  -3.893  -7.596  -8.197
  609   1HD   PRO  83          1HD       PRO  83  -6.484  -7.293  -9.089
  610   2HD   PRO  83          2HD       PRO  83  -6.077  -7.588  -7.373
  611    H    VAL  84           H        VAL  84  -6.149  -2.190  -7.900
  612    HA   VAL  84           HA       VAL  84  -6.589  -1.983 -10.756
  613    HB   VAL  84           HB       VAL  84  -7.115  -0.416  -8.361
  614   1HG1  VAL  84          1HG1      VAL  84  -5.648   1.293  -9.288
  615   2HG1  VAL  84          2HG1      VAL  84  -6.525   1.226 -10.836
  616   3HG1  VAL  84          3HG1      VAL  84  -7.336   1.796  -9.360
  617   1HG2  VAL  84          1HG2      VAL  84  -8.832  -1.546  -9.674
  618   2HG2  VAL  84          2HG2      VAL  84  -9.123   0.204  -9.725
  619   3HG2  VAL  84          3HG2      VAL  84  -8.398  -0.608 -11.110
  620    H    LYS  85           H        LYS  85  -3.989  -0.931  -8.519
  621    HA   LYS  85           HA       LYS  85  -2.078  -1.063 -10.640
  622   1HB   LYS  85          1HB       LYS  85  -1.375   1.138 -10.882
  623   2HB   LYS  85          2HB       LYS  85  -3.122   1.298 -10.937
  624   1HG   LYS  85          1HG       LYS  85  -3.028   1.970  -8.463
  625   2HG   LYS  85          2HG       LYS  85  -1.265   1.947  -8.596
  626   1HD   LYS  85          1HD       LYS  85  -1.865   4.209  -8.889
  627   2HD   LYS  85          2HD       LYS  85  -1.478   3.624 -10.504
  628   1HE   LYS  85          1HE       LYS  85  -3.536   4.122 -11.240
  629   2HE   LYS  85          2HE       LYS  85  -4.256   3.070 -10.007
  630   1HZ   LYS  85          1HZ       LYS  85  -5.069   5.350  -9.864
  631   2HZ   LYS  85          2HZ       LYS  85  -4.244   4.962  -8.497
  632   3HZ   LYS  85          3HZ       LYS  85  -3.586   5.940  -9.675
  633    H    GLN  86           H        GLN  86   0.172  -0.669  -9.718
  634    HA   GLN  86           HA       GLN  86   0.134  -0.093  -6.878
  635   1HB   GLN  86          1HB       GLN  86   1.654  -1.793  -6.296
  636   2HB   GLN  86          2HB       GLN  86   0.316  -2.547  -7.178
  637   1HG   GLN  86          1HG       GLN  86   3.080  -2.008  -8.289
  638   2HG   GLN  86          2HG       GLN  86   2.506  -3.546  -7.650
  639   1HE2  GLN  86          1HE2      GLN  86   0.800  -4.754  -8.858
  640   2HE2  GLN  86          2HE2      GLN  86   0.500  -4.305 -10.531
  641    H    LEU  87           H        LEU  87   2.210   0.591  -6.094
  642    HA   LEU  87           HA       LEU  87   3.984   1.910  -8.095
  643   1HB   LEU  87          1HB       LEU  87   3.152   2.812  -5.304
  644   2HB   LEU  87          2HB       LEU  87   4.504   3.475  -6.159
  645    HG   LEU  87           HG       LEU  87   2.616   4.949  -6.181
  646   1HD1  LEU  87          1HD1      LEU  87   2.779   5.630  -8.384
  647   2HD1  LEU  87          2HD1      LEU  87   4.281   4.763  -8.089
  648   3HD1  LEU  87          3HD1      LEU  87   2.990   3.963  -9.012
  649   1HD2  LEU  87          1HD2      LEU  87   1.032   3.071  -7.964
  650   2HD2  LEU  87          2HD2      LEU  87   0.731   3.261  -6.224
  651   3HD2  LEU  87          3HD2      LEU  87   0.550   4.644  -7.322
  652    H    ILE  88           H        ILE  88   6.233   1.691  -7.537
  653    HA   ILE  88           HA       ILE  88   6.967  -0.035  -5.289
  654    HB   ILE  88           HB       ILE  88   8.498  -1.294  -6.849
  655   1HG1  ILE  88          1HG1      ILE  88   6.628  -0.290  -9.051
  656   2HG1  ILE  88          2HG1      ILE  88   8.323   0.168  -8.850
  657   1HG2  ILE  88          1HG2      ILE  88   5.520  -1.785  -7.245
  658   2HG2  ILE  88          2HG2      ILE  88   6.827  -2.988  -7.349
  659   3HG2  ILE  88          3HG2      ILE  88   6.471  -2.221  -5.809
  660   1HD1  ILE  88          1HD1      ILE  88   8.198  -1.501 -10.564
  661   2HD1  ILE  88          2HD1      ILE  88   8.961  -2.249  -9.145
  662   3HD1  ILE  88          3HD1      ILE  88   7.258  -2.594  -9.543
  663    H    GLY  89           H        GLY  89   8.866   0.554  -4.430
  664   1HA   GLY  89          1HA       GLY  89  10.873   1.692  -4.134
  665   2HA   GLY  89          2HA       GLY  89  10.794   2.309  -5.794
  666    H    TYR  90           H        TYR  90  11.529   3.933  -3.692
  667    HA   TYR  90           HA       TYR  90   9.485   5.238  -2.276
  668   1HB   TYR  90          1HB       TYR  90  11.787   5.031  -1.549
  669   2HB   TYR  90          2HB       TYR  90  12.320   6.035  -2.891
  670    HD1  TYR  90           1HD      TYR  90  13.400   7.763  -1.655
  671    HD2  TYR  90           2HD      TYR  90   9.307   6.732  -0.720
  672    HE1  TYR  90           1HE      TYR  90  13.281   9.643  -0.038
  673    HE2  TYR  90           2HE      TYR  90   9.205   8.573   0.882
  674    HH   TYR  90           HH       TYR  90  10.618   9.920   2.232
  675    H    GLN  91           H        GLN  91   7.814   6.194  -3.510
  676    HA   GLN  91           HA       GLN  91   8.578   8.337  -5.397
  677   1HB   GLN  91          1HB       GLN  91   5.716   7.729  -4.655
  678   2HB   GLN  91          2HB       GLN  91   6.369   8.441  -6.094
  679   1HG   GLN  91          1HG       GLN  91   6.505   5.502  -5.337
  680   2HG   GLN  91          2HG       GLN  91   5.476   6.245  -6.555
  681   1HE2  GLN  91          1HE2      GLN  91   8.255   4.437  -6.262
  682   2HE2  GLN  91          2HE2      GLN  91   9.005   4.937  -7.773
  683    HA   PRO  92           HA       PRO  92   7.745  11.226  -1.952
  684   1HB   PRO  92          1HB       PRO  92   7.674  13.599  -3.305
  685   2HB   PRO  92          2HB       PRO  92   9.201  12.706  -3.021
  686   1HG   PRO  92          1HG       PRO  92   7.461  12.688  -5.497
  687   2HG   PRO  92          2HG       PRO  92   9.235  12.910  -5.404
  688   1HD   PRO  92          1HD       PRO  92   8.087  10.483  -5.957
  689   2HD   PRO  92          2HD       PRO  92   9.599  10.616  -5.011
  690    H    LYS  93           H        LYS  93   5.930  12.731  -1.354
  691    HA   LYS  93           HA       LYS  93   3.467  11.539  -1.777
  692   1HB   LYS  93          1HB       LYS  93   4.463  13.941  -0.387
  693   2HB   LYS  93          2HB       LYS  93   2.920  14.261  -1.143
  694   1HG   LYS  93          1HG       LYS  93   2.334  13.450   0.998
  695   2HG   LYS  93          2HG       LYS  93   2.016  12.122  -0.107
  696   1HD   LYS  93          1HD       LYS  93   3.316  10.821   1.179
  697   2HD   LYS  93          2HD       LYS  93   4.712  11.716   0.616
  698   1HE   LYS  93          1HE       LYS  93   3.092  12.186   3.137
  699   2HE   LYS  93          2HE       LYS  93   4.756  11.632   3.024
  700   1HZ   LYS  93          1HZ       LYS  93   3.651  14.310   2.666
  701   2HZ   LYS  93          2HZ       LYS  93   4.778  13.890   3.630
  702   3HZ   LYS  93          3HZ       LYS  93   5.173  13.961   1.996
  703    H    GLU  94           H        GLU  94   4.739  14.440  -3.379
  704    HA   GLU  94           HA       GLU  94   2.546  15.245  -4.891
  705   1HB   GLU  94          1HB       GLU  94   4.646  16.461  -4.678
  706   2HB   GLU  94          2HB       GLU  94   5.536  15.209  -5.506
  707   1HG   GLU  94          1HG       GLU  94   3.226  16.448  -7.007
  708   2HG   GLU  94          2HG       GLU  94   4.606  17.468  -6.684
  709    H    GLN  95           H        GLN  95   4.784  12.521  -5.553
  710    HA   GLN  95           HA       GLN  95   3.832  12.291  -8.295
  711   1HB   GLN  95          1HB       GLN  95   6.260  12.153  -7.322
  712   2HB   GLN  95          2HB       GLN  95   5.825  10.572  -6.741
  713   1HG   GLN  95          1HG       GLN  95   7.006  10.355  -8.817
  714   2HG   GLN  95          2HG       GLN  95   5.345   9.816  -9.027
  715   1HE2  GLN  95          1HE2      GLN  95   5.782  13.464  -9.024
  716   2HE2  GLN  95          2HE2      GLN  95   5.711  13.521 -10.755
  717    H    LEU  96           H        LEU  96   3.960  10.562  -5.284
  718    HA   LEU  96           HA       LEU  96   2.526   8.177  -5.968
  719   1HB   LEU  96          1HB       LEU  96   3.927   8.911  -3.901
  720   2HB   LEU  96          2HB       LEU  96   2.394   9.415  -3.252
  721    HG   LEU  96           HG       LEU  96   2.766   6.618  -4.407
  722   1HD1  LEU  96          1HD1      LEU  96   4.495   6.893  -2.715
  723   2HD1  LEU  96          2HD1      LEU  96   3.302   7.504  -1.550
  724   3HD1  LEU  96          3HD1      LEU  96   3.208   5.822  -2.138
  725   1HD2  LEU  96          1HD2      LEU  96   0.906   6.069  -2.840
  726   2HD2  LEU  96          2HD2      LEU  96   0.845   7.770  -2.334
  727   3HD2  LEU  96          3HD2      LEU  96   0.433   7.313  -4.002
  728    H    GLU  97           H        GLU  97   1.324  11.163  -4.273
  729    HA   GLU  97           HA       GLU  97  -1.395  10.384  -4.433
  730   1HB   GLU  97          1HB       GLU  97  -0.311  12.165  -2.957
  731   2HB   GLU  97          2HB       GLU  97  -0.409  13.246  -4.342
  732   1HG   GLU  97          1HG       GLU  97  -2.797  11.750  -3.163
  733   2HG   GLU  97          2HG       GLU  97  -2.300  13.348  -2.615
  734    H    ALA  98           H        ALA  98   0.745  12.138  -6.739
  735    HA   ALA  98           HA       ALA  98  -1.458  12.902  -8.464
  736   1HB   ALA  98          1HB       ALA  98   0.666  14.000  -8.797
  737   2HB   ALA  98          2HB       ALA  98   1.470  12.452  -9.171
  738   3HB   ALA  98          3HB       ALA  98   0.246  13.121 -10.270
  739    H    GLN  99           H        GLN  99   0.747  10.050  -8.515
  740    HA   GLN  99           HA       GLN  99  -0.535   8.825 -10.755
  741   1HB   GLN  99          1HB       GLN  99   1.735   8.366  -9.792
  742   2HB   GLN  99          2HB       GLN  99   0.990   7.506  -8.466
  743   1HG   GLN  99          1HG       GLN  99   1.913   6.052 -10.307
  744   2HG   GLN  99          2HG       GLN  99   0.243   5.727  -9.870
  745   1HE2  GLN  99          1HE2      GLN  99  -1.461   6.669 -11.389
  746   2HE2  GLN  99          2HE2      GLN  99  -1.004   6.734 -13.104
  747    H    LEU 100           H        LEU 100  -1.317   8.915  -7.443
  748    HA   LEU 100           HA       LEU 100  -3.368   6.787  -7.576
  749   1HB   LEU 100          1HB       LEU 100  -1.580   7.608  -5.615
  750   2HB   LEU 100          2HB       LEU 100  -3.083   8.261  -5.065
  751    HG   LEU 100           HG       LEU 100  -4.001   5.833  -5.379
  752   1HD1  LEU 100          1HD1      LEU 100  -2.244   4.072  -5.394
  753   2HD1  LEU 100          2HD1      LEU 100  -2.078   5.081  -6.844
  754   3HD1  LEU 100          3HD1      LEU 100  -0.979   5.309  -5.480
  755   1HD2  LEU 100          1HD2      LEU 100  -1.773   6.491  -3.400
  756   2HD2  LEU 100          2HD2      LEU 100  -3.530   6.686  -3.164
  757   3HD2  LEU 100          3HD2      LEU 100  -2.818   5.082  -3.265
  758    H    ALA 101           H        ALA 101  -3.362  10.130  -8.101
  759    HA   ALA 101           HA       ALA 101  -5.415  11.203  -6.728
  760   1HB   ALA 101          1HB       ALA 101  -5.546  12.892  -8.517
  761   2HB   ALA 101          2HB       ALA 101  -3.868  12.465  -8.156
  762   3HB   ALA 101          3HB       ALA 101  -4.651  11.818  -9.616
  763    H    ASP 102           H        ASP 102  -5.794   9.092  -9.561
  764    HA   ASP 102           HA       ASP 102  -8.555   9.645 -10.145
  765   1HB   ASP 102          1HB       ASP 102  -8.319   7.413 -11.352
  766   2HB   ASP 102          2HB       ASP 102  -7.047   8.569 -11.758
  767    H    VAL 103           H        VAL 103  -7.200   8.164  -7.352
  768    HA   VAL 103           HA       VAL 103  -9.984   7.333  -6.739
  769    HB   VAL 103           HB       VAL 103  -7.887   5.555  -6.949
  770   1HG1  VAL 103          1HG1      VAL 103  -8.184   6.023  -3.967
  771   2HG1  VAL 103          2HG1      VAL 103  -7.376   4.665  -4.743
  772   3HG1  VAL 103          3HG1      VAL 103  -6.724   6.297  -4.952
  773   1HG2  VAL 103          1HG2      VAL 103 -10.234   5.089  -7.087
  774   2HG2  VAL 103          2HG2      VAL 103  -9.450   3.984  -5.930
  775   3HG2  VAL 103          3HG2      VAL 103 -10.436   5.354  -5.351
  776    H    LEU 104           H        LEU 104  -7.766   9.714  -6.124
  777    HA   LEU 104           HA       LEU 104  -8.817  10.198  -3.408
  778   1HB   LEU 104          1HB       LEU 104  -6.300  10.957  -4.907
  779   2HB   LEU 104          2HB       LEU 104  -6.874  11.994  -3.701
  780    HG   LEU 104           HG       LEU 104  -5.403  10.794  -2.456
  781   1HD1  LEU 104          1HD1      LEU 104  -7.679   8.791  -2.292
  782   2HD1  LEU 104          2HD1      LEU 104  -6.395   9.029  -1.095
  783   3HD1  LEU 104          3HD1      LEU 104  -7.598  10.313  -1.366
  784   1HD2  LEU 104          1HD2      LEU 104  -6.025   8.300  -4.071
  785   2HD2  LEU 104          2HD2      LEU 104  -4.664   9.419  -4.286
  786   3HD2  LEU 104          3HD2      LEU 104  -4.793   8.460  -2.793
  787    H    GLN 105           H        GLN 105  -9.070  11.196  -6.659
  788    HA   GLN 105           HA       GLN 105 -10.342  13.682  -6.488
  789   1HB   GLN 105          2HB       GLN 105  -9.760  12.128  -8.486
  790   2HB   GLN 105          3HB       GLN 105 -11.238  11.311  -8.106
  791   1HG   GLN 105          2HG       GLN 105 -11.682  12.861  -9.881
  792   2HG   GLN 105          3HG       GLN 105 -12.465  13.512  -8.443
  793   1HE2  GLN 105          1HE2      GLN 105  -8.901  13.817  -8.832
  794   2HE2  GLN 105          2HE2      GLN 105  -8.964  15.531  -9.226
  Start of MODEL    5
    1   1H    ALA   1           H        ALA   1 -11.121   4.947   6.962
    2   2H    ALA   1          2HN       ALA   1 -10.034   4.403   5.829
    3   3H    ALA   1          3HN       ALA   1 -10.633   3.369   6.963
    4    HA   ALA   1           HA       ALA   1  -8.759   5.581   7.322
    5   1HB   ALA   1          1HB       ALA   1  -8.819   5.166   9.746
    6   2HB   ALA   1          2HB       ALA   1 -10.395   5.708   9.155
    7   3HB   ALA   1          3HB       ALA   1 -10.127   3.983   9.523
    8    H    THR   2           H        THR   2  -6.732   4.808   8.479
    9    HA   THR   2           HA       THR   2  -5.687   2.593   7.174
   10    HB   THR   2           HB       THR   2  -4.655   3.959   9.688
   11    HG1  THR   2           1HG      THR   2  -3.756   5.447   8.320
   12   1HG2  THR   2          1HG2      THR   2  -3.222   2.078   9.218
   13   2HG2  THR   2          2HG2      THR   2  -3.230   2.390   7.488
   14   3HG2  THR   2          3HG2      THR   2  -2.374   3.487   8.581
   15    H    MET   3           H        MET   3  -4.862   0.564   8.004
   16    HA   MET   3           HA       MET   3  -5.251  -0.061  10.805
   17   1HB   MET   3          1HB       MET   3  -7.274  -1.020   9.467
   18   2HB   MET   3          2HB       MET   3  -6.115  -2.157   8.775
   19   1HG   MET   3          1HG       MET   3  -5.596  -2.975  11.079
   20   2HG   MET   3          2HG       MET   3  -6.675  -1.748  11.742
   21   1HE   MET   3          1HE       MET   3  -6.294  -5.267  10.193
   22   2HE   MET   3          2HE       MET   3  -7.922  -5.649   9.597
   23   3HE   MET   3          3HE       MET   3  -6.937  -4.427   8.762
   24    H    THR   4           H        THR   4  -3.841  -2.227  11.201
   25    HA   THR   4           HA       THR   4  -1.483  -2.311   9.433
   26    HB   THR   4           HB       THR   4  -2.211  -4.214  11.660
   27    HG1  THR   4           1HG      THR   4  -0.930  -1.699  11.872
   28   1HG2  THR   4          1HG2      THR   4  -0.260  -4.876  10.314
   29   2HG2  THR   4          2HG2      THR   4   0.471  -3.274  10.539
   30   3HG2  THR   4          3HG2      THR   4   0.262  -4.371  11.921
   31    H    LEU   5           H        LEU   5  -1.063  -4.294   8.156
   32    HA   LEU   5           HA       LEU   5  -3.505  -5.967   7.663
   33   1HB   LEU   5          1HB       LEU   5  -2.401  -4.302   5.817
   34   2HB   LEU   5          2HB       LEU   5  -1.398  -5.688   5.581
   35    HG   LEU   5           HG       LEU   5  -3.466  -7.091   5.234
   36   1HD1  LEU   5          1HD1      LEU   5  -5.080  -5.368   6.350
   37   2HD1  LEU   5          2HD1      LEU   5  -4.947  -4.456   4.847
   38   3HD1  LEU   5          3HD1      LEU   5  -5.577  -6.091   4.804
   39   1HD2  LEU   5          1HD2      LEU   5  -3.840  -6.184   2.936
   40   2HD2  LEU   5          2HD2      LEU   5  -2.973  -4.699   3.406
   41   3HD2  LEU   5          3HD2      LEU   5  -2.125  -6.255   3.360
   42    H    THR   6           H        THR   6  -2.935  -8.271   6.816
   43    HA   THR   6           HA       THR   6  -0.615  -9.509   7.752
   44    HB   THR   6           HB       THR   6  -3.089 -10.455   9.174
   45    HG1  THR   6           1HG      THR   6  -1.735  -8.107   9.944
   46   1HG2  THR   6          1HG2      THR   6  -0.951 -11.628   9.483
   47   2HG2  THR   6          2HG2      THR   6  -0.182 -10.125  10.049
   48   3HG2  THR   6          3HG2      THR   6  -1.471 -10.893  11.004
   49    H    ASP   7           H        ASP   7  -1.301 -11.876   7.511
   50    HA   ASP   7           HA       ASP   7  -2.034 -12.530   4.902
   51   1HB   ASP   7          1HB       ASP   7  -2.017 -14.818   5.578
   52   2HB   ASP   7          2HB       ASP   7  -0.719 -13.978   6.426
   53    H    ALA   8           H        ALA   8  -4.130 -13.122   7.765
   54    HA   ALA   8           HA       ALA   8  -6.426 -13.816   6.258
   55   1HB   ALA   8          1HB       ALA   8  -6.177 -14.187   8.703
   56   2HB   ALA   8          2HB       ALA   8  -6.286 -12.437   8.986
   57   3HB   ALA   8          3HB       ALA   8  -7.688 -13.314   8.341
   58    H    ASN   9           H        ASN   9  -5.296 -10.632   7.249
   59    HA   ASN   9           HA       ASN   9  -7.674  -9.170   6.505
   60   1HB   ASN   9          1HB       ASN   9  -4.856  -8.251   7.052
   61   2HB   ASN   9          2HB       ASN   9  -6.268  -7.229   6.864
   62   1HD2  ASN   9          1HD2      ASN   9  -4.303  -8.483   9.411
   63   2HD2  ASN   9          2HD2      ASN   9  -5.621  -8.513  10.538
   64    H    PHE  10           H        PHE  10  -4.748 -10.303   4.896
   65    HA   PHE  10           HA       PHE  10  -4.893  -8.643   2.588
   66   1HB   PHE  10          1HB       PHE  10  -3.016 -10.380   3.537
   67   2HB   PHE  10          2HB       PHE  10  -3.771 -11.437   2.361
   68    HD1  PHE  10           1HD      PHE  10  -1.558  -8.634   2.933
   69    HD2  PHE  10           2HD      PHE  10  -3.802 -10.684  -0.120
   70    HE1  PHE  10           1HE      PHE  10  -0.365  -7.366   1.202
   71    HE2  PHE  10           2HE      PHE  10  -2.731  -9.282  -1.845
   72    HZ   PHE  10           HZ       PHE  10  -1.043  -7.604  -1.209
   73    H    GLN  11           H        GLN  11  -7.054 -11.038   3.577
   74    HA   GLN  11           HA       GLN  11  -8.287 -10.720   0.879
   75   1HB   GLN  11          1HB       GLN  11  -7.567 -13.168   1.843
   76   2HB   GLN  11          2HB       GLN  11  -9.141 -13.040   2.620
   77   1HG   GLN  11          1HG       GLN  11  -8.525 -12.680  -0.339
   78   2HG   GLN  11          2HG       GLN  11  -9.190 -14.149   0.397
   79   1HE2  GLN  11          1HE2      GLN  11 -10.305 -12.342  -1.768
   80   2HE2  GLN  11          2HE2      GLN  11 -11.896 -11.921  -1.160
   81    H    GLN  12           H        GLN  12  -8.988 -11.283   4.386
   82    HA   GLN  12           HA       GLN  12 -11.710 -10.590   4.054
   83   1HB   GLN  12          1HB       GLN  12 -10.642 -12.086   5.786
   84   2HB   GLN  12          2HB       GLN  12 -10.058 -10.644   6.622
   85   1HG   GLN  12          1HG       GLN  12 -12.334  -9.947   7.118
   86   2HG   GLN  12          2HG       GLN  12 -13.002 -11.182   6.041
   87   1HE2  GLN  12          1HE2      GLN  12 -13.654 -13.101   7.047
   88   2HE2  GLN  12          2HE2      GLN  12 -13.047 -13.597   8.625
   89    H    ALA  13           H        ALA  13  -9.033  -8.453   4.183
   90    HA   ALA  13           HA       ALA  13 -10.817  -6.243   4.926
   91   1HB   ALA  13          1HB       ALA  13  -9.005  -4.988   5.795
   92   2HB   ALA  13          2HB       ALA  13  -8.936  -6.595   6.545
   93   3HB   ALA  13          3HB       ALA  13  -7.819  -6.164   5.225
   94    H    ILE  14           H        ILE  14  -9.374  -7.705   2.258
   95    HA   ILE  14           HA       ILE  14  -9.751  -5.152   0.760
   96    HB   ILE  14           HB       ILE  14  -9.092  -6.535  -1.260
   97   1HG1  ILE  14          1HG1      ILE  14  -7.656  -8.300   0.717
   98   2HG1  ILE  14          2HG1      ILE  14  -9.100  -8.791  -0.165
   99   1HG2  ILE  14          1HG2      ILE  14  -6.708  -5.958  -0.899
  100   2HG2  ILE  14          2HG2      ILE  14  -7.775  -4.706  -0.281
  101   3HG2  ILE  14          3HG2      ILE  14  -7.004  -5.841   0.849
  102   1HD1  ILE  14          1HD1      ILE  14  -6.403  -8.140  -1.378
  103   2HD1  ILE  14          2HD1      ILE  14  -7.298  -9.667  -1.419
  104   3HD1  ILE  14          3HD1      ILE  14  -7.897  -8.280  -2.335
  105    H    GLN  15           H        GLN  15 -10.585  -8.101  -0.717
  106    HA   GLN  15           HA       GLN  15 -12.385  -8.881  -1.700
  107   1HB   GLN  15          1HB       GLN  15 -13.840 -10.037  -0.201
  108   2HB   GLN  15          2HB       GLN  15 -12.176 -10.076   0.362
  109   1HG   GLN  15          1HG       GLN  15 -12.643  -8.529   2.151
  110   2HG   GLN  15          2HG       GLN  15 -14.234  -8.153   1.483
  111   1HE2  GLN  15          1HE2      GLN  15 -12.705 -11.514   1.931
  112   2HE2  GLN  15          2HE2      GLN  15 -14.026 -11.976   2.994
  113    H    GLY  16           H        GLY  16 -13.055  -5.804  -0.522
  114   1HA   GLY  16          1HA       GLY  16 -15.793  -5.770  -1.724
  115   2HA   GLY  16          2HA       GLY  16 -15.191  -4.692  -0.459
  116    H    ASP  17           H        ASP  17 -16.347  -3.276  -2.311
  117    HA   ASP  17           HA       ASP  17 -14.713  -2.653  -4.625
  118   1HB   ASP  17          1HB       ASP  17 -16.572  -1.189  -5.152
  119   2HB   ASP  17          2HB       ASP  17 -17.205  -2.760  -4.657
  120    H    GLY  18           H        GLY  18 -14.775  -1.656  -1.347
  121   1HA   GLY  18          1HA       GLY  18 -14.404   1.138  -1.563
  122   2HA   GLY  18          2HA       GLY  18 -13.897   0.139  -0.191
  123    HA   PRO  19           HA       PRO  19 -10.116   1.368  -2.882
  124   1HB   PRO  19          1HB       PRO  19  -9.346   3.829  -1.987
  125   2HB   PRO  19          2HB       PRO  19 -10.504   3.598  -3.327
  126   1HG   PRO  19          1HG       PRO  19 -11.126   4.170  -0.421
  127   2HG   PRO  19          2HG       PRO  19 -11.828   4.940  -1.871
  128   1HD   PRO  19          1HD       PRO  19 -13.046   2.894  -0.496
  129   2HD   PRO  19          2HD       PRO  19 -13.231   3.095  -2.262
  130    H    VAL  20           H        VAL  20  -9.171  -0.327  -1.765
  131    HA   VAL  20           HA       VAL  20  -7.943   0.348   0.851
  132    HB   VAL  20           HB       VAL  20  -8.515  -2.331  -0.445
  133   1HG1  VAL  20          1HG1      VAL  20  -6.368  -2.592   0.649
  134   2HG1  VAL  20          2HG1      VAL  20  -6.923  -1.699   2.080
  135   3HG1  VAL  20          3HG1      VAL  20  -7.590  -3.300   1.713
  136   1HG2  VAL  20          1HG2      VAL  20  -9.508  -1.102   2.157
  137   2HG2  VAL  20          2HG2      VAL  20 -10.457  -1.270   0.664
  138   3HG2  VAL  20          3HG2      VAL  20  -9.921  -2.707   1.528
  139    H    LEU  21           H        LEU  21  -5.688   0.361   0.949
  140    HA   LEU  21           HA       LEU  21  -4.236  -0.587  -1.422
  141   1HB   LEU  21          1HB       LEU  21  -2.592   1.346  -1.159
  142   2HB   LEU  21          2HB       LEU  21  -4.049   1.608  -2.081
  143    HG   LEU  21           HG       LEU  21  -4.213   2.323   0.815
  144   1HD1  LEU  21          1HD1      LEU  21  -3.145   4.483   0.509
  145   2HD1  LEU  21          2HD1      LEU  21  -1.985   3.167   0.255
  146   3HD1  LEU  21          3HD1      LEU  21  -2.669   4.043  -1.142
  147   1HD2  LEU  21          1HD2      LEU  21  -5.108   3.778  -1.701
  148   2HD2  LEU  21          2HD2      LEU  21  -6.127   2.686  -0.742
  149   3HD2  LEU  21          3HD2      LEU  21  -5.524   4.187  -0.034
  150    H    VAL  22           H        VAL  22  -2.361  -1.519  -1.083
  151    HA   VAL  22           HA       VAL  22  -1.922  -2.464   1.694
  152    HB   VAL  22           HB       VAL  22  -1.408  -3.599  -1.097
  153   1HG1  VAL  22          1HG1      VAL  22  -0.852  -4.965   1.558
  154   2HG1  VAL  22          2HG1      VAL  22  -0.590  -5.598  -0.091
  155   3HG1  VAL  22          3HG1      VAL  22   0.405  -4.288   0.496
  156   1HG2  VAL  22          1HG2      VAL  22  -3.317  -4.461   1.124
  157   2HG2  VAL  22          2HG2      VAL  22  -3.770  -3.737  -0.420
  158   3HG2  VAL  22          3HG2      VAL  22  -3.043  -5.352  -0.385
  159    H    ASP  23           H        ASP  23  -0.088  -1.659   2.664
  160    HA   ASP  23           HA       ASP  23   2.001  -0.482   0.928
  161   1HB   ASP  23          1HB       ASP  23   0.589   0.448   3.215
  162   2HB   ASP  23          2HB       ASP  23   2.215   0.089   3.764
  163    H    PHE  24           H        PHE  24   3.238  -2.203   0.360
  164    HA   PHE  24           HA       PHE  24   4.028  -4.284   2.281
  165   1HB   PHE  24          1HB       PHE  24   4.815  -3.719  -0.600
  166   2HB   PHE  24          2HB       PHE  24   5.374  -5.084   0.322
  167    HD1  PHE  24           1HD      PHE  24   2.963  -4.094  -2.025
  168    HD2  PHE  24           2HD      PHE  24   3.544  -6.605   1.433
  169    HE1  PHE  24           1HE      PHE  24   1.388  -5.747  -2.965
  170    HE2  PHE  24           2HE      PHE  24   1.998  -8.278   0.471
  171    HZ   PHE  24           HZ       PHE  24   1.026  -7.928  -1.752
  172    H    TRP  25           H        TRP  25   5.595  -3.842   3.698
  173    HA   TRP  25           HA       TRP  25   8.058  -2.560   2.729
  174   1HB   TRP  25          1HB       TRP  25   8.318  -1.198   4.655
  175   2HB   TRP  25          2HB       TRP  25   6.718  -0.841   4.031
  176    HD1  TRP  25           HD       TRP  25   4.674  -2.262   5.396
  177    HE1  TRP  25           1HE      TRP  25   4.459  -2.842   7.885
  178    HE3  TRP  25           3HE      TRP  25   9.478  -1.293   6.871
  179    HZ2  TRP  25           2HZ      TRP  25   6.246  -3.111  10.187
  180    HZ3  TRP  25           3HZ      TRP  25  10.183  -1.696   9.204
  181    HH2  TRP  25           HH       TRP  25   8.583  -2.637  10.859
  182    H    ALA  26           H        ALA  26   9.664  -3.053   4.925
  183    HA   ALA  26           HA       ALA  26   9.020  -5.388   6.396
  184   1HB   ALA  26          1HB       ALA  26  10.910  -6.788   5.594
  185   2HB   ALA  26          2HB       ALA  26   9.753  -6.528   4.289
  186   3HB   ALA  26          3HB       ALA  26  11.263  -5.588   4.325
  187    H    ALA  27           H        ALA  27  10.968  -5.835   7.862
  188    HA   ALA  27           HA       ALA  27  11.800  -3.365   8.970
  189   1HB   ALA  27          1HB       ALA  27  13.007  -4.761  10.592
  190   2HB   ALA  27          2HB       ALA  27  11.377  -5.384  10.284
  191   3HB   ALA  27          3HB       ALA  27  12.788  -6.184   9.547
  192    H    TRP  28           H        TRP  28  13.253  -4.902   6.292
  193    HA   TRP  28           HA       TRP  28  15.955  -3.892   7.008
  194   1HB   TRP  28          1HB       TRP  28  16.842  -5.697   6.142
  195   2HB   TRP  28          2HB       TRP  28  15.250  -6.398   6.276
  196    HD1  TRP  28           HD       TRP  28  17.776  -5.020   3.820
  197    HE1  TRP  28           1HE      TRP  28  17.134  -5.499   1.397
  198    HE3  TRP  28           3HE      TRP  28  13.205  -7.213   4.603
  199    HZ2  TRP  28           2HZ      TRP  28  14.788  -6.379  -0.045
  200    HZ3  TRP  28           3HZ      TRP  28  11.765  -7.815   2.658
  201    HH2  TRP  28           HH       TRP  28  12.539  -7.330   0.351
  202    H    CYS  29           H        CYS  29  13.368  -3.180   4.769
  203    HA   CYS  29           HA       CYS  29  15.010  -2.818   2.472
  204   1HB   CYS  29          1HB       CYS  29  12.841  -2.026   1.437
  205   2HB   CYS  29          2HB       CYS  29  12.971  -3.656   2.048
  206    H    GLY  30           H        GLY  30  16.138  -1.084   4.196
  207   1HA   GLY  30          1HA       GLY  30  16.627   1.126   4.760
  208   2HA   GLY  30          2HA       GLY  30  17.021   1.084   3.053
  209    HA   PRO  31           HA       PRO  31  14.440   4.637   2.604
  210   1HB   PRO  31          1HB       PRO  31  13.357   4.336   0.064
  211   2HB   PRO  31          2HB       PRO  31  15.036   4.860   0.420
  212   1HG   PRO  31          1HG       PRO  31  14.046   2.080  -0.269
  213   2HG   PRO  31          2HG       PRO  31  15.462   2.954  -0.943
  214   1HD   PRO  31          1HD       PRO  31  15.770   1.136   1.025
  215   2HD   PRO  31          2HD       PRO  31  16.704   2.661   1.065
  216    H    CYS  32           H        CYS  32  12.840   1.476   2.261
  217    HA   CYS  32           HA       CYS  32  10.142   2.452   2.306
  218   1HB   CYS  32          1HB       CYS  32   9.503   0.313   3.106
  219   2HB   CYS  32          2HB       CYS  32  10.802   0.083   1.942
  220    H    ARG  33           H        ARG  33  12.617   2.256   4.832
  221    HA   ARG  33           HA       ARG  33  10.852   2.775   7.058
  222   1HB   ARG  33          1HB       ARG  33  13.125   1.599   6.996
  223   2HB   ARG  33          2HB       ARG  33  13.842   3.210   6.868
  224   1HG   ARG  33          1HG       ARG  33  12.951   3.830   9.055
  225   2HG   ARG  33          2HG       ARG  33  12.046   2.299   9.154
  226   1HD   ARG  33          1HD       ARG  33  14.168   1.031   9.041
  227   2HD   ARG  33          2HD       ARG  33  15.081   2.552   8.943
  228    HE   ARG  33           HE       ARG  33  13.522   2.750  11.230
  229   1HH1  ARG  33          2HH2      ARG  33  16.062   0.580  10.087
  230   2HH1  ARG  33          1HH2      ARG  33  16.687   0.200  11.653
  231   1HH2  ARG  33          2HH1      ARG  33  14.320   2.252  13.349
  232   2HH2  ARG  33          1HH1      ARG  33  15.657   1.183  13.551
  233    H    MET  34           H        MET  34  12.257   4.821   4.580
  234    HA   MET  34           HA       MET  34  11.702   7.238   6.161
  235   1HB   MET  34          1HB       MET  34  13.277   8.337   4.987
  236   2HB   MET  34          2HB       MET  34  13.922   6.717   4.783
  237   1HG   MET  34          1HG       MET  34  12.577   6.709   2.543
  238   2HG   MET  34          2HG       MET  34  12.446   8.445   2.794
  239   1HE   MET  34          1HE       MET  34  13.645   7.090   0.220
  240   2HE   MET  34          2HE       MET  34  13.576   8.854   0.440
  241   3HE   MET  34          3HE       MET  34  15.093   8.082  -0.073
  242    H    MET  35           H        MET  35  10.429   5.228   3.684
  243    HA   MET  35           HA       MET  35   8.491   7.088   2.646
  244   1HB   MET  35          1HB       MET  35   9.416   4.767   1.649
  245   2HB   MET  35          2HB       MET  35   8.084   4.092   2.588
  246   1HG   MET  35          1HG       MET  35   6.508   5.599   1.444
  247   2HG   MET  35          2HG       MET  35   7.836   6.360   0.561
  248   1HE   MET  35          1HE       MET  35   5.736   4.324  -2.111
  249   2HE   MET  35          2HE       MET  35   5.190   5.242  -0.690
  250   3HE   MET  35          3HE       MET  35   6.442   5.924  -1.750
  251    H    ALA  36           H        ALA  36   8.598   4.571   5.237
  252    HA   ALA  36           HA       ALA  36   6.004   4.603   6.086
  253   1HB   ALA  36          1HB       ALA  36   8.498   4.553   7.831
  254   2HB   ALA  36          2HB       ALA  36   6.863   4.094   8.355
  255   3HB   ALA  36          3HB       ALA  36   7.680   3.175   7.075
  256    HA   PRO  37           HA       PRO  37   6.161   8.723   8.440
  257   1HB   PRO  37          1HB       PRO  37   8.222  10.513   8.082
  258   2HB   PRO  37          2HB       PRO  37   8.172   9.283   9.382
  259   1HG   PRO  37          1HG       PRO  37   9.592   9.140   6.727
  260   2HG   PRO  37          2HG       PRO  37  10.228   8.708   8.343
  261   1HD   PRO  37          1HD       PRO  37   9.278   6.795   6.668
  262   2HD   PRO  37          2HD       PRO  37   8.987   6.710   8.420
  263    H    VAL  38           H        VAL  38   7.591   8.706   5.036
  264    HA   VAL  38           HA       VAL  38   6.154  11.155   4.454
  265    HB   VAL  38           HB       VAL  38   8.087   9.799   3.108
  266   1HG1  VAL  38          1HG1      VAL  38   6.536   8.113   2.119
  267   2HG1  VAL  38          2HG1      VAL  38   5.619   9.421   1.356
  268   3HG1  VAL  38          3HG1      VAL  38   7.310   9.131   0.907
  269   1HG2  VAL  38          1HG2      VAL  38   6.137  11.841   1.973
  270   2HG2  VAL  38          2HG2      VAL  38   7.583  12.183   2.946
  271   3HG2  VAL  38          3HG2      VAL  38   7.760  11.480   1.332
  272    H    LEU  39           H        LEU  39   5.223   7.780   4.551
  273    HA   LEU  39           HA       LEU  39   2.643   8.073   3.427
  274   1HB   LEU  39          1HB       LEU  39   4.194   6.001   4.920
  275   2HB   LEU  39          2HB       LEU  39   2.475   5.834   4.964
  276    HG   LEU  39           HG       LEU  39   2.262   5.191   2.817
  277   1HD1  LEU  39          1HD1      LEU  39   3.748   5.709   0.914
  278   2HD1  LEU  39          2HD1      LEU  39   2.979   7.135   1.578
  279   3HD1  LEU  39          3HD1      LEU  39   4.684   6.801   1.961
  280   1HD2  LEU  39          1HD2      LEU  39   4.183   3.761   2.151
  281   2HD2  LEU  39          2HD2      LEU  39   5.218   4.592   3.321
  282   3HD2  LEU  39          3HD2      LEU  39   3.828   3.626   3.874
  283    H    GLU  40           H        GLU  40   3.855   9.139   6.495
  284    HA   GLU  40           HA       GLU  40   1.223   8.967   7.778
  285   1HB   GLU  40          1HB       GLU  40   3.644   8.961   8.859
  286   2HB   GLU  40          2HB       GLU  40   3.521  10.705   8.728
  287   1HG   GLU  40          1HG       GLU  40   2.735  10.074  10.917
  288   2HG   GLU  40          2HG       GLU  40   1.297  10.527   9.995
  289    H    GLU  41           H        GLU  41   3.278  11.389   6.128
  290    HA   GLU  41           HA       GLU  41   1.326  13.513   6.116
  291   1HB   GLU  41          1HB       GLU  41   3.908  13.551   5.641
  292   2HB   GLU  41          2HB       GLU  41   3.462  13.044   4.017
  293   1HG   GLU  41          1HG       GLU  41   1.790  15.178   4.271
  294   2HG   GLU  41          2HG       GLU  41   3.018  15.667   5.433
  295    H    PHE  42           H        PHE  42   1.592  10.530   4.399
  296    HA   PHE  42           HA       PHE  42  -0.386  11.260   2.339
  297   1HB   PHE  42          1HB       PHE  42   1.508   9.601   1.951
  298   2HB   PHE  42          2HB       PHE  42   0.681   8.540   3.095
  299    HD1  PHE  42           1HD      PHE  42   0.218   6.647   1.811
  300    HD2  PHE  42           2HD      PHE  42  -0.890  10.556   0.352
  301    HE1  PHE  42           1HE      PHE  42  -1.111   5.612   0.014
  302    HE2  PHE  42           2HE      PHE  42  -2.178   9.478  -1.484
  303    HZ   PHE  42           HZ       PHE  42  -2.384   7.080  -1.612
  304    H    ALA  43           H        ALA  43  -0.341   9.292   5.361
  305    HA   ALA  43           HA       ALA  43  -2.946   8.396   5.341
  306   1HB   ALA  43          1HB       ALA  43  -1.428   9.421   7.768
  307   2HB   ALA  43          2HB       ALA  43  -2.812   8.319   7.772
  308   3HB   ALA  43          3HB       ALA  43  -1.273   7.802   7.055
  309    H    GLU  44           H        GLU  44  -1.837  11.580   6.508
  310    HA   GLU  44           HA       GLU  44  -4.289  12.637   7.356
  311   1HB   GLU  44          1HB       GLU  44  -2.032  13.620   7.724
  312   2HB   GLU  44          2HB       GLU  44  -1.976  14.112   6.024
  313   1HG   GLU  44          1HG       GLU  44  -4.001  15.537   6.394
  314   2HG   GLU  44          2HG       GLU  44  -4.036  15.030   8.086
  315    H    ALA  45           H        ALA  45  -2.936  12.574   4.064
  316    HA   ALA  45           HA       ALA  45  -4.796  14.366   2.842
  317   1HB   ALA  45          1HB       ALA  45  -3.225  12.097   1.540
  318   2HB   ALA  45          2HB       ALA  45  -3.888  13.525   0.738
  319   3HB   ALA  45          3HB       ALA  45  -2.558  13.706   1.907
  320    H    HIS  46           H        HIS  46  -5.293  11.175   3.976
  321    HA   HIS  46           HA       HIS  46  -7.944  11.030   2.766
  322   1HB   HIS  46          1HB       HIS  46  -7.427   8.785   1.775
  323   2HB   HIS  46          2HB       HIS  46  -6.602  10.124   1.001
  324    HD1  HIS  46           1HD      HIS  46  -5.618   7.882   3.978
  325    HD2  HIS  46           2HD      HIS  46  -4.244   9.404   0.298
  326    HE1  HIS  46           1HE      HIS  46  -3.183   6.935   3.608
  327    HE2  HIS  46           2HE      HIS  46  -2.422   7.887   1.324
  328    H    ALA  47           H        ALA  47  -7.346  11.500   5.379
  329    HA   ALA  47           HA       ALA  47  -6.637   9.566   7.093
  330   1HB   ALA  47          1HB       ALA  47  -7.139  11.879   7.734
  331   2HB   ALA  47          2HB       ALA  47  -8.883  11.572   7.561
  332   3HB   ALA  47          3HB       ALA  47  -7.949  10.729   8.818
  333    H    ASP  48           H        ASP  48 -10.070   9.974   6.091
  334    HA   ASP  48           HA       ASP  48 -10.413   7.053   6.567
  335   1HB   ASP  48          1HB       ASP  48 -11.605   8.549   8.216
  336   2HB   ASP  48          2HB       ASP  48 -12.601   9.121   6.873
  337    H    LYS  49           H        LYS  49 -10.285   9.382   4.190
  338    HA   LYS  49           HA       LYS  49 -12.310   8.722   2.340
  339   1HB   LYS  49          1HB       LYS  49 -10.737  10.670   2.223
  340   2HB   LYS  49          2HB       LYS  49  -9.433   9.547   1.871
  341   1HG   LYS  49          1HG       LYS  49 -10.817   8.884  -0.235
  342   2HG   LYS  49          2HG       LYS  49 -11.728  10.366   0.077
  343   1HD   LYS  49          1HD       LYS  49  -8.696  10.158  -0.300
  344   2HD   LYS  49          2HD       LYS  49  -9.839  10.568  -1.571
  345   1HE   LYS  49          1HE       LYS  49 -10.431  12.634  -0.558
  346   2HE   LYS  49          2HE       LYS  49  -9.605  12.240   0.962
  347   1HZ   LYS  49          1HZ       LYS  49  -8.415  13.759  -0.634
  348   2HZ   LYS  49          2HZ       LYS  49  -7.523  12.521  -0.049
  349   3HZ   LYS  49          3HZ       LYS  49  -8.169  12.459  -1.601
  350    H    VAL  50           H        VAL  50  -9.392   6.920   3.213
  351    HA   VAL  50           HA       VAL  50 -10.211   4.734   1.438
  352    HB   VAL  50           HB       VAL  50  -7.989   4.350   0.571
  353   1HG1  VAL  50          1HG1      VAL  50  -8.540   7.291   0.089
  354   2HG1  VAL  50          2HG1      VAL  50  -7.705   6.135  -0.976
  355   3HG1  VAL  50          3HG1      VAL  50  -9.438   5.974  -0.681
  356   1HG2  VAL  50          1HG2      VAL  50  -7.146   6.626   2.361
  357   2HG2  VAL  50          2HG2      VAL  50  -6.472   4.998   2.246
  358   3HG2  VAL  50          3HG2      VAL  50  -6.177   6.161   0.947
  359    H    THR  51           H        THR  51  -8.736   2.754   2.004
  360    HA   THR  51           HA       THR  51  -7.882   2.830   4.789
  361    HB   THR  51           HB       THR  51  -9.543   0.844   3.393
  362    HG1  THR  51           1HG      THR  51  -9.281   1.753   6.072
  363   1HG2  THR  51          1HG2      THR  51  -7.592   0.058   5.602
  364   2HG2  THR  51          2HG2      THR  51  -9.020  -0.894   5.112
  365   3HG2  THR  51          3HG2      THR  51  -7.707  -0.645   3.974
  366    H    VAL  52           H        VAL  52  -5.775   3.351   4.502
  367    HA   VAL  52           HA       VAL  52  -4.196   1.620   2.714
  368    HB   VAL  52           HB       VAL  52  -3.421   3.777   2.738
  369   1HG1  VAL  52          1HG1      VAL  52  -4.271   4.760   4.804
  370   2HG1  VAL  52          2HG1      VAL  52  -3.175   3.738   5.751
  371   3HG1  VAL  52          3HG1      VAL  52  -2.515   4.997   4.710
  372   1HG2  VAL  52          1HG2      VAL  52  -1.095   3.561   3.305
  373   2HG2  VAL  52          2HG2      VAL  52  -1.448   2.253   4.444
  374   3HG2  VAL  52          3HG2      VAL  52  -1.697   2.019   2.695
  375    H    ALA  53           H        ALA  53  -2.843   0.089   3.458
  376    HA   ALA  53           HA       ALA  53  -2.903  -0.461   6.322
  377   1HB   ALA  53          1HB       ALA  53  -4.936  -1.596   5.360
  378   2HB   ALA  53          2HB       ALA  53  -3.845  -2.578   4.359
  379   3HB   ALA  53          3HB       ALA  53  -3.811  -2.694   6.151
  380    H    LYS  54           H        LYS  54  -0.865  -0.631   6.863
  381    HA   LYS  54           HA       LYS  54   1.068  -1.565   4.855
  382   1HB   LYS  54          1HB       LYS  54   2.801  -0.660   6.302
  383   2HB   LYS  54          2HB       LYS  54   1.573   0.535   5.895
  384   1HG   LYS  54          1HG       LYS  54   0.537   0.211   8.156
  385   2HG   LYS  54          2HG       LYS  54   1.884  -0.875   8.575
  386   1HD   LYS  54          1HD       LYS  54   3.502   0.947   8.187
  387   2HD   LYS  54          2HD       LYS  54   2.200   2.015   7.625
  388   1HE   LYS  54          1HE       LYS  54   1.126   1.827   9.888
  389   2HE   LYS  54          2HE       LYS  54   2.531   0.901  10.440
  390   1HZ   LYS  54          1HZ       LYS  54   3.904   2.833   9.930
  391   2HZ   LYS  54          2HZ       LYS  54   2.589   3.686   9.428
  392   3HZ   LYS  54          3HZ       LYS  54   2.722   3.244  10.996
  393    H    LEU  55           H        LEU  55   2.470  -3.294   5.100
  394    HA   LEU  55           HA       LEU  55   2.477  -4.793   7.588
  395   1HB   LEU  55          1HB       LEU  55   1.755  -6.873   6.802
  396   2HB   LEU  55          2HB       LEU  55   0.506  -5.721   6.430
  397    HG   LEU  55           HG       LEU  55   2.516  -6.917   4.454
  398   1HD1  LEU  55          1HD1      LEU  55   0.821  -8.491   5.361
  399   2HD1  LEU  55          2HD1      LEU  55  -0.465  -7.464   4.722
  400   3HD1  LEU  55          3HD1      LEU  55   0.689  -8.233   3.615
  401   1HD2  LEU  55          1HD2      LEU  55   1.879  -4.758   3.556
  402   2HD2  LEU  55          2HD2      LEU  55   1.018  -6.000   2.667
  403   3HD2  LEU  55          3HD2      LEU  55   0.162  -5.049   3.905
  404    H    ASN  56           H        ASN  56   4.004  -6.473   7.648
  405    HA   ASN  56           HA       ASN  56   6.471  -5.945   6.208
  406   1HB   ASN  56          1HB       ASN  56   6.543  -6.398   8.604
  407   2HB   ASN  56          2HB       ASN  56   5.629  -7.902   8.391
  408   1HD2  ASN  56          1HD2      ASN  56   7.258  -9.158   9.418
  409   2HD2  ASN  56          2HD2      ASN  56   8.796  -9.462   8.592
  410    H    VAL  57           H        VAL  57   6.548  -6.688   4.169
  411    HA   VAL  57           HA       VAL  57   4.827  -8.657   3.114
  412    HB   VAL  57           HB       VAL  57   5.932  -6.753   1.969
  413   1HG1  VAL  57          1HG1      VAL  57   8.331  -8.645   1.763
  414   2HG1  VAL  57          2HG1      VAL  57   8.113  -7.177   0.837
  415   3HG1  VAL  57          3HG1      VAL  57   8.282  -7.081   2.603
  416   1HG2  VAL  57          1HG2      VAL  57   5.896  -7.712  -0.168
  417   2HG2  VAL  57          2HG2      VAL  57   6.321  -9.329   0.438
  418   3HG2  VAL  57          3HG2      VAL  57   4.723  -8.638   0.787
  419    H    ASP  58           H        ASP  58   8.018  -9.000   4.557
  420    HA   ASP  58           HA       ASP  58   8.804 -11.529   3.474
  421   1HB   ASP  58          1HB       ASP  58  10.226  -9.843   4.651
  422   2HB   ASP  58          2HB       ASP  58   9.406 -10.257   6.151
  423    H    GLU  59           H        GLU  59   6.710 -10.531   6.019
  424    HA   GLU  59           HA       GLU  59   6.424 -13.186   7.271
  425   1HB   GLU  59          1HB       GLU  59   6.959 -11.329   8.605
  426   2HB   GLU  59          2HB       GLU  59   5.683 -10.338   7.889
  427   1HG   GLU  59          1HG       GLU  59   3.973 -11.677   9.016
  428   2HG   GLU  59          2HG       GLU  59   5.235 -12.682   9.745
  429    H    ASN  60           H        ASN  60   4.694 -11.066   5.110
  430    HA   ASN  60           HA       ASN  60   2.347 -12.921   5.266
  431   1HB   ASN  60          1HB       ASN  60   1.548 -10.700   5.517
  432   2HB   ASN  60          2HB       ASN  60   2.405 -10.162   4.043
  433   1HD2  ASN  60          1HD2      ASN  60   0.978 -10.169   2.187
  434   2HD2  ASN  60          2HD2      ASN  60  -0.177 -11.444   1.910
  435    HA   PRO  61           HA       PRO  61   4.188 -14.219   1.279
  436   1HB   PRO  61          1HB       PRO  61   3.635 -16.889   1.502
  437   2HB   PRO  61          2HB       PRO  61   5.088 -16.125   2.219
  438   1HG   PRO  61          1HG       PRO  61   2.454 -16.773   3.587
  439   2HG   PRO  61          2HG       PRO  61   4.116 -17.146   4.153
  440   1HD   PRO  61          1HD       PRO  61   2.739 -14.963   5.041
  441   2HD   PRO  61          2HD       PRO  61   4.502 -14.897   4.783
  442    H    GLU  62           H        GLU  62   1.012 -14.321   2.829
  443    HA   GLU  62           HA       GLU  62  -0.421 -15.761   0.855
  444   1HB   GLU  62          1HB       GLU  62  -1.039 -15.176   3.306
  445   2HB   GLU  62          2HB       GLU  62  -1.660 -13.655   2.653
  446   1HG   GLU  62          1HG       GLU  62  -2.536 -16.454   1.837
  447   2HG   GLU  62          2HG       GLU  62  -3.409 -15.384   2.929
  448    H    THR  63           H        THR  63  -0.727 -15.177  -1.132
  449    HA   THR  63           HA       THR  63  -1.038 -14.167  -3.045
  450    HB   THR  63           HB       THR  63  -2.641 -12.408  -1.199
  451    HG1  THR  63           1HG      THR  63  -3.329 -14.525  -1.432
  452   1HG2  THR  63          1HG2      THR  63  -2.656 -12.342  -4.243
  453   2HG2  THR  63          2HG2      THR  63  -3.875 -11.609  -3.172
  454   3HG2  THR  63          3HG2      THR  63  -2.208 -11.006  -3.166
  455    H    THR  64           H        THR  64   0.814 -12.448  -0.802
  456    HA   THR  64           HA       THR  64   2.310 -10.648  -2.384
  457    HB   THR  64           HB       THR  64   3.164 -12.730  -0.343
  458    HG1  THR  64           1HG      THR  64   2.862 -11.271   1.130
  459   1HG2  THR  64          1HG2      THR  64   5.165 -11.895  -1.559
  460   2HG2  THR  64          2HG2      THR  64   4.700 -10.241  -1.100
  461   3HG2  THR  64          3HG2      THR  64   5.128 -11.428   0.145
  462    H    SER  65           H        SER  65   2.693 -14.213  -1.964
  463    HA   SER  65           HA       SER  65   4.631 -14.431  -4.083
  464   1HB   SER  65          1HB       SER  65   4.498 -15.969  -2.114
  465   2HB   SER  65          2HB       SER  65   2.970 -16.611  -2.754
  466    HG   SER  65           HG       SER  65   4.309 -16.912  -4.762
  467    H    GLN  66           H        GLN  66   1.259 -13.936  -4.351
  468    HA   GLN  66           HA       GLN  66   1.010 -15.492  -6.840
  469   1HB   GLN  66          1HB       GLN  66  -0.775 -15.497  -5.138
  470   2HB   GLN  66          2HB       GLN  66  -0.998 -13.768  -5.327
  471   1HG   GLN  66          1HG       GLN  66  -1.229 -15.586  -7.747
  472   2HG   GLN  66          2HG       GLN  66  -2.565 -15.447  -6.604
  473   1HE2  GLN  66          1HE2      GLN  66  -3.349 -13.151  -6.080
  474   2HE2  GLN  66          2HE2      GLN  66  -3.207 -11.962  -7.368
  475    H    PHE  67           H        PHE  67   0.883 -12.008  -5.654
  476    HA   PHE  67           HA       PHE  67   0.691 -11.167  -8.460
  477   1HB   PHE  67          1HB       PHE  67   0.658  -9.682  -5.823
  478   2HB   PHE  67          2HB       PHE  67   0.686  -8.847  -7.368
  479    HD1  PHE  67           1HD      PHE  67  -1.469  -9.739  -4.867
  480    HD2  PHE  67           2HD      PHE  67  -1.148  -9.921  -9.159
  481    HE1  PHE  67           1HE      PHE  67  -3.949  -9.783  -5.057
  482    HE2  PHE  67           2HE      PHE  67  -3.613  -9.949  -9.346
  483    HZ   PHE  67           HZ       PHE  67  -5.027  -9.871  -7.291
  484    H    GLY  68           H        GLY  68   3.235 -12.489  -7.321
  485   1HA   GLY  68          1HA       GLY  68   5.483 -12.360  -7.812
  486   2HA   GLY  68          2HA       GLY  68   5.062 -11.097  -8.982
  487    H    ILE  69           H        ILE  69   4.466 -10.895  -5.473
  488    HA   ILE  69           HA       ILE  69   5.657  -8.255  -5.422
  489    HB   ILE  69           HB       ILE  69   4.404  -9.966  -3.270
  490   1HG1  ILE  69          1HG1      ILE  69   2.783  -9.604  -5.044
  491   2HG1  ILE  69          2HG1      ILE  69   2.333  -8.724  -3.605
  492   1HG2  ILE  69          1HG2      ILE  69   4.818  -6.963  -3.239
  493   2HG2  ILE  69          2HG2      ILE  69   4.006  -7.966  -2.012
  494   3HG2  ILE  69          3HG2      ILE  69   5.728  -8.169  -2.305
  495   1HD1  ILE  69          1HD1      ILE  69   1.933  -7.409  -5.627
  496   2HD1  ILE  69          2HD1      ILE  69   3.124  -6.609  -4.596
  497   3HD1  ILE  69          3HD1      ILE  69   3.651  -7.477  -6.055
  498    H    MET  70           H        MET  70   7.743  -8.949  -6.046
  499    HA   MET  70           HA       MET  70   9.442 -10.135  -3.914
  500   1HB   MET  70          1HB       MET  70  10.859 -10.894  -5.674
  501   2HB   MET  70          2HB       MET  70   9.192 -11.371  -6.015
  502   1HG   MET  70          1HG       MET  70   9.019  -9.450  -7.618
  503   2HG   MET  70          2HG       MET  70  10.715  -9.071  -7.310
  504   1HE   MET  70          1HE       MET  70  10.644 -10.477 -10.979
  505   2HE   MET  70          2HE       MET  70   9.342  -9.566 -10.178
  506   3HE   MET  70          3HE       MET  70  11.041  -9.088  -9.942
  507    H    SER  71           H        SER  71   8.667  -7.152  -4.436
  508    HA   SER  71           HA       SER  71  11.211  -6.170  -3.502
  509   1HB   SER  71          1HB       SER  71  10.146  -5.193  -6.187
  510   2HB   SER  71          2HB       SER  71  11.360  -4.320  -5.226
  511    HG   SER  71           HG       SER  71  11.874  -7.025  -5.568
  512    H    ILE  72           H        ILE  72  11.024  -3.866  -2.706
  513    HA   ILE  72           HA       ILE  72   8.476  -2.809  -2.135
  514    HB   ILE  72           HB       ILE  72   9.080  -2.995   0.348
  515   1HG1  ILE  72          1HG1      ILE  72  10.897  -5.252  -0.581
  516   2HG1  ILE  72          2HG1      ILE  72  11.385  -3.724   0.158
  517   1HG2  ILE  72          1HG2      ILE  72   7.247  -4.240  -0.876
  518   2HG2  ILE  72          2HG2      ILE  72   8.327  -5.646  -0.899
  519   3HG2  ILE  72          3HG2      ILE  72   7.794  -4.937   0.648
  520   1HD1  ILE  72          1HD1      ILE  72   9.764  -4.499   2.111
  521   2HD1  ILE  72          2HD1      ILE  72  10.047  -6.103   1.396
  522   3HD1  ILE  72          3HD1      ILE  72  11.403  -5.147   1.978
  523    HA   PRO  73           HA       PRO  73   8.200  -1.154  -0.023
  524   1HB   PRO  73          1HB       PRO  73   7.634   1.475  -0.284
  525   2HB   PRO  73          2HB       PRO  73   8.713   0.817   0.969
  526   1HG   PRO  73          1HG       PRO  73   9.471   2.093  -1.665
  527   2HG   PRO  73          2HG       PRO  73  10.210   2.372  -0.061
  528   1HD   PRO  73          1HD       PRO  73  11.298   0.682  -1.931
  529   2HD   PRO  73          2HD       PRO  73  11.426   0.348  -0.183
  530    H    THR  74           H        THR  74   6.461  -1.803  -1.032
  531    HA   THR  74           HA       THR  74   5.744  -0.720  -3.725
  532    HB   THR  74           HB       THR  74   5.544  -3.572  -2.686
  533    HG1  THR  74           1HG      THR  74   7.300  -3.872  -3.841
  534   1HG2  THR  74          1HG2      THR  74   4.786  -4.133  -4.996
  535   2HG2  THR  74          2HG2      THR  74   3.603  -3.152  -4.118
  536   3HG2  THR  74          3HG2      THR  74   4.629  -2.398  -5.351
  537    H    LEU  75           H        LEU  75   3.627  -0.108  -4.043
  538    HA   LEU  75           HA       LEU  75   1.721  -0.273  -1.753
  539   1HB   LEU  75          1HB       LEU  75   2.951   1.823  -1.723
  540   2HB   LEU  75          2HB       LEU  75   2.384   2.209  -3.342
  541    HG   LEU  75           HG       LEU  75   0.341   1.417  -1.232
  542   1HD1  LEU  75          1HD1      LEU  75   0.231   3.699  -0.397
  543   2HD1  LEU  75          2HD1      LEU  75   1.827   3.012  -0.115
  544   3HD1  LEU  75          3HD1      LEU  75   1.609   4.163  -1.440
  545   1HD2  LEU  75          1HD2      LEU  75   0.278   3.460  -3.505
  546   2HD2  LEU  75          2HD2      LEU  75  -0.489   1.860  -3.535
  547   3HD2  LEU  75          3HD2      LEU  75  -1.061   3.082  -2.408
  548    H    ILE  76           H        ILE  76  -0.036  -1.344  -2.541
  549    HA   ILE  76           HA       ILE  76  -0.722  -0.924  -5.420
  550    HB   ILE  76           HB       ILE  76  -1.009  -3.519  -3.926
  551   1HG1  ILE  76          1HG1      ILE  76   1.159  -2.557  -5.818
  552   2HG1  ILE  76          2HG1      ILE  76   1.332  -3.225  -4.195
  553   1HG2  ILE  76          1HG2      ILE  76  -2.663  -3.121  -5.784
  554   2HG2  ILE  76          2HG2      ILE  76  -1.292  -2.988  -6.911
  555   3HG2  ILE  76          3HG2      ILE  76  -1.621  -4.503  -6.058
  556   1HD1  ILE  76          1HD1      ILE  76   2.107  -4.845  -5.742
  557   2HD1  ILE  76          2HD1      ILE  76   0.564  -5.448  -5.086
  558   3HD1  ILE  76          3HD1      ILE  76   0.637  -4.752  -6.722
  559    H    LEU  77           H        LEU  77  -2.736  -0.483  -5.784
  560    HA   LEU  77           HA       LEU  77  -4.593  -0.154  -3.466
  561   1HB   LEU  77          1HB       LEU  77  -3.897   1.882  -4.814
  562   2HB   LEU  77          2HB       LEU  77  -4.842   1.247  -6.164
  563    HG   LEU  77           HG       LEU  77  -6.016   1.633  -3.396
  564   1HD1  LEU  77          1HD1      LEU  77  -5.009   3.757  -3.997
  565   2HD1  LEU  77          2HD1      LEU  77  -5.835   3.742  -5.562
  566   3HD1  LEU  77          3HD1      LEU  77  -6.767   3.877  -4.044
  567   1HD2  LEU  77          1HD2      LEU  77  -7.326   1.718  -6.150
  568   2HD2  LEU  77          2HD2      LEU  77  -7.488   0.399  -4.972
  569   3HD2  LEU  77          3HD2      LEU  77  -8.152   1.979  -4.600
  570    H    PHE  78           H        PHE  78  -6.354  -1.452  -3.429
  571    HA   PHE  78           HA       PHE  78  -6.927  -3.130  -5.824
  572   1HB   PHE  78          1HB       PHE  78  -6.935  -3.950  -2.898
  573   2HB   PHE  78          2HB       PHE  78  -7.573  -4.925  -4.200
  574    HD1  PHE  78           1HD      PHE  78  -6.152  -6.149  -5.737
  575    HD2  PHE  78           2HD      PHE  78  -4.474  -3.730  -2.593
  576    HE1  PHE  78           1HE      PHE  78  -3.989  -7.298  -6.012
  577    HE2  PHE  78           2HE      PHE  78  -2.336  -4.980  -2.786
  578    HZ   PHE  78           HZ       PHE  78  -2.083  -6.763  -4.502
  579    H    LYS  79           H        LYS  79  -9.065  -3.667  -6.141
  580    HA   LYS  79           HA       LYS  79 -10.942  -3.567  -3.990
  581   1HB   LYS  79          1HB       LYS  79 -12.686  -2.247  -5.346
  582   2HB   LYS  79          2HB       LYS  79 -11.503  -1.407  -4.361
  583   1HG   LYS  79          1HG       LYS  79 -10.164  -0.888  -6.382
  584   2HG   LYS  79          2HG       LYS  79 -11.354  -1.751  -7.384
  585   1HD   LYS  79          1HD       LYS  79 -11.857   0.598  -7.540
  586   2HD   LYS  79          2HD       LYS  79 -13.096  -0.137  -6.514
  587   1HE   LYS  79          1HE       LYS  79 -11.331   0.544  -4.580
  588   2HE   LYS  79          2HE       LYS  79 -10.823   1.728  -5.790
  589   1HZ   LYS  79          1HZ       LYS  79 -13.525   1.316  -4.681
  590   2HZ   LYS  79          2HZ       LYS  79 -12.541   2.597  -4.339
  591   3HZ   LYS  79          3HZ       LYS  79 -13.187   2.438  -5.855
  592    H    GLY  80           H        GLY  80 -12.863  -4.778  -4.530
  593   1HA   GLY  80          1HA       GLY  80 -13.825  -6.679  -5.399
  594   2HA   GLY  80          2HA       GLY  80 -13.201  -6.224  -6.992
  595    H    GLY  81           H        GLY  81 -10.720  -6.467  -4.611
  596   1HA   GLY  81          1HA       GLY  81  -9.122  -8.104  -4.176
  597   2HA   GLY  81          2HA       GLY  81  -9.987  -9.252  -5.197
  598    H    GLU  82           H        GLU  82  -9.698  -6.340  -7.003
  599    HA   GLU  82           HA       GLU  82  -7.464  -7.561  -8.497
  600   1HB   GLU  82          1HB       GLU  82  -9.745  -7.443  -9.505
  601   2HB   GLU  82          2HB       GLU  82  -9.662  -5.677  -9.429
  602   1HG   GLU  82          1HG       GLU  82  -7.702  -5.691 -10.934
  603   2HG   GLU  82          2HG       GLU  82  -7.679  -7.462 -10.910
  604    HA   PRO  83           HA       PRO  83  -5.181  -3.870  -7.362
  605   1HB   PRO  83          1HB       PRO  83  -3.002  -4.063  -8.999
  606   2HB   PRO  83          2HB       PRO  83  -3.287  -5.140  -7.599
  607   1HG   PRO  83          1HG       PRO  83  -3.902  -5.699 -10.509
  608   2HG   PRO  83          2HG       PRO  83  -3.068  -6.755  -9.323
  609   1HD   PRO  83          1HD       PRO  83  -5.718  -7.014  -9.892
  610   2HD   PRO  83          2HD       PRO  83  -5.088  -7.297  -8.244
  611    H    VAL  84           H        VAL  84  -6.075  -2.004  -7.881
  612    HA   VAL  84           HA       VAL  84  -6.819  -1.133 -10.562
  613    HB   VAL  84           HB       VAL  84  -6.866   0.068  -7.835
  614   1HG1  VAL  84          1HG1      VAL  84  -7.797   1.430 -10.379
  615   2HG1  VAL  84          2HG1      VAL  84  -8.177   1.974  -8.727
  616   3HG1  VAL  84          3HG1      VAL  84  -6.502   1.987  -9.289
  617   1HG2  VAL  84          1HG2      VAL  84  -9.043  -0.803  -9.776
  618   2HG2  VAL  84          2HG2      VAL  84  -8.601  -1.602  -8.256
  619   3HG2  VAL  84          3HG2      VAL  84  -9.341   0.014  -8.236
  620    H    LYS  85           H        LYS  85  -4.105  -0.599  -8.275
  621    HA   LYS  85           HA       LYS  85  -2.460   0.377 -10.453
  622   1HB   LYS  85          1HB       LYS  85  -3.732   2.293  -8.613
  623   2HB   LYS  85          2HB       LYS  85  -1.985   2.344  -8.439
  624   1HG   LYS  85          1HG       LYS  85  -1.683   2.684 -10.847
  625   2HG   LYS  85          2HG       LYS  85  -3.424   2.585 -11.124
  626   1HD   LYS  85          1HD       LYS  85  -2.105   4.646  -9.322
  627   2HD   LYS  85          2HD       LYS  85  -2.446   4.944 -11.015
  628   1HE   LYS  85          1HE       LYS  85  -4.646   4.080  -9.095
  629   2HE   LYS  85          2HE       LYS  85  -4.170   5.782  -9.275
  630   1HZ   LYS  85          1HZ       LYS  85  -4.904   5.884 -11.384
  631   2HZ   LYS  85          2HZ       LYS  85  -4.936   4.211 -11.646
  632   3HZ   LYS  85          3HZ       LYS  85  -6.048   5.080 -10.744
  633    H    GLN  86           H        GLN  86  -0.173   0.553  -9.747
  634    HA   GLN  86           HA       GLN  86   0.576  -0.721  -7.228
  635   1HB   GLN  86          1HB       GLN  86   0.470  -2.660  -8.625
  636   2HB   GLN  86          2HB       GLN  86   1.147  -1.787 -10.013
  637   1HG   GLN  86          1HG       GLN  86   3.342  -1.657  -8.905
  638   2HG   GLN  86          2HG       GLN  86   2.714  -2.486  -7.488
  639   1HE2  GLN  86          1HE2      GLN  86   2.745  -4.810  -7.536
  640   2HE2  GLN  86          2HE2      GLN  86   3.173  -5.682  -8.998
  641    H    LEU  87           H        LEU  87   2.190   0.444  -6.450
  642    HA   LEU  87           HA       LEU  87   3.876   2.151  -8.219
  643   1HB   LEU  87          1HB       LEU  87   2.600   2.617  -5.499
  644   2HB   LEU  87          2HB       LEU  87   4.034   3.491  -6.001
  645    HG   LEU  87           HG       LEU  87   2.856   4.540  -7.839
  646   1HD1  LEU  87          1HD1      LEU  87   0.432   2.913  -6.938
  647   2HD1  LEU  87          2HD1      LEU  87   0.293   4.408  -7.889
  648   3HD1  LEU  87          3HD1      LEU  87   1.130   3.036  -8.578
  649   1HD2  LEU  87          1HD2      LEU  87   2.869   5.539  -5.647
  650   2HD2  LEU  87          2HD2      LEU  87   1.355   5.930  -6.476
  651   3HD2  LEU  87          3HD2      LEU  87   1.373   4.688  -5.200
  652    H    ILE  88           H        ILE  88   6.070   1.968  -7.784
  653    HA   ILE  88           HA       ILE  88   6.982   0.125  -5.671
  654    HB   ILE  88           HB       ILE  88   8.574  -0.772  -7.475
  655   1HG1  ILE  88          1HG1      ILE  88   6.384   0.189  -9.388
  656   2HG1  ILE  88          2HG1      ILE  88   8.012   0.863  -9.296
  657   1HG2  ILE  88          1HG2      ILE  88   6.763  -1.998  -6.352
  658   2HG2  ILE  88          2HG2      ILE  88   5.627  -1.513  -7.624
  659   3HG2  ILE  88          3HG2      ILE  88   7.018  -2.570  -7.991
  660   1HD1  ILE  88          1HD1      ILE  88   7.927  -0.644 -11.150
  661   2HD1  ILE  88          2HD1      ILE  88   8.933  -1.398  -9.893
  662   3HD1  ILE  88          3HD1      ILE  88   7.258  -1.949 -10.164
  663    H    GLY  89           H        GLY  89   8.435   1.052  -4.516
  664   1HA   GLY  89          1HA       GLY  89  10.641   2.021  -4.299
  665   2HA   GLY  89          2HA       GLY  89  10.315   3.060  -5.697
  666    H    TYR  90           H        TYR  90  11.255   4.330  -3.613
  667    HA   TYR  90           HA       TYR  90   9.255   5.465  -1.832
  668   1HB   TYR  90          1HB       TYR  90  11.553   5.376  -1.115
  669   2HB   TYR  90          2HB       TYR  90  12.077   6.261  -2.537
  670    HD1  TYR  90           1HD      TYR  90  11.934   8.698  -2.632
  671    HD2  TYR  90           2HD      TYR  90  10.300   6.538   0.708
  672    HE1  TYR  90           1HE      TYR  90  11.605  10.827  -1.442
  673    HE2  TYR  90           2HE      TYR  90   9.950   8.688   1.922
  674    HH   TYR  90           HH       TYR  90  10.864  11.845   0.542
  675    H    GLN  91           H        GLN  91   7.621   5.923  -3.447
  676    HA   GLN  91           HA       GLN  91   8.159   8.181  -5.237
  677   1HB   GLN  91          1HB       GLN  91   5.328   7.587  -4.578
  678   2HB   GLN  91          2HB       GLN  91   6.089   7.961  -6.101
  679   1HG   GLN  91          1HG       GLN  91   6.062   5.249  -4.717
  680   2HG   GLN  91          2HG       GLN  91   5.109   5.746  -6.102
  681   1HE2  GLN  91          1HE2      GLN  91   5.809   4.352  -7.742
  682   2HE2  GLN  91          2HE2      GLN  91   7.540   3.977  -7.925
  683    HA   PRO  92           HA       PRO  92   7.622  10.799  -1.566
  684   1HB   PRO  92          1HB       PRO  92   7.801  13.292  -2.718
  685   2HB   PRO  92          2HB       PRO  92   9.219  12.237  -2.423
  686   1HG   PRO  92          1HG       PRO  92   7.651  12.578  -4.993
  687   2HG   PRO  92          2HG       PRO  92   9.429  12.597  -4.772
  688   1HD   PRO  92          1HD       PRO  92   8.094  10.364  -5.596
  689   2HD   PRO  92          2HD       PRO  92   9.516  10.247  -4.517
  690    H    LYS  93           H        LYS  93   5.952  12.287  -0.764
  691    HA   LYS  93           HA       LYS  93   3.465  11.421  -1.129
  692   1HB   LYS  93          1HB       LYS  93   4.756  13.454   0.354
  693   2HB   LYS  93          2HB       LYS  93   3.476  14.320  -0.447
  694   1HG   LYS  93          1HG       LYS  93   3.047  11.716   1.087
  695   2HG   LYS  93          2HG       LYS  93   2.870  13.300   1.809
  696   1HD   LYS  93          1HD       LYS  93   1.295  12.360  -0.632
  697   2HD   LYS  93          2HD       LYS  93   0.750  12.219   1.014
  698   1HE   LYS  93          1HE       LYS  93   1.281  14.829  -0.435
  699   2HE   LYS  93          2HE       LYS  93  -0.300  14.123  -0.070
  700   1HZ   LYS  93          1HZ       LYS  93   1.675  15.210   1.833
  701   2HZ   LYS  93          2HZ       LYS  93   0.148  15.740   1.578
  702   3HZ   LYS  93          3HZ       LYS  93   0.405  14.293   2.348
  703    H    GLU  94           H        GLU  94   4.658  14.386  -2.606
  704    HA   GLU  94           HA       GLU  94   2.372  15.147  -4.047
  705   1HB   GLU  94          1HB       GLU  94   5.305  15.572  -4.747
  706   2HB   GLU  94          2HB       GLU  94   3.953  16.480  -5.434
  707   1HG   GLU  94          1HG       GLU  94   3.377  17.386  -3.224
  708   2HG   GLU  94          2HG       GLU  94   4.659  16.435  -2.462
  709    H    GLN  95           H        GLN  95   4.598  12.502  -4.840
  710    HA   GLN  95           HA       GLN  95   3.757  12.463  -7.656
  711   1HB   GLN  95          1HB       GLN  95   6.158  12.016  -6.807
  712   2HB   GLN  95          2HB       GLN  95   5.575  10.541  -6.100
  713   1HG   GLN  95          1HG       GLN  95   6.620  10.075  -8.250
  714   2HG   GLN  95          2HG       GLN  95   4.914   9.642  -8.276
  715   1HE2  GLN  95          1HE2      GLN  95   3.397  11.029  -9.511
  716   2HE2  GLN  95          2HE2      GLN  95   4.071  12.079 -10.760
  717    H    LEU  96           H        LEU  96   3.690  10.700  -4.663
  718    HA   LEU  96           HA       LEU  96   2.262   8.389  -5.426
  719   1HB   LEU  96          1HB       LEU  96   3.668   9.071  -3.330
  720   2HB   LEU  96          2HB       LEU  96   2.108   9.504  -2.664
  721    HG   LEU  96           HG       LEU  96   2.621   6.801  -3.951
  722   1HD1  LEU  96          1HD1      LEU  96   4.301   7.088  -2.224
  723   2HD1  LEU  96          2HD1      LEU  96   3.029   7.445  -1.030
  724   3HD1  LEU  96          3HD1      LEU  96   3.124   5.839  -1.799
  725   1HD2  LEU  96          1HD2      LEU  96   0.246   7.332  -3.567
  726   2HD2  LEU  96          2HD2      LEU  96   0.768   6.055  -2.465
  727   3HD2  LEU  96          3HD2      LEU  96   0.623   7.723  -1.875
  728    H    GLU  97           H        GLU  97   0.915  11.328  -3.683
  729    HA   GLU  97           HA       GLU  97  -1.806  10.494  -3.962
  730   1HB   GLU  97          1HB       GLU  97  -0.286  12.939  -3.246
  731   2HB   GLU  97          2HB       GLU  97  -1.842  13.235  -3.955
  732   1HG   GLU  97          1HG       GLU  97  -1.349  11.554  -1.500
  733   2HG   GLU  97          2HG       GLU  97  -1.789  13.248  -1.466
  734    H    ALA  98           H        ALA  98   0.485  12.143  -6.202
  735    HA   ALA  98           HA       ALA  98  -1.637  13.006  -7.997
  736   1HB   ALA  98          1HB       ALA  98   0.502  14.152  -8.064
  737   2HB   ALA  98          2HB       ALA  98   1.350  12.646  -8.495
  738   3HB   ALA  98          3HB       ALA  98   0.199  13.386  -9.628
  739    H    GLN  99           H        GLN  99   0.641  10.227  -8.027
  740    HA   GLN  99           HA       GLN  99  -0.405   9.034 -10.420
  741   1HB   GLN  99          1HB       GLN  99   1.793   8.535  -9.285
  742   2HB   GLN  99          2HB       GLN  99   0.927   7.727  -7.994
  743   1HG   GLN  99          1HG       GLN  99   1.850   6.095  -9.558
  744   2HG   GLN  99          2HG       GLN  99   0.094   6.020  -9.565
  745   1HE2  GLN  99          1HE2      GLN  99   2.640   7.966 -11.358
  746   2HE2  GLN  99          2HE2      GLN  99   1.895   7.631 -12.915
  747    H    LEU 100           H        LEU 100  -1.279   8.665  -7.008
  748    HA   LEU 100           HA       LEU 100  -3.376   6.704  -7.622
  749   1HB   LEU 100          1HB       LEU 100  -1.764   7.432  -5.368
  750   2HB   LEU 100          2HB       LEU 100  -3.406   7.768  -4.925
  751    HG   LEU 100           HG       LEU 100  -3.951   5.359  -5.549
  752   1HD1  LEU 100          1HD1      LEU 100  -2.096   4.994  -7.179
  753   2HD1  LEU 100          2HD1      LEU 100  -0.921   5.162  -5.869
  754   3HD1  LEU 100          3HD1      LEU 100  -2.053   3.792  -5.888
  755   1HD2  LEU 100          1HD2      LEU 100  -3.350   5.915  -3.208
  756   2HD2  LEU 100          2HD2      LEU 100  -2.736   4.323  -3.640
  757   3HD2  LEU 100          3HD2      LEU 100  -1.630   5.709  -3.579
  758    H    ALA 101           H        ALA 101  -3.328   9.983  -8.078
  759    HA   ALA 101           HA       ALA 101  -5.323  11.047  -6.635
  760   1HB   ALA 101          1HB       ALA 101  -3.905  12.381  -8.102
  761   2HB   ALA 101          2HB       ALA 101  -4.693  11.691  -9.544
  762   3HB   ALA 101          3HB       ALA 101  -5.606  12.726  -8.421
  763    H    ASP 102           H        ASP 102  -5.885   9.076  -9.612
  764    HA   ASP 102           HA       ASP 102  -8.657   9.967  -9.746
  765   1HB   ASP 102          1HB       ASP 102  -8.916   8.149 -11.448
  766   2HB   ASP 102          2HB       ASP 102  -7.561   9.222 -11.777
  767    H    VAL 103           H        VAL 103  -7.175   7.876  -7.551
  768    HA   VAL 103           HA       VAL 103  -9.865   6.909  -6.723
  769    HB   VAL 103           HB       VAL 103  -7.774   5.310  -5.572
  770   1HG1  VAL 103          1HG1      VAL 103 -10.091   4.604  -7.406
  771   2HG1  VAL 103          2HG1      VAL 103  -9.176   3.467  -6.393
  772   3HG1  VAL 103          3HG1      VAL 103 -10.158   4.732  -5.633
  773   1HG2  VAL 103          1HG2      VAL 103  -6.472   5.621  -7.637
  774   2HG2  VAL 103          2HG2      VAL 103  -7.087   3.969  -7.504
  775   3HG2  VAL 103          3HG2      VAL 103  -7.881   5.107  -8.601
  776    H    LEU 104           H        LEU 104  -7.695   9.253  -6.076
  777    HA   LEU 104           HA       LEU 104  -8.370   9.270  -3.212
  778   1HB   LEU 104          1HB       LEU 104  -5.825   9.730  -4.790
  779   2HB   LEU 104          2HB       LEU 104  -6.101  10.719  -3.402
  780    HG   LEU 104           HG       LEU 104  -4.683   8.865  -2.815
  781   1HD1  LEU 104          1HD1      LEU 104  -6.288   9.767  -1.178
  782   2HD1  LEU 104          2HD1      LEU 104  -7.439   8.471  -1.592
  783   3HD1  LEU 104          3HD1      LEU 104  -5.890   8.042  -0.875
  784   1HD2  LEU 104          1HD2      LEU 104  -5.538   7.128  -4.427
  785   2HD2  LEU 104          2HD2      LEU 104  -5.346   6.560  -2.751
  786   3HD2  LEU 104          3HD2      LEU 104  -6.941   6.919  -3.369
  787    H    GLN 105           H        GLN 105  -8.925  10.827  -6.117
  788    HA   GLN 105           HA       GLN 105  -9.198  13.530  -5.399
  789   1HB   GLN 105          2HB       GLN 105  -9.215  12.565  -7.673
  790   2HB   GLN 105          3HB       GLN 105 -10.777  11.850  -7.354
  791   1HG   GLN 105          2HG       GLN 105 -10.491  14.836  -6.968
  792   2HG   GLN 105          3HG       GLN 105 -10.372  14.218  -8.607
  793   1HE2  GLN 105          1HE2      GLN 105 -12.546  14.100  -5.735
  794   2HE2  GLN 105          2HE2      GLN 105 -14.033  14.001  -6.709
  Start of MODEL    6
    1   1H    ALA   1           H        ALA   1  -9.497   5.045   5.898
    2   2H    ALA   1          2HN       ALA   1 -10.149   3.573   6.271
    3   3H    ALA   1          3HN       ALA   1 -10.962   4.967   6.663
    4    HA   ALA   1           HA       ALA   1  -9.340   5.592   8.221
    5   1HB   ALA   1          1HB       ALA   1 -10.260   2.703   8.569
    6   2HB   ALA   1          2HB       ALA   1  -9.786   3.815   9.880
    7   3HB   ALA   1          3HB       ALA   1 -11.231   4.151   8.915
    8    H    THR   2           H        THR   2  -7.830   3.406   9.716
    9    HA   THR   2           HA       THR   2  -5.927   2.409   7.801
   10    HB   THR   2           HB       THR   2  -4.993   4.250  10.033
   11    HG1  THR   2           1HG      THR   2  -5.792   4.728   7.510
   12   1HG2  THR   2          1HG2      THR   2  -3.328   2.526   9.653
   13   2HG2  THR   2          2HG2      THR   2  -3.483   2.672   7.894
   14   3HG2  THR   2          3HG2      THR   2  -2.766   3.996   8.841
   15    H    MET   3           H        MET   3  -4.895   0.528   8.603
   16    HA   MET   3           HA       MET   3  -5.004  -0.127  11.435
   17   1HB   MET   3          1HB       MET   3  -6.303  -1.912   9.313
   18   2HB   MET   3          2HB       MET   3  -5.877  -2.445  10.939
   19   1HG   MET   3          1HG       MET   3  -7.352  -0.642  11.872
   20   2HG   MET   3          2HG       MET   3  -7.917  -0.327  10.228
   21   1HE   MET   3          1HE       MET   3  -9.749  -1.023  12.790
   22   2HE   MET   3          2HE       MET   3 -10.396  -0.624  11.180
   23   3HE   MET   3          3HE       MET   3 -10.952  -2.086  12.027
   24    H    THR   4           H        THR   4  -3.805  -2.416  11.602
   25    HA   THR   4           HA       THR   4  -1.548  -2.581   9.680
   26    HB   THR   4           HB       THR   4  -1.931  -4.007  12.319
   27    HG1  THR   4           1HG      THR   4  -0.520  -2.473  13.163
   28   1HG2  THR   4          1HG2      THR   4  -0.266  -5.130  10.900
   29   2HG2  THR   4          2HG2      THR   4   0.563  -3.581  10.611
   30   3HG2  THR   4          3HG2      THR   4   0.546  -4.310  12.229
   31    H    LEU   5           H        LEU   5  -1.185  -4.891   8.870
   32    HA   LEU   5           HA       LEU   5  -3.517  -6.701   9.133
   33   1HB   LEU   5          1HB       LEU   5  -2.152  -5.959   6.529
   34   2HB   LEU   5          2HB       LEU   5  -3.257  -7.313   6.697
   35    HG   LEU   5           HG       LEU   5  -4.049  -4.422   7.197
   36   1HD1  LEU   5          1HD1      LEU   5  -4.490  -6.145   4.720
   37   2HD1  LEU   5          2HD1      LEU   5  -5.118  -4.509   4.975
   38   3HD1  LEU   5          3HD1      LEU   5  -3.374  -4.777   4.828
   39   1HD2  LEU   5          1HD2      LEU   5  -5.744  -6.891   6.773
   40   2HD2  LEU   5          2HD2      LEU   5  -5.496  -6.053   8.326
   41   3HD2  LEU   5          3HD2      LEU   5  -6.326  -5.227   7.006
   42    H    THR   6           H        THR   6  -2.912  -8.961   8.368
   43    HA   THR   6           HA       THR   6  -0.182  -9.573   8.099
   44    HB   THR   6           HB       THR   6  -0.464  -9.835  10.530
   45    HG1  THR   6           1HG      THR   6   0.782 -11.406  10.255
   46   1HG2  THR   6          1HG2      THR   6  -1.985 -11.618  11.419
   47   2HG2  THR   6          2HG2      THR   6  -2.827 -10.180  10.833
   48   3HG2  THR   6          3HG2      THR   6  -2.809 -11.665   9.851
   49    H    ASP   7           H        ASP   7  -0.578 -12.099   7.813
   50    HA   ASP   7           HA       ASP   7  -1.177 -12.143   5.101
   51   1HB   ASP   7          1HB       ASP   7   0.277 -13.769   6.387
   52   2HB   ASP   7          2HB       ASP   7  -1.178 -14.621   6.889
   53    H    ALA   8           H        ALA   8  -3.187 -13.910   7.470
   54    HA   ALA   8           HA       ALA   8  -5.262 -14.521   5.616
   55   1HB   ALA   8          1HB       ALA   8  -4.914 -15.672   7.806
   56   2HB   ALA   8          2HB       ALA   8  -5.382 -14.181   8.659
   57   3HB   ALA   8          3HB       ALA   8  -6.576 -15.048   7.666
   58    H    ASN   9           H        ASN   9  -4.719 -11.621   7.568
   59    HA   ASN   9           HA       ASN   9  -7.427 -10.645   7.218
   60   1HB   ASN   9          1HB       ASN   9  -4.976  -9.299   8.318
   61   2HB   ASN   9          2HB       ASN   9  -6.602  -8.653   8.329
   62   1HD2  ASN   9          1HD2      ASN   9  -8.382 -10.389   9.406
   63   2HD2  ASN   9          2HD2      ASN   9  -7.689 -11.084  10.863
   64    H    PHE  10           H        PHE  10  -4.409 -10.554   5.415
   65    HA   PHE  10           HA       PHE  10  -4.734  -8.148   3.990
   66   1HB   PHE  10          1HB       PHE  10  -2.714  -9.609   3.987
   67   2HB   PHE  10          2HB       PHE  10  -3.544 -10.766   2.971
   68    HD1  PHE  10           1HD      PHE  10  -4.377  -9.972   0.625
   69    HD2  PHE  10           2HD      PHE  10  -1.538  -7.795   3.033
   70    HE1  PHE  10           1HE      PHE  10  -3.655  -8.709  -1.369
   71    HE2  PHE  10           2HE      PHE  10  -0.747  -6.624   1.032
   72    HZ   PHE  10           HZ       PHE  10  -1.815  -7.037  -1.184
   73    H    GLN  11           H        GLN  11  -5.754 -11.434   2.915
   74    HA   GLN  11           HA       GLN  11  -7.299 -10.497   0.724
   75   1HB   GLN  11          1HB       GLN  11  -6.430 -12.891   1.435
   76   2HB   GLN  11          2HB       GLN  11  -7.999 -13.046   2.210
   77   1HG   GLN  11          1HG       GLN  11  -7.452 -12.358  -0.719
   78   2HG   GLN  11          2HG       GLN  11  -7.946 -13.940  -0.113
   79   1HE2  GLN  11          1HE2      GLN  11 -10.150 -13.794   1.282
   80   2HE2  GLN  11          2HE2      GLN  11 -11.378 -12.810   0.486
   81    H    GLN  12           H        GLN  12  -8.231 -11.199   4.121
   82    HA   GLN  12           HA       GLN  12 -11.000 -10.698   3.906
   83   1HB   GLN  12          1HB       GLN  12  -9.672 -11.673   5.843
   84   2HB   GLN  12          2HB       GLN  12  -9.163 -10.021   6.215
   85   1HG   GLN  12          1HG       GLN  12 -11.512  -9.382   6.646
   86   2HG   GLN  12          2HG       GLN  12 -12.019 -11.040   6.267
   87   1HE2  GLN  12          1HE2      GLN  12 -12.393 -12.202   8.175
   88   2HE2  GLN  12          2HE2      GLN  12 -11.425 -12.001   9.628
   89    H    ALA  13           H        ALA  13  -8.284  -8.396   3.909
   90    HA   ALA  13           HA       ALA  13 -10.016  -6.149   4.508
   91   1HB   ALA  13          1HB       ALA  13  -7.045  -6.268   3.887
   92   2HB   ALA  13          2HB       ALA  13  -7.942  -4.839   4.448
   93   3HB   ALA  13          3HB       ALA  13  -7.800  -6.258   5.502
   94    H    ILE  14           H        ILE  14  -8.561  -7.631   1.638
   95    HA   ILE  14           HA       ILE  14  -9.326  -5.343  -0.038
   96    HB   ILE  14           HB       ILE  14  -8.756  -6.842  -1.956
   97   1HG1  ILE  14          1HG1      ILE  14  -7.219  -8.548  -0.022
   98   2HG1  ILE  14          2HG1      ILE  14  -8.798  -9.059  -0.622
   99   1HG2  ILE  14          1HG2      ILE  14  -6.348  -6.384  -1.632
  100   2HG2  ILE  14          2HG2      ILE  14  -7.319  -5.052  -1.011
  101   3HG2  ILE  14          3HG2      ILE  14  -6.597  -6.219   0.112
  102   1HD1  ILE  14          1HD1      ILE  14  -7.094 -10.083  -1.970
  103   2HD1  ILE  14          2HD1      ILE  14  -7.967  -8.898  -2.957
  104   3HD1  ILE  14          3HD1      ILE  14  -6.345  -8.521  -2.328
  105    H    GLN  15           H        GLN  15 -10.372  -8.545  -0.781
  106    HA   GLN  15           HA       GLN  15 -12.202  -9.473  -1.564
  107   1HB   GLN  15          1HB       GLN  15 -13.820  -9.923   0.112
  108   2HB   GLN  15          2HB       GLN  15 -12.219  -9.878   0.838
  109   1HG   GLN  15          1HG       GLN  15 -12.648  -7.761   1.897
  110   2HG   GLN  15          2HG       GLN  15 -14.097  -7.478   0.933
  111   1HE2  GLN  15          1HE2      GLN  15 -13.033  -8.585   3.969
  112   2HE2  GLN  15          2HE2      GLN  15 -14.555  -9.385   4.413
  113    H    GLY  16           H        GLY  16 -12.731  -6.110  -1.318
  114   1HA   GLY  16          1HA       GLY  16 -15.407  -6.262  -2.655
  115   2HA   GLY  16          2HA       GLY  16 -15.169  -5.441  -1.106
  116    H    ASP  17           H        ASP  17 -16.251  -3.731  -2.674
  117    HA   ASP  17           HA       ASP  17 -14.690  -2.702  -4.861
  118   1HB   ASP  17          1HB       ASP  17 -16.678  -1.348  -5.206
  119   2HB   ASP  17          2HB       ASP  17 -17.148  -3.019  -4.892
  120    H    GLY  18           H        GLY  18 -14.819  -1.934  -1.502
  121   1HA   GLY  18          1HA       GLY  18 -14.707   0.881  -1.554
  122   2HA   GLY  18          2HA       GLY  18 -14.049  -0.137  -0.261
  123    HA   PRO  19           HA       PRO  19 -10.453   1.729  -2.818
  124   1HB   PRO  19          1HB       PRO  19  -9.920   4.116  -1.586
  125   2HB   PRO  19          2HB       PRO  19 -11.056   3.958  -2.949
  126   1HG   PRO  19          1HG       PRO  19 -11.713   4.048   0.011
  127   2HG   PRO  19          2HG       PRO  19 -12.499   4.937  -1.331
  128   1HD   PRO  19          1HD       PRO  19 -13.495   2.614  -0.248
  129   2HD   PRO  19          2HD       PRO  19 -13.716   3.041  -1.972
  130    H    VAL  20           H        VAL  20  -9.759  -0.202  -1.735
  131    HA   VAL  20           HA       VAL  20  -8.631   0.016   0.983
  132    HB   VAL  20           HB       VAL  20  -8.833  -2.220  -1.073
  133   1HG1  VAL  20          1HG1      VAL  20  -7.657  -2.258   1.756
  134   2HG1  VAL  20          2HG1      VAL  20  -8.075  -3.711   0.844
  135   3HG1  VAL  20          3HG1      VAL  20  -6.804  -2.649   0.245
  136   1HG2  VAL  20          1HG2      VAL  20 -10.969  -1.566   0.051
  137   2HG2  VAL  20          2HG2      VAL  20 -10.449  -3.190   0.480
  138   3HG2  VAL  20          3HG2      VAL  20 -10.202  -1.858   1.628
  139    H    LEU  21           H        LEU  21  -6.436   0.188   1.380
  140    HA   LEU  21           HA       LEU  21  -4.577   0.272  -0.959
  141   1HB   LEU  21          1HB       LEU  21  -5.573   2.498  -0.251
  142   2HB   LEU  21          2HB       LEU  21  -4.669   2.375   1.233
  143    HG   LEU  21           HG       LEU  21  -3.350   2.311  -1.512
  144   1HD1  LEU  21          1HD1      LEU  21  -3.824   4.739   0.282
  145   2HD1  LEU  21          2HD1      LEU  21  -3.022   4.712  -1.305
  146   3HD1  LEU  21          3HD1      LEU  21  -4.751   4.379  -1.182
  147   1HD2  LEU  21          1HD2      LEU  21  -2.258   3.128   1.231
  148   2HD2  LEU  21          2HD2      LEU  21  -1.841   1.628   0.383
  149   3HD2  LEU  21          3HD2      LEU  21  -1.369   3.172  -0.284
  150    H    VAL  22           H        VAL  22  -2.476  -0.491  -0.517
  151    HA   VAL  22           HA       VAL  22  -2.076  -1.800   2.131
  152    HB   VAL  22           HB       VAL  22  -2.299  -2.872  -0.669
  153   1HG1  VAL  22          1HG1      VAL  22   0.044  -3.386  -0.332
  154   2HG1  VAL  22          2HG1      VAL  22  -0.293  -4.071   1.266
  155   3HG1  VAL  22          3HG1      VAL  22  -0.921  -4.838  -0.219
  156   1HG2  VAL  22          1HG2      VAL  22  -2.795  -4.129   2.064
  157   2HG2  VAL  22          2HG2      VAL  22  -4.017  -3.292   1.086
  158   3HG2  VAL  22          3HG2      VAL  22  -3.285  -4.791   0.491
  159    H    ASP  23           H        ASP  23  -0.166  -1.036   3.004
  160    HA   ASP  23           HA       ASP  23   1.980  -0.265   1.144
  161   1HB   ASP  23          1HB       ASP  23   0.756   0.881   3.531
  162   2HB   ASP  23          2HB       ASP  23   2.433   0.522   3.840
  163    H    PHE  24           H        PHE  24   3.044  -2.075   0.706
  164    HA   PHE  24           HA       PHE  24   3.695  -4.122   2.714
  165   1HB   PHE  24          1HB       PHE  24   4.555  -3.612  -0.147
  166   2HB   PHE  24          2HB       PHE  24   5.142  -4.948   0.796
  167    HD1  PHE  24           1HD      PHE  24   2.666  -4.048  -1.564
  168    HD2  PHE  24           2HD      PHE  24   3.396  -6.508   1.906
  169    HE1  PHE  24           1HE      PHE  24   1.144  -5.766  -2.465
  170    HE2  PHE  24           2HE      PHE  24   1.881  -8.229   0.991
  171    HZ   PHE  24           HZ       PHE  24   0.869  -7.954  -1.193
  172    H    TRP  25           H        TRP  25   5.238  -3.713   4.136
  173    HA   TRP  25           HA       TRP  25   7.690  -2.276   3.255
  174   1HB   TRP  25          1HB       TRP  25   7.980  -1.337   5.426
  175   2HB   TRP  25          2HB       TRP  25   6.374  -0.902   4.886
  176    HD1  TRP  25           HD       TRP  25   4.312  -2.219   6.108
  177    HE1  TRP  25           1HE      TRP  25   4.122  -3.255   8.458
  178    HE3  TRP  25           3HE      TRP  25   9.270  -2.295   7.381
  179    HZ2  TRP  25           2HZ      TRP  25   5.954  -4.235  10.537
  180    HZ3  TRP  25           3HZ      TRP  25  10.010  -3.223   9.545
  181    HH2  TRP  25           HH       TRP  25   8.357  -4.200  11.130
  182    H    ALA  26           H        ALA  26   9.563  -3.154   5.007
  183    HA   ALA  26           HA       ALA  26   9.015  -5.909   5.757
  184   1HB   ALA  26          1HB       ALA  26  10.797  -6.916   4.555
  185   2HB   ALA  26          2HB       ALA  26   9.842  -6.044   3.352
  186   3HB   ALA  26          3HB       ALA  26  11.380  -5.361   3.920
  187    H    ALA  27           H        ALA  27  10.818  -6.795   7.019
  188    HA   ALA  27           HA       ALA  27  11.716  -4.803   8.927
  189   1HB   ALA  27          1HB       ALA  27  10.780  -6.962   9.638
  190   2HB   ALA  27          2HB       ALA  27  12.123  -7.819   8.843
  191   3HB   ALA  27          3HB       ALA  27  12.425  -6.751  10.233
  192    H    TRP  28           H        TRP  28  13.009  -4.983   6.128
  193    HA   TRP  28           HA       TRP  28  15.644  -4.338   7.147
  194   1HB   TRP  28          1HB       TRP  28  16.986  -5.654   5.875
  195   2HB   TRP  28          2HB       TRP  28  15.736  -6.794   6.302
  196    HD1  TRP  28           HD       TRP  28  17.515  -5.220   3.454
  197    HE1  TRP  28           1HE      TRP  28  16.618  -5.961   1.185
  198    HE3  TRP  28           3HE      TRP  28  13.305  -7.724   5.007
  199    HZ2  TRP  28           2HZ      TRP  28  14.317  -7.349   0.145
  200    HZ3  TRP  28           3HZ      TRP  28  11.734  -8.681   3.304
  201    HH2  TRP  28           HH       TRP  28  12.230  -8.472   0.906
  202    H    CYS  29           H        CYS  29  14.022  -4.784   4.054
  203    HA   CYS  29           HA       CYS  29  13.608  -3.657   2.259
  204   1HB   CYS  29          1HB       CYS  29  12.111  -1.865   2.447
  205   2HB   CYS  29          2HB       CYS  29  11.791  -3.026   3.730
  206    H    GLY  30           H        GLY  30  15.140  -1.107   4.271
  207   1HA   GLY  30          1HA       GLY  30  16.797   0.442   3.574
  208   2HA   GLY  30          2HA       GLY  30  16.568  -0.022   1.887
  209    HA   PRO  31           HA       PRO  31  14.378   3.802   1.584
  210   1HB   PRO  31          1HB       PRO  31  12.598   3.294  -0.531
  211   2HB   PRO  31          2HB       PRO  31  14.318   3.782  -0.657
  212   1HG   PRO  31          1HG       PRO  31  13.122   1.018  -0.838
  213   2HG   PRO  31          2HG       PRO  31  14.439   1.731  -1.815
  214   1HD   PRO  31          1HD       PRO  31  14.931   0.038   0.225
  215   2HD   PRO  31          2HD       PRO  31  16.003   1.438  -0.065
  216    H    CYS  32           H        CYS  32  12.378   0.946   2.179
  217    HA   CYS  32           HA       CYS  32   9.964   2.425   2.632
  218   1HB   CYS  32          1HB       CYS  32   8.995   0.611   3.502
  219   2HB   CYS  32          2HB       CYS  32  10.220  -0.146   2.503
  220    H    ARG  33           H        ARG  33  12.918   2.178   4.566
  221    HA   ARG  33           HA       ARG  33  11.781   3.177   7.010
  222   1HB   ARG  33          1HB       ARG  33  14.035   1.995   6.572
  223   2HB   ARG  33          2HB       ARG  33  14.633   3.553   6.041
  224   1HG   ARG  33          1HG       ARG  33  13.303   3.573   8.722
  225   2HG   ARG  33          2HG       ARG  33  14.650   2.452   8.597
  226   1HD   ARG  33          1HD       ARG  33  15.580   4.418   9.399
  227   2HD   ARG  33          2HD       ARG  33  16.085   4.333   7.705
  228    HE   ARG  33           HE       ARG  33  13.644   5.773   7.886
  229   1HH1  ARG  33          2HH2      ARG  33  17.043   6.279   8.718
  230   2HH1  ARG  33          1HH2      ARG  33  16.985   8.001   8.556
  231   1HH2  ARG  33          2HH1      ARG  33  13.521   7.980   7.684
  232   2HH2  ARG  33          1HH1      ARG  33  14.890   9.012   7.950
  233    H    MET  34           H        MET  34  12.525   4.742   3.959
  234    HA   MET  34           HA       MET  34  12.389   7.454   5.122
  235   1HB   MET  34          1HB       MET  34  13.085   6.350   2.346
  236   2HB   MET  34          2HB       MET  34  12.985   8.070   2.719
  237   1HG   MET  34          1HG       MET  34  14.864   7.973   4.181
  238   2HG   MET  34          2HG       MET  34  14.849   6.204   4.205
  239   1HE   MET  34          1HE       MET  34  15.601   9.409   2.069
  240   2HE   MET  34          2HE       MET  34  16.221   8.718   0.553
  241   3HE   MET  34          3HE       MET  34  14.500   8.556   0.958
  242    H    MET  35           H        MET  35  10.572   5.088   3.302
  243    HA   MET  35           HA       MET  35   8.667   7.040   2.331
  244   1HB   MET  35          1HB       MET  35   9.439   4.744   1.227
  245   2HB   MET  35          2HB       MET  35   8.143   4.069   2.220
  246   1HG   MET  35          1HG       MET  35   6.590   5.713   1.157
  247   2HG   MET  35          2HG       MET  35   7.930   6.364   0.214
  248   1HE   MET  35          1HE       MET  35   5.132   5.336  -0.903
  249   2HE   MET  35          2HE       MET  35   6.370   5.991  -2.005
  250   3HE   MET  35          3HE       MET  35   5.601   4.424  -2.355
  251    H    ALA  36           H        ALA  36   8.882   4.592   5.015
  252    HA   ALA  36           HA       ALA  36   6.273   4.732   5.925
  253   1HB   ALA  36          1HB       ALA  36   7.922   3.240   6.898
  254   2HB   ALA  36          2HB       ALA  36   8.832   4.602   7.578
  255   3HB   ALA  36          3HB       ALA  36   7.196   4.240   8.171
  256    HA   PRO  37           HA       PRO  37   6.935   8.884   8.211
  257   1HB   PRO  37          1HB       PRO  37   8.977  10.560   7.275
  258   2HB   PRO  37          2HB       PRO  37   9.033   9.556   8.759
  259   1HG   PRO  37          1HG       PRO  37  10.152   8.987   6.050
  260   2HG   PRO  37          2HG       PRO  37  10.890   8.667   7.639
  261   1HD   PRO  37          1HD       PRO  37   9.703   6.682   6.239
  262   2HD   PRO  37          2HD       PRO  37   9.548   6.772   8.012
  263    H    VAL  38           H        VAL  38   7.857   8.685   4.667
  264    HA   VAL  38           HA       VAL  38   6.269  11.074   4.133
  265    HB   VAL  38           HB       VAL  38   8.196   9.768   2.711
  266   1HG1  VAL  38          1HG1      VAL  38   7.258   9.052   0.544
  267   2HG1  VAL  38          2HG1      VAL  38   6.784   7.972   1.856
  268   3HG1  VAL  38          3HG1      VAL  38   5.618   9.105   1.241
  269   1HG2  VAL  38          1HG2      VAL  38   7.622  12.108   2.501
  270   2HG2  VAL  38          2HG2      VAL  38   7.651  11.379   0.892
  271   3HG2  VAL  38          3HG2      VAL  38   6.098  11.725   1.700
  272    H    LEU  39           H        LEU  39   5.446   7.709   4.593
  273    HA   LEU  39           HA       LEU  39   2.886   7.906   3.344
  274   1HB   LEU  39          1HB       LEU  39   4.434   5.783   4.824
  275   2HB   LEU  39          2HB       LEU  39   2.798   5.519   4.282
  276    HG   LEU  39           HG       LEU  39   5.024   6.370   2.390
  277   1HD1  LEU  39          1HD1      LEU  39   5.032   3.936   1.706
  278   2HD1  LEU  39          2HD1      LEU  39   5.649   4.229   3.347
  279   3HD1  LEU  39          3HD1      LEU  39   4.010   3.609   3.110
  280   1HD2  LEU  39          1HD2      LEU  39   3.573   5.441   0.633
  281   2HD2  LEU  39          2HD2      LEU  39   2.284   5.262   1.827
  282   3HD2  LEU  39          3HD2      LEU  39   2.915   6.881   1.408
  283    H    GLU  40           H        GLU  40   4.168   8.449   6.546
  284    HA   GLU  40           HA       GLU  40   1.649   8.238   7.952
  285   1HB   GLU  40          1HB       GLU  40   4.001   8.227   8.897
  286   2HB   GLU  40          2HB       GLU  40   4.066   9.970   8.641
  287   1HG   GLU  40          1HG       GLU  40   2.446  10.386  10.310
  288   2HG   GLU  40          2HG       GLU  40   1.742   8.770  10.174
  289    H    GLU  41           H        GLU  41   3.466  10.897   6.405
  290    HA   GLU  41           HA       GLU  41   1.524  12.965   6.469
  291   1HB   GLU  41          1HB       GLU  41   3.786  13.390   5.822
  292   2HB   GLU  41          2HB       GLU  41   3.742  12.188   4.545
  293   1HG   GLU  41          1HG       GLU  41   2.156  13.592   3.250
  294   2HG   GLU  41          2HG       GLU  41   2.206  14.809   4.532
  295    H    PHE  42           H        PHE  42   2.055  10.394   4.003
  296    HA   PHE  42           HA       PHE  42  -0.119  11.001   2.345
  297   1HB   PHE  42          1HB       PHE  42   1.735   9.263   1.970
  298   2HB   PHE  42          2HB       PHE  42   0.828   8.197   3.015
  299    HD1  PHE  42           1HD      PHE  42   0.075   6.422   1.757
  300    HD2  PHE  42           2HD      PHE  42  -0.316  10.429   0.153
  301    HE1  PHE  42           1HE      PHE  42  -1.228   5.549  -0.138
  302    HE2  PHE  42           2HE      PHE  42  -1.613   9.528  -1.738
  303    HZ   PHE  42           HZ       PHE  42  -2.137   7.110  -1.862
  304    H    ALA  43           H        ALA  43  -0.099   8.718   5.156
  305    HA   ALA  43           HA       ALA  43  -2.735   7.869   4.986
  306   1HB   ALA  43          1HB       ALA  43  -1.095   6.848   6.494
  307   2HB   ALA  43          2HB       ALA  43  -1.058   8.319   7.491
  308   3HB   ALA  43          3HB       ALA  43  -2.539   7.345   7.399
  309    H    GLU  44           H        GLU  44  -1.514  10.625   6.936
  310    HA   GLU  44           HA       GLU  44  -4.043  11.444   7.882
  311   1HB   GLU  44          1HB       GLU  44  -1.882  12.182   8.823
  312   2HB   GLU  44          2HB       GLU  44  -1.593  13.188   7.391
  313   1HG   GLU  44          1HG       GLU  44  -3.592  14.537   7.898
  314   2HG   GLU  44          2HG       GLU  44  -4.028  13.452   9.220
  315    H    ALA  45           H        ALA  45  -2.286  12.454   4.915
  316    HA   ALA  45           HA       ALA  45  -3.912  14.533   4.092
  317   1HB   ALA  45          1HB       ALA  45  -3.027  14.101   1.835
  318   2HB   ALA  45          2HB       ALA  45  -1.747  13.870   3.048
  319   3HB   ALA  45          3HB       ALA  45  -2.549  12.468   2.304
  320    H    HIS  46           H        HIS  46  -4.800  11.192   4.070
  321    HA   HIS  46           HA       HIS  46  -7.403  11.827   2.800
  322   1HB   HIS  46          1HB       HIS  46  -7.106   9.916   1.227
  323   2HB   HIS  46          2HB       HIS  46  -6.005  11.249   0.932
  324    HD1  HIS  46           1HD      HIS  46  -5.650   8.212   3.306
  325    HD2  HIS  46           2HD      HIS  46  -3.773  10.222   0.104
  326    HE1  HIS  46           1HE      HIS  46  -3.386   6.988   2.855
  327    HE2  HIS  46           2HE      HIS  46  -2.322   8.219   0.846
  328    H    ALA  47           H        ALA  47  -6.830  11.356   5.490
  329    HA   ALA  47           HA       ALA  47  -6.460   8.961   6.527
  330   1HB   ALA  47          1HB       ALA  47  -7.572   9.748   8.576
  331   2HB   ALA  47          2HB       ALA  47  -6.625  11.039   7.812
  332   3HB   ALA  47          3HB       ALA  47  -8.396  11.022   7.652
  333    H    ASP  48           H        ASP  48  -9.748   9.933   5.502
  334    HA   ASP  48           HA       ASP  48 -10.490   7.063   5.700
  335   1HB   ASP  48          1HB       ASP  48 -11.358   8.575   7.611
  336   2HB   ASP  48          2HB       ASP  48 -12.468   9.231   6.404
  337    H    LYS  49           H        LYS  49  -9.883   9.287   3.502
  338    HA   LYS  49           HA       LYS  49 -12.138   8.876   1.669
  339   1HB   LYS  49          1HB       LYS  49 -10.663  10.814   1.375
  340   2HB   LYS  49          2HB       LYS  49  -9.256   9.754   1.244
  341   1HG   LYS  49          1HG       LYS  49 -10.138   8.755  -0.822
  342   2HG   LYS  49          2HG       LYS  49 -11.590   9.759  -0.723
  343   1HD   LYS  49          1HD       LYS  49  -8.789  10.961  -0.876
  344   2HD   LYS  49          2HD       LYS  49  -9.655  10.378  -2.305
  345   1HE   LYS  49          1HE       LYS  49 -11.541  11.852  -1.848
  346   2HE   LYS  49          2HE       LYS  49 -10.692  12.558  -0.447
  347   1HZ   LYS  49          1HZ       LYS  49  -9.213  12.480  -2.919
  348   2HZ   LYS  49          2HZ       LYS  49 -10.530  13.353  -3.077
  349   3HZ   LYS  49          3HZ       LYS  49  -9.386  13.758  -1.889
  350    H    VAL  50           H        VAL  50  -9.147   7.239   2.601
  351    HA   VAL  50           HA       VAL  50  -9.941   4.917   0.912
  352    HB   VAL  50           HB       VAL  50  -7.645   4.248   0.693
  353   1HG1  VAL  50          1HG1      VAL  50  -7.826   7.197  -0.009
  354   2HG1  VAL  50          2HG1      VAL  50  -6.760   5.985  -0.749
  355   3HG1  VAL  50          3HG1      VAL  50  -8.513   5.881  -0.976
  356   1HG2  VAL  50          1HG2      VAL  50  -6.649   4.972   2.784
  357   2HG2  VAL  50          2HG2      VAL  50  -5.759   5.717   1.451
  358   3HG2  VAL  50          3HG2      VAL  50  -6.940   6.673   2.380
  359    H    THR  51           H        THR  51  -9.108   2.826   1.972
  360    HA   THR  51           HA       THR  51  -8.574   3.225   4.788
  361    HB   THR  51           HB       THR  51 -10.889   2.277   4.364
  362    HG1  THR  51           1HG      THR  51  -9.508   0.764   6.193
  363   1HG2  THR  51          1HG2      THR  51 -10.274   0.401   2.888
  364   2HG2  THR  51          2HG2      THR  51  -9.333  -0.326   4.212
  365   3HG2  THR  51          3HG2      THR  51 -11.092  -0.126   4.374
  366    H    VAL  52           H        VAL  52  -6.524   3.239   4.851
  367    HA   VAL  52           HA       VAL  52  -4.983   1.466   3.099
  368    HB   VAL  52           HB       VAL  52  -4.248   3.669   3.014
  369   1HG1  VAL  52          1HG1      VAL  52  -3.501   5.033   4.966
  370   2HG1  VAL  52          2HG1      VAL  52  -5.236   4.710   4.973
  371   3HG1  VAL  52          3HG1      VAL  52  -4.151   3.775   6.028
  372   1HG2  VAL  52          1HG2      VAL  52  -1.953   3.658   3.661
  373   2HG2  VAL  52          2HG2      VAL  52  -2.236   2.464   4.932
  374   3HG2  VAL  52          3HG2      VAL  52  -2.385   2.001   3.223
  375    H    ALA  53           H        ALA  53  -3.222   0.187   3.990
  376    HA   ALA  53           HA       ALA  53  -3.154  -0.090   6.865
  377   1HB   ALA  53          1HB       ALA  53  -3.092  -2.569   6.735
  378   2HB   ALA  53          2HB       ALA  53  -4.699  -1.917   6.334
  379   3HB   ALA  53          3HB       ALA  53  -3.613  -2.469   5.032
  380    H    LYS  54           H        LYS  54  -1.089  -1.077   7.491
  381    HA   LYS  54           HA       LYS  54   0.851  -1.299   5.273
  382   1HB   LYS  54          1HB       LYS  54   2.617  -0.300   6.637
  383   2HB   LYS  54          2HB       LYS  54   1.336   0.835   6.222
  384   1HG   LYS  54          1HG       LYS  54   0.371   0.527   8.537
  385   2HG   LYS  54          2HG       LYS  54   1.773  -0.488   8.937
  386   1HD   LYS  54          1HD       LYS  54   3.291   1.406   8.451
  387   2HD   LYS  54          2HD       LYS  54   1.904   2.408   7.971
  388   1HE   LYS  54          1HE       LYS  54   0.962   2.160  10.274
  389   2HE   LYS  54          2HE       LYS  54   2.402   1.247  10.748
  390   1HZ   LYS  54          1HZ       LYS  54   2.566   3.581  11.362
  391   2HZ   LYS  54          2HZ       LYS  54   3.727   3.214  10.262
  392   3HZ   LYS  54          3HZ       LYS  54   2.393   4.057   9.806
  393    H    LEU  55           H        LEU  55   2.178  -3.076   5.416
  394    HA   LEU  55           HA       LEU  55   2.001  -4.793   7.817
  395   1HB   LEU  55          1HB       LEU  55   1.081  -6.665   6.596
  396   2HB   LEU  55          2HB       LEU  55  -0.018  -5.307   6.589
  397    HG   LEU  55           HG       LEU  55   1.577  -5.037   4.199
  398   1HD1  LEU  55          1HD1      LEU  55   0.500  -7.858   4.582
  399   2HD1  LEU  55          2HD1      LEU  55   1.122  -7.177   3.073
  400   3HD1  LEU  55          3HD1      LEU  55   2.214  -7.398   4.450
  401   1HD2  LEU  55          1HD2      LEU  55  -0.538  -5.358   3.049
  402   2HD2  LEU  55          2HD2      LEU  55  -1.281  -5.996   4.514
  403   3HD2  LEU  55          3HD2      LEU  55  -0.749  -4.294   4.448
  404    H    ASN  56           H        ASN  56   3.480  -6.554   7.804
  405    HA   ASN  56           HA       ASN  56   5.925  -5.837   6.362
  406   1HB   ASN  56          1HB       ASN  56   5.793  -6.488   8.860
  407   2HB   ASN  56          2HB       ASN  56   5.632  -8.156   8.293
  408   1HD2  ASN  56          1HD2      ASN  56   7.862  -5.768   9.161
  409   2HD2  ASN  56          2HD2      ASN  56   9.268  -6.480   8.413
  410    H    VAL  57           H        VAL  57   6.299  -6.669   4.419
  411    HA   VAL  57           HA       VAL  57   4.635  -8.521   3.162
  412    HB   VAL  57           HB       VAL  57   6.146  -6.724   2.266
  413   1HG1  VAL  57          1HG1      VAL  57   8.293  -7.608   3.242
  414   2HG1  VAL  57          2HG1      VAL  57   8.206  -8.984   2.127
  415   3HG1  VAL  57          3HG1      VAL  57   8.392  -7.355   1.485
  416   1HG2  VAL  57          1HG2      VAL  57   6.276  -7.672   0.101
  417   2HG2  VAL  57          2HG2      VAL  57   6.150  -9.326   0.745
  418   3HG2  VAL  57          3HG2      VAL  57   4.772  -8.219   0.861
  419    H    ASP  58           H        ASP  58   7.484  -9.122   5.176
  420    HA   ASP  58           HA       ASP  58   8.159 -11.738   4.203
  421   1HB   ASP  58          1HB       ASP  58   9.544 -10.100   5.584
  422   2HB   ASP  58          2HB       ASP  58   8.578 -10.599   6.969
  423    H    GLU  59           H        GLU  59   5.829 -10.461   6.472
  424    HA   GLU  59           HA       GLU  59   5.227 -13.044   7.723
  425   1HB   GLU  59          1HB       GLU  59   5.275 -10.846   8.917
  426   2HB   GLU  59          2HB       GLU  59   3.819 -10.387   8.017
  427   1HG   GLU  59          1HG       GLU  59   2.615 -12.327   8.974
  428   2HG   GLU  59          2HG       GLU  59   4.069 -12.815   9.843
  429    H    ASN  60           H        ASN  60   4.030 -11.132   5.048
  430    HA   ASN  60           HA       ASN  60   1.589 -12.835   4.846
  431   1HB   ASN  60          1HB       ASN  60   0.790 -10.671   5.204
  432   2HB   ASN  60          2HB       ASN  60   2.074  -9.941   4.249
  433   1HD2  ASN  60          1HD2      ASN  60  -0.199 -12.684   3.199
  434   2HD2  ASN  60          2HD2      ASN  60  -0.591 -11.778   1.750
  435    HA   PRO  61           HA       PRO  61   3.966 -13.991   1.096
  436   1HB   PRO  61          1HB       PRO  61   3.489 -16.683   1.177
  437   2HB   PRO  61          2HB       PRO  61   4.800 -15.892   2.100
  438   1HG   PRO  61          1HG       PRO  61   2.031 -16.647   3.089
  439   2HG   PRO  61          2HG       PRO  61   3.612 -17.004   3.857
  440   1HD   PRO  61          1HD       PRO  61   2.107 -14.883   4.638
  441   2HD   PRO  61          2HD       PRO  61   3.874 -14.745   4.559
  442    H    GLU  62           H        GLU  62   0.571 -14.564   2.213
  443    HA   GLU  62           HA       GLU  62  -0.302 -15.645  -0.279
  444   1HB   GLU  62          1HB       GLU  62  -1.380 -15.897   1.965
  445   2HB   GLU  62          2HB       GLU  62  -2.011 -14.255   1.830
  446   1HG   GLU  62          1HG       GLU  62  -2.519 -16.116  -0.483
  447   2HG   GLU  62          2HG       GLU  62  -3.292 -16.547   1.033
  448    H    THR  63           H        THR  63  -0.946 -14.672  -2.083
  449    HA   THR  63           HA       THR  63  -1.311 -13.253  -3.731
  450    HB   THR  63           HB       THR  63  -2.167 -11.336  -1.538
  451    HG1  THR  63           1HG      THR  63  -3.552 -13.058  -1.683
  452   1HG2  THR  63          1HG2      THR  63  -2.585 -11.072  -4.539
  453   2HG2  THR  63          2HG2      THR  63  -3.306 -10.067  -3.270
  454   3HG2  THR  63          3HG2      THR  63  -1.559 -10.002  -3.543
  455    H    THR  64           H        THR  64   0.760 -12.121  -1.239
  456    HA   THR  64           HA       THR  64   2.512 -10.371  -2.596
  457    HB   THR  64           HB       THR  64   3.054 -12.475  -0.486
  458    HG1  THR  64           1HG      THR  64   2.603 -10.968   0.898
  459   1HG2  THR  64          1HG2      THR  64   5.230 -11.731  -1.505
  460   2HG2  THR  64          2HG2      THR  64   4.813 -10.076  -1.006
  461   3HG2  THR  64          3HG2      THR  64   5.023 -11.343   0.207
  462    H    SER  65           H        SER  65   2.756 -13.938  -2.229
  463    HA   SER  65           HA       SER  65   4.883 -14.242  -4.124
  464   1HB   SER  65          1HB       SER  65   4.397 -15.808  -2.245
  465   2HB   SER  65          2HB       SER  65   2.896 -16.293  -3.065
  466    HG   SER  65           HG       SER  65   4.404 -16.685  -4.923
  467    H    GLN  66           H        GLN  66   1.700 -13.337  -4.848
  468    HA   GLN  66           HA       GLN  66   1.623 -14.930  -7.350
  469   1HB   GLN  66          1HB       GLN  66  -0.278 -14.947  -5.586
  470   2HB   GLN  66          2HB       GLN  66  -0.629 -13.306  -6.122
  471   1HG   GLN  66          1HG       GLN  66  -2.081 -14.850  -7.298
  472   2HG   GLN  66          2HG       GLN  66  -0.957 -14.135  -8.449
  473   1HE2  GLN  66          1HE2      GLN  66  -1.145 -17.072  -6.258
  474   2HE2  GLN  66          2HE2      GLN  66  -0.446 -18.125  -7.484
  475    H    PHE  67           H        PHE  67   1.572 -11.544  -6.036
  476    HA   PHE  67           HA       PHE  67   1.669 -10.572  -8.847
  477   1HB   PHE  67          1HB       PHE  67   1.179  -9.142  -6.229
  478   2HB   PHE  67          2HB       PHE  67   1.275  -8.351  -7.797
  479    HD1  PHE  67           1HD      PHE  67  -0.321 -10.231  -9.555
  480    HD2  PHE  67           2HD      PHE  67  -1.039  -8.742  -5.563
  481    HE1  PHE  67           1HE      PHE  67  -2.742 -10.526  -9.878
  482    HE2  PHE  67           2HE      PHE  67  -3.475  -9.048  -5.907
  483    HZ   PHE  67           HZ       PHE  67  -4.333  -9.932  -8.061
  484    H    GLY  68           H        GLY  68   3.939 -11.873  -7.141
  485   1HA   GLY  68          1HA       GLY  68   6.236 -11.743  -7.282
  486   2HA   GLY  68          2HA       GLY  68   6.010 -10.519  -8.543
  487    H    ILE  69           H        ILE  69   4.867 -10.294  -5.188
  488    HA   ILE  69           HA       ILE  69   5.857  -7.588  -4.961
  489    HB   ILE  69           HB       ILE  69   4.482  -9.458  -3.036
  490   1HG1  ILE  69          1HG1      ILE  69   3.070  -9.126  -4.977
  491   2HG1  ILE  69          2HG1      ILE  69   2.375  -8.366  -3.562
  492   1HG2  ILE  69          1HG2      ILE  69   3.815  -7.627  -1.696
  493   2HG2  ILE  69          2HG2      ILE  69   5.555  -7.536  -1.878
  494   3HG2  ILE  69          3HG2      ILE  69   4.542  -6.429  -2.794
  495   1HD1  ILE  69          1HD1      ILE  69   2.136  -6.992  -5.597
  496   2HD1  ILE  69          2HD1      ILE  69   3.020  -6.156  -4.321
  497   3HD1  ILE  69          3HD1      ILE  69   3.899  -6.838  -5.711
  498    H    MET  70           H        MET  70   8.080  -8.147  -5.321
  499    HA   MET  70           HA       MET  70   9.546  -8.754  -2.789
  500   1HB   MET  70          1HB       MET  70   9.370 -10.678  -4.460
  501   2HB   MET  70          2HB       MET  70  10.391  -9.725  -5.546
  502   1HG   MET  70          1HG       MET  70  12.167  -9.692  -3.806
  503   2HG   MET  70          2HG       MET  70  11.102 -10.569  -2.702
  504   1HE   MET  70          1HE       MET  70  13.053 -12.293  -2.243
  505   2HE   MET  70          2HE       MET  70  13.929 -13.154  -3.528
  506   3HE   MET  70          3HE       MET  70  14.095 -11.391  -3.368
  507    H    SER  71           H        SER  71   8.866  -6.157  -3.654
  508    HA   SER  71           HA       SER  71  11.529  -4.982  -3.732
  509   1HB   SER  71          1HB       SER  71   9.599  -4.535  -6.043
  510   2HB   SER  71          2HB       SER  71  11.001  -3.500  -5.697
  511    HG   SER  71           HG       SER  71  11.556  -6.213  -5.711
  512    H    ILE  72           H        ILE  72  10.202  -4.883  -1.565
  513    HA   ILE  72           HA       ILE  72   8.282  -2.833  -1.357
  514    HB   ILE  72           HB       ILE  72   8.686  -2.870   1.026
  515   1HG1  ILE  72          1HG1      ILE  72  11.135  -3.166   1.019
  516   2HG1  ILE  72          2HG1      ILE  72  10.233  -4.101   2.180
  517   1HG2  ILE  72          1HG2      ILE  72   7.875  -5.083   1.433
  518   2HG2  ILE  72          2HG2      ILE  72   7.184  -4.448  -0.068
  519   3HG2  ILE  72          3HG2      ILE  72   8.469  -5.652  -0.152
  520   1HD1  ILE  72          1HD1      ILE  72  11.546  -5.159  -0.355
  521   2HD1  ILE  72          2HD1      ILE  72  12.058  -5.401   1.314
  522   3HD1  ILE  72          3HD1      ILE  72  10.551  -6.140   0.754
  523    HA   PRO  73           HA       PRO  73   7.854  -1.040   0.434
  524   1HB   PRO  73          1HB       PRO  73   7.185   1.529  -0.045
  525   2HB   PRO  73          2HB       PRO  73   8.289   1.037   1.264
  526   1HG   PRO  73          1HG       PRO  73   9.023   2.095  -1.478
  527   2HG   PRO  73          2HG       PRO  73   9.717   2.560   0.106
  528   1HD   PRO  73          1HD       PRO  73  10.904   0.755  -1.577
  529   2HD   PRO  73          2HD       PRO  73  11.021   0.606   0.200
  530    H    THR  74           H        THR  74   6.121  -1.850  -0.598
  531    HA   THR  74           HA       THR  74   5.586  -1.055  -3.430
  532    HB   THR  74           HB       THR  74   4.881  -3.714  -2.141
  533    HG1  THR  74           1HG      THR  74   7.177  -2.942  -3.527
  534   1HG2  THR  74          1HG2      THR  74   3.355  -3.258  -3.899
  535   2HG2  THR  74          2HG2      THR  74   4.636  -2.696  -4.975
  536   3HG2  THR  74          3HG2      THR  74   4.550  -4.406  -4.526
  537    H    LEU  75           H        LEU  75   3.548  -0.232  -3.820
  538    HA   LEU  75           HA       LEU  75   1.720   0.093  -1.482
  539   1HB   LEU  75          1HB       LEU  75   3.187   2.110  -1.893
  540   2HB   LEU  75          2HB       LEU  75   2.464   2.282  -3.468
  541    HG   LEU  75           HG       LEU  75   0.569   1.950  -1.132
  542   1HD1  LEU  75          1HD1      LEU  75   0.743   4.350  -0.586
  543   2HD1  LEU  75          2HD1      LEU  75   2.217   3.461  -0.224
  544   3HD1  LEU  75          3HD1      LEU  75   2.155   4.467  -1.677
  545   1HD2  LEU  75          1HD2      LEU  75  -0.386   2.229  -3.386
  546   2HD2  LEU  75          2HD2      LEU  75  -0.722   3.657  -2.408
  547   3HD2  LEU  75          3HD2      LEU  75   0.561   3.713  -3.631
  548    H    ILE  76           H        ILE  76  -0.241  -0.770  -2.081
  549    HA   ILE  76           HA       ILE  76  -0.908  -0.693  -4.995
  550    HB   ILE  76           HB       ILE  76  -1.284  -3.080  -3.158
  551   1HG1  ILE  76          1HG1      ILE  76   0.692  -2.447  -5.375
  552   2HG1  ILE  76          2HG1      ILE  76   1.010  -3.022  -3.744
  553   1HG2  ILE  76          1HG2      ILE  76  -1.978  -2.759  -6.114
  554   2HG2  ILE  76          2HG2      ILE  76  -2.166  -4.232  -5.139
  555   3HG2  ILE  76          3HG2      ILE  76  -3.153  -2.844  -4.780
  556   1HD1  ILE  76          1HD1      ILE  76   1.499  -4.741  -5.328
  557   2HD1  ILE  76          2HD1      ILE  76   0.065  -5.252  -4.400
  558   3HD1  ILE  76          3HD1      ILE  76  -0.094  -4.643  -6.068
  559    H    LEU  77           H        LEU  77  -3.078  -0.479  -5.424
  560    HA   LEU  77           HA       LEU  77  -4.831   0.072  -3.106
  561   1HB   LEU  77          1HB       LEU  77  -3.938   2.129  -4.423
  562   2HB   LEU  77          2HB       LEU  77  -5.091   1.659  -5.675
  563    HG   LEU  77           HG       LEU  77  -5.825   2.074  -2.754
  564   1HD1  LEU  77          1HD1      LEU  77  -6.554   4.365  -3.387
  565   2HD1  LEU  77          2HD1      LEU  77  -4.810   4.105  -3.455
  566   3HD1  LEU  77          3HD1      LEU  77  -5.734   4.144  -4.955
  567   1HD2  LEU  77          1HD2      LEU  77  -8.103   2.604  -3.695
  568   2HD2  LEU  77          2HD2      LEU  77  -7.497   2.178  -5.313
  569   3HD2  LEU  77          3HD2      LEU  77  -7.620   0.954  -4.040
  570    H    PHE  78           H        PHE  78  -6.753  -0.986  -3.251
  571    HA   PHE  78           HA       PHE  78  -7.130  -2.769  -5.599
  572   1HB   PHE  78          1HB       PHE  78  -7.526  -3.313  -2.641
  573   2HB   PHE  78          2HB       PHE  78  -8.103  -4.373  -3.899
  574    HD1  PHE  78           1HD      PHE  78  -6.698  -5.944  -5.008
  575    HD2  PHE  78           2HD      PHE  78  -5.034  -3.117  -2.203
  576    HE1  PHE  78           1HE      PHE  78  -4.645  -7.298  -4.869
  577    HE2  PHE  78           2HE      PHE  78  -2.973  -4.497  -2.068
  578    HZ   PHE  78           HZ       PHE  78  -2.767  -6.579  -3.399
  579    H    LYS  79           H        LYS  79  -9.269  -3.327  -6.114
  580    HA   LYS  79           HA       LYS  79 -11.376  -2.981  -4.301
  581   1HB   LYS  79          1HB       LYS  79 -12.876  -1.593  -5.849
  582   2HB   LYS  79          2HB       LYS  79 -11.735  -0.807  -4.768
  583   1HG   LYS  79          1HG       LYS  79 -10.178  -0.469  -6.734
  584   2HG   LYS  79          2HG       LYS  79 -11.425  -1.180  -7.776
  585   1HD   LYS  79          1HD       LYS  79 -11.464   1.279  -7.831
  586   2HD   LYS  79          2HD       LYS  79 -12.974   0.646  -7.169
  587   1HE   LYS  79          1HE       LYS  79 -10.953   1.089  -5.065
  588   2HE   LYS  79          2HE       LYS  79 -11.213   2.557  -6.008
  589   1HZ   LYS  79          1HZ       LYS  79 -13.351   0.996  -4.681
  590   2HZ   LYS  79          2HZ       LYS  79 -12.715   2.409  -4.132
  591   3HZ   LYS  79          3HZ       LYS  79 -13.574   2.377  -5.540
  592    H    GLY  80           H        GLY  80 -13.185  -4.173  -4.958
  593   1HA   GLY  80          1HA       GLY  80 -14.220  -5.988  -5.944
  594   2HA   GLY  80          2HA       GLY  80 -13.366  -5.660  -7.461
  595    H    GLY  81           H        GLY  81 -11.397  -5.860  -4.588
  596   1HA   GLY  81          1HA       GLY  81  -9.737  -7.339  -3.979
  597   2HA   GLY  81          2HA       GLY  81 -10.514  -8.607  -4.931
  598    H    GLU  82           H        GLU  82 -10.153  -6.001  -7.096
  599    HA   GLU  82           HA       GLU  82  -7.809  -7.271  -8.299
  600   1HB   GLU  82          1HB       GLU  82  -9.825  -6.778  -9.649
  601   2HB   GLU  82          2HB       GLU  82  -9.661  -5.056  -9.277
  602   1HG   GLU  82          1HG       GLU  82  -7.444  -5.023 -10.407
  603   2HG   GLU  82          2HG       GLU  82  -7.607  -6.746 -10.763
  604    HA   PRO  83           HA       PRO  83  -5.340  -3.748  -6.715
  605   1HB   PRO  83          1HB       PRO  83  -2.974  -4.272  -7.955
  606   2HB   PRO  83          2HB       PRO  83  -3.579  -5.258  -6.590
  607   1HG   PRO  83          1HG       PRO  83  -3.793  -5.883  -9.545
  608   2HG   PRO  83          2HG       PRO  83  -3.245  -6.948  -8.218
  609   1HD   PRO  83          1HD       PRO  83  -5.808  -6.969  -9.185
  610   2HD   PRO  83          2HD       PRO  83  -5.449  -7.290  -7.462
  611    H    VAL  84           H        VAL  84  -6.481  -1.993  -7.746
  612    HA   VAL  84           HA       VAL  84  -6.708  -1.747 -10.558
  613    HB   VAL  84           HB       VAL  84  -7.261   0.664  -9.914
  614   1HG1  VAL  84          1HG1      VAL  84  -8.941  -1.612  -8.775
  615   2HG1  VAL  84          2HG1      VAL  84  -9.536   0.006  -9.232
  616   3HG1  VAL  84          3HG1      VAL  84  -8.920  -1.095 -10.470
  617   1HG2  VAL  84          1HG2      VAL  84  -7.498  -0.390  -7.092
  618   2HG2  VAL  84          2HG2      VAL  84  -6.243   0.746  -7.657
  619   3HG2  VAL  84          3HG2      VAL  84  -7.949   1.204  -7.701
  620    H    LYS  85           H        LYS  85  -4.293  -0.490  -8.297
  621    HA   LYS  85           HA       LYS  85  -2.485  -0.707 -10.481
  622   1HB   LYS  85          1HB       LYS  85  -1.433   1.505 -10.480
  623   2HB   LYS  85          2HB       LYS  85  -3.098   1.551 -11.003
  624   1HG   LYS  85          1HG       LYS  85  -3.311   2.135  -8.267
  625   2HG   LYS  85          2HG       LYS  85  -1.779   2.873  -8.719
  626   1HD   LYS  85          1HD       LYS  85  -4.549   3.414  -9.842
  627   2HD   LYS  85          2HD       LYS  85  -3.496   4.538  -8.995
  628   1HE   LYS  85          1HE       LYS  85  -3.070   3.428 -11.803
  629   2HE   LYS  85          2HE       LYS  85  -3.626   5.065 -11.371
  630   1HZ   LYS  85          1HZ       LYS  85  -1.001   3.992 -10.593
  631   2HZ   LYS  85          2HZ       LYS  85  -1.243   5.009 -11.879
  632   3HZ   LYS  85          3HZ       LYS  85  -1.615   5.531 -10.407
  633    H    GLN  86           H        GLN  86  -0.249  -0.525  -9.884
  634    HA   GLN  86           HA       GLN  86   0.370  -1.000  -7.025
  635   1HB   GLN  86          1HB       GLN  86   0.704  -3.102  -7.962
  636   2HB   GLN  86          2HB       GLN  86   1.115  -2.493  -9.549
  637   1HG   GLN  86          1HG       GLN  86   3.137  -1.904  -7.395
  638   2HG   GLN  86          2HG       GLN  86   2.910  -3.568  -7.800
  639   1HE2  GLN  86          1HE2      GLN  86   3.005  -0.597 -10.012
  640   2HE2  GLN  86          2HE2      GLN  86   4.259  -1.369 -10.984
  641    H    LEU  87           H        LEU  87   2.072   0.182  -6.241
  642    HA   LEU  87           HA       LEU  87   3.824   1.688  -8.064
  643   1HB   LEU  87          1HB       LEU  87   2.330   2.418  -5.529
  644   2HB   LEU  87          2HB       LEU  87   3.953   3.036  -5.725
  645    HG   LEU  87           HG       LEU  87   2.430   4.703  -6.376
  646   1HD1  LEU  87          1HD1      LEU  87   3.389   3.630  -9.049
  647   2HD1  LEU  87          2HD1      LEU  87   3.362   5.301  -8.425
  648   3HD1  LEU  87          3HD1      LEU  87   4.537   4.162  -7.798
  649   1HD2  LEU  87          1HD2      LEU  87   0.504   3.132  -6.882
  650   2HD2  LEU  87          2HD2      LEU  87   0.688   4.529  -7.967
  651   3HD2  LEU  87          3HD2      LEU  87   1.199   2.919  -8.500
  652    H    ILE  88           H        ILE  88   5.992   1.785  -7.280
  653    HA   ILE  88           HA       ILE  88   6.804  -0.019  -5.142
  654    HB   ILE  88           HB       ILE  88   8.590  -0.661  -7.190
  655   1HG1  ILE  88          1HG1      ILE  88   7.251  -1.780  -8.955
  656   2HG1  ILE  88          2HG1      ILE  88   5.794  -0.984  -8.381
  657   1HG2  ILE  88          1HG2      ILE  88   6.188  -2.338  -6.427
  658   2HG2  ILE  88          2HG2      ILE  88   7.795  -2.896  -6.921
  659   3HG2  ILE  88          3HG2      ILE  88   7.587  -2.082  -5.366
  660   1HD1  ILE  88          1HD1      ILE  88   6.718   0.044 -10.404
  661   2HD1  ILE  88          2HD1      ILE  88   6.711   1.205  -9.071
  662   3HD1  ILE  88          3HD1      ILE  88   8.234   0.406  -9.546
  663    H    GLY  89           H        GLY  89   8.323   0.976  -4.017
  664   1HA   GLY  89          1HA       GLY  89  10.353   2.081  -3.689
  665   2HA   GLY  89          2HA       GLY  89  10.292   2.748  -5.326
  666    H    TYR  90           H        TYR  90  11.020   4.312  -3.233
  667    HA   TYR  90           HA       TYR  90   9.011   5.834  -1.926
  668   1HB   TYR  90          1HB       TYR  90  11.335   5.726  -1.184
  669   2HB   TYR  90          2HB       TYR  90  11.862   6.470  -2.689
  670    HD1  TYR  90           1HD      TYR  90  11.371   8.887  -3.167
  671    HD2  TYR  90           2HD      TYR  90  10.477   7.067   0.639
  672    HE1  TYR  90           1HE      TYR  90  11.093  11.133  -2.156
  673    HE2  TYR  90           2HE      TYR  90  10.211   9.306   1.652
  674    HH   TYR  90           HH       TYR  90  10.196  11.615   1.273
  675    H    GLN  91           H        GLN  91   7.762   7.610  -2.618
  676    HA   GLN  91           HA       GLN  91   8.610   9.084  -4.987
  677   1HB   GLN  91          1HB       GLN  91   5.752   8.204  -4.402
  678   2HB   GLN  91          2HB       GLN  91   6.279   9.177  -5.723
  679   1HG   GLN  91          1HG       GLN  91   6.805   7.420  -7.034
  680   2HG   GLN  91          2HG       GLN  91   7.603   6.528  -5.748
  681   1HE2  GLN  91          1HE2      GLN  91   6.519   4.784  -4.792
  682   2HE2  GLN  91          2HE2      GLN  91   4.783   4.549  -5.007
  683    HA   PRO  92           HA       PRO  92   7.401  12.296  -1.973
  684   1HB   PRO  92          1HB       PRO  92   7.078  14.454  -3.633
  685   2HB   PRO  92          2HB       PRO  92   8.687  13.807  -3.182
  686   1HG   PRO  92          1HG       PRO  92   7.086  13.247  -5.693
  687   2HG   PRO  92          2HG       PRO  92   8.818  13.691  -5.562
  688   1HD   PRO  92          1HD       PRO  92   7.990  11.101  -5.834
  689   2HD   PRO  92          2HD       PRO  92   9.411  11.524  -4.834
  690    H    LYS  93           H        LYS  93   5.361  13.546  -1.512
  691    HA   LYS  93           HA       LYS  93   3.065  11.908  -2.186
  692   1HB   LYS  93          1HB       LYS  93   3.685  14.124  -0.391
  693   2HB   LYS  93          2HB       LYS  93   2.194  14.455  -1.247
  694   1HG   LYS  93          1HG       LYS  93   1.553  13.338   0.704
  695   2HG   LYS  93          2HG       LYS  93   1.296  12.203  -0.611
  696   1HD   LYS  93          1HD       LYS  93   3.784  12.137   1.161
  697   2HD   LYS  93          2HD       LYS  93   2.280  11.400   1.611
  698   1HE   LYS  93          1HE       LYS  93   3.318   9.580   0.766
  699   2HE   LYS  93          2HE       LYS  93   2.483  10.128  -0.697
  700   1HZ   LYS  93          1HZ       LYS  93   4.827   9.631  -1.149
  701   2HZ   LYS  93          2HZ       LYS  93   4.589  11.250  -1.274
  702   3HZ   LYS  93          3HZ       LYS  93   5.301  10.628   0.062
  703    H    GLU  94           H        GLU  94   4.155  15.032  -3.336
  704    HA   GLU  94           HA       GLU  94   2.099  15.625  -5.117
  705   1HB   GLU  94          1HB       GLU  94   5.109  15.949  -5.544
  706   2HB   GLU  94          2HB       GLU  94   3.871  16.856  -6.416
  707   1HG   GLU  94          1HG       GLU  94   3.220  18.071  -4.447
  708   2HG   GLU  94          2HG       GLU  94   4.148  17.011  -3.381
  709    H    GLN  95           H        GLN  95   4.318  12.884  -5.420
  710    HA   GLN  95           HA       GLN  95   3.574  12.541  -8.271
  711   1HB   GLN  95          1HB       GLN  95   5.961  12.336  -7.626
  712   2HB   GLN  95          2HB       GLN  95   5.588  11.115  -6.468
  713   1HG   GLN  95          1HG       GLN  95   6.539  10.174  -8.550
  714   2HG   GLN  95          2HG       GLN  95   4.967   9.501  -8.155
  715   1HE2  GLN  95          1HE2      GLN  95   3.019  10.436  -9.397
  716   2HE2  GLN  95          2HE2      GLN  95   3.363  10.989 -11.043
  717    H    LEU  96           H        LEU  96   3.768  10.886  -5.203
  718    HA   LEU  96           HA       LEU  96   2.394   8.486  -5.825
  719   1HB   LEU  96          1HB       LEU  96   3.811   9.304  -3.788
  720   2HB   LEU  96          2HB       LEU  96   2.257   9.702  -3.108
  721    HG   LEU  96           HG       LEU  96   2.872   6.925  -4.224
  722   1HD1  LEU  96          1HD1      LEU  96   4.562   7.491  -2.495
  723   2HD1  LEU  96          2HD1      LEU  96   3.244   7.847  -1.345
  724   3HD1  LEU  96          3HD1      LEU  96   3.455   6.214  -1.977
  725   1HD2  LEU  96          1HD2      LEU  96   0.463   7.449  -3.744
  726   2HD2  LEU  96          2HD2      LEU  96   1.102   6.171  -2.707
  727   3HD2  LEU  96          3HD2      LEU  96   0.933   7.809  -2.066
  728    H    GLU  97           H        GLU  97   1.027  11.430  -4.219
  729    HA   GLU  97           HA       GLU  97  -1.673  10.521  -4.211
  730   1HB   GLU  97          1HB       GLU  97  -0.403  12.439  -2.915
  731   2HB   GLU  97          2HB       GLU  97  -0.783  13.402  -4.340
  732   1HG   GLU  97          1HG       GLU  97  -2.492  13.889  -2.811
  733   2HG   GLU  97          2HG       GLU  97  -3.247  12.759  -3.934
  734    H    ALA  98           H        ALA  98   0.380  12.041  -6.694
  735    HA   ALA  98           HA       ALA  98  -1.919  12.826  -8.352
  736   1HB   ALA  98          1HB       ALA  98   1.047  12.687  -9.046
  737   2HB   ALA  98          2HB       ALA  98  -0.238  13.365 -10.065
  738   3HB   ALA  98          3HB       ALA  98   0.142  14.123  -8.512
  739    H    GLN  99           H        GLN  99   0.524  10.217  -8.378
  740    HA   GLN  99           HA       GLN  99  -0.446   8.876 -10.717
  741   1HB   GLN  99          1HB       GLN  99   1.819   8.629  -9.584
  742   2HB   GLN  99          2HB       GLN  99   1.043   7.755  -8.282
  743   1HG   GLN  99          1HG       GLN  99   2.116   6.224  -9.881
  744   2HG   GLN  99          2HG       GLN  99   0.396   5.949  -9.773
  745   1HE2  GLN  99          1HE2      GLN  99   2.545   8.198 -11.724
  746   2HE2  GLN  99          2HE2      GLN  99   1.809   7.727 -13.248
  747    H    LEU 100           H        LEU 100  -1.286   8.698  -7.312
  748    HA   LEU 100           HA       LEU 100  -3.216   6.513  -7.783
  749   1HB   LEU 100          1HB       LEU 100  -1.606   7.410  -5.612
  750   2HB   LEU 100          2HB       LEU 100  -3.256   7.677  -5.130
  751    HG   LEU 100           HG       LEU 100  -3.680   5.218  -5.771
  752   1HD1  LEU 100          1HD1      LEU 100  -0.627   5.191  -5.987
  753   2HD1  LEU 100          2HD1      LEU 100  -1.700   3.774  -6.070
  754   3HD1  LEU 100          3HD1      LEU 100  -1.729   4.985  -7.358
  755   1HD2  LEU 100          1HD2      LEU 100  -3.166   5.887  -3.438
  756   2HD2  LEU 100          2HD2      LEU 100  -2.488   4.300  -3.815
  757   3HD2  LEU 100          3HD2      LEU 100  -1.429   5.729  -3.759
  758    H    ALA 101           H        ALA 101  -3.432   9.722  -8.493
  759    HA   ALA 101           HA       ALA 101  -5.577  10.673  -7.040
  760   1HB   ALA 101          1HB       ALA 101  -5.817  12.350  -8.828
  761   2HB   ALA 101          2HB       ALA 101  -4.119  12.085  -8.413
  762   3HB   ALA 101          3HB       ALA 101  -4.794  11.370  -9.898
  763    H    ASP 102           H        ASP 102  -5.863   8.287  -9.714
  764    HA   ASP 102           HA       ASP 102  -8.615   9.011 -10.263
  765   1HB   ASP 102          1HB       ASP 102  -7.800   6.127 -10.547
  766   2HB   ASP 102          2HB       ASP 102  -8.609   7.171 -11.705
  767    H    VAL 103           H        VAL 103  -7.119   7.308  -7.647
  768    HA   VAL 103           HA       VAL 103  -9.772   6.576  -6.550
  769    HB   VAL 103           HB       VAL 103  -7.923   4.872  -5.401
  770   1HG1  VAL 103          1HG1      VAL 103  -9.726   4.340  -7.791
  771   2HG1  VAL 103          2HG1      VAL 103  -9.113   3.115  -6.661
  772   3HG1  VAL 103          3HG1      VAL 103 -10.228   4.372  -6.087
  773   1HG2  VAL 103          1HG2      VAL 103  -6.745   3.653  -7.139
  774   2HG2  VAL 103          2HG2      VAL 103  -7.276   4.802  -8.372
  775   3HG2  VAL 103          3HG2      VAL 103  -6.167   5.321  -7.082
  776    H    LEU 104           H        LEU 104  -7.040   8.522  -6.113
  777    HA   LEU 104           HA       LEU 104  -8.040   9.146  -3.432
  778   1HB   LEU 104          1HB       LEU 104  -5.431   9.488  -4.925
  779   2HB   LEU 104          2HB       LEU 104  -5.830  10.633  -3.698
  780    HG   LEU 104           HG       LEU 104  -4.418   8.839  -2.809
  781   1HD1  LEU 104          1HD1      LEU 104  -5.718   8.289  -0.839
  782   2HD1  LEU 104          2HD1      LEU 104  -6.127   9.952  -1.358
  783   3HD1  LEU 104          3HD1      LEU 104  -7.241   8.604  -1.666
  784   1HD2  LEU 104          1HD2      LEU 104  -5.085   6.578  -2.530
  785   2HD2  LEU 104          2HD2      LEU 104  -6.676   6.865  -3.221
  786   3HD2  LEU 104          3HD2      LEU 104  -5.247   6.957  -4.263
  787    H    GLN 105           H        GLN 105  -8.875  10.002  -6.456
  788    HA   GLN 105           HA       GLN 105  -9.333  12.737  -6.446
  789   1HB   GLN 105          2HB       GLN 105  -9.936  11.603  -8.384
  790   2HB   GLN 105          3HB       GLN 105 -10.746  10.336  -7.518
  791   1HG   GLN 105          2HG       GLN 105 -12.406  11.579  -8.673
  792   2HG   GLN 105          3HG       GLN 105 -12.629  11.960  -6.982
  793   1HE2  GLN 105          1HE2      GLN 105 -11.401  14.108  -6.233
  794   2HE2  GLN 105          2HE2      GLN 105 -11.508  15.420  -7.430
  Start of MODEL    7
    1   1H    ALA   1           H        ALA   1  -9.766   4.656   5.718
    2   2H    ALA   1          2HN       ALA   1 -10.232   3.077   5.906
    3   3H    ALA   1          3HN       ALA   1 -11.220   4.317   6.419
    4    HA   ALA   1           HA       ALA   1  -9.618   4.992   8.031
    5   1HB   ALA   1          1HB       ALA   1  -9.986   3.117   9.592
    6   2HB   ALA   1          2HB       ALA   1 -11.446   3.428   8.635
    7   3HB   ALA   1          3HB       ALA   1 -10.396   2.048   8.230
    8    H    THR   2           H        THR   2  -7.822   3.734   9.533
    9    HA   THR   2           HA       THR   2  -5.822   2.481   7.761
   10    HB   THR   2           HB       THR   2  -5.229   4.407  10.028
   11    HG1  THR   2           1HG      THR   2  -4.918   5.924   8.568
   12   1HG2  THR   2          1HG2      THR   2  -2.901   4.252   9.071
   13   2HG2  THR   2          2HG2      THR   2  -3.461   2.728   9.780
   14   3HG2  THR   2          3HG2      THR   2  -3.452   2.928   8.020
   15    H    MET   3           H        MET   3  -4.879   0.612   8.652
   16    HA   MET   3           HA       MET   3  -5.446  -0.148  11.412
   17   1HB   MET   3          1HB       MET   3  -7.459  -0.818  10.158
   18   2HB   MET   3          2HB       MET   3  -6.480  -1.695   8.988
   19   1HG   MET   3          1HG       MET   3  -7.704  -3.077  10.703
   20   2HG   MET   3          2HG       MET   3  -5.998  -3.410  10.511
   21   1HE   MET   3          1HE       MET   3  -5.564  -4.726  12.642
   22   2HE   MET   3          2HE       MET   3  -6.226  -4.302  14.235
   23   3HE   MET   3          3HE       MET   3  -7.325  -4.735  12.906
   24    H    THR   4           H        THR   4  -4.392  -2.557  11.622
   25    HA   THR   4           HA       THR   4  -1.778  -2.575  10.178
   26    HB   THR   4           HB       THR   4  -2.566  -3.911  12.768
   27    HG1  THR   4           1HG      THR   4  -2.254  -1.544  12.615
   28   1HG2  THR   4          1HG2      THR   4  -0.788  -5.196  11.629
   29   2HG2  THR   4          2HG2      THR   4   0.146  -3.703  11.372
   30   3HG2  THR   4          3HG2      THR   4  -0.120  -4.325  13.015
   31    H    LEU   5           H        LEU   5  -1.247  -4.490   8.972
   32    HA   LEU   5           HA       LEU   5  -3.591  -6.252   8.511
   33   1HB   LEU   5          1HB       LEU   5  -2.199  -4.474   6.760
   34   2HB   LEU   5          2HB       LEU   5  -1.662  -6.083   6.352
   35    HG   LEU   5           HG       LEU   5  -3.937  -6.829   5.996
   36   1HD1  LEU   5          1HD1      LEU   5  -5.501  -4.440   5.949
   37   2HD1  LEU   5          2HD1      LEU   5  -5.698  -5.861   6.949
   38   3HD1  LEU   5          3HD1      LEU   5  -4.731  -4.511   7.537
   39   1HD2  LEU   5          1HD2      LEU   5  -4.528  -5.221   4.059
   40   2HD2  LEU   5          2HD2      LEU   5  -3.109  -4.280   4.552
   41   3HD2  LEU   5          3HD2      LEU   5  -2.939  -5.961   4.030
   42    H    THR   6           H        THR   6  -3.015  -8.388   7.591
   43    HA   THR   6           HA       THR   6  -0.396  -9.378   8.212
   44    HB   THR   6           HB       THR   6  -1.332  -9.682  10.367
   45    HG1  THR   6           1HG      THR   6  -0.360 -11.623   9.091
   46   1HG2  THR   6          1HG2      THR   6  -3.749 -11.085   9.152
   47   2HG2  THR   6          2HG2      THR   6  -3.358 -10.968  10.874
   48   3HG2  THR   6          3HG2      THR   6  -3.739  -9.500   9.972
   49    H    ASP   7           H        ASP   7  -2.264 -12.099   7.884
   50    HA   ASP   7           HA       ASP   7  -2.314 -11.899   4.941
   51   1HB   ASP   7          1HB       ASP   7  -2.388 -14.344   5.003
   52   2HB   ASP   7          2HB       ASP   7  -1.019 -13.742   5.925
   53    H    ALA   8           H        ALA   8  -4.363 -13.314   7.513
   54    HA   ALA   8           HA       ALA   8  -6.743 -13.491   6.058
   55   1HB   ALA   8          1HB       ALA   8  -6.355 -14.508   8.280
   56   2HB   ALA   8          2HB       ALA   8  -6.365 -12.898   9.032
   57   3HB   ALA   8          3HB       ALA   8  -7.845 -13.536   8.284
   58    H    ASN   9           H        ASN   9  -5.481 -10.751   7.877
   59    HA   ASN   9           HA       ASN   9  -7.906  -9.166   7.564
   60   1HB   ASN   9          1HB       ASN   9  -6.225  -9.002   9.508
   61   2HB   ASN   9          2HB       ASN   9  -5.243  -8.044   8.385
   62   1HD2  ASN   9          1HD2      ASN   9  -5.535  -5.950   9.765
   63   2HD2  ASN   9          2HD2      ASN   9  -7.165  -5.322   9.756
   64    H    PHE  10           H        PHE  10  -5.051  -9.787   5.658
   65    HA   PHE  10           HA       PHE  10  -5.275  -7.354   4.066
   66   1HB   PHE  10          1HB       PHE  10  -3.115  -8.562   4.382
   67   2HB   PHE  10          2HB       PHE  10  -3.760  -9.924   3.503
   68    HD1  PHE  10           1HD      PHE  10  -4.705  -6.707   1.946
   69    HD2  PHE  10           2HD      PHE  10  -1.502  -9.601   2.318
   70    HE1  PHE  10           1HE      PHE  10  -3.781  -5.972  -0.177
   71    HE2  PHE  10           2HE      PHE  10  -0.630  -8.896   0.189
   72    HZ   PHE  10           HZ       PHE  10  -1.747  -7.081  -1.121
   73    H    GLN  11           H        GLN  11  -6.111 -10.847   3.679
   74    HA   GLN  11           HA       GLN  11  -7.506 -10.460   1.203
   75   1HB   GLN  11          1HB       GLN  11  -7.945 -12.608   3.331
   76   2HB   GLN  11          2HB       GLN  11  -8.594 -12.614   1.683
   77   1HG   GLN  11          1HG       GLN  11  -6.150 -12.396   0.890
   78   2HG   GLN  11          2HG       GLN  11  -5.696 -12.841   2.543
   79   1HE2  GLN  11          1HE2      GLN  11  -4.982 -14.417   0.274
   80   2HE2  GLN  11          2HE2      GLN  11  -5.887 -15.931   0.372
   81    H    GLN  12           H        GLN  12  -8.670 -10.132   4.611
   82    HA   GLN  12           HA       GLN  12 -11.387  -9.525   3.782
   83   1HB   GLN  12          1HB       GLN  12  -9.824  -8.659   6.259
   84   2HB   GLN  12          2HB       GLN  12 -11.523  -8.287   5.971
   85   1HG   GLN  12          1HG       GLN  12 -10.331 -11.058   6.344
   86   2HG   GLN  12          2HG       GLN  12 -11.384 -10.186   7.446
   87   1HE2  GLN  12          1HE2      GLN  12 -11.288 -12.431   4.833
   88   2HE2  GLN  12          2HE2      GLN  12 -13.017 -12.422   4.508
   89    H    ALA  13           H        ALA  13  -8.513  -7.371   4.377
   90    HA   ALA  13           HA       ALA  13  -9.874  -4.976   3.940
   91   1HB   ALA  13          1HB       ALA  13  -7.597  -5.062   4.824
   92   2HB   ALA  13          2HB       ALA  13  -6.976  -5.623   3.253
   93   3HB   ALA  13          3HB       ALA  13  -7.668  -3.998   3.408
   94    H    ILE  14           H        ILE  14  -8.223  -6.997   1.454
   95    HA   ILE  14           HA       ILE  14  -8.814  -5.248  -0.716
   96    HB   ILE  14           HB       ILE  14  -8.180  -7.106  -2.182
   97   1HG1  ILE  14          1HG1      ILE  14  -8.190  -8.785   0.280
   98   2HG1  ILE  14          2HG1      ILE  14  -9.257  -8.952  -1.106
   99   1HG2  ILE  14          1HG2      ILE  14  -6.518  -5.630  -1.030
  100   2HG2  ILE  14          2HG2      ILE  14  -6.313  -6.901   0.188
  101   3HG2  ILE  14          3HG2      ILE  14  -5.888  -7.208  -1.507
  102   1HD1  ILE  14          1HD1      ILE  14  -6.263  -9.494  -1.038
  103   2HD1  ILE  14          2HD1      ILE  14  -7.579 -10.651  -1.303
  104   3HD1  ILE  14          3HD1      ILE  14  -7.217  -9.429  -2.538
  105    H    GLN  15           H        GLN  15 -11.213  -6.846   1.011
  106    HA   GLN  15           HA       GLN  15 -12.999  -7.682  -0.991
  107   1HB   GLN  15          1HB       GLN  15 -14.711  -7.456   0.631
  108   2HB   GLN  15          2HB       GLN  15 -13.252  -7.974   1.464
  109   1HG   GLN  15          1HG       GLN  15 -12.922  -5.416   1.991
  110   2HG   GLN  15          2HG       GLN  15 -14.599  -5.239   1.491
  111   1HE2  GLN  15          1HE2      GLN  15 -15.020  -8.158   2.804
  112   2HE2  GLN  15          2HE2      GLN  15 -15.125  -7.717   4.502
  113    H    GLY  16           H        GLY  16 -12.090  -4.386  -0.022
  114   1HA   GLY  16          1HA       GLY  16 -11.989  -2.592  -1.462
  115   2HA   GLY  16          2HA       GLY  16 -12.545  -3.709  -2.690
  116    H    ASP  17           H        ASP  17 -13.958  -2.697  -3.790
  117    HA   ASP  17           HA       ASP  17 -15.496  -1.382  -4.634
  118   1HB   ASP  17          1HB       ASP  17 -17.217  -2.395  -3.251
  119   2HB   ASP  17          2HB       ASP  17 -16.844  -1.281  -1.921
  120    H    GLY  18           H        GLY  18 -14.484  -0.340  -1.468
  121   1HA   GLY  18          1HA       GLY  18 -14.033   2.481  -2.295
  122   2HA   GLY  18          2HA       GLY  18 -13.695   1.790  -0.696
  123    HA   PRO  19           HA       PRO  19  -9.763   1.788  -3.450
  124   1HB   PRO  19          1HB       PRO  19  -8.525   4.020  -2.150
  125   2HB   PRO  19          2HB       PRO  19  -9.145   3.910  -3.802
  126   1HG   PRO  19          1HG       PRO  19 -10.324   5.287  -1.516
  127   2HG   PRO  19          2HG       PRO  19 -10.740   5.435  -3.227
  128   1HD   PRO  19          1HD       PRO  19 -12.198   4.052  -1.194
  129   2HD   PRO  19          2HD       PRO  19 -12.529   4.062  -2.949
  130    H    VAL  20           H        VAL  20  -8.914  -0.038  -2.509
  131    HA   VAL  20           HA       VAL  20  -8.106   0.043   0.338
  132    HB   VAL  20           HB       VAL  20  -8.460  -2.186  -1.670
  133   1HG1  VAL  20          1HG1      VAL  20  -6.395  -2.774  -0.445
  134   2HG1  VAL  20          2HG1      VAL  20  -7.110  -2.249   1.092
  135   3HG1  VAL  20          3HG1      VAL  20  -7.712  -3.697   0.277
  136   1HG2  VAL  20          1HG2      VAL  20 -10.123  -2.940  -0.222
  137   2HG2  VAL  20          2HG2      VAL  20  -9.604  -1.887   1.117
  138   3HG2  VAL  20          3HG2      VAL  20 -10.403  -1.204  -0.316
  139    H    LEU  21           H        LEU  21  -6.256   0.948   0.554
  140    HA   LEU  21           HA       LEU  21  -4.011   0.514  -1.409
  141   1HB   LEU  21          1HB       LEU  21  -4.416   2.273   1.014
  142   2HB   LEU  21          2HB       LEU  21  -2.800   1.891   0.416
  143    HG   LEU  21           HG       LEU  21  -3.229   2.984  -1.690
  144   1HD1  LEU  21          1HD1      LEU  21  -5.277   4.429  -1.983
  145   2HD1  LEU  21          2HD1      LEU  21  -5.599   2.691  -2.099
  146   3HD1  LEU  21          3HD1      LEU  21  -6.004   3.570  -0.610
  147   1HD2  LEU  21          1HD2      LEU  21  -4.128   4.679   0.684
  148   2HD2  LEU  21          2HD2      LEU  21  -2.456   4.218   0.347
  149   3HD2  LEU  21          3HD2      LEU  21  -3.342   5.264  -0.796
  150    H    VAL  22           H        VAL  22  -2.230  -0.696  -0.726
  151    HA   VAL  22           HA       VAL  22  -2.284  -1.810   2.026
  152    HB   VAL  22           HB       VAL  22  -2.762  -3.433   0.135
  153   1HG1  VAL  22          1HG1      VAL  22  -1.350  -2.550  -1.580
  154   2HG1  VAL  22          2HG1      VAL  22   0.121  -2.967  -0.664
  155   3HG1  VAL  22          3HG1      VAL  22  -0.966  -4.241  -1.257
  156   1HG2  VAL  22          1HG2      VAL  22  -1.198  -5.146   0.981
  157   2HG2  VAL  22          2HG2      VAL  22  -0.202  -3.900   1.735
  158   3HG2  VAL  22          3HG2      VAL  22  -1.867  -4.176   2.308
  159    H    ASP  23           H        ASP  23  -0.260  -1.619   3.127
  160    HA   ASP  23           HA       ASP  23   1.992  -0.404   1.529
  161   1HB   ASP  23          1HB       ASP  23   1.314   0.838   3.560
  162   2HB   ASP  23          2HB       ASP  23   1.468  -0.551   4.497
  163    H    PHE  24           H        PHE  24   3.098  -2.041   0.650
  164    HA   PHE  24           HA       PHE  24   3.904  -4.367   2.315
  165   1HB   PHE  24          1HB       PHE  24   4.307  -3.708  -0.611
  166   2HB   PHE  24          2HB       PHE  24   5.053  -5.059   0.187
  167    HD1  PHE  24           1HD      PHE  24   3.578  -6.718   1.430
  168    HD2  PHE  24           2HD      PHE  24   2.144  -4.031  -1.610
  169    HE1  PHE  24           1HE      PHE  24   2.076  -8.487   0.578
  170    HE2  PHE  24           2HE      PHE  24   0.541  -5.748  -2.372
  171    HZ   PHE  24           HZ       PHE  24   0.691  -8.084  -1.372
  172    H    TRP  25           H        TRP  25   5.451  -3.810   3.608
  173    HA   TRP  25           HA       TRP  25   7.827  -2.369   2.619
  174   1HB   TRP  25          1HB       TRP  25   7.985  -0.997   4.535
  175   2HB   TRP  25          2HB       TRP  25   6.333  -0.800   3.996
  176    HD1  TRP  25           HD       TRP  25   4.552  -2.582   5.395
  177    HE1  TRP  25           1HE      TRP  25   4.538  -3.246   7.869
  178    HE3  TRP  25           3HE      TRP  25   9.216  -0.948   6.672
  179    HZ2  TRP  25           2HZ      TRP  25   6.389  -3.160  10.124
  180    HZ3  TRP  25           3HZ      TRP  25  10.075  -1.261   8.976
  181    HH2  TRP  25           HH       TRP  25   8.671  -2.374  10.705
  182    H    ALA  26           H        ALA  26   9.528  -2.763   4.694
  183    HA   ALA  26           HA       ALA  26   8.968  -4.971   6.329
  184   1HB   ALA  26          1HB       ALA  26  11.148  -5.362   4.213
  185   2HB   ALA  26          2HB       ALA  26  10.873  -6.421   5.617
  186   3HB   ALA  26          3HB       ALA  26   9.653  -6.313   4.351
  187    H    ALA  27           H        ALA  27  11.017  -5.344   7.744
  188    HA   ALA  27           HA       ALA  27  11.852  -2.812   8.708
  189   1HB   ALA  27          1HB       ALA  27  13.084  -5.553   9.213
  190   2HB   ALA  27          2HB       ALA  27  13.337  -4.095  10.196
  191   3HB   ALA  27          3HB       ALA  27  11.726  -4.829  10.107
  192    H    TRP  28           H        TRP  28  13.459  -5.011   6.414
  193    HA   TRP  28           HA       TRP  28  16.012  -3.703   6.806
  194   1HB   TRP  28          1HB       TRP  28  16.908  -5.598   6.092
  195   2HB   TRP  28          2HB       TRP  28  15.323  -6.267   6.385
  196    HD1  TRP  28           HD       TRP  28  17.820  -5.410   3.723
  197    HE1  TRP  28           1HE      TRP  28  17.108  -6.227   1.411
  198    HE3  TRP  28           3HE      TRP  28  13.068  -7.008   4.837
  199    HZ2  TRP  28           2HZ      TRP  28  14.714  -7.214   0.144
  200    HZ3  TRP  28           3HZ      TRP  28  11.567  -7.815   3.007
  201    HH2  TRP  28           HH       TRP  28  12.393  -7.884   0.681
  202    H    CYS  29           H        CYS  29  13.511  -3.355   4.427
  203    HA   CYS  29           HA       CYS  29  15.103  -3.225   2.099
  204   1HB   CYS  29          1HB       CYS  29  12.873  -2.556   1.066
  205   2HB   CYS  29          2HB       CYS  29  13.034  -4.114   1.851
  206    H    GLY  30           H        GLY  30  16.122  -1.199   3.751
  207   1HA   GLY  30          1HA       GLY  30  16.789   1.004   3.827
  208   2HA   GLY  30          2HA       GLY  30  17.000   0.698   2.113
  209    HA   PRO  31           HA       PRO  31  14.429   4.283   1.484
  210   1HB   PRO  31          1HB       PRO  31  13.219   3.702  -0.956
  211   2HB   PRO  31          2HB       PRO  31  14.892   4.307  -0.743
  212   1HG   PRO  31          1HG       PRO  31  13.951   1.442  -1.074
  213   2HG   PRO  31          2HG       PRO  31  15.295   2.273  -1.927
  214   1HD   PRO  31          1HD       PRO  31  15.809   0.698   0.182
  215   2HD   PRO  31          2HD       PRO  31  16.646   2.270   0.045
  216    H    CYS  32           H        CYS  32  12.872   1.085   1.502
  217    HA   CYS  32           HA       CYS  32  10.175   2.031   1.626
  218   1HB   CYS  32          1HB       CYS  32   9.618  -0.063   2.635
  219   2HB   CYS  32          2HB       CYS  32  10.856  -0.375   1.425
  220    H    ARG  33           H        ARG  33  12.765   2.017   4.037
  221    HA   ARG  33           HA       ARG  33  11.057   2.654   6.274
  222   1HB   ARG  33          1HB       ARG  33  13.623   1.659   5.968
  223   2HB   ARG  33          2HB       ARG  33  13.968   3.346   6.334
  224   1HG   ARG  33          1HG       ARG  33  13.966   2.240   8.418
  225   2HG   ARG  33          2HG       ARG  33  12.392   3.047   8.366
  226   1HD   ARG  33          1HD       ARG  33  11.398   0.848   7.548
  227   2HD   ARG  33          2HD       ARG  33  12.979   0.100   7.765
  228    HE   ARG  33           HE       ARG  33  11.211   1.250   9.863
  229   1HH1  ARG  33          2HH2      ARG  33  13.857  -1.085   9.125
  230   2HH1  ARG  33          1HH2      ARG  33  14.184  -1.381  10.788
  231   1HH2  ARG  33          2HH1      ARG  33  11.557   0.641  12.035
  232   2HH2  ARG  33          1HH1      ARG  33  12.771  -0.513  12.444
  233    H    MET  34           H        MET  34  12.020   4.550   3.594
  234    HA   MET  34           HA       MET  34  11.579   7.055   5.081
  235   1HB   MET  34          1HB       MET  34  12.743   6.583   2.307
  236   2HB   MET  34          2HB       MET  34  12.530   8.155   3.091
  237   1HG   MET  34          1HG       MET  34  14.051   7.382   4.930
  238   2HG   MET  34          2HG       MET  34  14.392   5.925   3.993
  239   1HE   MET  34          1HE       MET  34  15.972   5.875   1.814
  240   2HE   MET  34          2HE       MET  34  14.663   6.797   1.027
  241   3HE   MET  34          3HE       MET  34  16.348   7.342   0.889
  242    H    MET  35           H        MET  35  10.041   4.771   3.132
  243    HA   MET  35           HA       MET  35   8.136   6.603   1.839
  244   1HB   MET  35          1HB       MET  35   9.344   4.576   0.755
  245   2HB   MET  35          2HB       MET  35   8.243   3.561   1.672
  246   1HG   MET  35          1HG       MET  35   7.079   5.779  -0.008
  247   2HG   MET  35          2HG       MET  35   7.839   4.422  -0.830
  248   1HE   MET  35          1HE       MET  35   4.431   3.166  -1.641
  249   2HE   MET  35          2HE       MET  35   5.261   4.719  -1.904
  250   3HE   MET  35          3HE       MET  35   6.147   3.193  -2.100
  251    H    ALA  36           H        ALA  36   8.353   3.960   4.264
  252    HA   ALA  36           HA       ALA  36   5.719   3.860   5.165
  253   1HB   ALA  36          1HB       ALA  36   7.359   2.273   5.895
  254   2HB   ALA  36          2HB       ALA  36   8.323   3.527   6.698
  255   3HB   ALA  36          3HB       ALA  36   6.712   3.109   7.318
  256    HA   PRO  37           HA       PRO  37   6.333   7.537   8.185
  257   1HB   PRO  37          1HB       PRO  37   8.327   9.383   7.749
  258   2HB   PRO  37          2HB       PRO  37   8.473   7.967   8.838
  259   1HG   PRO  37          1HG       PRO  37   9.359   8.194   5.948
  260   2HG   PRO  37          2HG       PRO  37  10.310   7.599   7.345
  261   1HD   PRO  37          1HD       PRO  37   9.094   5.845   5.727
  262   2HD   PRO  37          2HD       PRO  37   9.015   5.604   7.492
  263    H    VAL  38           H        VAL  38   7.003   7.860   4.671
  264    HA   VAL  38           HA       VAL  38   5.530  10.356   4.448
  265    HB   VAL  38           HB       VAL  38   7.057   8.607   2.741
  266   1HG1  VAL  38          1HG1      VAL  38   5.009   7.919   1.637
  267   2HG1  VAL  38          2HG1      VAL  38   4.497   9.616   1.461
  268   3HG1  VAL  38          3HG1      VAL  38   5.929   9.001   0.597
  269   1HG2  VAL  38          1HG2      VAL  38   7.444  10.666   1.506
  270   2HG2  VAL  38          2HG2      VAL  38   6.102  11.459   2.364
  271   3HG2  VAL  38          3HG2      VAL  38   7.559  10.953   3.247
  272    H    LEU  39           H        LEU  39   4.770   6.882   4.051
  273    HA   LEU  39           HA       LEU  39   2.057   7.131   3.374
  274   1HB   LEU  39          1HB       LEU  39   3.914   5.017   4.278
  275   2HB   LEU  39          2HB       LEU  39   2.250   4.730   4.724
  276    HG   LEU  39           HG       LEU  39   1.496   4.730   2.466
  277   1HD1  LEU  39          1HD1      LEU  39   2.734   6.540   1.399
  278   2HD1  LEU  39          2HD1      LEU  39   4.268   5.679   1.647
  279   3HD1  LEU  39          3HD1      LEU  39   3.051   5.037   0.532
  280   1HD2  LEU  39          1HD2      LEU  39   4.179   3.278   2.669
  281   2HD2  LEU  39          2HD2      LEU  39   2.627   2.716   3.302
  282   3HD2  LEU  39          3HD2      LEU  39   2.870   2.863   1.552
  283    H    GLU  40           H        GLU  40   3.658   7.013   6.495
  284    HA   GLU  40           HA       GLU  40   1.392   6.763   8.196
  285   1HB   GLU  40          1HB       GLU  40   4.308   7.357   8.389
  286   2HB   GLU  40          2HB       GLU  40   3.387   7.992   9.705
  287   1HG   GLU  40          1HG       GLU  40   4.187   5.836  10.337
  288   2HG   GLU  40          2HG       GLU  40   2.442   5.733  10.161
  289    H    GLU  41           H        GLU  41   2.310   9.374   6.308
  290    HA   GLU  41           HA       GLU  41   0.558  11.217   7.868
  291   1HB   GLU  41          1HB       GLU  41   2.783  12.120   7.627
  292   2HB   GLU  41          2HB       GLU  41   2.813  11.812   5.898
  293   1HG   GLU  41          1HG       GLU  41   0.722  13.661   7.101
  294   2HG   GLU  41          2HG       GLU  41   2.368  14.225   6.833
  295    H    PHE  42           H        PHE  42   1.433  10.182   4.560
  296    HA   PHE  42           HA       PHE  42  -0.636  11.167   3.045
  297   1HB   PHE  42          1HB       PHE  42   1.313   9.850   2.190
  298   2HB   PHE  42          2HB       PHE  42   0.694   8.476   3.053
  299    HD1  PHE  42           1HD      PHE  42  -0.066   6.734   1.779
  300    HD2  PHE  42           2HD      PHE  42  -0.769  10.780   0.421
  301    HE1  PHE  42           1HE      PHE  42  -1.215   5.891  -0.195
  302    HE2  PHE  42           2HE      PHE  42  -1.980   9.902  -1.532
  303    HZ   PHE  42           HZ       PHE  42  -2.315   7.465  -1.798
  304    H    ALA  43           H        ALA  43  -0.761   8.063   4.899
  305    HA   ALA  43           HA       ALA  43  -3.289   7.199   4.104
  306   1HB   ALA  43          1HB       ALA  43  -1.779   6.904   6.747
  307   2HB   ALA  43          2HB       ALA  43  -3.244   6.004   6.353
  308   3HB   ALA  43          3HB       ALA  43  -1.768   5.783   5.378
  309    H    GLU  44           H        GLU  44  -2.524   8.902   7.125
  310    HA   GLU  44           HA       GLU  44  -5.142   9.388   7.958
  311   1HB   GLU  44          1HB       GLU  44  -2.408  10.277   8.720
  312   2HB   GLU  44          2HB       GLU  44  -3.769  11.236   9.322
  313   1HG   GLU  44          1HG       GLU  44  -3.211   9.363  10.843
  314   2HG   GLU  44          2HG       GLU  44  -4.861   9.294  10.266
  315    H    ALA  45           H        ALA  45  -3.018  11.419   5.902
  316    HA   ALA  45           HA       ALA  45  -4.579  13.753   5.855
  317   1HB   ALA  45          1HB       ALA  45  -3.467  14.240   3.727
  318   2HB   ALA  45          2HB       ALA  45  -2.317  13.525   4.879
  319   3HB   ALA  45          3HB       ALA  45  -2.987  12.543   3.555
  320    H    HIS  46           H        HIS  46  -5.381  10.682   4.478
  321    HA   HIS  46           HA       HIS  46  -7.983  11.791   3.630
  322   1HB   HIS  46          1HB       HIS  46  -7.897  10.324   1.567
  323   2HB   HIS  46          2HB       HIS  46  -6.869  11.755   1.530
  324    HD1  HIS  46           1HD      HIS  46  -6.265   8.173   2.800
  325    HD2  HIS  46           2HD      HIS  46  -4.512  11.251   0.520
  326    HE1  HIS  46           1HE      HIS  46  -3.947   7.298   1.962
  327    HE2  HIS  46           2HE      HIS  46  -2.943   9.205   0.584
  328    H    ALA  47           H        ALA  47  -7.442  10.637   6.015
  329    HA   ALA  47           HA       ALA  47  -7.052   8.068   6.420
  330   1HB   ALA  47          1HB       ALA  47  -9.124   9.672   7.976
  331   2HB   ALA  47          2HB       ALA  47  -8.233   8.246   8.554
  332   3HB   ALA  47          3HB       ALA  47  -7.367   9.752   8.216
  333    H    ASP  48           H        ASP  48 -10.315   9.256   5.541
  334    HA   ASP  48           HA       ASP  48 -11.139   6.413   5.269
  335   1HB   ASP  48          1HB       ASP  48 -11.928   7.837   7.356
  336   2HB   ASP  48          2HB       ASP  48 -13.132   8.440   6.212
  337    H    LYS  49           H        LYS  49 -10.613   9.015   3.314
  338    HA   LYS  49           HA       LYS  49 -12.804   8.410   1.450
  339   1HB   LYS  49          1HB       LYS  49 -11.528  10.496   1.161
  340   2HB   LYS  49          2HB       LYS  49 -10.026   9.581   0.949
  341   1HG   LYS  49          1HG       LYS  49 -10.815   8.542  -1.079
  342   2HG   LYS  49          2HG       LYS  49 -12.447   9.171  -0.863
  343   1HD   LYS  49          1HD       LYS  49 -10.018  10.948  -1.376
  344   2HD   LYS  49          2HD       LYS  49 -11.004  10.213  -2.645
  345   1HE   LYS  49          1HE       LYS  49 -13.045  11.299  -1.488
  346   2HE   LYS  49          2HE       LYS  49 -11.865  12.292  -0.606
  347   1HZ   LYS  49          1HZ       LYS  49 -12.528  13.429  -2.640
  348   2HZ   LYS  49          2HZ       LYS  49 -10.974  12.870  -2.888
  349   3HZ   LYS  49          3HZ       LYS  49 -12.210  12.107  -3.555
  350    H    VAL  50           H        VAL  50  -9.644   7.128   2.377
  351    HA   VAL  50           HA       VAL  50 -10.027   4.838   0.517
  352    HB   VAL  50           HB       VAL  50  -7.724   4.591   0.306
  353   1HG1  VAL  50          1HG1      VAL  50  -7.953   7.625   0.366
  354   2HG1  VAL  50          2HG1      VAL  50  -6.818   6.635  -0.578
  355   3HG1  VAL  50          3HG1      VAL  50  -8.541   6.598  -0.957
  356   1HG2  VAL  50          1HG2      VAL  50  -6.897   4.765   2.559
  357   2HG2  VAL  50          2HG2      VAL  50  -6.004   5.907   1.575
  358   3HG2  VAL  50          3HG2      VAL  50  -7.317   6.478   2.650
  359    H    THR  51           H        THR  51  -8.887   2.798   1.477
  360    HA   THR  51           HA       THR  51  -8.634   3.054   4.318
  361    HB   THR  51           HB       THR  51 -10.859   1.895   3.706
  362    HG1  THR  51           1HG      THR  51  -9.172   0.615   5.556
  363   1HG2  THR  51          1HG2      THR  51 -10.757  -0.524   3.524
  364   2HG2  THR  51          2HG2      THR  51  -9.924   0.233   2.149
  365   3HG2  THR  51          3HG2      THR  51  -8.978  -0.487   3.471
  366    H    VAL  52           H        VAL  52  -6.744   2.277   5.080
  367    HA   VAL  52           HA       VAL  52  -5.051   0.732   3.228
  368    HB   VAL  52           HB       VAL  52  -4.708   3.074   2.961
  369   1HG1  VAL  52          1HG1      VAL  52  -5.327   4.004   5.134
  370   2HG1  VAL  52          2HG1      VAL  52  -3.836   3.338   5.828
  371   3HG1  VAL  52          3HG1      VAL  52  -3.762   4.582   4.565
  372   1HG2  VAL  52          1HG2      VAL  52  -2.328   3.199   3.019
  373   2HG2  VAL  52          2HG2      VAL  52  -2.227   2.050   4.361
  374   3HG2  VAL  52          3HG2      VAL  52  -2.742   1.496   2.757
  375    H    ALA  53           H        ALA  53  -3.143  -0.143   4.286
  376    HA   ALA  53           HA       ALA  53  -2.907  -0.129   7.093
  377   1HB   ALA  53          1HB       ALA  53  -3.335  -2.604   7.455
  378   2HB   ALA  53          2HB       ALA  53  -4.817  -1.721   7.072
  379   3HB   ALA  53          3HB       ALA  53  -4.015  -2.666   5.808
  380    H    LYS  54           H        LYS  54  -1.085  -1.686   7.730
  381    HA   LYS  54           HA       LYS  54   0.671  -2.119   5.373
  382   1HB   LYS  54          1HB       LYS  54   2.544  -1.417   6.444
  383   2HB   LYS  54          2HB       LYS  54   1.323  -0.162   6.670
  384   1HG   LYS  54          1HG       LYS  54   1.007  -0.888   9.023
  385   2HG   LYS  54          2HG       LYS  54   2.181  -2.205   8.770
  386   1HD   LYS  54          1HD       LYS  54   3.381  -0.402   9.753
  387   2HD   LYS  54          2HD       LYS  54   3.877  -0.506   8.052
  388   1HE   LYS  54          1HE       LYS  54   1.583   1.256   8.294
  389   2HE   LYS  54          2HE       LYS  54   2.795   1.759   9.468
  390   1HZ   LYS  54          1HZ       LYS  54   4.300   2.222   7.818
  391   2HZ   LYS  54          2HZ       LYS  54   3.476   1.375   6.586
  392   3HZ   LYS  54          3HZ       LYS  54   2.952   2.812   7.310
  393    H    LEU  55           H        LEU  55   1.992  -3.671   5.204
  394    HA   LEU  55           HA       LEU  55   2.157  -5.637   7.416
  395   1HB   LEU  55          1HB       LEU  55   2.014  -7.556   5.898
  396   2HB   LEU  55          2HB       LEU  55   0.505  -6.745   6.236
  397    HG   LEU  55           HG       LEU  55   1.856  -5.892   3.689
  398   1HD1  LEU  55          1HD1      LEU  55   0.703  -8.694   4.093
  399   2HD1  LEU  55          2HD1      LEU  55   0.912  -7.927   2.511
  400   3HD1  LEU  55          3HD1      LEU  55   2.327  -8.253   3.518
  401   1HD2  LEU  55          1HD2      LEU  55  -0.424  -5.115   4.332
  402   2HD2  LEU  55          2HD2      LEU  55  -0.462  -6.133   2.871
  403   3HD2  LEU  55          3HD2      LEU  55  -0.949  -6.830   4.403
  404    H    ASN  56           H        ASN  56   4.014  -6.578   7.685
  405    HA   ASN  56           HA       ASN  56   6.401  -5.651   6.270
  406   1HB   ASN  56          1HB       ASN  56   6.499  -5.833   8.688
  407   2HB   ASN  56          2HB       ASN  56   5.827  -7.462   8.646
  408   1HD2  ASN  56          1HD2      ASN  56   7.620  -8.249   9.921
  409   2HD2  ASN  56          2HD2      ASN  56   9.197  -8.456   9.148
  410    H    VAL  57           H        VAL  57   6.515  -6.549   4.261
  411    HA   VAL  57           HA       VAL  57   5.039  -8.763   3.455
  412    HB   VAL  57           HB       VAL  57   5.961  -6.793   2.189
  413   1HG1  VAL  57          1HG1      VAL  57   8.373  -7.045   2.525
  414   2HG1  VAL  57          2HG1      VAL  57   8.352  -8.657   1.771
  415   3HG1  VAL  57          3HG1      VAL  57   8.014  -7.245   0.800
  416   1HG2  VAL  57          1HG2      VAL  57   5.658  -7.798   0.084
  417   2HG2  VAL  57          2HG2      VAL  57   6.106  -9.404   0.690
  418   3HG2  VAL  57          3HG2      VAL  57   4.602  -8.644   1.218
  419    H    ASP  58           H        ASP  58   8.210  -8.684   4.829
  420    HA   ASP  58           HA       ASP  58   9.273 -11.178   3.883
  421   1HB   ASP  58          1HB       ASP  58  10.434  -9.062   4.768
  422   2HB   ASP  58          2HB       ASP  58   9.972  -9.604   6.370
  423    H    GLU  59           H        GLU  59   7.094 -10.298   6.260
  424    HA   GLU  59           HA       GLU  59   7.331 -12.768   7.937
  425   1HB   GLU  59          1HB       GLU  59   7.739 -10.866   9.248
  426   2HB   GLU  59          2HB       GLU  59   6.651  -9.883   8.284
  427   1HG   GLU  59          1HG       GLU  59   4.717 -11.265   9.363
  428   2HG   GLU  59          2HG       GLU  59   5.928 -11.665  10.573
  429    H    ASN  60           H        ASN  60   5.033 -10.532   6.303
  430    HA   ASN  60           HA       ASN  60   2.816 -12.473   6.657
  431   1HB   ASN  60          1HB       ASN  60   3.074  -9.506   7.024
  432   2HB   ASN  60          2HB       ASN  60   1.667 -10.069   6.165
  433   1HD2  ASN  60          1HD2      ASN  60   2.973  -9.679   9.454
  434   2HD2  ASN  60          2HD2      ASN  60   1.684 -10.616  10.151
  435    HA   PRO  61           HA       PRO  61   4.302 -12.341   2.308
  436   1HB   PRO  61          1HB       PRO  61   3.317 -14.929   1.647
  437   2HB   PRO  61          2HB       PRO  61   4.972 -14.496   2.104
  438   1HG   PRO  61          1HG       PRO  61   2.733 -15.589   3.808
  439   2HG   PRO  61          2HG       PRO  61   4.487 -15.925   3.936
  440   1HD   PRO  61          1HD       PRO  61   3.222 -14.253   5.680
  441   2HD   PRO  61          2HD       PRO  61   4.871 -13.909   5.124
  442    H    GLU  62           H        GLU  62   1.246 -14.136   2.833
  443    HA   GLU  62           HA       GLU  62  -0.553 -14.306   1.462
  444   1HB   GLU  62          1HB       GLU  62  -1.199 -13.192   3.423
  445   2HB   GLU  62          2HB       GLU  62  -0.733 -11.610   2.817
  446   1HG   GLU  62          1HG       GLU  62  -3.244 -12.154   2.785
  447   2HG   GLU  62          2HG       GLU  62  -2.572 -11.538   1.286
  448    H    THR  63           H        THR  63  -0.381 -14.487  -0.683
  449    HA   THR  63           HA       THR  63  -0.544 -14.020  -2.857
  450    HB   THR  63           HB       THR  63  -1.981 -11.610  -1.705
  451    HG1  THR  63           1HG      THR  63  -3.155 -13.389  -1.239
  452   1HG2  THR  63          1HG2      THR  63  -2.018 -12.570  -4.585
  453   2HG2  THR  63          2HG2      THR  63  -3.158 -11.426  -3.850
  454   3HG2  THR  63          3HG2      THR  63  -1.455 -10.976  -3.998
  455    H    THR  64           H        THR  64   1.510 -12.034  -1.030
  456    HA   THR  64           HA       THR  64   2.938 -10.576  -2.877
  457    HB   THR  64           HB       THR  64   3.855 -12.375  -0.615
  458    HG1  THR  64           1HG      THR  64   2.974 -10.765   0.282
  459   1HG2  THR  64          1HG2      THR  64   5.869 -12.134  -2.065
  460   2HG2  THR  64          2HG2      THR  64   5.722 -10.370  -1.919
  461   3HG2  THR  64          3HG2      THR  64   6.014 -11.366  -0.491
  462    H    SER  65           H        SER  65   3.249 -14.069  -2.299
  463    HA   SER  65           HA       SER  65   5.223 -14.492  -4.331
  464   1HB   SER  65          1HB       SER  65   5.007 -15.881  -2.302
  465   2HB   SER  65          2HB       SER  65   3.421 -16.451  -2.849
  466    HG   SER  65           HG       SER  65   4.712 -17.009  -4.869
  467    H    GLN  66           H        GLN  66   1.893 -13.782  -4.769
  468    HA   GLN  66           HA       GLN  66   1.706 -15.386  -7.231
  469   1HB   GLN  66          1HB       GLN  66  -0.168 -15.267  -5.612
  470   2HB   GLN  66          2HB       GLN  66  -0.269 -13.541  -5.831
  471   1HG   GLN  66          1HG       GLN  66  -2.011 -14.712  -7.101
  472   2HG   GLN  66          2HG       GLN  66  -0.977 -13.724  -8.120
  473   1HE2  GLN  66          1HE2      GLN  66   0.712 -14.845  -9.443
  474   2HE2  GLN  66          2HE2      GLN  66   0.350 -16.504  -9.955
  475    H    PHE  67           H        PHE  67   2.111 -12.023  -6.059
  476    HA   PHE  67           HA       PHE  67   2.146 -11.088  -8.899
  477   1HB   PHE  67          1HB       PHE  67   1.486  -9.700  -6.299
  478   2HB   PHE  67          2HB       PHE  67   1.806  -8.830  -7.794
  479    HD1  PHE  67           1HD      PHE  67   0.168  -8.675  -9.548
  480    HD2  PHE  67           2HD      PHE  67  -0.503 -11.208  -6.129
  481    HE1  PHE  67           1HE      PHE  67  -2.218  -8.907 -10.185
  482    HE2  PHE  67           2HE      PHE  67  -2.895 -11.441  -6.772
  483    HZ   PHE  67           HZ       PHE  67  -3.753 -10.288  -8.799
  484    H    GLY  68           H        GLY  68   4.398 -11.996  -6.586
  485   1HA   GLY  68          1HA       GLY  68   6.684 -11.934  -6.797
  486   2HA   GLY  68          2HA       GLY  68   6.515 -10.848  -8.181
  487    H    ILE  69           H        ILE  69   5.198 -10.361  -4.929
  488    HA   ILE  69           HA       ILE  69   6.035  -7.599  -5.052
  489    HB   ILE  69           HB       ILE  69   4.353  -9.144  -3.069
  490   1HG1  ILE  69          1HG1      ILE  69   3.413  -9.233  -5.326
  491   2HG1  ILE  69          2HG1      ILE  69   2.398  -8.299  -4.260
  492   1HG2  ILE  69          1HG2      ILE  69   4.716  -6.173  -3.237
  493   2HG2  ILE  69          2HG2      ILE  69   3.198  -6.910  -2.708
  494   3HG2  ILE  69          3HG2      ILE  69   4.650  -7.257  -1.816
  495   1HD1  ILE  69          1HD1      ILE  69   3.388  -6.185  -5.191
  496   2HD1  ILE  69          2HD1      ILE  69   4.326  -7.165  -6.337
  497   3HD1  ILE  69          3HD1      ILE  69   2.554  -7.159  -6.396
  498    H    MET  70           H        MET  70   8.238  -8.825  -4.974
  499    HA   MET  70           HA       MET  70   9.485  -8.276  -2.314
  500   1HB   MET  70          1HB       MET  70  10.150 -10.304  -3.756
  501   2HB   MET  70          2HB       MET  70  10.931  -9.146  -4.844
  502   1HG   MET  70          1HG       MET  70  12.375  -8.386  -2.986
  503   2HG   MET  70          2HG       MET  70  11.493  -9.423  -1.859
  504   1HE   MET  70          1HE       MET  70  13.666 -10.450  -0.914
  505   2HE   MET  70          2HE       MET  70  14.973 -11.126  -1.913
  506   3HE   MET  70          3HE       MET  70  14.614  -9.384  -1.979
  507    H    SER  71           H        SER  71   8.255  -6.516  -4.828
  508    HA   SER  71           HA       SER  71  10.365  -4.769  -5.555
  509   1HB   SER  71          1HB       SER  71   8.371  -3.573  -6.623
  510   2HB   SER  71          2HB       SER  71   8.522  -5.283  -7.041
  511    HG   SER  71           HG       SER  71   6.753  -4.130  -5.101
  512    H    ILE  72           H        ILE  72   9.616  -4.926  -2.614
  513    HA   ILE  72           HA       ILE  72   8.106  -2.686  -2.016
  514    HB   ILE  72           HB       ILE  72   8.426  -3.046   0.283
  515   1HG1  ILE  72          1HG1      ILE  72  10.736  -3.439   0.523
  516   2HG1  ILE  72          2HG1      ILE  72   9.809  -4.731   1.279
  517   1HG2  ILE  72          1HG2      ILE  72   6.922  -4.462  -1.108
  518   2HG2  ILE  72          2HG2      ILE  72   8.148  -5.736  -1.084
  519   3HG2  ILE  72          3HG2      ILE  72   7.416  -5.157   0.434
  520   1HD1  ILE  72          1HD1      ILE  72  11.795  -5.603   0.219
  521   2HD1  ILE  72          2HD1      ILE  72  10.380  -6.213  -0.663
  522   3HD1  ILE  72          3HD1      ILE  72  11.377  -4.881  -1.324
  523    HA   PRO  73           HA       PRO  73   7.940  -0.947  -0.055
  524   1HB   PRO  73          1HB       PRO  73   7.387   1.650  -0.643
  525   2HB   PRO  73          2HB       PRO  73   8.483   1.138   0.666
  526   1HG   PRO  73          1HG       PRO  73   9.156   2.053  -2.135
  527   2HG   PRO  73          2HG       PRO  73   9.965   2.537  -0.617
  528   1HD   PRO  73          1HD       PRO  73  10.962   0.606  -2.297
  529   2HD   PRO  73          2HD       PRO  73  11.177   0.507  -0.531
  530    H    THR  74           H        THR  74   6.020  -1.562  -0.872
  531    HA   THR  74           HA       THR  74   5.263  -0.692  -3.618
  532    HB   THR  74           HB       THR  74   5.237  -3.504  -2.477
  533    HG1  THR  74           1HG      THR  74   6.982  -2.248  -3.849
  534   1HG2  THR  74          1HG2      THR  74   3.098  -3.271  -3.617
  535   2HG2  THR  74          2HG2      THR  74   3.878  -2.494  -5.006
  536   3HG2  THR  74          3HG2      THR  74   4.206  -4.194  -4.638
  537    H    LEU  75           H        LEU  75   3.148  -0.251  -3.950
  538    HA   LEU  75           HA       LEU  75   1.248  -0.252  -1.677
  539   1HB   LEU  75          1HB       LEU  75   2.508   1.820  -1.700
  540   2HB   LEU  75          2HB       LEU  75   2.035   2.142  -3.341
  541    HG   LEU  75           HG       LEU  75  -0.227   1.496  -1.458
  542   1HD1  LEU  75          1HD1      LEU  75  -0.269   3.780  -0.538
  543   2HD1  LEU  75          2HD1      LEU  75   1.127   2.852   0.008
  544   3HD1  LEU  75          3HD1      LEU  75   1.336   4.089  -1.249
  545   1HD2  LEU  75          1HD2      LEU  75   0.216   3.552  -3.645
  546   2HD2  LEU  75          2HD2      LEU  75  -0.751   2.061  -3.735
  547   3HD2  LEU  75          3HD2      LEU  75  -1.276   3.383  -2.692
  548    H    ILE  76           H        ILE  76  -0.135  -1.706  -2.590
  549    HA   ILE  76           HA       ILE  76  -0.791  -1.479  -5.478
  550    HB   ILE  76           HB       ILE  76  -1.644  -3.650  -3.541
  551   1HG1  ILE  76          1HG1      ILE  76   0.626  -3.538  -5.581
  552   2HG1  ILE  76          2HG1      ILE  76   0.743  -3.856  -3.853
  553   1HG2  ILE  76          1HG2      ILE  76  -3.229  -3.314  -5.402
  554   2HG2  ILE  76          2HG2      ILE  76  -1.892  -3.389  -6.576
  555   3HG2  ILE  76          3HG2      ILE  76  -2.368  -4.809  -5.626
  556   1HD1  ILE  76          1HD1      ILE  76   1.052  -5.947  -4.873
  557   2HD1  ILE  76          2HD1      ILE  76  -0.624  -6.000  -4.304
  558   3HD1  ILE  76          3HD1      ILE  76  -0.267  -5.711  -6.024
  559    H    LEU  77           H        LEU  77  -2.875  -0.974  -6.059
  560    HA   LEU  77           HA       LEU  77  -4.639   0.149  -3.946
  561   1HB   LEU  77          1HB       LEU  77  -3.407   1.663  -5.597
  562   2HB   LEU  77          2HB       LEU  77  -4.473   1.003  -6.832
  563    HG   LEU  77           HG       LEU  77  -5.023   2.837  -4.501
  564   1HD1  LEU  77          1HD1      LEU  77  -5.953   2.903  -7.405
  565   2HD1  LEU  77          2HD1      LEU  77  -5.989   4.225  -6.239
  566   3HD1  LEU  77          3HD1      LEU  77  -4.447   3.627  -6.820
  567   1HD2  LEU  77          1HD2      LEU  77  -7.206   1.192  -5.838
  568   2HD2  LEU  77          2HD2      LEU  77  -6.783   1.221  -4.119
  569   3HD2  LEU  77          3HD2      LEU  77  -7.480   2.649  -4.877
  570    H    PHE  78           H        PHE  78  -5.947  -1.410  -3.677
  571    HA   PHE  78           HA       PHE  78  -7.025  -3.184  -5.845
  572   1HB   PHE  78          1HB       PHE  78  -7.014  -3.472  -2.812
  573   2HB   PHE  78          2HB       PHE  78  -7.877  -4.545  -3.887
  574    HD1  PHE  78           1HD      PHE  78  -6.671  -6.118  -5.372
  575    HD2  PHE  78           2HD      PHE  78  -4.638  -3.739  -2.406
  576    HE1  PHE  78           1HE      PHE  78  -4.791  -7.721  -5.390
  577    HE2  PHE  78           2HE      PHE  78  -2.766  -5.365  -2.406
  578    HZ   PHE  78           HZ       PHE  78  -2.834  -7.361  -3.891
  579    H    LYS  79           H        LYS  79  -9.353  -3.522  -5.886
  580    HA   LYS  79           HA       LYS  79 -10.834  -2.525  -3.677
  581   1HB   LYS  79          1HB       LYS  79 -12.422  -1.051  -4.757
  582   2HB   LYS  79          2HB       LYS  79 -10.810  -0.391  -4.702
  583   1HG   LYS  79          1HG       LYS  79 -10.478  -0.582  -7.035
  584   2HG   LYS  79          2HG       LYS  79 -11.812  -1.738  -7.225
  585   1HD   LYS  79          1HD       LYS  79 -12.455   0.535  -8.005
  586   2HD   LYS  79          2HD       LYS  79 -13.462  -0.068  -6.684
  587   1HE   LYS  79          1HE       LYS  79 -11.876   1.247  -5.099
  588   2HE   LYS  79          2HE       LYS  79 -11.274   2.052  -6.551
  589   1HZ   LYS  79          1HZ       LYS  79 -13.680   2.642  -6.950
  590   2HZ   LYS  79          2HZ       LYS  79 -14.025   1.976  -5.474
  591   3HZ   LYS  79          3HZ       LYS  79 -13.061   3.309  -5.568
  592    H    GLY  80           H        GLY  80 -10.487  -5.020  -4.641
  593   1HA   GLY  80          1HA       GLY  80 -12.804  -6.209  -4.029
  594   2HA   GLY  80          2HA       GLY  80 -13.085  -5.932  -5.756
  595    H    GLY  81           H        GLY  81 -10.338  -7.026  -3.748
  596   1HA   GLY  81          1HA       GLY  81  -8.809  -8.722  -3.965
  597   2HA   GLY  81          2HA       GLY  81  -9.902  -9.549  -5.083
  598    H    GLU  82           H        GLU  82 -10.017  -7.145  -6.784
  599    HA   GLU  82           HA       GLU  82  -7.715  -7.694  -8.478
  600   1HB   GLU  82          1HB       GLU  82 -10.015  -7.693  -9.342
  601   2HB   GLU  82          2HB       GLU  82 -10.187  -5.978  -8.937
  602   1HG   GLU  82          1HG       GLU  82  -8.397  -5.402 -10.535
  603   2HG   GLU  82          2HG       GLU  82  -8.101  -7.116 -10.856
  604    HA   PRO  83           HA       PRO  83  -5.808  -3.682  -7.374
  605   1HB   PRO  83          1HB       PRO  83  -3.549  -3.865  -8.831
  606   2HB   PRO  83          2HB       PRO  83  -3.839  -4.883  -7.385
  607   1HG   PRO  83          1HG       PRO  83  -4.206  -5.677 -10.277
  608   2HG   PRO  83          2HG       PRO  83  -3.368  -6.569  -8.968
  609   1HD   PRO  83          1HD       PRO  83  -5.991  -7.023  -9.692
  610   2HD   PRO  83          2HD       PRO  83  -5.383  -7.279  -8.029
  611    H    VAL  84           H        VAL  84  -6.453  -1.715  -8.300
  612    HA   VAL  84           HA       VAL  84  -6.985  -1.543 -11.188
  613    HB   VAL  84           HB       VAL  84  -7.184   0.931 -10.506
  614   1HG1  VAL  84          1HG1      VAL  84  -9.087  -0.477 -11.203
  615   2HG1  VAL  84          2HG1      VAL  84  -9.256  -1.085  -9.545
  616   3HG1  VAL  84          3HG1      VAL  84  -9.573   0.629  -9.908
  617   1HG2  VAL  84          1HG2      VAL  84  -6.299   0.780  -8.216
  618   2HG2  VAL  84          2HG2      VAL  84  -7.912   1.498  -8.307
  619   3HG2  VAL  84          3HG2      VAL  84  -7.730  -0.175  -7.749
  620    H    LYS  85           H        LYS  85  -4.489  -0.604  -8.784
  621    HA   LYS  85           HA       LYS  85  -2.544  -0.692 -10.913
  622   1HB   LYS  85          1HB       LYS  85  -1.589   1.510 -10.718
  623   2HB   LYS  85          2HB       LYS  85  -3.270   1.631 -11.200
  624   1HG   LYS  85          1HG       LYS  85  -3.891   2.234  -8.851
  625   2HG   LYS  85          2HG       LYS  85  -2.188   2.109  -8.382
  626   1HD   LYS  85          1HD       LYS  85  -2.702   4.437  -8.725
  627   2HD   LYS  85          2HD       LYS  85  -1.640   3.923 -10.047
  628   1HE   LYS  85          1HE       LYS  85  -3.644   3.654 -11.494
  629   2HE   LYS  85          2HE       LYS  85  -4.679   4.150 -10.137
  630   1HZ   LYS  85          1HZ       LYS  85  -2.670   5.879 -11.473
  631   2HZ   LYS  85          2HZ       LYS  85  -4.360   5.970 -11.568
  632   3HZ   LYS  85          3HZ       LYS  85  -3.632   6.328 -10.205
  633    H    GLN  86           H        GLN  86  -0.318  -0.176 -10.038
  634    HA   GLN  86           HA       GLN  86   0.058  -0.738  -7.183
  635   1HB   GLN  86          1HB       GLN  86   0.201  -2.926  -7.986
  636   2HB   GLN  86          2HB       GLN  86   0.968  -2.456  -9.505
  637   1HG   GLN  86          1HG       GLN  86   3.065  -2.066  -8.491
  638   2HG   GLN  86          2HG       GLN  86   2.425  -2.172  -6.853
  639   1HE2  GLN  86          1HE2      GLN  86   4.635  -3.728  -7.387
  640   2HE2  GLN  86          2HE2      GLN  86   4.126  -5.398  -7.566
  641    H    LEU  87           H        LEU  87   1.699   0.421  -6.341
  642    HA   LEU  87           HA       LEU  87   3.468   2.042  -8.096
  643   1HB   LEU  87          1HB       LEU  87   2.214   2.369  -5.355
  644   2HB   LEU  87          2HB       LEU  87   3.699   3.209  -5.725
  645    HG   LEU  87           HG       LEU  87   1.732   4.623  -5.880
  646   1HD1  LEU  87          1HD1      LEU  87   3.789   4.980  -7.268
  647   2HD1  LEU  87          2HD1      LEU  87   2.938   4.224  -8.635
  648   3HD1  LEU  87          3HD1      LEU  87   2.320   5.724  -7.897
  649   1HD2  LEU  87          1HD2      LEU  87   0.814   2.970  -8.265
  650   2HD2  LEU  87          2HD2      LEU  87   0.057   2.953  -6.653
  651   3HD2  LEU  87          3HD2      LEU  87   0.072   4.438  -7.630
  652    H    ILE  88           H        ILE  88   5.698   1.798  -7.640
  653    HA   ILE  88           HA       ILE  88   6.535   0.011  -5.475
  654    HB   ILE  88           HB       ILE  88   8.015  -1.238  -6.987
  655   1HG1  ILE  88          1HG1      ILE  88   6.559   0.204  -9.255
  656   2HG1  ILE  88          2HG1      ILE  88   8.276   0.300  -8.854
  657   1HG2  ILE  88          1HG2      ILE  88   6.391  -2.794  -7.762
  658   2HG2  ILE  88          2HG2      ILE  88   5.707  -2.026  -6.326
  659   3HG2  ILE  88          3HG2      ILE  88   5.155  -1.521  -7.934
  660   1HD1  ILE  88          1HD1      ILE  88   6.784  -2.108  -9.960
  661   2HD1  ILE  88          2HD1      ILE  88   8.032  -1.141 -10.754
  662   3HD1  ILE  88          3HD1      ILE  88   8.462  -2.168  -9.364
  663    H    GLY  89           H        GLY  89   8.622   0.387  -4.819
  664   1HA   GLY  89          1HA       GLY  89  10.629   1.515  -4.542
  665   2HA   GLY  89          2HA       GLY  89  10.403   2.331  -6.101
  666    H    TYR  90           H        TYR  90  11.367   3.843  -4.040
  667    HA   TYR  90           HA       TYR  90   9.164   5.071  -2.591
  668   1HB   TYR  90          1HB       TYR  90  11.243   4.699  -1.450
  669   2HB   TYR  90          2HB       TYR  90  12.102   5.699  -2.621
  670    HD1  TYR  90           1HD      TYR  90   8.736   6.723  -1.276
  671    HD2  TYR  90           2HD      TYR  90  13.025   7.180  -0.949
  672    HE1  TYR  90           1HE      TYR  90   8.417   8.528   0.346
  673    HE2  TYR  90           2HE      TYR  90  12.687   9.045   0.652
  674    HH   TYR  90           HH       TYR  90  10.035   9.263   2.407
  675    H    GLN  91           H        GLN  91   8.018   5.637  -4.580
  676    HA   GLN  91           HA       GLN  91   8.846   8.222  -5.742
  677   1HB   GLN  91          1HB       GLN  91   5.961   7.434  -5.816
  678   2HB   GLN  91          2HB       GLN  91   6.967   8.232  -6.989
  679   1HG   GLN  91          1HG       GLN  91   6.932   5.244  -6.443
  680   2HG   GLN  91          2HG       GLN  91   6.250   6.081  -7.836
  681   1HE2  GLN  91          1HE2      GLN  91   8.511   3.951  -7.585
  682   2HE2  GLN  91          2HE2      GLN  91   9.821   4.747  -8.467
  683    HA   PRO  92           HA       PRO  92   7.635   9.769  -1.689
  684   1HB   PRO  92          1HB       PRO  92   8.049  12.450  -1.980
  685   2HB   PRO  92          2HB       PRO  92   9.400  11.275  -1.958
  686   1HG   PRO  92          1HG       PRO  92   7.987  12.443  -4.371
  687   2HG   PRO  92          2HG       PRO  92   9.753  12.403  -4.059
  688   1HD   PRO  92          1HD       PRO  92   8.538  10.515  -5.602
  689   2HD   PRO  92          2HD       PRO  92   9.866  10.070  -4.485
  690    H    LYS  93           H        LYS  93   6.120  11.461  -0.797
  691    HA   LYS  93           HA       LYS  93   3.497  11.128  -1.139
  692   1HB   LYS  93          1HB       LYS  93   4.816  12.751   0.423
  693   2HB   LYS  93          2HB       LYS  93   4.687  13.935  -0.802
  694   1HG   LYS  93          1HG       LYS  93   2.975  14.406   0.709
  695   2HG   LYS  93          2HG       LYS  93   2.231  13.847  -0.789
  696   1HD   LYS  93          1HD       LYS  93   1.906  11.581   0.255
  697   2HD   LYS  93          2HD       LYS  93   2.570  12.212   1.776
  698   1HE   LYS  93          1HE       LYS  93   0.154  13.294   0.266
  699   2HE   LYS  93          2HE       LYS  93   0.090  12.226   1.675
  700   1HZ   LYS  93          1HZ       LYS  93   0.667  15.059   1.595
  701   2HZ   LYS  93          2HZ       LYS  93  -0.045  14.144   2.807
  702   3HZ   LYS  93          3HZ       LYS  93   1.503  14.129   2.721
  703    H    GLU  94           H        GLU  94   5.089  13.753  -2.676
  704    HA   GLU  94           HA       GLU  94   3.014  14.784  -4.214
  705   1HB   GLU  94          1HB       GLU  94   5.291  15.806  -3.904
  706   2HB   GLU  94          2HB       GLU  94   5.949  14.642  -5.059
  707   1HG   GLU  94          1HG       GLU  94   4.341  15.612  -6.793
  708   2HG   GLU  94          2HG       GLU  94   3.929  16.858  -5.608
  709    H    GLN  95           H        GLN  95   5.197  12.129  -5.260
  710    HA   GLN  95           HA       GLN  95   4.034  11.979  -7.956
  711   1HB   GLN  95          1HB       GLN  95   6.182  10.478  -6.397
  712   2HB   GLN  95          2HB       GLN  95   5.466   9.769  -7.845
  713   1HG   GLN  95          1HG       GLN  95   7.549  10.847  -8.367
  714   2HG   GLN  95          2HG       GLN  95   6.200  11.593  -9.228
  715   1HE2  GLN  95          1HE2      GLN  95   5.748  13.861  -8.841
  716   2HE2  GLN  95          2HE2      GLN  95   6.725  14.841  -7.763
  717    H    LEU  96           H        LEU  96   3.988  10.222  -4.863
  718    HA   LEU  96           HA       LEU  96   2.428   7.982  -5.631
  719   1HB   LEU  96          1HB       LEU  96   3.896   8.624  -3.547
  720   2HB   LEU  96          2HB       LEU  96   2.380   9.201  -2.904
  721    HG   LEU  96           HG       LEU  96   2.818   6.374  -3.961
  722   1HD1  LEU  96          1HD1      LEU  96   2.806   7.379  -1.081
  723   2HD1  LEU  96          2HD1      LEU  96   3.010   5.698  -1.632
  724   3HD1  LEU  96          3HD1      LEU  96   4.252   6.901  -1.997
  725   1HD2  LEU  96          1HD2      LEU  96   0.444   6.971  -3.978
  726   2HD2  LEU  96          2HD2      LEU  96   0.738   5.896  -2.613
  727   3HD2  LEU  96          3HD2      LEU  96   0.570   7.641  -2.338
  728    H    GLU  97           H        GLU  97   1.452  10.960  -3.884
  729    HA   GLU  97           HA       GLU  97  -1.328  10.370  -4.037
  730   1HB   GLU  97          1HB       GLU  97  -0.042  11.744  -2.318
  731   2HB   GLU  97          2HB       GLU  97  -0.023  13.055  -3.500
  732   1HG   GLU  97          1HG       GLU  97  -2.325  13.406  -3.350
  733   2HG   GLU  97          2HG       GLU  97  -2.650  11.747  -2.818
  734    H    ALA  98           H        ALA  98   0.903  12.039  -6.251
  735    HA   ALA  98           HA       ALA  98  -1.247  13.156  -7.883
  736   1HB   ALA  98          1HB       ALA  98   0.981  14.086  -8.139
  737   2HB   ALA  98          2HB       ALA  98   1.638  12.496  -8.610
  738   3HB   ALA  98          3HB       ALA  98   0.479  13.334  -9.660
  739    H    GLN  99           H        GLN  99   0.817  10.173  -8.165
  740    HA   GLN  99           HA       GLN  99  -0.550   9.164 -10.450
  741   1HB   GLN  99          1HB       GLN  99   1.624   8.348  -9.600
  742   2HB   GLN  99          2HB       GLN  99   0.848   7.665  -8.185
  743   1HG   GLN  99          1HG       GLN  99   1.392   5.979  -9.970
  744   2HG   GLN  99          2HG       GLN  99  -0.294   6.000  -9.459
  745   1HE2  GLN  99          1HE2      GLN  99   1.655   7.863 -11.936
  746   2HE2  GLN  99          2HE2      GLN  99   0.512   7.509 -13.225
  747    H    LEU 100           H        LEU 100  -1.182   8.730  -7.003
  748    HA   LEU 100           HA       LEU 100  -3.496   7.013  -7.446
  749   1HB   LEU 100          1HB       LEU 100  -1.684   7.540  -5.309
  750   2HB   LEU 100          2HB       LEU 100  -3.234   8.071  -4.757
  751    HG   LEU 100           HG       LEU 100  -4.080   5.734  -5.614
  752   1HD1  LEU 100          1HD1      LEU 100  -1.065   5.216  -5.386
  753   2HD1  LEU 100          2HD1      LEU 100  -2.314   4.015  -5.766
  754   3HD1  LEU 100          3HD1      LEU 100  -1.941   5.324  -6.912
  755   1HD2  LEU 100          1HD2      LEU 100  -2.116   5.823  -3.286
  756   2HD2  LEU 100          2HD2      LEU 100  -3.844   6.277  -3.212
  757   3HD2  LEU 100          3HD2      LEU 100  -3.375   4.606  -3.562
  758    H    ALA 101           H        ALA 101  -3.221  10.324  -7.908
  759    HA   ALA 101           HA       ALA 101  -5.327  11.459  -6.461
  760   1HB   ALA 101          1HB       ALA 101  -4.407  12.162  -9.278
  761   2HB   ALA 101          2HB       ALA 101  -5.355  13.195  -8.190
  762   3HB   ALA 101          3HB       ALA 101  -3.692  12.770  -7.765
  763    H    ASP 102           H        ASP 102  -5.504   9.329  -9.283
  764    HA   ASP 102           HA       ASP 102  -8.219  10.028 -10.024
  765   1HB   ASP 102          1HB       ASP 102  -8.028   8.104 -11.531
  766   2HB   ASP 102          2HB       ASP 102  -6.649   9.185 -11.688
  767    H    VAL 103           H        VAL 103  -6.996   8.328  -7.334
  768    HA   VAL 103           HA       VAL 103  -9.802   7.415  -6.925
  769    HB   VAL 103           HB       VAL 103  -7.621   5.727  -6.935
  770   1HG1  VAL 103          1HG1      VAL 103  -8.197   6.298  -3.994
  771   2HG1  VAL 103          2HG1      VAL 103  -7.225   4.978  -4.627
  772   3HG1  VAL 103          3HG1      VAL 103  -6.678   6.640  -4.859
  773   1HG2  VAL 103          1HG2      VAL 103  -9.145   4.082  -6.052
  774   2HG2  VAL 103          2HG2      VAL 103 -10.237   5.375  -5.470
  775   3HG2  VAL 103          3HG2      VAL 103  -9.952   5.145  -7.206
  776    H    LEU 104           H        LEU 104  -7.330   9.604  -5.839
  777    HA   LEU 104           HA       LEU 104  -8.728  10.115  -3.317
  778   1HB   LEU 104          1HB       LEU 104  -6.190  11.056  -4.660
  779   2HB   LEU 104          2HB       LEU 104  -6.900  12.047  -3.477
  780    HG   LEU 104           HG       LEU 104  -5.477  10.967  -2.130
  781   1HD1  LEU 104          1HD1      LEU 104  -7.644  10.196  -1.209
  782   2HD1  LEU 104          2HD1      LEU 104  -7.516   8.707  -2.190
  783   3HD1  LEU 104          3HD1      LEU 104  -6.331   9.033  -0.922
  784   1HD2  LEU 104          1HD2      LEU 104  -4.397   9.753  -3.926
  785   2HD2  LEU 104          2HD2      LEU 104  -4.513   8.756  -2.467
  786   3HD2  LEU 104          3HD2      LEU 104  -5.622   8.464  -3.825
  787    H    GLN 105           H        GLN 105  -9.041  11.133  -6.564
  788    HA   GLN 105           HA       GLN 105 -10.085  13.698  -6.352
  789   1HB   GLN 105          2HB       GLN 105  -9.641  12.427  -8.419
  790   2HB   GLN 105          3HB       GLN 105 -11.076  11.466  -8.121
  791   1HG   GLN 105          2HG       GLN 105 -11.333  14.486  -8.220
  792   2HG   GLN 105          3HG       GLN 105 -11.011  13.627  -9.719
  793   1HE2  GLN 105          1HE2      GLN 105 -13.354  13.644  -6.951
  794   2HE2  GLN 105          2HE2      GLN 105 -14.719  13.154  -7.979
  Start of MODEL    8
    1   1H    ALA   1           H        ALA   1 -10.372   1.018  11.371
    2   2H    ALA   1          2HN       ALA   1 -10.826   2.087  10.224
    3   3H    ALA   1          3HN       ALA   1 -11.640   0.647  10.359
    4    HA   ALA   1           HA       ALA   1  -9.700  -0.564   9.707
    5   1HB   ALA   1          1HB       ALA   1  -9.575   0.196   7.354
    6   2HB   ALA   1          2HB       ALA   1 -11.248   0.253   7.921
    7   3HB   ALA   1          3HB       ALA   1 -10.302   1.752   7.798
    8    H    THR   2           H        THR   2  -7.639   0.154   8.145
    9    HA   THR   2           HA       THR   2  -5.969   1.343   7.564
   10    HB   THR   2           HB       THR   2  -7.047   3.597   9.302
   11    HG1  THR   2           1HG      THR   2  -8.171   4.090   7.307
   12   1HG2  THR   2          1HG2      THR   2  -4.994   4.377   8.422
   13   2HG2  THR   2          2HG2      THR   2  -5.251   3.565   6.868
   14   3HG2  THR   2          3HG2      THR   2  -6.218   4.979   7.299
   15    H    MET   3           H        MET   3  -3.998   2.577   8.192
   16    HA   MET   3           HA       MET   3  -2.092   2.890   9.166
   17   1HB   MET   3          1HB       MET   3  -3.685   3.824  10.941
   18   2HB   MET   3          2HB       MET   3  -3.361   2.353  11.865
   19   1HG   MET   3          1HG       MET   3  -0.936   2.952  11.898
   20   2HG   MET   3          2HG       MET   3  -1.306   4.416  10.979
   21   1HE   MET   3          1HE       MET   3  -0.388   5.850  14.494
   22   2HE   MET   3          2HE       MET   3   0.376   4.571  13.522
   23   3HE   MET   3          3HE       MET   3  -0.195   6.064  12.742
   24    H    THR   4           H        THR   4  -3.459  -0.058   9.775
   25    HA   THR   4           HA       THR   4  -0.855  -1.406   9.514
   26    HB   THR   4           HB       THR   4  -2.533  -1.686  12.006
   27    HG1  THR   4           1HG      THR   4  -0.619  -0.108  11.422
   28   1HG2  THR   4          1HG2      THR   4  -1.771  -3.963  11.501
   29   2HG2  THR   4          2HG2      THR   4  -0.123  -3.369  11.174
   30   3HG2  THR   4          3HG2      THR   4  -0.799  -3.301  12.815
   31    H    LEU   5           H        LEU   5  -1.051  -3.663   9.001
   32    HA   LEU   5           HA       LEU   5  -3.639  -4.928   8.534
   33   1HB   LEU   5          1HB       LEU   5  -2.490  -3.482   6.444
   34   2HB   LEU   5          2HB       LEU   5  -1.726  -5.015   6.261
   35    HG   LEU   5           HG       LEU   5  -3.932  -6.135   6.095
   36   1HD1  LEU   5          1HD1      LEU   5  -5.251  -3.428   5.759
   37   2HD1  LEU   5          2HD1      LEU   5  -5.979  -5.018   5.957
   38   3HD1  LEU   5          3HD1      LEU   5  -5.225  -4.208   7.339
   39   1HD2  LEU   5          1HD2      LEU   5  -4.504  -4.969   3.832
   40   2HD2  LEU   5          2HD2      LEU   5  -3.177  -3.867   4.204
   41   3HD2  LEU   5          3HD2      LEU   5  -2.851  -5.591   4.036
   42    H    THR   6           H        THR   6  -3.082  -7.314   7.738
   43    HA   THR   6           HA       THR   6  -0.621  -8.320   8.718
   44    HB   THR   6           HB       THR   6  -3.325  -8.946  10.013
   45    HG1  THR   6           1HG      THR   6  -1.256  -7.266  10.650
   46   1HG2  THR   6          1HG2      THR   6  -1.931 -10.986   9.961
   47   2HG2  THR   6          2HG2      THR   6  -0.592 -10.090  10.720
   48   3HG2  THR   6          3HG2      THR   6  -2.100 -10.357  11.605
   49    H    ASP   7           H        ASP   7  -0.602 -10.447   8.004
   50    HA   ASP   7           HA       ASP   7  -1.011 -10.778   5.346
   51   1HB   ASP   7          1HB       ASP   7   0.498 -12.191   6.710
   52   2HB   ASP   7          2HB       ASP   7  -0.877 -12.974   7.478
   53    H    ALA   8           H        ALA   8  -3.158 -12.401   7.665
   54    HA   ALA   8           HA       ALA   8  -5.046 -13.333   5.718
   55   1HB   ALA   8          1HB       ALA   8  -6.567 -13.525   7.692
   56   2HB   ALA   8          2HB       ALA   8  -4.941 -14.158   8.061
   57   3HB   ALA   8          3HB       ALA   8  -5.438 -12.556   8.654
   58    H    ASN   9           H        ASN   9  -4.801 -10.321   7.499
   59    HA   ASN   9           HA       ASN   9  -7.478  -9.415   6.873
   60   1HB   ASN   9          1HB       ASN   9  -6.217  -8.844   8.979
   61   2HB   ASN   9          2HB       ASN   9  -5.234  -7.760   7.979
   62   1HD2  ASN   9          1HD2      ASN   9  -5.993  -5.743   8.920
   63   2HD2  ASN   9          2HD2      ASN   9  -7.682  -5.293   8.757
   64    H    PHE  10           H        PHE  10  -4.356  -9.280   5.328
   65    HA   PHE  10           HA       PHE  10  -4.758  -7.075   3.610
   66   1HB   PHE  10          1HB       PHE  10  -2.612  -8.257   3.832
   67   2HB   PHE  10          2HB       PHE  10  -3.315  -9.689   3.112
   68    HD1  PHE  10           1HD      PHE  10  -1.444  -9.745   1.563
   69    HD2  PHE  10           2HD      PHE  10  -4.233  -6.452   1.522
   70    HE1  PHE  10           1HE      PHE  10  -0.693  -9.136  -0.686
   71    HE2  PHE  10           2HE      PHE  10  -3.510  -5.874  -0.746
   72    HZ   PHE  10           HZ       PHE  10  -1.757  -7.220  -1.888
   73    H    GLN  11           H        GLN  11  -5.486 -10.557   2.870
   74    HA   GLN  11           HA       GLN  11  -6.896  -9.866   0.493
   75   1HB   GLN  11          1HB       GLN  11  -5.891 -12.116   1.176
   76   2HB   GLN  11          2HB       GLN  11  -7.398 -12.408   2.067
   77   1HG   GLN  11          1HG       GLN  11  -8.656 -11.933  -0.083
   78   2HG   GLN  11          2HG       GLN  11  -7.113 -11.732  -0.914
   79   1HE2  GLN  11          1HE2      GLN  11  -5.537 -13.946  -0.133
   80   2HE2  GLN  11          2HE2      GLN  11  -6.436 -15.372  -0.615
   81    H    GLN  12           H        GLN  12  -8.018 -10.354   3.869
   82    HA   GLN  12           HA       GLN  12 -10.800 -10.106   3.287
   83   1HB   GLN  12          1HB       GLN  12  -9.272  -9.342   5.809
   84   2HB   GLN  12          2HB       GLN  12 -11.020  -9.467   5.703
   85   1HG   GLN  12          1HG       GLN  12 -10.923 -11.853   5.290
   86   2HG   GLN  12          2HG       GLN  12  -9.166 -11.825   5.168
   87   1HE2  GLN  12          1HE2      GLN  12 -11.885 -11.221   7.481
   88   2HE2  GLN  12          2HE2      GLN  12 -10.890 -11.556   8.895
   89    H    ALA  13           H        ALA  13  -8.311  -7.508   3.722
   90    HA   ALA  13           HA       ALA  13 -10.259  -5.414   3.604
   91   1HB   ALA  13          1HB       ALA  13  -7.302  -5.377   2.857
   92   2HB   ALA  13          2HB       ALA  13  -8.351  -3.963   3.092
   93   3HB   ALA  13          3HB       ALA  13  -7.989  -5.030   4.458
   94    H    ILE  14           H        ILE  14  -8.029  -6.797   1.086
   95    HA   ILE  14           HA       ILE  14  -9.104  -5.064  -0.875
   96    HB   ILE  14           HB       ILE  14  -7.880  -6.350  -2.550
   97   1HG1  ILE  14          1HG1      ILE  14  -6.647  -8.118  -0.500
   98   2HG1  ILE  14          2HG1      ILE  14  -8.166  -8.632  -1.261
   99   1HG2  ILE  14          1HG2      ILE  14  -6.267  -5.771  -0.031
  100   2HG2  ILE  14          2HG2      ILE  14  -5.637  -5.870  -1.686
  101   3HG2  ILE  14          3HG2      ILE  14  -6.767  -4.588  -1.258
  102   1HD1  ILE  14          1HD1      ILE  14  -6.268  -9.572  -2.461
  103   2HD1  ILE  14          2HD1      ILE  14  -7.106  -8.401  -3.498
  104   3HD1  ILE  14          3HD1      ILE  14  -5.570  -7.961  -2.712
  105    H    GLN  15           H        GLN  15 -10.347  -8.139   0.090
  106    HA   GLN  15           HA       GLN  15 -11.571  -8.937  -2.277
  107   1HB   GLN  15          1HB       GLN  15 -13.059 -10.349  -0.918
  108   2HB   GLN  15          2HB       GLN  15 -11.369 -10.442  -0.454
  109   1HG   GLN  15          1HG       GLN  15 -12.757 -10.540   1.502
  110   2HG   GLN  15          2HG       GLN  15 -11.773  -9.085   1.500
  111   1HE2  GLN  15          1HE2      GLN  15 -12.911  -7.537   2.596
  112   2HE2  GLN  15          2HE2      GLN  15 -14.498  -6.976   2.037
  113    H    GLY  16           H        GLY  16 -12.806  -6.383  -0.138
  114   1HA   GLY  16          1HA       GLY  16 -14.756  -5.342  -1.893
  115   2HA   GLY  16          2HA       GLY  16 -15.538  -6.599  -0.972
  116    H    ASP  17           H        ASP  17 -14.589  -3.543  -1.064
  117    HA   ASP  17           HA       ASP  17 -15.307  -2.764   1.680
  118   1HB   ASP  17          1HB       ASP  17 -13.023  -3.621   1.993
  119   2HB   ASP  17          2HB       ASP  17 -12.423  -2.607   0.694
  120    H    GLY  18           H        GLY  18 -13.129  -1.506  -0.899
  121   1HA   GLY  18          1HA       GLY  18 -14.561   0.572  -2.068
  122   2HA   GLY  18          2HA       GLY  18 -13.903   1.133  -0.504
  123    HA   PRO  19           HA       PRO  19 -10.186   1.270  -3.385
  124   1HB   PRO  19          1HB       PRO  19  -9.279   3.728  -2.543
  125   2HB   PRO  19          2HB       PRO  19 -10.424   3.524  -3.891
  126   1HG   PRO  19          1HG       PRO  19 -11.045   4.220  -1.019
  127   2HG   PRO  19          2HG       PRO  19 -11.704   4.959  -2.505
  128   1HD   PRO  19          1HD       PRO  19 -13.033   3.051  -1.058
  129   2HD   PRO  19          2HD       PRO  19 -13.188   3.161  -2.836
  130    H    VAL  20           H        VAL  20  -8.866  -0.162  -2.411
  131    HA   VAL  20           HA       VAL  20  -8.071   0.228   0.427
  132    HB   VAL  20           HB       VAL  20  -8.302  -2.257  -1.293
  133   1HG1  VAL  20          1HG1      VAL  20  -7.583  -3.532   0.755
  134   2HG1  VAL  20          2HG1      VAL  20  -6.287  -2.541   0.083
  135   3HG1  VAL  20          3HG1      VAL  20  -7.161  -1.996   1.532
  136   1HG2  VAL  20          1HG2      VAL  20  -9.942  -3.038   0.268
  137   2HG2  VAL  20          2HG2      VAL  20  -9.657  -1.675   1.358
  138   3HG2  VAL  20          3HG2      VAL  20 -10.422  -1.410  -0.213
  139    H    LEU  21           H        LEU  21  -5.845   0.286   0.841
  140    HA   LEU  21           HA       LEU  21  -4.028   0.356  -1.539
  141   1HB   LEU  21          1HB       LEU  21  -5.068   2.541  -1.365
  142   2HB   LEU  21          2HB       LEU  21  -4.720   2.638   0.349
  143    HG   LEU  21           HG       LEU  21  -2.292   2.747  -0.101
  144   1HD1  LEU  21          1HD1      LEU  21  -1.984   1.484  -2.083
  145   2HD1  LEU  21          2HD1      LEU  21  -3.259   2.362  -2.948
  146   3HD1  LEU  21          3HD1      LEU  21  -1.735   3.157  -2.584
  147   1HD2  LEU  21          1HD2      LEU  21  -3.933   4.737  -1.731
  148   2HD2  LEU  21          2HD2      LEU  21  -3.608   4.829   0.011
  149   3HD2  LEU  21          3HD2      LEU  21  -2.275   4.979  -1.138
  150    H    VAL  22           H        VAL  22  -2.239  -0.894  -1.022
  151    HA   VAL  22           HA       VAL  22  -1.790  -1.248   1.918
  152    HB   VAL  22           HB       VAL  22  -1.497  -3.233  -0.362
  153   1HG1  VAL  22          1HG1      VAL  22  -1.098  -3.572   2.647
  154   2HG1  VAL  22          2HG1      VAL  22  -1.134  -4.893   1.457
  155   3HG1  VAL  22          3HG1      VAL  22   0.165  -3.701   1.402
  156   1HG2  VAL  22          1HG2      VAL  22  -3.838  -2.839   0.111
  157   2HG2  VAL  22          2HG2      VAL  22  -3.408  -4.328   0.947
  158   3HG2  VAL  22          3HG2      VAL  22  -3.552  -2.830   1.864
  159    H    ASP  23           H        ASP  23   0.020  -0.556   2.744
  160    HA   ASP  23           HA       ASP  23   2.389   0.019   1.034
  161   1HB   ASP  23          1HB       ASP  23   1.949   1.574   2.868
  162   2HB   ASP  23          2HB       ASP  23   1.900   0.305   4.017
  163    H    PHE  24           H        PHE  24   3.397  -1.788   0.369
  164    HA   PHE  24           HA       PHE  24   4.024  -3.970   2.278
  165   1HB   PHE  24          1HB       PHE  24   4.813  -3.540  -0.608
  166   2HB   PHE  24          2HB       PHE  24   5.262  -4.909   0.359
  167    HD1  PHE  24           1HD      PHE  24   3.398  -6.314   1.404
  168    HD2  PHE  24           2HD      PHE  24   2.751  -3.643  -1.907
  169    HE1  PHE  24           1HE      PHE  24   1.666  -7.844   0.522
  170    HE2  PHE  24           2HE      PHE  24   0.998  -5.155  -2.779
  171    HZ   PHE  24           HZ       PHE  24   0.579  -7.349  -1.598
  172    H    TRP  25           H        TRP  25   5.434  -3.285   3.681
  173    HA   TRP  25           HA       TRP  25   8.014  -2.219   2.677
  174   1HB   TRP  25          1HB       TRP  25   8.331  -0.864   4.597
  175   2HB   TRP  25          2HB       TRP  25   6.731  -0.501   4.024
  176    HD1  TRP  25           HD       TRP  25   4.694  -1.524   5.499
  177    HE1  TRP  25           1HE      TRP  25   4.504  -1.972   8.014
  178    HE3  TRP  25           3HE      TRP  25   9.668  -1.475   6.672
  179    HZ2  TRP  25           2HZ      TRP  25   6.331  -2.259  10.287
  180    HZ3  TRP  25           3HZ      TRP  25  10.417  -1.778   9.010
  181    HH2  TRP  25           HH       TRP  25   8.757  -2.166  10.826
  182    H    ALA  26           H        ALA  26   9.722  -2.974   4.739
  183    HA   ALA  26           HA       ALA  26   8.908  -5.532   5.814
  184   1HB   ALA  26          1HB       ALA  26   9.743  -6.113   3.512
  185   2HB   ALA  26          2HB       ALA  26  11.316  -5.419   3.960
  186   3HB   ALA  26          3HB       ALA  26  10.669  -6.830   4.833
  187    H    ALA  27           H        ALA  27  10.308  -6.211   7.491
  188    HA   ALA  27           HA       ALA  27  11.450  -4.076   8.960
  189   1HB   ALA  27          1HB       ALA  27  12.115  -5.825  10.561
  190   2HB   ALA  27          2HB       ALA  27  10.460  -6.088   9.984
  191   3HB   ALA  27          3HB       ALA  27  11.791  -7.080   9.344
  192    H    TRP  28           H        TRP  28  13.030  -6.175   6.609
  193    HA   TRP  28           HA       TRP  28  15.689  -5.550   7.685
  194   1HB   TRP  28          1HB       TRP  28  16.419  -7.370   6.658
  195   2HB   TRP  28          2HB       TRP  28  14.732  -7.818   6.613
  196    HD1  TRP  28           HD       TRP  28  17.663  -6.767   4.507
  197    HE1  TRP  28           1HE      TRP  28  17.172  -6.880   2.006
  198    HE3  TRP  28           3HE      TRP  28  12.691  -8.005   4.706
  199    HZ2  TRP  28           2HZ      TRP  28  14.843  -7.087   0.310
  200    HZ3  TRP  28           3HZ      TRP  28  11.337  -8.067   2.607
  201    HH2  TRP  28           HH       TRP  28  12.413  -7.511   0.437
  202    H    CYS  29           H        CYS  29  13.610  -3.982   5.490
  203    HA   CYS  29           HA       CYS  29  15.348  -3.669   3.255
  204   1HB   CYS  29          1HB       CYS  29  13.613  -2.393   2.319
  205   2HB   CYS  29          2HB       CYS  29  12.800  -3.542   3.380
  206    H    GLY  30           H        GLY  30  15.693  -1.291   2.360
  207   1HA   GLY  30          1HA       GLY  30  16.782   0.553   4.436
  208   2HA   GLY  30          2HA       GLY  30  17.127   0.624   2.715
  209    HA   PRO  31           HA       PRO  31  14.368   3.930   2.519
  210   1HB   PRO  31          1HB       PRO  31  13.325   3.888  -0.036
  211   2HB   PRO  31          2HB       PRO  31  15.035   4.263   0.346
  212   1HG   PRO  31          1HG       PRO  31  13.852   1.602  -0.509
  213   2HG   PRO  31          2HG       PRO  31  15.300   2.431  -1.167
  214   1HD   PRO  31          1HD       PRO  31  15.540   0.474   0.687
  215   2HD   PRO  31          2HD       PRO  31  16.574   1.933   0.778
  216    H    CYS  32           H        CYS  32  12.813   0.839   1.916
  217    HA   CYS  32           HA       CYS  32  10.136   1.807   1.912
  218   1HB   CYS  32          1HB       CYS  32   9.457  -0.355   2.025
  219   2HB   CYS  32          2HB       CYS  32  11.083  -0.607   1.415
  220    H    ARG  33           H        ARG  33  12.445   1.366   4.543
  221    HA   ARG  33           HA       ARG  33  10.544   1.621   6.691
  222   1HB   ARG  33          1HB       ARG  33  12.896   0.569   6.667
  223   2HB   ARG  33          2HB       ARG  33  13.512   2.224   6.742
  224   1HG   ARG  33          1HG       ARG  33  12.308   2.550   8.900
  225   2HG   ARG  33          2HG       ARG  33  11.665   0.898   8.782
  226   1HD   ARG  33          1HD       ARG  33  13.967  -0.005   8.800
  227   2HD   ARG  33          2HD       ARG  33  14.634   1.624   8.882
  228    HE   ARG  33           HE       ARG  33  13.524   0.028  11.013
  229   1HH1  ARG  33          2HH2      ARG  33  14.077   3.377  10.045
  230   2HH1  ARG  33          1HH2      ARG  33  14.143   4.015  11.653
  231   1HH2  ARG  33          2HH1      ARG  33  13.580   0.845  13.174
  232   2HH2  ARG  33          1HH1      ARG  33  13.837   2.524  13.471
  233    H    MET  34           H        MET  34  11.777   3.926   4.427
  234    HA   MET  34           HA       MET  34  11.170   6.199   6.203
  235   1HB   MET  34          1HB       MET  34  12.481   6.061   3.443
  236   2HB   MET  34          2HB       MET  34  12.132   7.547   4.327
  237   1HG   MET  34          1HG       MET  34  13.580   6.699   6.201
  238   2HG   MET  34          2HG       MET  34  14.067   5.358   5.159
  239   1HE   MET  34          1HE       MET  34  16.087   7.183   2.316
  240   2HE   MET  34          2HE       MET  34  15.707   5.615   3.054
  241   3HE   MET  34          3HE       MET  34  14.419   6.579   2.287
  242    H    MET  35           H        MET  35  10.192   4.571   3.195
  243    HA   MET  35           HA       MET  35   8.157   6.450   2.510
  244   1HB   MET  35          1HB       MET  35   9.192   4.776   0.955
  245   2HB   MET  35          2HB       MET  35   8.229   3.508   1.730
  246   1HG   MET  35          1HG       MET  35   6.197   4.703   1.073
  247   2HG   MET  35          2HG       MET  35   7.146   6.047   0.425
  248   1HE   MET  35          1HE       MET  35   5.957   6.058  -1.865
  249   2HE   MET  35          2HE       MET  35   5.752   4.631  -2.911
  250   3HE   MET  35          3HE       MET  35   4.856   4.736  -1.386
  251    H    ALA  36           H        ALA  36   8.112   3.360   4.406
  252    HA   ALA  36           HA       ALA  36   5.365   3.191   4.820
  253   1HB   ALA  36          1HB       ALA  36   5.947   1.946   6.909
  254   2HB   ALA  36          2HB       ALA  36   6.882   1.442   5.500
  255   3HB   ALA  36          3HB       ALA  36   7.637   2.466   6.735
  256    HA   PRO  37           HA       PRO  37   5.244   6.303   8.405
  257   1HB   PRO  37          1HB       PRO  37   7.323   8.097   8.774
  258   2HB   PRO  37          2HB       PRO  37   7.098   6.572   9.685
  259   1HG   PRO  37          1HG       PRO  37   8.882   7.104   7.329
  260   2HG   PRO  37          2HG       PRO  37   9.246   6.172   8.802
  261   1HD   PRO  37          1HD       PRO  37   8.547   4.926   6.488
  262   2HD   PRO  37          2HD       PRO  37   8.025   4.309   8.072
  263    H    VAL  38           H        VAL  38   7.031   7.280   5.356
  264    HA   VAL  38           HA       VAL  38   5.633   9.803   5.204
  265    HB   VAL  38           HB       VAL  38   7.556   8.338   3.679
  266   1HG1  VAL  38          1HG1      VAL  38   7.002   8.837   1.363
  267   2HG1  VAL  38          2HG1      VAL  38   5.897   7.659   2.051
  268   3HG1  VAL  38          3HG1      VAL  38   5.366   9.328   1.836
  269   1HG2  VAL  38          1HG2      VAL  38   6.599  11.193   3.486
  270   2HG2  VAL  38          2HG2      VAL  38   7.901  10.548   4.496
  271   3HG2  VAL  38          3HG2      VAL  38   8.067  10.546   2.737
  272    H    LEU  39           H        LEU  39   4.687   6.518   4.341
  273    HA   LEU  39           HA       LEU  39   2.263   7.226   3.004
  274   1HB   LEU  39          1HB       LEU  39   3.560   4.678   4.043
  275   2HB   LEU  39          2HB       LEU  39   1.991   4.662   3.314
  276    HG   LEU  39           HG       LEU  39   4.561   5.581   1.984
  277   1HD1  LEU  39          1HD1      LEU  39   4.395   3.159   2.269
  278   2HD1  LEU  39          2HD1      LEU  39   2.797   3.156   1.488
  279   3HD1  LEU  39          3HD1      LEU  39   4.247   3.572   0.563
  280   1HD2  LEU  39          1HD2      LEU  39   2.946   6.940   0.978
  281   2HD2  LEU  39          2HD2      LEU  39   3.292   5.611  -0.112
  282   3HD2  LEU  39          3HD2      LEU  39   1.787   5.580   0.836
  283    H    GLU  40           H        GLU  40   3.232   6.604   6.362
  284    HA   GLU  40           HA       GLU  40   0.544   6.247   7.315
  285   1HB   GLU  40          1HB       GLU  40   2.648   5.570   8.495
  286   2HB   GLU  40          2HB       GLU  40   2.942   7.268   8.883
  287   1HG   GLU  40          1HG       GLU  40   0.993   7.386  10.272
  288   2HG   GLU  40          2HG       GLU  40   0.306   5.916   9.563
  289    H    GLU  41           H        GLU  41   2.609   9.153   6.774
  290    HA   GLU  41           HA       GLU  41   0.503  10.879   7.788
  291   1HB   GLU  41          1HB       GLU  41   1.901  12.611   7.584
  292   2HB   GLU  41          2HB       GLU  41   3.064  11.296   7.608
  293   1HG   GLU  41          1HG       GLU  41   3.854  12.752   6.003
  294   2HG   GLU  41          2HG       GLU  41   3.145  11.414   5.128
  295    H    PHE  42           H        PHE  42   1.344   9.705   4.526
  296    HA   PHE  42           HA       PHE  42  -0.730  11.009   3.039
  297   1HB   PHE  42          1HB       PHE  42   1.099   9.566   2.100
  298   2HB   PHE  42          2HB       PHE  42   0.314   8.160   2.783
  299    HD1  PHE  42           1HD      PHE  42   0.675  10.045  -0.190
  300    HD2  PHE  42           2HD      PHE  42  -2.167   7.654   2.019
  301    HE1  PHE  42           1HE      PHE  42  -0.639   9.676  -2.237
  302    HE2  PHE  42           2HE      PHE  42  -3.520   7.382  -0.022
  303    HZ   PHE  42           HZ       PHE  42  -2.794   8.450  -2.149
  304    H    ALA  43           H        ALA  43  -0.777   7.979   5.002
  305    HA   ALA  43           HA       ALA  43  -3.497   7.457   4.650
  306   1HB   ALA  43          1HB       ALA  43  -3.286   6.000   6.657
  307   2HB   ALA  43          2HB       ALA  43  -1.953   5.751   5.508
  308   3HB   ALA  43          3HB       ALA  43  -1.703   6.690   6.993
  309    H    GLU  44           H        GLU  44  -1.931   9.221   7.355
  310    HA   GLU  44           HA       GLU  44  -4.284   9.842   8.761
  311   1HB   GLU  44          1HB       GLU  44  -1.976  10.179   9.586
  312   2HB   GLU  44          2HB       GLU  44  -1.770  11.541   8.471
  313   1HG   GLU  44          1HG       GLU  44  -3.559  12.785   9.612
  314   2HG   GLU  44          2HG       GLU  44  -3.920  11.388  10.633
  315    H    ALA  45           H        ALA  45  -2.707  11.675   6.104
  316    HA   ALA  45           HA       ALA  45  -4.579  13.798   6.004
  317   1HB   ALA  45          1HB       ALA  45  -3.615  14.244   3.783
  318   2HB   ALA  45          2HB       ALA  45  -2.330  13.804   4.929
  319   3HB   ALA  45          3HB       ALA  45  -2.908  12.616   3.741
  320    H    HIS  46           H        HIS  46  -5.111  10.528   5.045
  321    HA   HIS  46           HA       HIS  46  -7.550  11.244   3.497
  322   1HB   HIS  46          1HB       HIS  46  -5.413   9.427   2.589
  323   2HB   HIS  46          2HB       HIS  46  -6.998   9.542   1.848
  324    HD1  HIS  46           1HD      HIS  46  -6.564  12.973   2.314
  325    HD2  HIS  46           2HD      HIS  46  -4.555  10.082   0.013
  326    HE1  HIS  46           1HE      HIS  46  -5.867  14.140   0.086
  327    HE2  HIS  46           2HE      HIS  46  -4.701  12.348  -1.339
  328    H    ALA  47           H        ALA  47  -7.103  10.225   6.259
  329    HA   ALA  47           HA       ALA  47  -7.165   7.498   6.475
  330   1HB   ALA  47          1HB       ALA  47  -7.932   7.904   8.797
  331   2HB   ALA  47          2HB       ALA  47  -6.692   9.072   8.305
  332   3HB   ALA  47          3HB       ALA  47  -8.400   9.559   8.355
  333    H    ASP  48           H        ASP  48  -9.908   9.508   5.666
  334    HA   ASP  48           HA       ASP  48 -11.918   7.404   6.062
  335   1HB   ASP  48          1HB       ASP  48 -13.464   9.255   5.588
  336   2HB   ASP  48          2HB       ASP  48 -12.352   9.728   6.868
  337    H    LYS  49           H        LYS  49 -10.542   9.523   3.590
  338    HA   LYS  49           HA       LYS  49 -12.119   8.708   1.434
  339   1HB   LYS  49          1HB       LYS  49 -10.891  10.794   1.585
  340   2HB   LYS  49          2HB       LYS  49  -9.338   9.953   1.531
  341   1HG   LYS  49          1HG       LYS  49  -9.633   9.341  -0.762
  342   2HG   LYS  49          2HG       LYS  49 -11.341   9.794  -0.752
  343   1HD   LYS  49          1HD       LYS  49  -9.499  12.010   0.017
  344   2HD   LYS  49          2HD       LYS  49  -9.209  11.401  -1.598
  345   1HE   LYS  49          1HE       LYS  49 -12.009  12.154  -0.627
  346   2HE   LYS  49          2HE       LYS  49 -10.893  13.321  -1.366
  347   1HZ   LYS  49          1HZ       LYS  49 -10.749  11.851  -3.291
  348   2HZ   LYS  49          2HZ       LYS  49 -11.902  10.877  -2.739
  349   3HZ   LYS  49          3HZ       LYS  49 -12.243  12.414  -3.155
  350    H    VAL  50           H        VAL  50  -9.421   6.918   2.775
  351    HA   VAL  50           HA       VAL  50  -9.881   4.901   0.709
  352    HB   VAL  50           HB       VAL  50  -8.218   6.133  -0.385
  353   1HG1  VAL  50          1HG1      VAL  50  -7.214   7.426   1.422
  354   2HG1  VAL  50          2HG1      VAL  50  -6.480   5.976   2.112
  355   3HG1  VAL  50          3HG1      VAL  50  -5.937   6.591   0.538
  356   1HG2  VAL  50          1HG2      VAL  50  -6.799   3.727   0.752
  357   2HG2  VAL  50          2HG2      VAL  50  -7.928   3.759  -0.620
  358   3HG2  VAL  50          3HG2      VAL  50  -6.396   4.610  -0.732
  359    H    THR  51           H        THR  51  -9.505   2.889   1.347
  360    HA   THR  51           HA       THR  51  -8.993   2.313   4.136
  361    HB   THR  51           HB       THR  51  -9.616   0.529   1.840
  362    HG1  THR  51           1HG      THR  51 -11.695   0.539   2.595
  363   1HG2  THR  51          1HG2      THR  51 -10.305  -1.113   3.602
  364   2HG2  THR  51          2HG2      THR  51  -8.568  -0.822   3.600
  365   3HG2  THR  51          3HG2      THR  51  -9.594  -0.043   4.830
  366    H    VAL  52           H        VAL  52  -6.895   3.558   3.610
  367    HA   VAL  52           HA       VAL  52  -4.828   1.977   2.311
  368    HB   VAL  52           HB       VAL  52  -4.519   4.220   2.125
  369   1HG1  VAL  52          1HG1      VAL  52  -5.869   5.005   4.152
  370   2HG1  VAL  52          2HG1      VAL  52  -4.408   4.711   5.106
  371   3HG1  VAL  52          3HG1      VAL  52  -4.416   5.896   3.772
  372   1HG2  VAL  52          1HG2      VAL  52  -2.449   3.464   4.182
  373   2HG2  VAL  52          2HG2      VAL  52  -2.416   3.042   2.455
  374   3HG2  VAL  52          3HG2      VAL  52  -2.327   4.735   2.956
  375    H    ALA  53           H        ALA  53  -3.035   0.962   3.372
  376    HA   ALA  53           HA       ALA  53  -3.244   0.616   6.229
  377   1HB   ALA  53          1HB       ALA  53  -3.688  -1.787   6.155
  378   2HB   ALA  53          2HB       ALA  53  -4.992  -0.981   5.296
  379   3HB   ALA  53          3HB       ALA  53  -3.708  -1.761   4.363
  380    H    LYS  54           H        LYS  54  -1.478  -1.126   6.884
  381    HA   LYS  54           HA       LYS  54   0.821  -0.903   5.075
  382   1HB   LYS  54          1HB       LYS  54   0.964   1.193   6.161
  383   2HB   LYS  54          2HB       LYS  54   0.374   0.555   7.702
  384   1HG   LYS  54          1HG       LYS  54   2.446  -0.421   8.258
  385   2HG   LYS  54          2HG       LYS  54   3.040  -0.320   6.598
  386   1HD   LYS  54          1HD       LYS  54   4.076   1.339   8.157
  387   2HD   LYS  54          2HD       LYS  54   3.360   2.020   6.704
  388   1HE   LYS  54          1HE       LYS  54   2.932   3.438   8.611
  389   2HE   LYS  54          2HE       LYS  54   1.424   2.830   7.947
  390   1HZ   LYS  54          1HZ       LYS  54   1.721   2.871  10.414
  391   2HZ   LYS  54          2HZ       LYS  54   1.101   1.484   9.815
  392   3HZ   LYS  54          3HZ       LYS  54   2.707   1.565  10.281
  393    H    LEU  55           H        LEU  55   2.047  -2.632   5.071
  394    HA   LEU  55           HA       LEU  55   2.158  -4.210   7.555
  395   1HB   LEU  55          1HB       LEU  55   1.632  -6.328   6.401
  396   2HB   LEU  55          2HB       LEU  55   0.316  -5.217   6.730
  397    HG   LEU  55           HG       LEU  55   0.046  -4.688   4.407
  398   1HD1  LEU  55          1HD1      LEU  55   2.449  -6.496   3.877
  399   2HD1  LEU  55          2HD1      LEU  55   1.310  -5.905   2.647
  400   3HD1  LEU  55          3HD1      LEU  55   2.310  -4.754   3.524
  401   1HD2  LEU  55          1HD2      LEU  55   0.405  -7.692   4.793
  402   2HD2  LEU  55          2HD2      LEU  55  -1.020  -6.792   5.291
  403   3HD2  LEU  55          3HD2      LEU  55  -0.613  -6.920   3.571
  404    H    ASN  56           H        ASN  56   3.637  -5.871   7.653
  405    HA   ASN  56           HA       ASN  56   6.152  -5.172   6.300
  406   1HB   ASN  56          1HB       ASN  56   5.708  -5.565   8.909
  407   2HB   ASN  56          2HB       ASN  56   5.891  -7.262   8.479
  408   1HD2  ASN  56          1HD2      ASN  56   7.523  -4.187   8.965
  409   2HD2  ASN  56          2HD2      ASN  56   9.123  -4.787   8.643
  410    H    VAL  57           H        VAL  57   6.256  -6.203   4.308
  411    HA   VAL  57           HA       VAL  57   4.610  -8.388   3.661
  412    HB   VAL  57           HB       VAL  57   5.566  -6.558   2.243
  413   1HG1  VAL  57          1HG1      VAL  57   7.959  -6.869   2.558
  414   2HG1  VAL  57          2HG1      VAL  57   7.878  -8.521   1.903
  415   3HG1  VAL  57          3HG1      VAL  57   7.544  -7.140   0.855
  416   1HG2  VAL  57          1HG2      VAL  57   4.131  -8.418   1.441
  417   2HG2  VAL  57          2HG2      VAL  57   5.220  -7.744   0.227
  418   3HG2  VAL  57          3HG2      VAL  57   5.606  -9.297   1.002
  419    H    ASP  58           H        ASP  58   7.590  -8.418   5.333
  420    HA   ASP  58           HA       ASP  58   8.550 -11.068   4.783
  421   1HB   ASP  58          1HB       ASP  58   9.714  -9.095   5.929
  422   2HB   ASP  58          2HB       ASP  58   8.759  -9.499   7.351
  423    H    GLU  59           H        GLU  59   6.071  -9.695   6.926
  424    HA   GLU  59           HA       GLU  59   5.457 -12.201   8.327
  425   1HB   GLU  59          1HB       GLU  59   5.088 -10.023   9.416
  426   2HB   GLU  59          2HB       GLU  59   4.020  -9.551   8.099
  427   1HG   GLU  59          1HG       GLU  59   2.484 -11.483   8.757
  428   2HG   GLU  59          2HG       GLU  59   3.464 -11.634  10.215
  429    H    ASN  60           H        ASN  60   4.457 -10.461   5.432
  430    HA   ASN  60           HA       ASN  60   2.059 -12.177   5.168
  431   1HB   ASN  60          1HB       ASN  60   1.290 -10.018   5.457
  432   2HB   ASN  60          2HB       ASN  60   2.580  -9.296   4.512
  433   1HD2  ASN  60          1HD2      ASN  60   0.236 -11.995   3.639
  434   2HD2  ASN  60          2HD2      ASN  60  -0.153 -11.242   2.113
  435    HA   PRO  61           HA       PRO  61   4.137 -13.579   1.350
  436   1HB   PRO  61          1HB       PRO  61   3.744 -16.247   1.621
  437   2HB   PRO  61          2HB       PRO  61   5.071 -15.391   2.466
  438   1HG   PRO  61          1HG       PRO  61   2.334 -16.126   3.575
  439   2HG   PRO  61          2HG       PRO  61   3.942 -16.449   4.302
  440   1HD   PRO  61          1HD       PRO  61   2.448 -14.288   5.009
  441   2HD   PRO  61          2HD       PRO  61   4.225 -14.192   4.908
  442    H    GLU  62           H        GLU  62   0.861 -13.978   2.811
  443    HA   GLU  62           HA       GLU  62  -0.247 -15.306   0.532
  444   1HB   GLU  62          1HB       GLU  62  -1.053 -15.326   2.917
  445   2HB   GLU  62          2HB       GLU  62  -1.732 -13.713   2.658
  446   1HG   GLU  62          1HG       GLU  62  -2.430 -15.919   0.707
  447   2HG   GLU  62          2HG       GLU  62  -3.097 -16.014   2.328
  448    H    THR  63           H        THR  63  -1.018 -14.485  -1.303
  449    HA   THR  63           HA       THR  63  -1.431 -13.195  -3.041
  450    HB   THR  63           HB       THR  63  -2.208 -11.132  -0.965
  451    HG1  THR  63           1HG      THR  63  -3.572 -12.970  -1.014
  452   1HG2  THR  63          1HG2      THR  63  -2.744 -11.087  -3.961
  453   2HG2  THR  63          2HG2      THR  63  -3.425  -9.982  -2.751
  454   3HG2  THR  63          3HG2      THR  63  -1.690  -9.940  -3.092
  455    H    THR  64           H        THR  64   0.816 -11.950  -0.768
  456    HA   THR  64           HA       THR  64   2.518 -10.334  -2.374
  457    HB   THR  64           HB       THR  64   3.023 -12.289  -0.139
  458    HG1  THR  64           1HG      THR  64   2.985 -10.584   1.098
  459   1HG2  THR  64          1HG2      THR  64   5.202 -11.477   0.294
  460   2HG2  THR  64          2HG2      THR  64   5.194 -12.060  -1.365
  461   3HG2  THR  64          3HG2      THR  64   5.130 -10.317  -1.033
  462    H    SER  65           H        SER  65   2.684 -13.892  -1.782
  463    HA   SER  65           HA       SER  65   4.592 -14.350  -3.875
  464   1HB   SER  65          1HB       SER  65   4.299 -15.800  -1.869
  465   2HB   SER  65          2HB       SER  65   2.715 -16.310  -2.495
  466    HG   SER  65           HG       SER  65   4.016 -16.816  -4.482
  467    H    GLN  66           H        GLN  66   1.341 -13.459  -4.264
  468    HA   GLN  66           HA       GLN  66   0.922 -15.156  -6.653
  469   1HB   GLN  66          1HB       GLN  66  -0.858 -14.785  -4.864
  470   2HB   GLN  66          2HB       GLN  66  -0.965 -13.113  -5.422
  471   1HG   GLN  66          1HG       GLN  66  -1.579 -13.878  -7.685
  472   2HG   GLN  66          2HG       GLN  66  -1.429 -15.564  -7.172
  473   1HE2  GLN  66          1HE2      GLN  66  -3.080 -16.455  -5.690
  474   2HE2  GLN  66          2HE2      GLN  66  -4.572 -15.553  -5.453
  475    H    PHE  67           H        PHE  67   1.528 -11.734  -5.622
  476    HA   PHE  67           HA       PHE  67   1.517 -10.964  -8.500
  477   1HB   PHE  67          1HB       PHE  67   1.073  -9.421  -5.944
  478   2HB   PHE  67          2HB       PHE  67   1.409  -8.631  -7.483
  479    HD1  PHE  67           1HD      PHE  67  -1.071 -10.628  -5.605
  480    HD2  PHE  67           2HD      PHE  67  -0.179  -8.682  -9.343
  481    HE1  PHE  67           1HE      PHE  67  -3.445 -10.864  -6.295
  482    HE2  PHE  67           2HE      PHE  67  -2.551  -8.905 -10.023
  483    HZ   PHE  67           HZ       PHE  67  -4.189  -9.999  -8.495
  484    H    GLY  68           H        GLY  68   3.755 -12.240  -6.635
  485   1HA   GLY  68          1HA       GLY  68   6.051 -12.295  -6.803
  486   2HA   GLY  68          2HA       GLY  68   5.910 -11.205  -8.194
  487    H    ILE  69           H        ILE  69   4.790 -10.572  -4.871
  488    HA   ILE  69           HA       ILE  69   5.840  -7.903  -5.061
  489    HB   ILE  69           HB       ILE  69   4.464  -9.330  -2.783
  490   1HG1  ILE  69          1HG1      ILE  69   3.012  -9.328  -4.718
  491   2HG1  ILE  69          2HG1      ILE  69   2.409  -8.225  -3.497
  492   1HG2  ILE  69          1HG2      ILE  69   4.911  -6.354  -3.224
  493   2HG2  ILE  69          2HG2      ILE  69   3.870  -7.091  -1.980
  494   3HG2  ILE  69          3HG2      ILE  69   5.609  -7.357  -1.945
  495   1HD1  ILE  69          1HD1      ILE  69   3.898  -7.417  -6.036
  496   2HD1  ILE  69          2HD1      ILE  69   2.169  -7.237  -5.698
  497   3HD1  ILE  69          3HD1      ILE  69   3.340  -6.300  -4.767
  498    H    MET  70           H        MET  70   8.028  -8.330  -5.320
  499    HA   MET  70           HA       MET  70   9.435  -8.274  -2.673
  500   1HB   MET  70          1HB       MET  70   9.955 -10.234  -4.183
  501   2HB   MET  70          2HB       MET  70  10.633  -9.092  -5.350
  502   1HG   MET  70          1HG       MET  70  12.331  -8.407  -3.709
  503   2HG   MET  70          2HG       MET  70  11.572  -9.416  -2.471
  504   1HE   MET  70          1HE       MET  70  13.921 -10.472  -1.909
  505   2HE   MET  70          2HE       MET  70  15.003 -11.180  -3.130
  506   3HE   MET  70          3HE       MET  70  14.662  -9.434  -3.152
  507    H    SER  71           H        SER  71   8.225  -6.289  -5.028
  508    HA   SER  71           HA       SER  71  10.437  -4.733  -5.870
  509   1HB   SER  71          1HB       SER  71   8.560  -3.427  -6.906
  510   2HB   SER  71          2HB       SER  71   8.546  -5.145  -7.281
  511    HG   SER  71           HG       SER  71   6.413  -4.373  -6.720
  512    H    ILE  72           H        ILE  72  10.122  -4.751  -2.921
  513    HA   ILE  72           HA       ILE  72   8.509  -2.635  -2.161
  514    HB   ILE  72           HB       ILE  72   9.298  -2.943   0.134
  515   1HG1  ILE  72          1HG1      ILE  72  11.207  -5.039  -0.982
  516   2HG1  ILE  72          2HG1      ILE  72  11.687  -3.452  -0.365
  517   1HG2  ILE  72          1HG2      ILE  72   7.510  -4.315  -0.985
  518   2HG2  ILE  72          2HG2      ILE  72   8.722  -5.588  -1.244
  519   3HG2  ILE  72          3HG2      ILE  72   8.285  -5.067   0.402
  520   1HD1  ILE  72          1HD1      ILE  72  10.400  -5.699   1.212
  521   2HD1  ILE  72          2HD1      ILE  72  12.015  -4.989   1.414
  522   3HD1  ILE  72          3HD1      ILE  72  10.580  -4.038   1.834
  523    HA   PRO  73           HA       PRO  73   8.239  -1.069  -0.186
  524   1HB   PRO  73          1HB       PRO  73   7.447   1.519  -0.546
  525   2HB   PRO  73          2HB       PRO  73   8.524   0.998   0.747
  526   1HG   PRO  73          1HG       PRO  73   9.247   2.239  -1.905
  527   2HG   PRO  73          2HG       PRO  73   9.971   2.586  -0.308
  528   1HD   PRO  73          1HD       PRO  73  11.171   0.960  -2.157
  529   2HD   PRO  73          2HD       PRO  73  11.304   0.637  -0.411
  530    H    THR  74           H        THR  74   6.361  -1.732  -1.076
  531    HA   THR  74           HA       THR  74   5.747  -0.893  -3.871
  532    HB   THR  74           HB       THR  74   4.817  -3.492  -2.631
  533    HG1  THR  74           1HG      THR  74   6.707  -3.879  -4.489
  534   1HG2  THR  74          1HG2      THR  74   4.429  -4.117  -4.947
  535   2HG2  THR  74          2HG2      THR  74   3.569  -2.617  -4.559
  536   3HG2  THR  74          3HG2      THR  74   5.065  -2.544  -5.489
  537    H    LEU  75           H        LEU  75   3.838   0.097  -4.157
  538    HA   LEU  75           HA       LEU  75   1.816   0.237  -1.949
  539   1HB   LEU  75          1HB       LEU  75   3.109   2.254  -1.996
  540   2HB   LEU  75          2HB       LEU  75   2.909   2.448  -3.692
  541    HG   LEU  75           HG       LEU  75   0.347   2.056  -2.175
  542   1HD1  LEU  75          1HD1      LEU  75   1.989   4.570  -1.809
  543   2HD1  LEU  75          2HD1      LEU  75   0.268   4.398  -1.387
  544   3HD1  LEU  75          3HD1      LEU  75   1.486   3.422  -0.554
  545   1HD2  LEU  75          1HD2      LEU  75   1.374   3.877  -4.377
  546   2HD2  LEU  75          2HD2      LEU  75   0.216   2.527  -4.511
  547   3HD2  LEU  75          3HD2      LEU  75  -0.237   4.040  -3.707
  548    H    ILE  76           H        ILE  76   0.192  -1.057  -2.645
  549    HA   ILE  76           HA       ILE  76  -0.502  -0.826  -5.531
  550    HB   ILE  76           HB       ILE  76  -0.868  -3.304  -3.862
  551   1HG1  ILE  76          1HG1      ILE  76   1.291  -2.489  -5.817
  552   2HG1  ILE  76          2HG1      ILE  76   1.450  -3.164  -4.197
  553   1HG2  ILE  76          1HG2      ILE  76  -1.573  -4.370  -5.956
  554   2HG2  ILE  76          2HG2      ILE  76  -2.565  -2.955  -5.694
  555   3HG2  ILE  76          3HG2      ILE  76  -1.231  -2.892  -6.867
  556   1HD1  ILE  76          1HD1      ILE  76   0.681  -5.370  -5.055
  557   2HD1  ILE  76          2HD1      ILE  76   0.601  -4.686  -6.696
  558   3HD1  ILE  76          3HD1      ILE  76   2.147  -4.759  -5.865
  559    H    LEU  77           H        LEU  77  -2.474  -0.387  -5.954
  560    HA   LEU  77           HA       LEU  77  -4.367   0.112  -3.708
  561   1HB   LEU  77          1HB       LEU  77  -3.527   2.068  -5.168
  562   2HB   LEU  77          2HB       LEU  77  -4.550   1.423  -6.450
  563    HG   LEU  77           HG       LEU  77  -5.679   1.890  -3.700
  564   1HD1  LEU  77          1HD1      LEU  77  -6.264   4.251  -4.373
  565   2HD1  LEU  77          2HD1      LEU  77  -4.574   3.944  -3.983
  566   3HD1  LEU  77          3HD1      LEU  77  -5.060   4.065  -5.674
  567   1HD2  LEU  77          1HD2      LEU  77  -7.750   2.468  -4.941
  568   2HD2  LEU  77          2HD2      LEU  77  -6.883   2.302  -6.487
  569   3HD2  LEU  77          3HD2      LEU  77  -7.175   0.888  -5.461
  570    H    PHE  78           H        PHE  78  -6.339  -0.907  -3.823
  571    HA   PHE  78           HA       PHE  78  -6.991  -2.622  -6.151
  572   1HB   PHE  78          1HB       PHE  78  -7.242  -3.429  -3.229
  573   2HB   PHE  78          2HB       PHE  78  -7.646  -4.409  -4.619
  574    HD1  PHE  78           1HD      PHE  78  -6.046  -5.906  -5.549
  575    HD2  PHE  78           2HD      PHE  78  -4.791  -2.875  -2.741
  576    HE1  PHE  78           1HE      PHE  78  -3.839  -7.013  -5.330
  577    HE2  PHE  78           2HE      PHE  78  -2.605  -3.998  -2.509
  578    HZ   PHE  78           HZ       PHE  78  -2.110  -6.057  -3.828
  579    H    LYS  79           H        LYS  79  -9.333  -3.144  -6.154
  580    HA   LYS  79           HA       LYS  79 -10.846  -2.358  -3.820
  581   1HB   LYS  79          1HB       LYS  79 -12.636  -1.104  -5.066
  582   2HB   LYS  79          2HB       LYS  79 -11.126  -0.278  -4.751
  583   1HG   LYS  79          1HG       LYS  79 -10.445  -0.825  -7.180
  584   2HG   LYS  79          2HG       LYS  79 -12.112  -1.356  -7.415
  585   1HD   LYS  79          1HD       LYS  79 -11.842   0.938  -8.171
  586   2HD   LYS  79          2HD       LYS  79 -12.898   0.920  -6.748
  587   1HE   LYS  79          1HE       LYS  79 -11.010   1.619  -5.312
  588   2HE   LYS  79          2HE       LYS  79  -9.900   1.529  -6.677
  589   1HZ   LYS  79          1HZ       LYS  79 -10.612   3.790  -6.246
  590   2HZ   LYS  79          2HZ       LYS  79 -11.160   3.314  -7.720
  591   3HZ   LYS  79          3HZ       LYS  79 -12.192   3.387  -6.441
  592    H    GLY  80           H        GLY  80 -12.570  -3.644  -3.518
  593   1HA   GLY  80          1HA       GLY  80 -13.690  -5.636  -3.615
  594   2HA   GLY  80          2HA       GLY  80 -14.337  -4.913  -5.076
  595    H    GLY  81           H        GLY  81 -11.253  -6.490  -4.090
  596   1HA   GLY  81          1HA       GLY  81 -10.334  -8.484  -4.728
  597   2HA   GLY  81          2HA       GLY  81 -11.680  -8.769  -5.834
  598    H    GLU  82           H        GLU  82 -10.672  -5.749  -6.820
  599    HA   GLU  82           HA       GLU  82  -8.991  -6.987  -8.909
  600   1HB   GLU  82          1HB       GLU  82 -11.165  -6.087  -9.574
  601   2HB   GLU  82          2HB       GLU  82 -10.700  -4.482  -8.984
  602   1HG   GLU  82          1HG       GLU  82  -8.865  -4.384 -10.621
  603   2HG   GLU  82          2HG       GLU  82  -9.203  -6.039 -11.141
  604    HA   PRO  83           HA       PRO  83  -5.726  -4.165  -7.349
  605   1HB   PRO  83          1HB       PRO  83  -3.720  -4.919  -9.034
  606   2HB   PRO  83          2HB       PRO  83  -4.221  -5.922  -7.640
  607   1HG   PRO  83          1HG       PRO  83  -5.031  -6.230 -10.542
  608   2HG   PRO  83          2HG       PRO  83  -4.490  -7.496  -9.399
  609   1HD   PRO  83          1HD       PRO  83  -7.126  -6.991  -9.941
  610   2HD   PRO  83          2HD       PRO  83  -6.578  -7.565  -8.336
  611    H    VAL  84           H        VAL  84  -5.360  -2.107  -8.013
  612    HA   VAL  84           HA       VAL  84  -6.481  -1.284 -10.616
  613    HB   VAL  84           HB       VAL  84  -5.922   0.250  -8.122
  614   1HG1  VAL  84          1HG1      VAL  84  -7.374   1.101 -10.648
  615   2HG1  VAL  84          2HG1      VAL  84  -7.287   2.035  -9.140
  616   3HG1  VAL  84          3HG1      VAL  84  -5.815   1.737 -10.067
  617   1HG2  VAL  84          1HG2      VAL  84  -7.810  -1.347  -7.842
  618   2HG2  VAL  84          2HG2      VAL  84  -8.380   0.323  -7.855
  619   3HG2  VAL  84          3HG2      VAL  84  -8.569  -0.697  -9.300
  620    H    LYS  85           H        LYS  85  -3.581  -0.507  -8.534
  621    HA   LYS  85           HA       LYS  85  -1.899  -0.764 -10.822
  622   1HB   LYS  85          1HB       LYS  85  -0.943   1.430 -10.980
  623   2HB   LYS  85          2HB       LYS  85  -2.674   1.583 -11.199
  624   1HG   LYS  85          1HG       LYS  85  -2.732   2.235  -8.656
  625   2HG   LYS  85          2HG       LYS  85  -0.976   2.368  -8.809
  626   1HD   LYS  85          1HD       LYS  85  -1.684   4.564  -9.264
  627   2HD   LYS  85          2HD       LYS  85  -1.491   3.895 -10.889
  628   1HE   LYS  85          1HE       LYS  85  -3.965   3.260 -10.800
  629   2HE   LYS  85          2HE       LYS  85  -4.064   4.149  -9.268
  630   1HZ   LYS  85          1HZ       LYS  85  -3.398   6.153 -10.475
  631   2HZ   LYS  85          2HZ       LYS  85  -3.398   5.321 -11.898
  632   3HZ   LYS  85          3HZ       LYS  85  -4.792   5.559 -11.044
  633    H    GLN  86           H        GLN  86   0.407  -0.413 -10.204
  634    HA   GLN  86           HA       GLN  86   0.981  -0.807  -7.333
  635   1HB   GLN  86          1HB       GLN  86   1.267  -2.965  -8.240
  636   2HB   GLN  86          2HB       GLN  86   1.975  -2.362  -9.746
  637   1HG   GLN  86          1HG       GLN  86   4.019  -1.779  -8.704
  638   2HG   GLN  86          2HG       GLN  86   3.388  -2.025  -7.082
  639   1HE2  GLN  86          1HE2      GLN  86   2.295  -4.676  -8.970
  640   2HE2  GLN  86          2HE2      GLN  86   3.626  -5.751  -8.579
  641    H    LEU  87           H        LEU  87   2.442   0.562  -6.591
  642    HA   LEU  87           HA       LEU  87   4.165   2.212  -8.371
  643   1HB   LEU  87          1HB       LEU  87   2.790   2.627  -5.710
  644   2HB   LEU  87          2HB       LEU  87   4.299   3.461  -6.012
  645    HG   LEU  87           HG       LEU  87   2.502   4.947  -6.355
  646   1HD1  LEU  87          1HD1      LEU  87   4.523   4.861  -7.955
  647   2HD1  LEU  87          2HD1      LEU  87   3.381   4.252  -9.164
  648   3HD1  LEU  87          3HD1      LEU  87   3.135   5.847  -8.405
  649   1HD2  LEU  87          1HD2      LEU  87   1.341   3.097  -8.473
  650   2HD2  LEU  87          2HD2      LEU  87   0.688   3.305  -6.833
  651   3HD2  LEU  87          3HD2      LEU  87   0.709   4.673  -7.961
  652    H    ILE  88           H        ILE  88   6.374   2.193  -7.777
  653    HA   ILE  88           HA       ILE  88   7.250   0.230  -5.754
  654    HB   ILE  88           HB       ILE  88   8.870  -0.636  -7.515
  655   1HG1  ILE  88          1HG1      ILE  88   6.814   0.493  -9.489
  656   2HG1  ILE  88          2HG1      ILE  88   8.462   1.091  -9.293
  657   1HG2  ILE  88          1HG2      ILE  88   5.902  -1.203  -7.789
  658   2HG2  ILE  88          2HG2      ILE  88   7.206  -2.317  -8.218
  659   3HG2  ILE  88          3HG2      ILE  88   6.971  -1.835  -6.530
  660   1HD1  ILE  88          1HD1      ILE  88   7.641  -1.649 -10.312
  661   2HD1  ILE  88          2HD1      ILE  88   8.415  -0.338 -11.208
  662   3HD1  ILE  88          3HD1      ILE  88   9.319  -1.184  -9.933
  663    H    GLY  89           H        GLY  89   8.647   1.080  -4.515
  664   1HA   GLY  89          1HA       GLY  89  10.682   2.160  -3.957
  665   2HA   GLY  89          2HA       GLY  89  10.696   2.989  -5.519
  666    H    TYR  90           H        TYR  90  11.237   4.453  -3.375
  667    HA   TYR  90           HA       TYR  90   9.008   5.647  -2.014
  668   1HB   TYR  90          1HB       TYR  90  11.230   5.246  -1.070
  669   2HB   TYR  90          2HB       TYR  90  11.912   6.406  -2.194
  670    HD1  TYR  90           1HD      TYR  90   8.889   7.996  -1.193
  671    HD2  TYR  90           2HD      TYR  90  12.759   6.804   0.330
  672    HE1  TYR  90           1HE      TYR  90   8.819   9.824   0.429
  673    HE2  TYR  90           2HE      TYR  90  12.652   8.606   2.010
  674    HH   TYR  90           HH       TYR  90  11.414  10.410   2.827
  675    H    GLN  91           H        GLN  91   7.705   6.237  -3.898
  676    HA   GLN  91           HA       GLN  91   8.477   8.575  -5.450
  677   1HB   GLN  91          1HB       GLN  91   5.574   8.388  -4.929
  678   2HB   GLN  91          2HB       GLN  91   6.445   8.532  -6.420
  679   1HG   GLN  91          1HG       GLN  91   6.061   5.896  -4.976
  680   2HG   GLN  91          2HG       GLN  91   5.007   6.542  -6.226
  681   1HE2  GLN  91          1HE2      GLN  91   7.581   4.487  -5.768
  682   2HE2  GLN  91          2HE2      GLN  91   8.165   4.410  -7.407
  683    HA   PRO  92           HA       PRO  92   7.575  11.390  -1.938
  684   1HB   PRO  92          1HB       PRO  92   7.733  13.798  -3.231
  685   2HB   PRO  92          2HB       PRO  92   9.179  12.850  -2.765
  686   1HG   PRO  92          1HG       PRO  92   7.809  12.961  -5.460
  687   2HG   PRO  92          2HG       PRO  92   9.559  13.080  -5.105
  688   1HD   PRO  92          1HD       PRO  92   8.362  10.735  -5.887
  689   2HD   PRO  92          2HD       PRO  92   9.747  10.759  -4.757
  690    H    LYS  93           H        LYS  93   5.713  12.857  -1.469
  691    HA   LYS  93           HA       LYS  93   3.349  11.604  -2.222
  692   1HB   LYS  93          1HB       LYS  93   4.149  13.943  -0.596
  693   2HB   LYS  93          2HB       LYS  93   2.601  14.176  -1.357
  694   1HG   LYS  93          1HG       LYS  93   2.257  13.155   0.828
  695   2HG   LYS  93          2HG       LYS  93   1.719  12.089  -0.465
  696   1HD   LYS  93          1HD       LYS  93   2.847  10.712   1.146
  697   2HD   LYS  93          2HD       LYS  93   3.916  10.811  -0.240
  698   1HE   LYS  93          1HE       LYS  93   5.470  11.301   1.362
  699   2HE   LYS  93          2HE       LYS  93   4.853  12.947   1.139
  700   1HZ   LYS  93          1HZ       LYS  93   3.277  12.486   2.966
  701   2HZ   LYS  93          2HZ       LYS  93   3.929  11.018   3.195
  702   3HZ   LYS  93          3HZ       LYS  93   4.838  12.380   3.465
  703    H    GLU  94           H        GLU  94   4.648  14.618  -3.547
  704    HA   GLU  94           HA       GLU  94   2.462  15.306  -5.189
  705   1HB   GLU  94          1HB       GLU  94   4.441  16.700  -4.597
  706   2HB   GLU  94          2HB       GLU  94   5.466  15.686  -5.616
  707   1HG   GLU  94          1HG       GLU  94   4.224  16.427  -7.622
  708   2HG   GLU  94          2HG       GLU  94   3.126  17.375  -6.603
  709    H    GLN  95           H        GLN  95   4.798  12.711  -5.667
  710    HA   GLN  95           HA       GLN  95   4.267  12.365  -8.542
  711   1HB   GLN  95          1HB       GLN  95   6.523  12.095  -7.106
  712   2HB   GLN  95          2HB       GLN  95   5.849  10.560  -6.677
  713   1HG   GLN  95          1HG       GLN  95   6.896  11.543  -9.309
  714   2HG   GLN  95          2HG       GLN  95   7.379  10.127  -8.382
  715   1HE2  GLN  95          1HE2      GLN  95   6.285   8.006  -8.858
  716   2HE2  GLN  95          2HE2      GLN  95   5.061   8.002 -10.109
  717    H    LEU  96           H        LEU  96   3.910  10.847  -5.335
  718    HA   LEU  96           HA       LEU  96   2.585   8.486  -6.003
  719   1HB   LEU  96          1HB       LEU  96   3.767   9.532  -3.846
  720   2HB   LEU  96          2HB       LEU  96   2.100   9.798  -3.397
  721    HG   LEU  96           HG       LEU  96   3.142   7.107  -4.394
  722   1HD1  LEU  96          1HD1      LEU  96   4.457   7.809  -2.427
  723   2HD1  LEU  96          2HD1      LEU  96   2.953   8.010  -1.498
  724   3HD1  LEU  96          3HD1      LEU  96   3.424   6.408  -2.118
  725   1HD2  LEU  96          1HD2      LEU  96   1.206   6.158  -3.273
  726   2HD2  LEU  96          2HD2      LEU  96   0.755   7.731  -2.606
  727   3HD2  LEU  96          3HD2      LEU  96   0.648   7.436  -4.355
  728    H    GLU  97           H        GLU  97   1.085  11.560  -4.659
  729    HA   GLU  97           HA       GLU  97  -1.542  10.589  -5.215
  730   1HB   GLU  97          1HB       GLU  97  -0.271  13.035  -4.138
  731   2HB   GLU  97          2HB       GLU  97  -1.683  13.373  -5.098
  732   1HG   GLU  97          1HG       GLU  97  -1.544  11.520  -2.699
  733   2HG   GLU  97          2HG       GLU  97  -2.034  13.193  -2.651
  734    H    ALA  98           H        ALA  98   0.922  12.320  -7.272
  735    HA   ALA  98           HA       ALA  98  -1.205  12.986  -9.178
  736   1HB   ALA  98          1HB       ALA  98   1.815  12.739  -9.614
  737   2HB   ALA  98          2HB       ALA  98   0.654  13.380 -10.795
  738   3HB   ALA  98          3HB       ALA  98   0.908  14.236  -9.266
  739    H    GLN  99           H        GLN  99   0.762  10.103  -8.566
  740    HA   GLN  99           HA       GLN  99  -0.332   8.687 -10.903
  741   1HB   GLN  99          1HB       GLN  99   1.502   8.078  -8.685
  742   2HB   GLN  99          2HB       GLN  99   0.282   6.833  -8.812
  743   1HG   GLN  99          1HG       GLN  99   1.847   5.981 -10.244
  744   2HG   GLN  99          2HG       GLN  99   0.854   6.849 -11.397
  745   1HE2  GLN  99          1HE2      GLN  99   1.756   9.546 -10.914
  746   2HE2  GLN  99          2HE2      GLN  99   3.492   9.641 -11.129
  747    H    LEU 100           H        LEU 100  -1.697   9.547  -7.898
  748    HA   LEU 100           HA       LEU 100  -3.603   7.264  -8.022
  749   1HB   LEU 100          1HB       LEU 100  -1.550   7.693  -6.281
  750   2HB   LEU 100          2HB       LEU 100  -2.859   8.470  -5.427
  751    HG   LEU 100           HG       LEU 100  -4.068   6.245  -5.509
  752   1HD1  LEU 100          1HD1      LEU 100  -3.140   5.254  -7.533
  753   2HD1  LEU 100          2HD1      LEU 100  -1.483   5.368  -6.893
  754   3HD1  LEU 100          3HD1      LEU 100  -2.653   4.239  -6.179
  755   1HD2  LEU 100          1HD2      LEU 100  -1.200   6.093  -4.473
  756   2HD2  LEU 100          2HD2      LEU 100  -2.554   6.850  -3.617
  757   3HD2  LEU 100          3HD2      LEU 100  -2.566   5.110  -3.918
  758    H    ALA 101           H        ALA 101  -3.524  10.661  -7.997
  759    HA   ALA 101           HA       ALA 101  -5.839  11.429  -6.723
  760   1HB   ALA 101          1HB       ALA 101  -4.203  12.992  -7.608
  761   2HB   ALA 101          2HB       ALA 101  -4.507  12.457  -9.273
  762   3HB   ALA 101          3HB       ALA 101  -5.758  13.342  -8.372
  763    H    ASP 102           H        ASP 102  -5.704   9.368  -9.555
  764    HA   ASP 102           HA       ASP 102  -8.390   9.965 -10.508
  765   1HB   ASP 102          1HB       ASP 102  -8.017   7.930 -11.866
  766   2HB   ASP 102          2HB       ASP 102  -6.671   9.059 -12.016
  767    H    VAL 103           H        VAL 103  -7.037   7.989  -7.910
  768    HA   VAL 103           HA       VAL 103  -9.715   6.930  -7.326
  769    HB   VAL 103           HB       VAL 103  -8.283   5.053  -6.360
  770   1HG1  VAL 103          1HG1      VAL 103  -9.806   4.954  -8.404
  771   2HG1  VAL 103          2HG1      VAL 103  -8.372   5.234  -9.393
  772   3HG1  VAL 103          3HG1      VAL 103  -8.481   3.771  -8.396
  773   1HG2  VAL 103          1HG2      VAL 103  -6.227   6.002  -8.381
  774   2HG2  VAL 103          2HG2      VAL 103  -6.049   5.988  -6.616
  775   3HG2  VAL 103          3HG2      VAL 103  -6.217   4.468  -7.525
  776    H    LEU 104           H        LEU 104  -7.238   8.956  -6.195
  777    HA   LEU 104           HA       LEU 104  -8.634   9.124  -3.613
  778   1HB   LEU 104          1HB       LEU 104  -6.115  10.282  -4.860
  779   2HB   LEU 104          2HB       LEU 104  -6.871  11.099  -3.543
  780    HG   LEU 104           HG       LEU 104  -5.136   9.805  -2.596
  781   1HD1  LEU 104          1HD1      LEU 104  -6.196   8.435  -1.014
  782   2HD1  LEU 104          2HD1      LEU 104  -7.302   9.780  -1.391
  783   3HD1  LEU 104          3HD1      LEU 104  -7.596   8.147  -2.061
  784   1HD2  LEU 104          1HD2      LEU 104  -4.784   8.192  -4.396
  785   2HD2  LEU 104          2HD2      LEU 104  -4.862   7.395  -2.814
  786   3HD2  LEU 104          3HD2      LEU 104  -6.241   7.299  -3.924
  787    H    GLN 105           H        GLN 105  -9.377   9.903  -6.685
  788    HA   GLN 105           HA       GLN 105 -10.454  12.517  -6.548
  789   1HB   GLN 105          2HB       GLN 105 -10.397  11.453  -8.640
  790   2HB   GLN 105          3HB       GLN 105 -11.181  10.015  -8.023
  791   1HG   GLN 105          2HG       GLN 105 -12.716  11.214  -9.436
  792   2HG   GLN 105          3HG       GLN 105 -13.325  11.285  -7.794
  793   1HE2  GLN 105          1HE2      GLN 105 -12.732  13.384  -6.532
  794   2HE2  GLN 105          2HE2      GLN 105 -12.772  14.868  -7.508
  Start of MODEL    9
    1   1H    ALA   1           H        ALA   1  -8.147  -0.883   7.363
    2   2H    ALA   1          2HN       ALA   1  -8.961  -0.812   5.932
    3   3H    ALA   1          3HN       ALA   1  -7.364  -0.380   6.003
    4    HA   ALA   1           HA       ALA   1  -8.790   1.514   5.809
    5   1HB   ALA   1          1HB       ALA   1 -10.136   2.193   7.744
    6   2HB   ALA   1          2HB       ALA   1 -10.727   0.689   7.017
    7   3HB   ALA   1          3HB       ALA   1  -9.794   0.635   8.534
    8    H    THR   2           H        THR   2  -7.190   0.373   8.858
    9    HA   THR   2           HA       THR   2  -5.416   2.727   8.824
   10    HB   THR   2           HB       THR   2  -7.588   3.317   9.925
   11    HG1  THR   2           1HG      THR   2  -5.329   2.928  11.545
   12   1HG2  THR   2          1HG2      THR   2  -7.003   0.946  11.782
   13   2HG2  THR   2          2HG2      THR   2  -8.294   2.141  11.990
   14   3HG2  THR   2          3HG2      THR   2  -8.326   1.038  10.611
   15    H    MET   3           H        MET   3  -5.183  -0.416   8.710
   16    HA   MET   3           HA       MET   3  -4.033  -0.837  11.426
   17   1HB   MET   3          1HB       MET   3  -6.385  -1.729  10.858
   18   2HB   MET   3          2HB       MET   3  -5.549  -2.962   9.905
   19   1HG   MET   3          1HG       MET   3  -4.360  -3.687  11.980
   20   2HG   MET   3          2HG       MET   3  -5.160  -2.395  12.877
   21   1HE   MET   3          1HE       MET   3  -5.029  -5.388  13.768
   22   2HE   MET   3          2HE       MET   3  -5.907  -4.152  14.701
   23   3HE   MET   3          3HE       MET   3  -6.697  -5.695  14.304
   24    H    THR   4           H        THR   4  -2.591  -2.574  11.821
   25    HA   THR   4           HA       THR   4  -0.666  -3.309   9.865
   26    HB   THR   4           HB       THR   4  -1.288  -4.690  12.469
   27    HG1  THR   4           1HG      THR   4   0.247  -2.340  12.086
   28   1HG2  THR   4          1HG2      THR   4   1.305  -4.239  10.914
   29   2HG2  THR   4          2HG2      THR   4   1.194  -4.991  12.523
   30   3HG2  THR   4          3HG2      THR   4   0.449  -5.781  11.129
   31    H    LEU   5           H        LEU   5  -0.506  -5.311   8.788
   32    HA   LEU   5           HA       LEU   5  -2.978  -6.974   8.688
   33   1HB   LEU   5          1HB       LEU   5  -1.738  -5.171   6.764
   34   2HB   LEU   5          2HB       LEU   5  -1.770  -6.814   6.123
   35    HG   LEU   5           HG       LEU   5  -4.167  -6.895   6.431
   36   1HD1  LEU   5          1HD1      LEU   5  -5.340  -4.596   6.877
   37   2HD1  LEU   5          2HD1      LEU   5  -4.801  -5.582   8.221
   38   3HD1  LEU   5          3HD1      LEU   5  -3.830  -4.206   7.746
   39   1HD2  LEU   5          1HD2      LEU   5  -3.241  -6.160   4.316
   40   2HD2  LEU   5          2HD2      LEU   5  -4.681  -5.187   4.641
   41   3HD2  LEU   5          3HD2      LEU   5  -3.054  -4.525   4.884
   42    H    THR   6           H        THR   6  -2.648  -9.119   7.722
   43    HA   THR   6           HA       THR   6   0.095 -10.182   8.089
   44    HB   THR   6           HB       THR   6  -0.928 -12.070   9.302
   45    HG1  THR   6           1HG      THR   6  -2.943 -12.309   8.977
   46   1HG2  THR   6          1HG2      THR   6  -1.289 -11.008  11.427
   47   2HG2  THR   6          2HG2      THR   6  -0.006 -10.121  10.584
   48   3HG2  THR   6          3HG2      THR   6  -1.649  -9.445  10.669
   49    H    ASP   7           H        ASP   7  -3.056 -11.259   7.277
   50    HA   ASP   7           HA       ASP   7  -2.600 -12.387   4.645
   51   1HB   ASP   7          1HB       ASP   7  -2.731 -14.704   5.451
   52   2HB   ASP   7          2HB       ASP   7  -1.257 -13.895   5.973
   53    H    ALA   8           H        ALA   8  -4.526 -13.460   7.470
   54    HA   ALA   8           HA       ALA   8  -7.028 -13.452   6.062
   55   1HB   ALA   8          1HB       ALA   8  -7.976 -13.747   8.330
   56   2HB   ALA   8          2HB       ALA   8  -6.594 -14.835   8.071
   57   3HB   ALA   8          3HB       ALA   8  -6.395 -13.363   9.050
   58    H    ASN   9           H        ASN   9  -5.230 -11.093   8.008
   59    HA   ASN   9           HA       ASN   9  -7.484  -9.241   8.023
   60   1HB   ASN   9          1HB       ASN   9  -5.622  -9.438   9.818
   61   2HB   ASN   9          2HB       ASN   9  -4.693  -8.415   8.719
   62   1HD2  ASN   9          1HD2      ASN   9  -4.737  -6.565  10.413
   63   2HD2  ASN   9          2HD2      ASN   9  -6.291  -5.852  10.735
   64    H    PHE  10           H        PHE  10  -4.954 -10.081   5.815
   65    HA   PHE  10           HA       PHE  10  -4.881  -7.565   4.352
   66   1HB   PHE  10          1HB       PHE  10  -3.022  -9.303   4.372
   67   2HB   PHE  10          2HB       PHE  10  -4.040 -10.319   3.374
   68    HD1  PHE  10           1HD      PHE  10  -5.020  -8.980   1.128
   69    HD2  PHE  10           2HD      PHE  10  -1.288  -8.218   3.200
   70    HE1  PHE  10           1HE      PHE  10  -4.077  -8.017  -0.907
   71    HE2  PHE  10           2HE      PHE  10  -0.356  -7.335   1.153
   72    HZ   PHE  10           HZ       PHE  10  -1.725  -7.204  -0.935
   73    H    GLN  11           H        GLN  11  -6.352 -10.806   3.799
   74    HA   GLN  11           HA       GLN  11  -7.975  -9.897   1.625
   75   1HB   GLN  11          1HB       GLN  11  -8.371 -12.263   3.505
   76   2HB   GLN  11          2HB       GLN  11  -9.243 -11.982   1.985
   77   1HG   GLN  11          1HG       GLN  11  -7.048 -11.971   0.763
   78   2HG   GLN  11          2HG       GLN  11  -6.228 -12.391   2.278
   79   1HE2  GLN  11          1HE2      GLN  11  -5.614 -14.113   0.421
   80   2HE2  GLN  11          2HE2      GLN  11  -6.576 -15.587   0.562
   81    H    GLN  12           H        GLN  12  -8.647  -9.955   5.173
   82    HA   GLN  12           HA       GLN  12 -11.298  -8.984   5.046
   83   1HB   GLN  12          1HB       GLN  12 -10.075  -9.757   7.113
   84   2HB   GLN  12          2HB       GLN  12  -9.153  -8.256   7.073
   85   1HG   GLN  12          1HG       GLN  12 -10.889  -8.046   8.709
   86   2HG   GLN  12          2HG       GLN  12 -11.241  -6.951   7.381
   87   1HE2  GLN  12          1HE2      GLN  12 -11.924 -10.483   8.072
   88   2HE2  GLN  12          2HE2      GLN  12 -13.639 -10.315   7.713
   89    H    ALA  13           H        ALA  13  -8.165  -7.094   5.001
   90    HA   ALA  13           HA       ALA  13  -9.455  -4.588   4.982
   91   1HB   ALA  13          1HB       ALA  13  -7.067  -4.940   5.500
   92   2HB   ALA  13          2HB       ALA  13  -6.758  -5.298   3.782
   93   3HB   ALA  13          3HB       ALA  13  -7.308  -3.683   4.270
   94    H    ILE  14           H        ILE  14  -8.477  -6.664   2.202
   95    HA   ILE  14           HA       ILE  14  -9.329  -4.638   0.295
   96    HB   ILE  14           HB       ILE  14  -9.081  -6.430  -1.424
   97   1HG1  ILE  14          1HG1      ILE  14  -7.523  -8.012   0.601
   98   2HG1  ILE  14          2HG1      ILE  14  -9.197  -8.417   0.210
   99   1HG2  ILE  14          1HG2      ILE  14  -6.678  -5.709   0.315
  100   2HG2  ILE  14          2HG2      ILE  14  -6.616  -6.165  -1.397
  101   3HG2  ILE  14          3HG2      ILE  14  -7.417  -4.674  -0.924
  102   1HD1  ILE  14          1HD1      ILE  14  -6.887  -8.364  -1.764
  103   2HD1  ILE  14          2HD1      ILE  14  -7.690  -9.790  -1.093
  104   3HD1  ILE  14          3HD1      ILE  14  -8.588  -8.700  -2.165
  105    H    GLN  15           H        GLN  15 -10.709  -7.748   0.924
  106    HA   GLN  15           HA       GLN  15 -12.534  -8.818   0.329
  107   1HB   GLN  15          1HB       GLN  15 -14.220  -8.514   1.920
  108   2HB   GLN  15          2HB       GLN  15 -12.680  -8.128   2.667
  109   1HG   GLN  15          1HG       GLN  15 -13.206  -5.701   2.500
  110   2HG   GLN  15          2HG       GLN  15 -14.735  -6.083   1.692
  111   1HE2  GLN  15          1HE2      GLN  15 -12.912  -6.460   4.711
  112   2HE2  GLN  15          2HE2      GLN  15 -14.235  -6.924   5.752
  113    H    GLY  16           H        GLY  16 -12.752  -5.722  -1.047
  114   1HA   GLY  16          1HA       GLY  16 -14.897  -6.447  -2.882
  115   2HA   GLY  16          2HA       GLY  16 -15.528  -5.597  -1.476
  116    H    ASP  17           H        ASP  17 -16.337  -4.151  -3.027
  117    HA   ASP  17           HA       ASP  17 -15.066  -2.904  -5.077
  118   1HB   ASP  17          1HB       ASP  17 -17.566  -2.073  -3.594
  119   2HB   ASP  17          2HB       ASP  17 -17.128  -1.625  -5.248
  120    H    GLY  18           H        GLY  18 -14.543  -1.919  -1.850
  121   1HA   GLY  18          1HA       GLY  18 -14.731   0.947  -2.246
  122   2HA   GLY  18          2HA       GLY  18 -14.031   0.119  -0.846
  123    HA   PRO  19           HA       PRO  19 -10.395   1.829  -3.391
  124   1HB   PRO  19          1HB       PRO  19  -9.844   4.121  -1.929
  125   2HB   PRO  19          2HB       PRO  19 -10.881   4.136  -3.365
  126   1HG   PRO  19          1HG       PRO  19 -11.749   4.014  -0.470
  127   2HG   PRO  19          2HG       PRO  19 -12.402   5.030  -1.785
  128   1HD   PRO  19          1HD       PRO  19 -13.580   2.691  -0.974
  129   2HD   PRO  19          2HD       PRO  19 -13.634   3.237  -2.676
  130    H    VAL  20           H        VAL  20  -9.110   0.139  -2.506
  131    HA   VAL  20           HA       VAL  20  -8.290   0.551   0.324
  132    HB   VAL  20           HB       VAL  20  -8.457  -2.060  -1.216
  133   1HG1  VAL  20          1HG1      VAL  20  -7.931  -3.165   0.946
  134   2HG1  VAL  20          2HG1      VAL  20  -6.618  -2.125   0.424
  135   3HG1  VAL  20          3HG1      VAL  20  -7.729  -1.592   1.705
  136   1HG2  VAL  20          1HG2      VAL  20 -10.157  -1.520   1.201
  137   2HG2  VAL  20          2HG2      VAL  20 -10.724  -1.085  -0.422
  138   3HG2  VAL  20          3HG2      VAL  20 -10.320  -2.748  -0.047
  139    H    LEU  21           H        LEU  21  -6.134   0.431   0.767
  140    HA   LEU  21           HA       LEU  21  -4.369  -0.273  -1.450
  141   1HB   LEU  21          1HB       LEU  21  -3.010   1.579  -1.542
  142   2HB   LEU  21          2HB       LEU  21  -4.629   2.233  -1.523
  143    HG   LEU  21           HG       LEU  21  -4.277   2.646   1.009
  144   1HD1  LEU  21          1HD1      LEU  21  -2.254   1.445   1.575
  145   2HD1  LEU  21          2HD1      LEU  21  -1.417   2.033   0.140
  146   3HD1  LEU  21          3HD1      LEU  21  -1.753   3.125   1.483
  147   1HD2  LEU  21          1HD2      LEU  21  -3.138   4.773   0.564
  148   2HD2  LEU  21          2HD2      LEU  21  -2.574   4.170  -1.006
  149   3HD2  LEU  21          3HD2      LEU  21  -4.301   4.424  -0.717
  150    H    VAL  22           H        VAL  22  -2.293  -0.882  -0.837
  151    HA   VAL  22           HA       VAL  22  -2.060  -1.810   1.990
  152    HB   VAL  22           HB       VAL  22  -2.039  -3.216  -0.664
  153   1HG1  VAL  22          1HG1      VAL  22  -0.279  -4.139   1.612
  154   2HG1  VAL  22          2HG1      VAL  22  -0.807  -5.146   0.247
  155   3HG1  VAL  22          3HG1      VAL  22   0.193  -3.726  -0.028
  156   1HG2  VAL  22          1HG2      VAL  22  -3.981  -3.403   0.833
  157   2HG2  VAL  22          2HG2      VAL  22  -3.182  -4.973   0.663
  158   3HG2  VAL  22          3HG2      VAL  22  -2.943  -4.014   2.139
  159    H    ASP  23           H        ASP  23  -0.258  -1.097   2.948
  160    HA   ASP  23           HA       ASP  23   1.955   0.037   1.390
  161   1HB   ASP  23          1HB       ASP  23   0.676   0.555   3.893
  162   2HB   ASP  23          2HB       ASP  23   2.265  -0.064   4.286
  163    H    PHE  24           H        PHE  24   3.282  -1.598   0.549
  164    HA   PHE  24           HA       PHE  24   3.968  -3.951   2.221
  165   1HB   PHE  24          1HB       PHE  24   4.509  -3.297  -0.683
  166   2HB   PHE  24          2HB       PHE  24   5.225  -4.642   0.126
  167    HD1  PHE  24           1HD      PHE  24   3.731  -6.262   1.382
  168    HD2  PHE  24           2HD      PHE  24   2.377  -3.707  -1.807
  169    HE1  PHE  24           1HE      PHE  24   2.105  -7.967   0.708
  170    HE2  PHE  24           2HE      PHE  24   0.697  -5.432  -2.456
  171    HZ   PHE  24           HZ       PHE  24   0.716  -7.665  -1.261
  172    H    TRP  25           H        TRP  25   5.539  -3.625   3.585
  173    HA   TRP  25           HA       TRP  25   8.037  -2.397   2.700
  174   1HB   TRP  25          1HB       TRP  25   8.276  -0.940   4.550
  175   2HB   TRP  25          2HB       TRP  25   6.698  -0.576   3.883
  176    HD1  TRP  25           HD       TRP  25   4.636  -2.074   5.250
  177    HE1  TRP  25           1HE      TRP  25   4.365  -2.528   7.739
  178    HE3  TRP  25           3HE      TRP  25   9.322  -0.733   6.824
  179    HZ2  TRP  25           2HZ      TRP  25   6.033  -2.461  10.135
  180    HZ3  TRP  25           3HZ      TRP  25   9.947  -0.934   9.206
  181    HH2  TRP  25           HH       TRP  25   8.319  -1.821  10.865
  182    H    ALA  26           H        ALA  26   9.493  -2.816   5.042
  183    HA   ALA  26           HA       ALA  26   8.715  -5.092   6.514
  184   1HB   ALA  26          1HB       ALA  26  10.587  -6.571   5.862
  185   2HB   ALA  26          2HB       ALA  26   9.537  -6.296   4.476
  186   3HB   ALA  26          3HB       ALA  26  11.076  -5.414   4.594
  187    H    ALA  27           H        ALA  27  10.618  -5.563   8.082
  188    HA   ALA  27           HA       ALA  27  11.406  -3.081   9.186
  189   1HB   ALA  27          1HB       ALA  27  10.994  -5.109  10.514
  190   2HB   ALA  27          2HB       ALA  27  12.452  -5.867   9.826
  191   3HB   ALA  27          3HB       ALA  27  12.589  -4.425  10.858
  192    H    TRP  28           H        TRP  28  13.016  -4.811   6.659
  193    HA   TRP  28           HA       TRP  28  15.663  -3.744   7.464
  194   1HB   TRP  28          1HB       TRP  28  16.573  -5.652   6.862
  195   2HB   TRP  28          2HB       TRP  28  14.963  -6.294   7.058
  196    HD1  TRP  28           HD       TRP  28  17.629  -5.478   4.541
  197    HE1  TRP  28           1HE      TRP  28  17.077  -6.379   2.214
  198    HE3  TRP  28           3HE      TRP  28  12.852  -7.153   5.411
  199    HZ2  TRP  28           2HZ      TRP  28  14.771  -7.394   0.823
  200    HZ3  TRP  28           3HZ      TRP  28  11.454  -7.987   3.489
  201    HH2  TRP  28           HH       TRP  28  12.426  -8.032   1.217
  202    H    CYS  29           H        CYS  29  13.370  -3.382   4.862
  203    HA   CYS  29           HA       CYS  29  15.071  -3.295   2.662
  204   1HB   CYS  29          1HB       CYS  29  12.972  -2.415   1.523
  205   2HB   CYS  29          2HB       CYS  29  12.981  -3.976   2.298
  206    H    GLY  30           H        GLY  30  16.102  -1.241   4.474
  207   1HA   GLY  30          1HA       GLY  30  16.978   0.889   4.463
  208   2HA   GLY  30          2HA       GLY  30  17.123   0.565   2.744
  209    HA   PRO  31           HA       PRO  31  14.781   4.414   2.427
  210   1HB   PRO  31          1HB       PRO  31  13.877   4.222  -0.195
  211   2HB   PRO  31          2HB       PRO  31  15.525   4.731   0.299
  212   1HG   PRO  31          1HG       PRO  31  14.590   1.984  -0.565
  213   2HG   PRO  31          2HG       PRO  31  16.048   2.883  -1.103
  214   1HD   PRO  31          1HD       PRO  31  16.257   0.997   0.794
  215   2HD   PRO  31          2HD       PRO  31  17.128   2.548   0.995
  216    H    CYS  32           H        CYS  32  13.220   1.313   1.979
  217    HA   CYS  32           HA       CYS  32  10.527   2.267   1.932
  218   1HB   CYS  32          1HB       CYS  32   9.861   0.197   2.890
  219   2HB   CYS  32          2HB       CYS  32  11.170  -0.134   1.757
  220    H    ARG  33           H        ARG  33  12.934   2.319   4.548
  221    HA   ARG  33           HA       ARG  33  11.047   3.014   6.621
  222   1HB   ARG  33          1HB       ARG  33  13.574   2.057   6.642
  223   2HB   ARG  33          2HB       ARG  33  13.947   3.778   6.808
  224   1HG   ARG  33          1HG       ARG  33  12.335   3.806   8.800
  225   2HG   ARG  33          2HG       ARG  33  12.153   2.061   8.579
  226   1HD   ARG  33          1HD       ARG  33  14.937   2.384   8.648
  227   2HD   ARG  33          2HD       ARG  33  14.382   3.631   9.757
  228    HE   ARG  33           HE       ARG  33  13.706   2.029  11.255
  229   1HH1  ARG  33          2HH2      ARG  33  14.407   0.406   8.163
  230   2HH1  ARG  33          1HH2      ARG  33  14.259  -1.203   8.834
  231   1HH2  ARG  33          2HH1      ARG  33  13.578  -0.167  12.108
  232   2HH2  ARG  33          1HH1      ARG  33  13.846  -1.499  11.026
  233    H    MET  34           H        MET  34  12.089   4.835   3.940
  234    HA   MET  34           HA       MET  34  11.557   7.400   5.298
  235   1HB   MET  34          1HB       MET  34  12.908   6.771   2.638
  236   2HB   MET  34          2HB       MET  34  12.611   8.395   3.266
  237   1HG   MET  34          1HG       MET  34  13.991   7.772   5.286
  238   2HG   MET  34          2HG       MET  34  14.430   6.277   4.451
  239   1HE   MET  34          1HE       MET  34  14.725   7.338   1.377
  240   2HE   MET  34          2HE       MET  34  16.459   7.714   1.339
  241   3HE   MET  34          3HE       MET  34  15.900   6.241   2.151
  242    H    MET  35           H        MET  35  10.552   5.184   2.804
  243    HA   MET  35           HA       MET  35   8.550   6.852   1.560
  244   1HB   MET  35          1HB       MET  35   9.835   4.925   0.488
  245   2HB   MET  35          2HB       MET  35   8.966   3.818   1.553
  246   1HG   MET  35          1HG       MET  35   8.005   3.865  -0.664
  247   2HG   MET  35          2HG       MET  35   6.844   4.454   0.520
  248   1HE   MET  35          1HE       MET  35   6.264   6.119  -3.057
  249   2HE   MET  35          2HE       MET  35   6.869   4.504  -2.642
  250   3HE   MET  35          3HE       MET  35   5.472   5.165  -1.783
  251    H    ALA  36           H        ALA  36   8.595   4.194   4.033
  252    HA   ALA  36           HA       ALA  36   5.820   4.011   4.411
  253   1HB   ALA  36          1HB       ALA  36   7.374   2.348   5.277
  254   2HB   ALA  36          2HB       ALA  36   8.078   3.527   6.404
  255   3HB   ALA  36          3HB       ALA  36   6.390   3.005   6.597
  256    HA   PRO  37           HA       PRO  37   5.929   7.482   7.679
  257   1HB   PRO  37          1HB       PRO  37   7.873   9.434   7.528
  258   2HB   PRO  37          2HB       PRO  37   7.819   8.075   8.693
  259   1HG   PRO  37          1HG       PRO  37   9.337   8.279   6.109
  260   2HG   PRO  37          2HG       PRO  37   9.893   7.611   7.662
  261   1HD   PRO  37          1HD       PRO  37   9.072   5.971   5.666
  262   2HD   PRO  37          2HD       PRO  37   8.683   5.607   7.366
  263    H    VAL  38           H        VAL  38   7.274   8.148   4.345
  264    HA   VAL  38           HA       VAL  38   5.606  10.515   4.114
  265    HB   VAL  38           HB       VAL  38   7.640   9.319   2.558
  266   1HG1  VAL  38          1HG1      VAL  38   6.096   8.227   1.076
  267   2HG1  VAL  38          2HG1      VAL  38   5.184   9.733   0.820
  268   3HG1  VAL  38          3HG1      VAL  38   6.859   9.576   0.250
  269   1HG2  VAL  38          1HG2      VAL  38   6.020  11.861   2.142
  270   2HG2  VAL  38          2HG2      VAL  38   7.442  11.678   3.187
  271   3HG2  VAL  38          3HG2      VAL  38   7.613  11.518   1.431
  272    H    LEU  39           H        LEU  39   5.019   7.073   3.477
  273    HA   LEU  39           HA       LEU  39   2.368   7.447   2.473
  274   1HB   LEU  39          1HB       LEU  39   4.142   5.168   3.291
  275   2HB   LEU  39          2HB       LEU  39   2.424   4.890   3.213
  276    HG   LEU  39           HG       LEU  39   2.269   5.278   0.918
  277   1HD1  LEU  39          1HD1      LEU  39   3.925   6.207  -0.556
  278   2HD1  LEU  39          2HD1      LEU  39   3.652   7.378   0.714
  279   3HD1  LEU  39          3HD1      LEU  39   5.097   6.339   0.757
  280   1HD2  LEU  39          1HD2      LEU  39   4.950   3.911   1.411
  281   2HD2  LEU  39          2HD2      LEU  39   3.382   3.141   1.244
  282   3HD2  LEU  39          3HD2      LEU  39   4.102   3.894  -0.162
  283    H    GLU  40           H        GLU  40   3.717   7.248   5.731
  284    HA   GLU  40           HA       GLU  40   1.247   6.883   7.125
  285   1HB   GLU  40          1HB       GLU  40   3.946   7.310   7.807
  286   2HB   GLU  40          2HB       GLU  40   3.151   8.729   8.442
  287   1HG   GLU  40          1HG       GLU  40   2.923   7.386  10.250
  288   2HG   GLU  40          2HG       GLU  40   1.460   6.879   9.413
  289    H    GLU  41           H        GLU  41   2.996   9.801   5.989
  290    HA   GLU  41           HA       GLU  41   1.017  11.719   6.791
  291   1HB   GLU  41          1HB       GLU  41   3.331  12.322   5.974
  292   2HB   GLU  41          2HB       GLU  41   2.830  11.862   4.345
  293   1HG   GLU  41          1HG       GLU  41   0.874  13.598   4.726
  294   2HG   GLU  41          2HG       GLU  41   1.906  14.210   6.017
  295    H    PHE  42           H        PHE  42   1.471   9.919   3.709
  296    HA   PHE  42           HA       PHE  42  -0.789  10.851   2.338
  297   1HB   PHE  42          1HB       PHE  42   1.002   9.302   1.425
  298   2HB   PHE  42          2HB       PHE  42   0.239   7.969   2.256
  299    HD1  PHE  42           1HD      PHE  42   0.189  10.012  -0.691
  300    HD2  PHE  42           2HD      PHE  42  -2.191   7.334   1.722
  301    HE1  PHE  42           1HE      PHE  42  -1.410   9.725  -2.546
  302    HE2  PHE  42           2HE      PHE  42  -3.799   7.098  -0.125
  303    HZ   PHE  42           HZ       PHE  42  -3.384   8.350  -2.290
  304    H    ALA  43           H        ALA  43  -0.594   8.062   4.581
  305    HA   ALA  43           HA       ALA  43  -3.292   7.354   4.362
  306   1HB   ALA  43          1HB       ALA  43  -2.843   5.902   6.275
  307   2HB   ALA  43          2HB       ALA  43  -1.410   5.909   5.217
  308   3HB   ALA  43          3HB       ALA  43  -1.405   6.846   6.720
  309    H    GLU  44           H        GLU  44  -1.643   9.294   6.904
  310    HA   GLU  44           HA       GLU  44  -3.894   9.710   8.545
  311   1HB   GLU  44          1HB       GLU  44  -1.591  10.172   9.188
  312   2HB   GLU  44          2HB       GLU  44  -1.517  11.571   8.122
  313   1HG   GLU  44          1HG       GLU  44  -3.808  11.434  10.096
  314   2HG   GLU  44          2HG       GLU  44  -2.205  11.608  10.769
  315    H    ALA  45           H        ALA  45  -2.677  11.707   5.836
  316    HA   ALA  45           HA       ALA  45  -4.686  13.677   5.983
  317   1HB   ALA  45          1HB       ALA  45  -2.582  13.980   4.753
  318   2HB   ALA  45          2HB       ALA  45  -3.045  12.709   3.596
  319   3HB   ALA  45          3HB       ALA  45  -3.953  14.235   3.656
  320    H    HIS  46           H        HIS  46  -5.081  10.429   4.868
  321    HA   HIS  46           HA       HIS  46  -7.571  11.144   3.378
  322   1HB   HIS  46          1HB       HIS  46  -5.381   9.439   2.405
  323   2HB   HIS  46          2HB       HIS  46  -6.970   9.514   1.661
  324    HD1  HIS  46           1HD      HIS  46  -6.586  12.943   2.405
  325    HD2  HIS  46           2HD      HIS  46  -4.704  10.208  -0.182
  326    HE1  HIS  46           1HE      HIS  46  -5.719  14.339   0.402
  327    HE2  HIS  46           2HE      HIS  46  -4.544  12.808  -1.128
  328    H    ALA  47           H        ALA  47  -6.730   9.612   6.041
  329    HA   ALA  47           HA       ALA  47  -7.266   7.036   6.101
  330   1HB   ALA  47          1HB       ALA  47  -8.480   9.079   8.011
  331   2HB   ALA  47          2HB       ALA  47  -8.128   7.373   8.377
  332   3HB   ALA  47          3HB       ALA  47  -6.798   8.502   8.041
  333    H    ASP  48           H        ASP  48 -10.025   9.389   6.102
  334    HA   ASP  48           HA       ASP  48 -11.964   7.289   5.872
  335   1HB   ASP  48          1HB       ASP  48 -12.307  10.290   5.453
  336   2HB   ASP  48          2HB       ASP  48 -13.582   9.129   5.823
  337    H    LYS  49           H        LYS  49 -10.068   8.760   3.450
  338    HA   LYS  49           HA       LYS  49 -12.205   8.521   1.384
  339   1HB   LYS  49          1HB       LYS  49 -10.805  10.612   1.580
  340   2HB   LYS  49          2HB       LYS  49  -9.396   9.663   1.089
  341   1HG   LYS  49          1HG       LYS  49 -10.364   9.169  -1.059
  342   2HG   LYS  49          2HG       LYS  49 -11.940   9.813  -0.600
  343   1HD   LYS  49          1HD       LYS  49  -9.562  11.687  -0.543
  344   2HD   LYS  49          2HD       LYS  49 -10.190  11.145  -2.092
  345   1HE   LYS  49          1HE       LYS  49 -11.202  13.231  -1.612
  346   2HE   LYS  49          2HE       LYS  49 -12.416  11.951  -1.613
  347   1HZ   LYS  49          1HZ       LYS  49 -12.318  11.953   0.804
  348   2HZ   LYS  49          2HZ       LYS  49 -11.215  13.181   0.789
  349   3HZ   LYS  49          3HZ       LYS  49 -12.741  13.435   0.226
  350    H    VAL  50           H        VAL  50  -9.391   6.824   2.624
  351    HA   VAL  50           HA       VAL  50  -9.851   4.763   0.597
  352    HB   VAL  50           HB       VAL  50  -8.352   6.010  -0.639
  353   1HG1  VAL  50          1HG1      VAL  50  -6.074   6.696   0.118
  354   2HG1  VAL  50          2HG1      VAL  50  -7.373   7.503   0.992
  355   3HG1  VAL  50          3HG1      VAL  50  -6.489   6.176   1.770
  356   1HG2  VAL  50          1HG2      VAL  50  -6.589   3.872   0.564
  357   2HG2  VAL  50          2HG2      VAL  50  -7.906   3.571  -0.604
  358   3HG2  VAL  50          3HG2      VAL  50  -6.532   4.575  -1.070
  359    H    THR  51           H        THR  51  -9.442   2.836   1.250
  360    HA   THR  51           HA       THR  51  -9.252   2.370   4.058
  361    HB   THR  51           HB       THR  51  -9.399   0.366   1.873
  362    HG1  THR  51           1HG      THR  51 -10.973   1.580   1.328
  363   1HG2  THR  51          1HG2      THR  51 -10.756  -0.986   3.362
  364   2HG2  THR  51          2HG2      THR  51  -9.117  -0.737   3.950
  365   3HG2  THR  51          3HG2      THR  51 -10.495   0.193   4.658
  366    H    VAL  52           H        VAL  52  -6.972   2.960   4.637
  367    HA   VAL  52           HA       VAL  52  -4.838   1.810   3.000
  368    HB   VAL  52           HB       VAL  52  -4.692   3.369   5.547
  369   1HG1  VAL  52          1HG1      VAL  52  -2.571   2.623   3.526
  370   2HG1  VAL  52          2HG1      VAL  52  -2.358   3.956   4.658
  371   3HG1  VAL  52          3HG1      VAL  52  -2.574   2.332   5.274
  372   1HG2  VAL  52          1HG2      VAL  52  -5.762   4.802   3.894
  373   2HG2  VAL  52          2HG2      VAL  52  -4.093   5.318   4.037
  374   3HG2  VAL  52          3HG2      VAL  52  -4.583   4.328   2.652
  375    H    ALA  53           H        ALA  53  -3.160   0.352   3.963
  376    HA   ALA  53           HA       ALA  53  -3.441  -0.450   6.668
  377   1HB   ALA  53          1HB       ALA  53  -5.094  -2.063   5.827
  378   2HB   ALA  53          2HB       ALA  53  -4.008  -2.505   4.483
  379   3HB   ALA  53          3HB       ALA  53  -3.556  -2.863   6.166
  380    H    LYS  54           H        LYS  54  -1.520  -1.768   7.260
  381    HA   LYS  54           HA       LYS  54   0.700  -1.341   5.297
  382   1HB   LYS  54          1HB       LYS  54   0.364   0.579   6.834
  383   2HB   LYS  54          2HB       LYS  54   0.439  -0.496   8.236
  384   1HG   LYS  54          1HG       LYS  54   2.812  -0.994   7.765
  385   2HG   LYS  54          2HG       LYS  54   2.745   0.043   6.326
  386   1HD   LYS  54          1HD       LYS  54   1.961   1.928   7.880
  387   2HD   LYS  54          2HD       LYS  54   2.401   0.861   9.222
  388   1HE   LYS  54          1HE       LYS  54   4.748   0.754   8.204
  389   2HE   LYS  54          2HE       LYS  54   4.208   1.966   7.014
  390   1HZ   LYS  54          1HZ       LYS  54   5.104   3.252   8.778
  391   2HZ   LYS  54          2HZ       LYS  54   3.533   3.340   8.990
  392   3HZ   LYS  54          3HZ       LYS  54   4.384   2.322   9.945
  393    H    LEU  55           H        LEU  55   2.138  -3.130   5.180
  394    HA   LEU  55           HA       LEU  55   2.252  -4.896   7.518
  395   1HB   LEU  55          1HB       LEU  55   1.679  -6.903   6.118
  396   2HB   LEU  55          2HB       LEU  55   0.394  -5.863   6.625
  397    HG   LEU  55           HG       LEU  55   0.084  -6.795   4.423
  398   1HD1  LEU  55          1HD1      LEU  55  -0.763  -4.370   5.092
  399   2HD1  LEU  55          2HD1      LEU  55   0.313  -3.865   3.806
  400   3HD1  LEU  55          3HD1      LEU  55  -0.991  -5.031   3.473
  401   1HD2  LEU  55          1HD2      LEU  55   1.282  -6.124   2.492
  402   2HD2  LEU  55          2HD2      LEU  55   2.316  -5.014   3.404
  403   3HD2  LEU  55          3HD2      LEU  55   2.454  -6.771   3.653
  404    H    ASN  56           H        ASN  56   3.757  -6.492   7.489
  405    HA   ASN  56           HA       ASN  56   6.277  -5.682   6.227
  406   1HB   ASN  56          1HB       ASN  56   6.338  -5.989   8.620
  407   2HB   ASN  56          2HB       ASN  56   5.415  -7.493   8.534
  408   1HD2  ASN  56          1HD2      ASN  56   6.885  -8.806   9.657
  409   2HD2  ASN  56          2HD2      ASN  56   8.473  -9.177   8.969
  410    H    VAL  57           H        VAL  57   6.464  -6.513   4.221
  411    HA   VAL  57           HA       VAL  57   4.786  -8.457   3.190
  412    HB   VAL  57           HB       VAL  57   6.009  -6.588   2.087
  413   1HG1  VAL  57          1HG1      VAL  57   8.325  -7.082   2.680
  414   2HG1  VAL  57          2HG1      VAL  57   8.252  -8.655   1.851
  415   3HG1  VAL  57          3HG1      VAL  57   8.137  -7.181   0.911
  416   1HG2  VAL  57          1HG2      VAL  57   4.648  -8.280   0.842
  417   2HG2  VAL  57          2HG2      VAL  57   5.927  -7.477  -0.082
  418   3HG2  VAL  57          3HG2      VAL  57   6.162  -9.138   0.496
  419    H    ASP  58           H        ASP  58   7.842  -9.028   4.797
  420    HA   ASP  58           HA       ASP  58   8.436 -11.646   3.718
  421   1HB   ASP  58          1HB       ASP  58  10.095 -10.210   4.786
  422   2HB   ASP  58          2HB       ASP  58   9.187 -10.247   6.292
  423    H    GLU  59           H        GLU  59   6.688 -10.401   6.489
  424    HA   GLU  59           HA       GLU  59   5.905 -12.970   7.648
  425   1HB   GLU  59          1HB       GLU  59   6.571 -11.156   9.014
  426   2HB   GLU  59          2HB       GLU  59   5.496 -10.039   8.170
  427   1HG   GLU  59          1HG       GLU  59   3.537 -11.079   9.171
  428   2HG   GLU  59          2HG       GLU  59   4.576 -12.240  10.020
  429    H    ASN  60           H        ASN  60   4.667 -10.696   5.354
  430    HA   ASN  60           HA       ASN  60   2.012 -12.057   5.285
  431   1HB   ASN  60          1HB       ASN  60   1.655  -9.717   5.640
  432   2HB   ASN  60          2HB       ASN  60   2.920  -9.276   4.499
  433   1HD2  ASN  60          1HD2      ASN  60  -0.093 -11.310   4.277
  434   2HD2  ASN  60          2HD2      ASN  60  -0.372 -10.807   2.573
  435    HA   PRO  61           HA       PRO  61   4.063 -13.551   1.407
  436   1HB   PRO  61          1HB       PRO  61   3.529 -16.215   1.671
  437   2HB   PRO  61          2HB       PRO  61   4.951 -15.427   2.405
  438   1HG   PRO  61          1HG       PRO  61   2.288 -16.116   3.704
  439   2HG   PRO  61          2HG       PRO  61   3.938 -16.390   4.351
  440   1HD   PRO  61          1HD       PRO  61   2.368 -14.242   5.062
  441   2HD   PRO  61          2HD       PRO  61   4.148 -14.141   4.993
  442    H    GLU  62           H        GLU  62   0.966 -13.797   2.958
  443    HA   GLU  62           HA       GLU  62  -0.586 -14.988   0.888
  444   1HB   GLU  62          1HB       GLU  62  -1.476 -15.024   3.054
  445   2HB   GLU  62          2HB       GLU  62  -1.133 -13.326   3.348
  446   1HG   GLU  62          1HG       GLU  62  -3.588 -14.045   3.013
  447   2HG   GLU  62          2HG       GLU  62  -3.010 -12.566   2.243
  448    H    THR  63           H        THR  63  -1.321 -14.186  -0.903
  449    HA   THR  63           HA       THR  63  -1.629 -13.033  -2.750
  450    HB   THR  63           HB       THR  63  -2.210 -10.848  -0.754
  451    HG1  THR  63           1HG      THR  63  -3.772 -12.555  -0.898
  452   1HG2  THR  63          1HG2      THR  63  -3.276  -9.589  -2.620
  453   2HG2  THR  63          2HG2      THR  63  -1.513  -9.645  -2.771
  454   3HG2  THR  63          3HG2      THR  63  -2.539 -10.701  -3.782
  455    H    THR  64           H        THR  64   0.756 -11.782  -0.653
  456    HA   THR  64           HA       THR  64   2.440 -10.286  -2.308
  457    HB   THR  64           HB       THR  64   2.944 -12.231  -0.064
  458    HG1  THR  64           1HG      THR  64   2.891 -10.544   1.155
  459   1HG2  THR  64          1HG2      THR  64   5.119 -12.115  -1.197
  460   2HG2  THR  64          2HG2      THR  64   5.056 -10.340  -1.103
  461   3HG2  THR  64          3HG2      THR  64   5.132 -11.309   0.371
  462    H    SER  65           H        SER  65   2.523 -13.850  -1.741
  463    HA   SER  65           HA       SER  65   4.620 -14.349  -3.568
  464   1HB   SER  65          1HB       SER  65   3.881 -15.880  -1.760
  465   2HB   SER  65          2HB       SER  65   2.380 -16.206  -2.641
  466    HG   SER  65           HG       SER  65   4.988 -16.682  -3.678
  467    H    GLN  66           H        GLN  66   1.078 -14.292  -4.072
  468    HA   GLN  66           HA       GLN  66   1.043 -15.373  -6.685
  469   1HB   GLN  66          1HB       GLN  66  -0.910 -15.146  -5.173
  470   2HB   GLN  66          2HB       GLN  66  -0.889 -13.394  -5.392
  471   1HG   GLN  66          1HG       GLN  66  -1.381 -13.629  -7.773
  472   2HG   GLN  66          2HG       GLN  66  -1.228 -15.387  -7.675
  473   1HE2  GLN  66          1HE2      GLN  66  -3.158 -16.544  -7.303
  474   2HE2  GLN  66          2HE2      GLN  66  -4.617 -15.756  -6.709
  475    H    PHE  67           H        PHE  67   1.371 -11.934  -5.579
  476    HA   PHE  67           HA       PHE  67   1.538 -11.135  -8.438
  477   1HB   PHE  67          1HB       PHE  67   1.018  -9.615  -5.889
  478   2HB   PHE  67          2HB       PHE  67   1.447  -8.804  -7.392
  479    HD1  PHE  67           1HD      PHE  67  -1.136 -10.879  -5.716
  480    HD2  PHE  67           2HD      PHE  67  -0.087  -8.667  -9.266
  481    HE1  PHE  67           1HE      PHE  67  -3.487 -10.994  -6.483
  482    HE2  PHE  67           2HE      PHE  67  -2.444  -8.788 -10.032
  483    HZ   PHE  67           HZ       PHE  67  -4.148  -9.954  -8.643
  484    H    GLY  68           H        GLY  68   3.814 -12.346  -6.420
  485   1HA   GLY  68          1HA       GLY  68   6.106 -12.337  -6.605
  486   2HA   GLY  68          2HA       GLY  68   5.933 -11.296  -8.030
  487    H    ILE  69           H        ILE  69   4.766 -10.563  -4.777
  488    HA   ILE  69           HA       ILE  69   5.731  -7.862  -4.989
  489    HB   ILE  69           HB       ILE  69   4.289  -9.425  -2.859
  490   1HG1  ILE  69          1HG1      ILE  69   2.918  -9.411  -4.778
  491   2HG1  ILE  69          2HG1      ILE  69   2.246  -8.212  -3.685
  492   1HG2  ILE  69          1HG2      ILE  69   3.901  -7.722  -1.552
  493   2HG2  ILE  69          2HG2      ILE  69   5.359  -7.005  -2.234
  494   3HG2  ILE  69          3HG2      ILE  69   3.765  -6.520  -2.831
  495   1HD1  ILE  69          1HD1      ILE  69   3.846  -7.744  -6.229
  496   2HD1  ILE  69          2HD1      ILE  69   2.212  -7.187  -5.821
  497   3HD1  ILE  69          3HD1      ILE  69   3.633  -6.463  -5.032
  498    H    MET  70           H        MET  70   7.983  -8.393  -5.168
  499    HA   MET  70           HA       MET  70   9.335  -8.499  -2.495
  500   1HB   MET  70          1HB       MET  70  10.363  -9.218  -5.273
  501   2HB   MET  70          2HB       MET  70  11.277  -9.317  -3.765
  502   1HG   MET  70          1HG       MET  70   9.667 -10.987  -2.885
  503   2HG   MET  70          2HG       MET  70   8.740 -10.880  -4.378
  504   1HE   MET  70          1HE       MET  70  12.853 -12.936  -3.923
  505   2HE   MET  70          2HE       MET  70  12.699 -11.177  -3.727
  506   3HE   MET  70          3HE       MET  70  11.875 -12.275  -2.593
  507    H    SER  71           H        SER  71   8.374  -6.241  -4.722
  508    HA   SER  71           HA       SER  71  10.911  -4.908  -5.184
  509   1HB   SER  71          1HB       SER  71   9.176  -5.181  -6.947
  510   2HB   SER  71          2HB       SER  71   8.067  -4.163  -5.998
  511    HG   SER  71           HG       SER  71   9.794  -2.586  -6.058
  512    H    ILE  72           H        ILE  72   9.825  -4.908  -2.399
  513    HA   ILE  72           HA       ILE  72   8.576  -2.604  -1.728
  514    HB   ILE  72           HB       ILE  72   9.315  -2.994   0.602
  515   1HG1  ILE  72          1HG1      ILE  72  10.934  -5.271  -0.646
  516   2HG1  ILE  72          2HG1      ILE  72  11.559  -3.862   0.215
  517   1HG2  ILE  72          1HG2      ILE  72   7.929  -4.916   0.823
  518   2HG2  ILE  72          2HG2      ILE  72   7.332  -4.021  -0.567
  519   3HG2  ILE  72          3HG2      ILE  72   8.303  -5.484  -0.825
  520   1HD1  ILE  72          1HD1      ILE  72  11.614  -5.550   1.814
  521   2HD1  ILE  72          2HD1      ILE  72  10.107  -4.710   2.221
  522   3HD1  ILE  72          3HD1      ILE  72  10.084  -6.239   1.310
  523    HA   PRO  73           HA       PRO  73   8.449  -0.892   0.063
  524   1HB   PRO  73          1HB       PRO  73   7.969   1.731  -0.499
  525   2HB   PRO  73          2HB       PRO  73   9.016   1.184   0.833
  526   1HG   PRO  73          1HG       PRO  73   9.812   2.087  -1.944
  527   2HG   PRO  73          2HG       PRO  73  10.569   2.565  -0.397
  528   1HD   PRO  73          1HD       PRO  73  11.609   0.618  -2.020
  529   2HD   PRO  73          2HD       PRO  73  11.722   0.495  -0.247
  530    H    THR  74           H        THR  74   6.462  -1.233  -0.775
  531    HA   THR  74           HA       THR  74   5.844  -0.320  -3.532
  532    HB   THR  74           HB       THR  74   5.701  -3.147  -2.422
  533    HG1  THR  74           1HG      THR  74   7.505  -1.897  -3.756
  534   1HG2  THR  74          1HG2      THR  74   4.699  -3.856  -4.557
  535   2HG2  THR  74          2HG2      THR  74   3.603  -2.817  -3.635
  536   3HG2  THR  74          3HG2      THR  74   4.480  -2.159  -5.032
  537    H    LEU  75           H        LEU  75   3.651   0.032  -3.903
  538    HA   LEU  75           HA       LEU  75   1.769  -0.070  -1.630
  539   1HB   LEU  75          1HB       LEU  75   2.809   2.160  -1.786
  540   2HB   LEU  75          2HB       LEU  75   2.208   2.318  -3.417
  541    HG   LEU  75           HG       LEU  75   0.197   1.511  -1.332
  542   1HD1  LEU  75          1HD1      LEU  75  -0.145   3.900  -0.693
  543   2HD1  LEU  75          2HD1      LEU  75   1.378   3.213  -0.133
  544   3HD1  LEU  75          3HD1      LEU  75   1.369   4.307  -1.540
  545   1HD2  LEU  75          1HD2      LEU  75  -1.303   2.921  -2.636
  546   2HD2  LEU  75          2HD2      LEU  75   0.049   3.503  -3.638
  547   3HD2  LEU  75          3HD2      LEU  75  -0.481   1.812  -3.724
  548    H    ILE  76           H        ILE  76  -0.033  -1.156  -2.421
  549    HA   ILE  76           HA       ILE  76  -0.570  -0.972  -5.350
  550    HB   ILE  76           HB       ILE  76  -0.620  -3.506  -3.690
  551   1HG1  ILE  76          1HG1      ILE  76   0.707  -3.299  -6.362
  552   2HG1  ILE  76          2HG1      ILE  76   1.573  -2.495  -5.079
  553   1HG2  ILE  76          1HG2      ILE  76  -1.551  -3.027  -6.563
  554   2HG2  ILE  76          2HG2      ILE  76  -1.355  -4.620  -5.824
  555   3HG2  ILE  76          3HG2      ILE  76  -2.575  -3.507  -5.192
  556   1HD1  ILE  76          1HD1      ILE  76   0.734  -5.408  -4.985
  557   2HD1  ILE  76          2HD1      ILE  76   2.242  -4.804  -5.714
  558   3HD1  ILE  76          3HD1      ILE  76   1.961  -4.559  -3.995
  559    H    LEU  77           H        LEU  77  -2.726  -1.011  -5.874
  560    HA   LEU  77           HA       LEU  77  -4.508  -0.213  -3.628
  561   1HB   LEU  77          1HB       LEU  77  -3.352   1.660  -4.842
  562   2HB   LEU  77          2HB       LEU  77  -4.294   1.257  -6.284
  563    HG   LEU  77           HG       LEU  77  -5.599   1.760  -3.604
  564   1HD1  LEU  77          1HD1      LEU  77  -5.007   3.922  -5.610
  565   2HD1  LEU  77          2HD1      LEU  77  -5.746   4.083  -3.984
  566   3HD1  LEU  77          3HD1      LEU  77  -4.074   3.607  -4.124
  567   1HD2  LEU  77          1HD2      LEU  77  -6.623   2.218  -6.442
  568   2HD2  LEU  77          2HD2      LEU  77  -7.124   0.889  -5.372
  569   3HD2  LEU  77          3HD2      LEU  77  -7.531   2.535  -4.938
  570    H    PHE  78           H        PHE  78  -6.448  -1.104  -3.674
  571    HA   PHE  78           HA       PHE  78  -7.178  -2.814  -5.979
  572   1HB   PHE  78          1HB       PHE  78  -7.642  -3.275  -3.007
  573   2HB   PHE  78          2HB       PHE  78  -8.155  -4.342  -4.296
  574    HD1  PHE  78           1HD      PHE  78  -6.769  -6.148  -4.954
  575    HD2  PHE  78           2HD      PHE  78  -5.082  -2.921  -2.637
  576    HE1  PHE  78           1HE      PHE  78  -4.699  -7.459  -4.627
  577    HE2  PHE  78           2HE      PHE  78  -3.014  -4.240  -2.331
  578    HZ   PHE  78           HZ       PHE  78  -2.812  -6.510  -3.315
  579    H    LYS  79           H        LYS  79  -9.355  -3.044  -6.454
  580    HA   LYS  79           HA       LYS  79 -11.349  -2.248  -4.591
  581   1HB   LYS  79          1HB       LYS  79 -12.723  -0.837  -5.960
  582   2HB   LYS  79          2HB       LYS  79 -11.222  -0.043  -5.575
  583   1HG   LYS  79          1HG       LYS  79 -11.988  -1.286  -8.258
  584   2HG   LYS  79          2HG       LYS  79 -12.051   0.422  -7.851
  585   1HD   LYS  79          1HD       LYS  79  -9.534  -1.263  -8.108
  586   2HD   LYS  79          2HD       LYS  79 -10.104  -0.061  -9.242
  587   1HE   LYS  79          1HE       LYS  79  -9.364   0.571  -6.345
  588   2HE   LYS  79          2HE       LYS  79  -8.229   0.691  -7.682
  589   1HZ   LYS  79          1HZ       LYS  79  -9.260   2.811  -7.161
  590   2HZ   LYS  79          2HZ       LYS  79  -9.599   2.355  -8.700
  591   3HZ   LYS  79          3HZ       LYS  79 -10.748   2.208  -7.528
  592    H    GLY  80           H        GLY  80 -13.246  -3.441  -5.001
  593   1HA   GLY  80          1HA       GLY  80 -14.487  -5.218  -5.844
  594   2HA   GLY  80          2HA       GLY  80 -13.556  -5.173  -7.350
  595    H    GLY  81           H        GLY  81 -11.871  -5.212  -4.251
  596   1HA   GLY  81          1HA       GLY  81 -10.418  -6.745  -3.332
  597   2HA   GLY  81          2HA       GLY  81 -11.279  -8.025  -4.190
  598    H    GLU  82           H        GLU  82 -10.242  -5.746  -6.552
  599    HA   GLU  82           HA       GLU  82  -7.941  -7.497  -7.198
  600   1HB   GLU  82          1HB       GLU  82 -10.047  -7.816  -8.488
  601   2HB   GLU  82          2HB       GLU  82  -9.948  -6.137  -9.037
  602   1HG   GLU  82          1HG       GLU  82  -7.803  -6.633 -10.168
  603   2HG   GLU  82          2HG       GLU  82  -7.836  -8.284  -9.526
  604    HA   PRO  83           HA       PRO  83  -5.670  -3.697  -7.047
  605   1HB   PRO  83          1HB       PRO  83  -3.310  -4.337  -8.222
  606   2HB   PRO  83          2HB       PRO  83  -3.850  -5.010  -6.651
  607   1HG   PRO  83          1HG       PRO  83  -4.072  -6.291  -9.387
  608   2HG   PRO  83          2HG       PRO  83  -3.459  -7.011  -7.862
  609   1HD   PRO  83          1HD       PRO  83  -6.012  -7.376  -8.739
  610   2HD   PRO  83          2HD       PRO  83  -5.629  -7.262  -6.999
  611    H    VAL  84           H        VAL  84  -5.904  -1.858  -8.168
  612    HA   VAL  84           HA       VAL  84  -6.447  -1.889 -11.056
  613    HB   VAL  84           HB       VAL  84  -7.425  -0.394  -9.115
  614   1HG1  VAL  84          1HG1      VAL  84  -5.459   0.795  -8.394
  615   2HG1  VAL  84          2HG1      VAL  84  -5.332   1.549 -10.007
  616   3HG1  VAL  84          3HG1      VAL  84  -6.727   1.876  -8.984
  617   1HG2  VAL  84          1HG2      VAL  84  -6.948   0.586 -11.938
  618   2HG2  VAL  84          2HG2      VAL  84  -8.291  -0.428 -11.372
  619   3HG2  VAL  84          3HG2      VAL  84  -8.169   1.258 -10.838
  620    H    LYS  85           H        LYS  85  -3.906  -0.807  -8.829
  621    HA   LYS  85           HA       LYS  85  -1.902  -0.792 -10.935
  622   1HB   LYS  85          1HB       LYS  85  -1.431   1.452 -11.069
  623   2HB   LYS  85          2HB       LYS  85  -3.187   1.481 -11.060
  624   1HG   LYS  85          1HG       LYS  85  -3.166   2.159  -8.656
  625   2HG   LYS  85          2HG       LYS  85  -1.402   2.046  -8.632
  626   1HD   LYS  85          1HD       LYS  85  -1.700   4.301  -8.937
  627   2HD   LYS  85          2HD       LYS  85  -1.380   3.721 -10.571
  628   1HE   LYS  85          1HE       LYS  85  -3.958   3.585 -10.833
  629   2HE   LYS  85          2HE       LYS  85  -4.048   4.470  -9.309
  630   1HZ   LYS  85          1HZ       LYS  85  -2.857   6.290 -10.298
  631   2HZ   LYS  85          2HZ       LYS  85  -2.569   5.506 -11.681
  632   3HZ   LYS  85          3HZ       LYS  85  -4.129   5.985 -11.197
  633    H    GLN  86           H        GLN  86   0.248  -0.118 -10.048
  634    HA   GLN  86           HA       GLN  86   0.456  -0.243  -7.123
  635   1HB   GLN  86          1HB       GLN  86   2.170  -1.851  -7.244
  636   2HB   GLN  86          2HB       GLN  86   0.794  -2.472  -8.204
  637   1HG   GLN  86          1HG       GLN  86   3.270  -1.264  -9.355
  638   2HG   GLN  86          2HG       GLN  86   3.039  -2.982  -9.065
  639   1HE2  GLN  86          1HE2      GLN  86   1.963  -4.237 -10.647
  640   2HE2  GLN  86          2HE2      GLN  86   1.138  -3.505 -12.016
  641    H    LEU  87           H        LEU  87   2.377   0.658  -6.297
  642    HA   LEU  87           HA       LEU  87   4.058   2.369  -8.049
  643   1HB   LEU  87          1HB       LEU  87   2.922   2.843  -5.264
  644   2HB   LEU  87          2HB       LEU  87   4.365   3.653  -5.804
  645    HG   LEU  87           HG       LEU  87   2.539   5.139  -5.934
  646   1HD1  LEU  87          1HD1      LEU  87   3.130   4.369  -8.800
  647   2HD1  LEU  87          2HD1      LEU  87   2.889   5.991  -8.078
  648   3HD1  LEU  87          3HD1      LEU  87   4.351   5.074  -7.718
  649   1HD2  LEU  87          1HD2      LEU  87   0.586   4.930  -7.302
  650   2HD2  LEU  87          2HD2      LEU  87   1.091   3.356  -7.922
  651   3HD2  LEU  87          3HD2      LEU  87   0.653   3.532  -6.208
  652    H    ILE  88           H        ILE  88   6.286   2.216  -7.482
  653    HA   ILE  88           HA       ILE  88   7.085   0.332  -5.376
  654    HB   ILE  88           HB       ILE  88   8.655  -0.760  -6.938
  655   1HG1  ILE  88          1HG1      ILE  88   7.074   0.540  -9.210
  656   2HG1  ILE  88          2HG1      ILE  88   8.705   1.009  -8.714
  657   1HG2  ILE  88          1HG2      ILE  88   7.082  -2.343  -7.859
  658   2HG2  ILE  88          2HG2      ILE  88   6.437  -1.763  -6.331
  659   3HG2  ILE  88          3HG2      ILE  88   5.772  -1.142  -7.851
  660   1HD1  ILE  88          1HD1      ILE  88   7.887  -1.672  -9.888
  661   2HD1  ILE  88          2HD1      ILE  88   8.887  -0.417 -10.630
  662   3HD1  ILE  88          3HD1      ILE  88   9.501  -1.312  -9.225
  663    H    GLY  89           H        GLY  89   9.232   0.656  -4.687
  664   1HA   GLY  89          1HA       GLY  89  11.192   1.802  -4.304
  665   2HA   GLY  89          2HA       GLY  89  10.988   2.687  -5.829
  666    H    TYR  90           H        TYR  90  11.885   4.332  -4.017
  667    HA   TYR  90           HA       TYR  90   9.817   5.530  -2.350
  668   1HB   TYR  90          1HB       TYR  90  12.217   5.662  -1.769
  669   2HB   TYR  90          2HB       TYR  90  12.493   6.624  -3.218
  670    HD1  TYR  90           1HD      TYR  90  11.386   8.929  -3.426
  671    HD2  TYR  90           2HD      TYR  90  11.385   6.660   0.251
  672    HE1  TYR  90           1HE      TYR  90  10.715  10.956  -2.168
  673    HE2  TYR  90           2HE      TYR  90  10.723   8.688   1.498
  674    HH   TYR  90           HH       TYR  90  10.139  10.914   1.364
  675    H    GLN  91           H        GLN  91   8.225   6.952  -3.117
  676    HA   GLN  91           HA       GLN  91   8.875   8.660  -5.398
  677   1HB   GLN  91          1HB       GLN  91   6.050   7.695  -4.794
  678   2HB   GLN  91          2HB       GLN  91   6.646   8.571  -6.160
  679   1HG   GLN  91          1HG       GLN  91   7.273   5.649  -5.599
  680   2HG   GLN  91          2HG       GLN  91   6.113   6.270  -6.771
  681   1HE2  GLN  91          1HE2      GLN  91   8.613   4.553  -7.226
  682   2HE2  GLN  91          2HE2      GLN  91   9.543   5.552  -8.341
  683    HA   PRO  92           HA       PRO  92   7.999  11.342  -1.883
  684   1HB   PRO  92          1HB       PRO  92   7.608  13.776  -3.128
  685   2HB   PRO  92          2HB       PRO  92   9.223  13.039  -2.889
  686   1HG   PRO  92          1HG       PRO  92   7.456  12.937  -5.342
  687   2HG   PRO  92          2HG       PRO  92   9.207  13.310  -5.263
  688   1HD   PRO  92          1HD       PRO  92   8.316  10.819  -5.918
  689   2HD   PRO  92          2HD       PRO  92   9.767  11.033  -4.890
  690    H    LYS  93           H        LYS  93   6.198  12.481  -0.973
  691    HA   LYS  93           HA       LYS  93   3.714  11.391  -1.290
  692   1HB   LYS  93          1HB       LYS  93   4.963  13.540   0.183
  693   2HB   LYS  93          2HB       LYS  93   3.453  14.170  -0.400
  694   1HG   LYS  93          1HG       LYS  93   3.735  11.525   1.088
  695   2HG   LYS  93          2HG       LYS  93   3.305  13.040   1.848
  696   1HD   LYS  93          1HD       LYS  93   1.685  11.607  -0.302
  697   2HD   LYS  93          2HD       LYS  93   1.414  11.549   1.428
  698   1HE   LYS  93          1HE       LYS  93  -0.204  13.025   0.713
  699   2HE   LYS  93          2HE       LYS  93   1.048  14.078   1.369
  700   1HZ   LYS  93          1HZ       LYS  93   1.454  14.915  -0.656
  701   2HZ   LYS  93          2HZ       LYS  93   1.175  13.498  -1.489
  702   3HZ   LYS  93          3HZ       LYS  93  -0.092  14.423  -0.987
  703    H    GLU  94           H        GLU  94   4.959  14.244  -2.862
  704    HA   GLU  94           HA       GLU  94   2.664  15.218  -4.204
  705   1HB   GLU  94          1HB       GLU  94   5.560  15.167  -5.138
  706   2HB   GLU  94          2HB       GLU  94   4.293  16.214  -5.787
  707   1HG   GLU  94          1HG       GLU  94   4.154  17.487  -3.765
  708   2HG   GLU  94          2HG       GLU  94   5.103  16.312  -2.851
  709    H    GLN  95           H        GLN  95   4.973  12.585  -5.225
  710    HA   GLN  95           HA       GLN  95   3.864  12.427  -7.914
  711   1HB   GLN  95          1HB       GLN  95   6.300  12.061  -7.111
  712   2HB   GLN  95          2HB       GLN  95   5.774  10.570  -6.416
  713   1HG   GLN  95          1HG       GLN  95   6.740  10.086  -8.590
  714   2HG   GLN  95          2HG       GLN  95   5.012   9.756  -8.653
  715   1HE2  GLN  95          1HE2      GLN  95   7.521  12.209  -9.561
  716   2HE2  GLN  95          2HE2      GLN  95   6.543  12.880 -10.861
  717    H    LEU  96           H        LEU  96   3.874  10.818  -4.830
  718    HA   LEU  96           HA       LEU  96   2.407   8.467  -5.407
  719   1HB   LEU  96          1HB       LEU  96   3.575   9.435  -3.191
  720   2HB   LEU  96          2HB       LEU  96   1.942   9.920  -2.855
  721    HG   LEU  96           HG       LEU  96   2.161   7.883  -1.753
  722   1HD1  LEU  96          1HD1      LEU  96   0.079   7.990  -3.177
  723   2HD1  LEU  96          2HD1      LEU  96   0.886   6.960  -4.365
  724   3HD1  LEU  96          3HD1      LEU  96   0.591   6.365  -2.718
  725   1HD2  LEU  96          1HD2      LEU  96   4.246   7.171  -2.793
  726   2HD2  LEU  96          2HD2      LEU  96   3.075   5.838  -2.712
  727   3HD2  LEU  96          3HD2      LEU  96   3.377   6.660  -4.259
  728    H    GLU  97           H        GLU  97   1.168  11.594  -4.012
  729    HA   GLU  97           HA       GLU  97  -1.558  10.801  -4.401
  730   1HB   GLU  97          1HB       GLU  97  -0.183  12.941  -3.139
  731   2HB   GLU  97          2HB       GLU  97  -1.255  13.695  -4.332
  732   1HG   GLU  97          1HG       GLU  97  -3.085  12.219  -3.292
  733   2HG   GLU  97          2HG       GLU  97  -1.908  11.859  -2.015
  734    H    ALA  98           H        ALA  98   0.768  12.464  -6.510
  735    HA   ALA  98           HA       ALA  98  -1.315  13.290  -8.373
  736   1HB   ALA  98          1HB       ALA  98   0.510  13.670  -9.979
  737   2HB   ALA  98          2HB       ALA  98   0.949  14.341  -8.399
  738   3HB   ALA  98          3HB       ALA  98   1.655  12.798  -8.939
  739    H    GLN  99           H        GLN  99   0.810  10.373  -8.229
  740    HA   GLN  99           HA       GLN  99  -0.395   9.199 -10.563
  741   1HB   GLN  99          1HB       GLN  99   1.781   8.532  -9.524
  742   2HB   GLN  99          2HB       GLN  99   0.927   7.856  -8.160
  743   1HG   GLN  99          1HG       GLN  99   1.681   6.178  -9.897
  744   2HG   GLN  99          2HG       GLN  99  -0.009   6.092  -9.416
  745   1HE2  GLN  99          1HE2      GLN  99   1.834   8.036 -11.916
  746   2HE2  GLN  99          2HE2      GLN  99   0.783   7.517 -13.223
  747    H    LEU 100           H        LEU 100  -1.186   9.044  -7.125
  748    HA   LEU 100           HA       LEU 100  -3.298   7.057  -7.550
  749   1HB   LEU 100          1HB       LEU 100  -1.616   7.780  -5.430
  750   2HB   LEU 100          2HB       LEU 100  -3.178   8.291  -4.901
  751    HG   LEU 100           HG       LEU 100  -3.952   5.896  -5.456
  752   1HD1  LEU 100          1HD1      LEU 100  -1.979   5.384  -6.971
  753   2HD1  LEU 100          2HD1      LEU 100  -0.935   5.428  -5.541
  754   3HD1  LEU 100          3HD1      LEU 100  -2.197   4.186  -5.689
  755   1HD2  LEU 100          1HD2      LEU 100  -3.644   6.274  -3.149
  756   2HD2  LEU 100          2HD2      LEU 100  -2.519   4.945  -3.425
  757   3HD2  LEU 100          3HD2      LEU 100  -1.898   6.582  -3.327
  758    H    ALA 101           H        ALA 101  -3.341  10.435  -7.884
  759    HA   ALA 101           HA       ALA 101  -5.574  11.382  -6.794
  760   1HB   ALA 101          1HB       ALA 101  -5.715  12.928  -8.732
  761   2HB   ALA 101          2HB       ALA 101  -4.051  12.716  -8.172
  762   3HB   ALA 101          3HB       ALA 101  -4.603  11.880  -9.639
  763    H    ASP 102           H        ASP 102  -5.720   9.107  -9.609
  764    HA   ASP 102           HA       ASP 102  -8.454   9.755 -10.222
  765   1HB   ASP 102          1HB       ASP 102  -8.459   7.637 -11.512
  766   2HB   ASP 102          2HB       ASP 102  -7.073   8.654 -11.888
  767    H    VAL 103           H        VAL 103  -7.257   8.157  -7.446
  768    HA   VAL 103           HA       VAL 103 -10.131   7.466  -6.939
  769    HB   VAL 103           HB       VAL 103  -8.388   5.537  -7.079
  770   1HG1  VAL 103          1HG1      VAL 103  -7.982   6.291  -4.183
  771   2HG1  VAL 103          2HG1      VAL 103  -7.506   4.796  -4.988
  772   3HG1  VAL 103          3HG1      VAL 103  -6.760   6.316  -5.493
  773   1HG2  VAL 103          1HG2      VAL 103 -10.729   5.198  -6.625
  774   2HG2  VAL 103          2HG2      VAL 103  -9.754   4.198  -5.529
  775   3HG2  VAL 103          3HG2      VAL 103 -10.508   5.694  -4.938
  776    H    LEU 104           H        LEU 104  -7.925   9.833  -6.280
  777    HA   LEU 104           HA       LEU 104  -9.016  10.278  -3.575
  778   1HB   LEU 104          1HB       LEU 104  -6.384  10.871  -4.935
  779   2HB   LEU 104          2HB       LEU 104  -6.920  11.894  -3.682
  780    HG   LEU 104           HG       LEU 104  -5.548  10.420  -2.532
  781   1HD1  LEU 104          1HD1      LEU 104  -7.772  10.238  -1.406
  782   2HD1  LEU 104          2HD1      LEU 104  -8.070   8.733  -2.327
  783   3HD1  LEU 104          3HD1      LEU 104  -6.721   8.822  -1.186
  784   1HD2  LEU 104          1HD2      LEU 104  -6.586   8.193  -4.290
  785   2HD2  LEU 104          2HD2      LEU 104  -5.024   8.998  -4.346
  786   3HD2  LEU 104          3HD2      LEU 104  -5.440   7.952  -2.966
  787    H    GLN 105           H        GLN 105  -9.115  11.336  -6.807
  788    HA   GLN 105           HA       GLN 105 -10.066  14.011  -6.563
  789   1HB   GLN 105          2HB       GLN 105  -9.230  12.955  -8.641
  790   2HB   GLN 105          3HB       GLN 105 -10.556  11.803  -8.559
  791   1HG   GLN 105          2HG       GLN 105 -12.197  13.628  -8.885
  792   2HG   GLN 105          3HG       GLN 105 -10.890  14.823  -8.850
  793   1HE2  GLN 105          1HE2      GLN 105 -11.607  11.701 -10.583
  794   2HE2  GLN 105          2HE2      GLN 105 -11.121  12.338 -12.157
  Start of MODEL   10
    1   1H    ALA   1           H        ALA   1 -11.778   5.323   6.536
    2   2H    ALA   1          2HN       ALA   1 -10.244   5.897   6.553
    3   3H    ALA   1          3HN       ALA   1 -10.598   4.694   5.516
    4    HA   ALA   1           HA       ALA   1 -10.669   4.533   8.447
    5   1HB   ALA   1          1HB       ALA   1 -12.219   2.937   7.365
    6   2HB   ALA   1          2HB       ALA   1 -10.891   2.321   6.354
    7   3HB   ALA   1          3HB       ALA   1 -10.855   2.087   8.116
    8    H    THR   2           H        THR   2  -8.830   3.141   9.368
    9    HA   THR   2           HA       THR   2  -6.741   2.541   7.517
   10    HB   THR   2           HB       THR   2  -6.230   4.459   9.817
   11    HG1  THR   2           1HG      THR   2  -6.816   4.823   7.317
   12   1HG2  THR   2          1HG2      THR   2  -4.222   2.954   8.074
   13   2HG2  THR   2          2HG2      THR   2  -3.826   4.382   9.050
   14   3HG2  THR   2          3HG2      THR   2  -4.363   2.893   9.839
   15    H    MET   3           H        MET   3  -5.428   0.826   8.315
   16    HA   MET   3           HA       MET   3  -6.082  -0.325  10.928
   17   1HB   MET   3          1HB       MET   3  -7.403  -1.164   8.535
   18   2HB   MET   3          2HB       MET   3  -6.195  -2.403   8.840
   19   1HG   MET   3          1HG       MET   3  -8.237  -1.366  10.851
   20   2HG   MET   3          2HG       MET   3  -8.405  -2.842   9.901
   21   1HE   MET   3          1HE       MET   3  -8.983  -4.108  12.169
   22   2HE   MET   3          2HE       MET   3  -7.914  -4.117  13.591
   23   3HE   MET   3          3HE       MET   3  -8.717  -2.609  13.095
   24    H    THR   4           H        THR   4  -4.764  -2.636  10.871
   25    HA   THR   4           HA       THR   4  -2.118  -2.233   9.581
   26    HB   THR   4           HB       THR   4  -2.712  -3.754  12.123
   27    HG1  THR   4           1HG      THR   4  -2.685  -1.398  12.137
   28   1HG2  THR   4          1HG2      THR   4  -0.836  -4.782  10.887
   29   2HG2  THR   4          2HG2      THR   4  -0.065  -3.189  10.705
   30   3HG2  THR   4          3HG2      THR   4  -0.234  -3.924  12.312
   31    H    LEU   5           H        LEU   5  -1.438  -4.093   8.389
   32    HA   LEU   5           HA       LEU   5  -3.605  -6.083   7.890
   33   1HB   LEU   5          1HB       LEU   5  -2.158  -4.288   6.078
   34   2HB   LEU   5          2HB       LEU   5  -1.810  -5.966   5.691
   35    HG   LEU   5           HG       LEU   5  -4.083  -6.517   5.436
   36   1HD1  LEU   5          1HD1      LEU   5  -5.848  -4.585   5.399
   37   2HD1  LEU   5          2HD1      LEU   5  -5.450  -5.405   6.896
   38   3HD1  LEU   5          3HD1      LEU   5  -4.755  -3.824   6.573
   39   1HD2  LEU   5          1HD2      LEU   5  -4.641  -5.131   3.450
   40   2HD2  LEU   5          2HD2      LEU   5  -3.465  -3.911   3.975
   41   3HD2  LEU   5          3HD2      LEU   5  -2.919  -5.525   3.502
   42    H    THR   6           H        THR   6  -2.764  -8.244   7.153
   43    HA   THR   6           HA       THR   6  -0.057  -8.837   7.875
   44    HB   THR   6           HB       THR   6  -1.111  -8.770  10.067
   45    HG1  THR   6           1HG      THR   6   0.572 -10.094   9.772
   46   1HG2  THR   6          1HG2      THR   6  -3.449  -9.385   9.537
   47   2HG2  THR   6          2HG2      THR   6  -2.938 -11.072   9.278
   48   3HG2  THR   6          3HG2      THR   6  -2.748 -10.323  10.862
   49    H    ASP   7           H        ASP   7  -1.523 -11.738   8.078
   50    HA   ASP   7           HA       ASP   7  -1.788 -12.079   5.141
   51   1HB   ASP   7          1HB       ASP   7  -1.875 -14.424   5.483
   52   2HB   ASP   7          2HB       ASP   7  -0.512 -13.796   6.400
   53    H    ALA   8           H        ALA   8  -3.896 -13.122   7.848
   54    HA   ALA   8           HA       ALA   8  -6.125 -13.523   6.222
   55   1HB   ALA   8          1HB       ALA   8  -7.440 -13.430   8.321
   56   2HB   ALA   8          2HB       ALA   8  -5.912 -14.310   8.556
   57   3HB   ALA   8          3HB       ALA   8  -6.079 -12.641   9.146
   58    H    ASN   9           H        ASN   9  -5.119 -10.555   7.801
   59    HA   ASN   9           HA       ASN   9  -7.637  -9.176   7.212
   60   1HB   ASN   9          1HB       ASN   9  -6.113  -8.802   9.278
   61   2HB   ASN   9          2HB       ASN   9  -5.163  -7.787   8.174
   62   1HD2  ASN   9          1HD2      ASN   9  -5.718  -5.689   9.364
   63   2HD2  ASN   9          2HD2      ASN   9  -7.401  -5.223   9.347
   64    H    PHE  10           H        PHE  10  -4.748  -9.874   5.445
   65    HA   PHE  10           HA       PHE  10  -4.782  -7.477   3.766
   66   1HB   PHE  10          1HB       PHE  10  -2.829  -8.973   4.121
   67   2HB   PHE  10          2HB       PHE  10  -3.634 -10.225   3.210
   68    HD1  PHE  10           1HD      PHE  10  -1.433  -7.451   3.098
   69    HD2  PHE  10           2HD      PHE  10  -4.236  -9.678   0.691
   70    HE1  PHE  10           1HE      PHE  10  -0.376  -6.603   1.086
   71    HE2  PHE  10           2HE      PHE  10  -3.223  -8.725  -1.344
   72    HZ   PHE  10           HZ       PHE  10  -1.299  -7.177  -1.177
   73    H    GLN  11           H        GLN  11  -5.589 -10.876   3.039
   74    HA   GLN  11           HA       GLN  11  -7.079 -10.347   0.744
   75   1HB   GLN  11          1HB       GLN  11  -6.191 -12.519   1.470
   76   2HB   GLN  11          2HB       GLN  11  -7.428 -12.642   2.720
   77   1HG   GLN  11          1HG       GLN  11  -8.376 -12.135  -0.094
   78   2HG   GLN  11          2HG       GLN  11  -7.613 -13.688   0.211
   79   1HE2  GLN  11          1HE2      GLN  11  -8.901 -15.337   1.049
   80   2HE2  GLN  11          2HE2      GLN  11 -10.467 -15.031   1.797
   81    H    GLN  12           H        GLN  12  -8.336 -10.662   4.139
   82    HA   GLN  12           HA       GLN  12 -11.028 -10.195   3.329
   83   1HB   GLN  12          1HB       GLN  12  -9.661  -9.930   6.045
   84   2HB   GLN  12          2HB       GLN  12 -11.406  -9.813   5.796
   85   1HG   GLN  12          1HG       GLN  12 -11.458 -12.102   4.849
   86   2HG   GLN  12          2HG       GLN  12  -9.721 -12.262   5.099
   87   1HE2  GLN  12          1HE2      GLN  12 -12.888 -12.054   6.755
   88   2HE2  GLN  12          2HE2      GLN  12 -12.251 -12.623   8.294
   89    H    ALA  13           H        ALA  13  -8.421  -7.803   3.883
   90    HA   ALA  13           HA       ALA  13 -10.337  -5.627   3.853
   91   1HB   ALA  13          1HB       ALA  13  -7.327  -5.644   3.434
   92   2HB   ALA  13          2HB       ALA  13  -8.354  -4.198   3.531
   93   3HB   ALA  13          3HB       ALA  13  -8.200  -5.267   4.936
   94    H    ILE  14           H        ILE  14  -7.931  -6.989   1.513
   95    HA   ILE  14           HA       ILE  14  -8.615  -5.141  -0.506
   96    HB   ILE  14           HB       ILE  14  -7.315  -6.502  -2.044
   97   1HG1  ILE  14          1HG1      ILE  14  -6.566  -8.500   0.008
   98   2HG1  ILE  14          2HG1      ILE  14  -8.044  -8.780  -0.928
   99   1HG2  ILE  14          1HG2      ILE  14  -5.996  -6.215   0.694
  100   2HG2  ILE  14          2HG2      ILE  14  -5.149  -6.361  -0.850
  101   3HG2  ILE  14          3HG2      ILE  14  -6.158  -4.950  -0.536
  102   1HD1  ILE  14          1HD1      ILE  14  -5.282  -8.307  -2.114
  103   2HD1  ILE  14          2HD1      ILE  14  -6.074  -9.882  -1.926
  104   3HD1  ILE  14          3HD1      ILE  14  -6.759  -8.663  -3.018
  105    H    GLN  15           H        GLN  15 -10.221  -8.087   0.264
  106    HA   GLN  15           HA       GLN  15 -11.641  -8.454  -2.182
  107   1HB   GLN  15          1HB       GLN  15 -13.134  -9.883  -0.901
  108   2HB   GLN  15          2HB       GLN  15 -11.452 -10.168  -0.483
  109   1HG   GLN  15          1HG       GLN  15 -12.605 -10.300   1.532
  110   2HG   GLN  15          2HG       GLN  15 -11.773  -8.750   1.557
  111   1HE2  GLN  15          1HE2      GLN  15 -13.081  -7.645   3.010
  112   2HE2  GLN  15          2HE2      GLN  15 -14.802  -7.347   2.700
  113    H    GLY  16           H        GLY  16 -12.045  -5.868   0.178
  114   1HA   GLY  16          1HA       GLY  16 -14.891  -5.503  -0.345
  115   2HA   GLY  16          2HA       GLY  16 -13.815  -4.472   0.619
  116    H    ASP  17           H        ASP  17 -15.683  -3.364  -1.113
  117    HA   ASP  17           HA       ASP  17 -14.299  -2.581  -3.578
  118   1HB   ASP  17          1HB       ASP  17 -16.753  -3.086  -3.515
  119   2HB   ASP  17          2HB       ASP  17 -16.980  -1.590  -2.591
  120    H    GLY  18           H        GLY  18 -14.028  -1.453  -0.448
  121   1HA   GLY  18          1HA       GLY  18 -13.922   1.408  -0.903
  122   2HA   GLY  18          2HA       GLY  18 -13.138   0.519   0.419
  123    HA   PRO  19           HA       PRO  19  -9.850   1.438  -2.965
  124   1HB   PRO  19          1HB       PRO  19  -8.984   3.991  -2.085
  125   2HB   PRO  19          2HB       PRO  19  -9.888   3.624  -3.560
  126   1HG   PRO  19          1HG       PRO  19 -10.907   4.738  -1.012
  127   2HG   PRO  19          2HG       PRO  19 -11.548   4.942  -2.654
  128   1HD   PRO  19          1HD       PRO  19 -12.617   3.288  -0.670
  129   2HD   PRO  19          2HD       PRO  19 -12.914   3.096  -2.424
  130    H    VAL  20           H        VAL  20  -8.884  -0.215  -1.825
  131    HA   VAL  20           HA       VAL  20  -7.973   0.226   0.941
  132    HB   VAL  20           HB       VAL  20  -8.613  -2.118  -0.824
  133   1HG1  VAL  20          1HG1      VAL  20  -6.437  -2.783   0.194
  134   2HG1  VAL  20          2HG1      VAL  20  -6.996  -2.244   1.788
  135   3HG1  VAL  20          3HG1      VAL  20  -7.751  -3.643   1.004
  136   1HG2  VAL  20          1HG2      VAL  20  -9.367  -1.549   2.050
  137   2HG2  VAL  20          2HG2      VAL  20 -10.327  -1.019   0.658
  138   3HG2  VAL  20          3HG2      VAL  20 -10.078  -2.743   0.956
  139    H    LEU  21           H        LEU  21  -5.956   0.849   1.310
  140    HA   LEU  21           HA       LEU  21  -3.922   0.712  -0.893
  141   1HB   LEU  21          1HB       LEU  21  -4.979   2.907  -0.325
  142   2HB   LEU  21          2HB       LEU  21  -4.364   2.774   1.315
  143    HG   LEU  21           HG       LEU  21  -2.666   2.896  -1.207
  144   1HD1  LEU  21          1HD1      LEU  21  -2.206   5.212  -0.544
  145   2HD1  LEU  21          2HD1      LEU  21  -3.945   4.970  -0.759
  146   3HD1  LEU  21          3HD1      LEU  21  -3.260   5.036   0.879
  147   1HD2  LEU  21          1HD2      LEU  21  -1.221   1.893   0.386
  148   2HD2  LEU  21          2HD2      LEU  21  -0.856   3.602   0.553
  149   3HD2  LEU  21          3HD2      LEU  21  -1.898   2.809   1.738
  150    H    VAL  22           H        VAL  22  -2.279  -0.540  -0.507
  151    HA   VAL  22           HA       VAL  22  -1.816  -1.637   2.211
  152    HB   VAL  22           HB       VAL  22  -1.338  -2.611  -0.647
  153   1HG1  VAL  22          1HG1      VAL  22   0.405  -3.507   0.951
  154   2HG1  VAL  22          2HG1      VAL  22  -0.936  -4.242   1.866
  155   3HG1  VAL  22          3HG1      VAL  22  -0.622  -4.692   0.166
  156   1HG2  VAL  22          1HG2      VAL  22  -3.045  -4.348  -0.040
  157   2HG2  VAL  22          2HG2      VAL  22  -3.322  -3.500   1.491
  158   3HG2  VAL  22          3HG2      VAL  22  -3.706  -2.706  -0.047
  159    H    ASP  23           H        ASP  23  -0.085  -0.551   3.226
  160    HA   ASP  23           HA       ASP  23   2.322   0.175   1.638
  161   1HB   ASP  23          1HB       ASP  23   1.698   1.547   3.613
  162   2HB   ASP  23          2HB       ASP  23   1.856   0.187   4.625
  163    H    PHE  24           H        PHE  24   3.271  -1.657   0.809
  164    HA   PHE  24           HA       PHE  24   3.977  -3.900   2.622
  165   1HB   PHE  24          1HB       PHE  24   4.637  -3.292  -0.279
  166   2HB   PHE  24          2HB       PHE  24   5.316  -4.618   0.616
  167    HD1  PHE  24           1HD      PHE  24   2.662  -3.747  -1.562
  168    HD2  PHE  24           2HD      PHE  24   3.649  -6.220   1.832
  169    HE1  PHE  24           1HE      PHE  24   1.110  -5.484  -2.369
  170    HE2  PHE  24           2HE      PHE  24   2.122  -7.972   0.998
  171    HZ   PHE  24           HZ       PHE  24   0.963  -7.689  -1.133
  172    H    TRP  25           H        TRP  25   5.554  -3.451   4.007
  173    HA   TRP  25           HA       TRP  25   8.043  -2.287   2.959
  174   1HB   TRP  25          1HB       TRP  25   8.363  -0.830   4.810
  175   2HB   TRP  25          2HB       TRP  25   6.758  -0.480   4.203
  176    HD1  TRP  25           HD       TRP  25   4.711  -1.749   5.675
  177    HE1  TRP  25           1HE      TRP  25   4.540  -2.248   8.175
  178    HE3  TRP  25           3HE      TRP  25   9.574  -0.876   6.993
  179    HZ2  TRP  25           2HZ      TRP  25   6.321  -2.285  10.487
  180    HZ3  TRP  25           3HZ      TRP  25  10.298  -1.088   9.349
  181    HH2  TRP  25           HH       TRP  25   8.686  -1.819  11.100
  182    H    ALA  26           H        ALA  26   9.688  -2.752   5.147
  183    HA   ALA  26           HA       ALA  26   8.918  -4.957   6.742
  184   1HB   ALA  26          1HB       ALA  26  11.100  -5.427   4.652
  185   2HB   ALA  26          2HB       ALA  26  10.790  -6.483   6.052
  186   3HB   ALA  26          3HB       ALA  26   9.570  -6.315   4.794
  187    H    ALA  27           H        ALA  27  10.772  -5.438   8.285
  188    HA   ALA  27           HA       ALA  27  11.647  -2.990   9.344
  189   1HB   ALA  27          1HB       ALA  27  12.848  -4.350  10.996
  190   2HB   ALA  27          2HB       ALA  27  11.235  -5.012  10.676
  191   3HB   ALA  27          3HB       ALA  27  12.674  -5.788   9.965
  192    H    TRP  28           H        TRP  28  13.289  -4.882   6.915
  193    HA   TRP  28           HA       TRP  28  15.914  -3.773   7.671
  194   1HB   TRP  28          1HB       TRP  28  16.808  -5.628   6.948
  195   2HB   TRP  28          2HB       TRP  28  15.195  -6.286   6.959
  196    HD1  TRP  28           HD       TRP  28  18.050  -5.284   4.761
  197    HE1  TRP  28           1HE      TRP  28  17.635  -5.832   2.301
  198    HE3  TRP  28           3HE      TRP  28  13.117  -6.661   5.047
  199    HZ2  TRP  28           2HZ      TRP  28  15.402  -6.565   0.627
  200    HZ3  TRP  28           3HZ      TRP  28  11.845  -7.211   2.958
  201    HH2  TRP  28           HH       TRP  28  13.001  -7.137   0.769
  202    H    CYS  29           H        CYS  29  13.534  -3.355   5.062
  203    HA   CYS  29           HA       CYS  29  15.511  -2.755   3.088
  204   1HB   CYS  29          1HB       CYS  29  13.400  -1.972   1.784
  205   2HB   CYS  29          2HB       CYS  29  13.777  -3.656   2.077
  206    H    GLY  30           H        GLY  30  16.784  -1.030   3.655
  207   1HA   GLY  30          1HA       GLY  30  16.673   1.368   4.624
  208   2HA   GLY  30          2HA       GLY  30  17.344   1.181   3.008
  209    HA   PRO  31           HA       PRO  31  14.324   3.935   1.406
  210   1HB   PRO  31          1HB       PRO  31  13.177   2.831  -0.841
  211   2HB   PRO  31          2HB       PRO  31  14.876   3.391  -0.755
  212   1HG   PRO  31          1HG       PRO  31  13.823   0.566  -0.408
  213   2HG   PRO  31          2HG       PRO  31  15.195   1.121  -1.418
  214   1HD   PRO  31          1HD       PRO  31  15.582   0.070   1.051
  215   2HD   PRO  31          2HD       PRO  31  16.578   1.440   0.478
  216    H    CYS  32           H        CYS  32  12.931   0.701   2.074
  217    HA   CYS  32           HA       CYS  32  10.199   1.697   1.942
  218   1HB   CYS  32          1HB       CYS  32   9.474  -0.409   2.558
  219   2HB   CYS  32          2HB       CYS  32  10.935  -0.778   1.656
  220    H    ARG  33           H        ARG  33  12.706   1.316   4.401
  221    HA   ARG  33           HA       ARG  33  11.083   2.164   6.595
  222   1HB   ARG  33          1HB       ARG  33  13.417   1.003   6.512
  223   2HB   ARG  33          2HB       ARG  33  14.063   2.645   6.376
  224   1HG   ARG  33          1HG       ARG  33  12.997   3.239   8.538
  225   2HG   ARG  33          2HG       ARG  33  12.261   1.621   8.618
  226   1HD   ARG  33          1HD       ARG  33  14.531   0.606   8.628
  227   2HD   ARG  33          2HD       ARG  33  15.246   2.236   8.590
  228    HE   ARG  33           HE       ARG  33  13.422   2.065  10.750
  229   1HH1  ARG  33          2HH2      ARG  33  16.568   0.781   9.824
  230   2HH1  ARG  33          1HH2      ARG  33  17.171   0.597  11.436
  231   1HH2  ARG  33          2HH1      ARG  33  14.165   1.803  12.926
  232   2HH2  ARG  33          1HH1      ARG  33  15.746   1.189  13.245
  233    H    MET  34           H        MET  34  12.182   4.007   3.886
  234    HA   MET  34           HA       MET  34  11.751   6.551   5.306
  235   1HB   MET  34          1HB       MET  34  12.628   5.981   2.436
  236   2HB   MET  34          2HB       MET  34  12.494   7.576   3.168
  237   1HG   MET  34          1HG       MET  34  14.341   7.175   4.632
  238   2HG   MET  34          2HG       MET  34  14.345   5.445   4.287
  239   1HE   MET  34          1HE       MET  34  14.012   8.296   1.476
  240   2HE   MET  34          2HE       MET  34  15.019   9.018   2.757
  241   3HE   MET  34          3HE       MET  34  15.733   8.606   1.182
  242    H    MET  35           H        MET  35  10.398   4.490   2.747
  243    HA   MET  35           HA       MET  35   8.382   6.372   1.961
  244   1HB   MET  35          1HB       MET  35   9.364   4.485   0.555
  245   2HB   MET  35          2HB       MET  35   8.342   3.372   1.471
  246   1HG   MET  35          1HG       MET  35   6.338   4.507   0.740
  247   2HG   MET  35          2HG       MET  35   7.267   5.843   0.046
  248   1HE   MET  35          1HE       MET  35   4.884   4.331  -1.557
  249   2HE   MET  35          2HE       MET  35   5.835   5.732  -2.116
  250   3HE   MET  35          3HE       MET  35   5.669   4.292  -3.151
  251    H    ALA  36           H        ALA  36   8.464   3.581   4.216
  252    HA   ALA  36           HA       ALA  36   5.684   3.427   4.713
  253   1HB   ALA  36          1HB       ALA  36   8.011   2.761   6.569
  254   2HB   ALA  36          2HB       ALA  36   6.309   2.299   6.819
  255   3HB   ALA  36          3HB       ALA  36   7.197   1.684   5.420
  256    HA   PRO  37           HA       PRO  37   6.014   6.754   8.119
  257   1HB   PRO  37          1HB       PRO  37   8.136   8.549   8.062
  258   2HB   PRO  37          2HB       PRO  37   7.998   7.129   9.143
  259   1HG   PRO  37          1HG       PRO  37   9.503   7.382   6.560
  260   2HG   PRO  37          2HG       PRO  37  10.017   6.587   8.069
  261   1HD   PRO  37          1HD       PRO  37   9.054   5.144   5.978
  262   2HD   PRO  37          2HD       PRO  37   8.681   4.691   7.660
  263    H    VAL  38           H        VAL  38   7.443   7.470   4.809
  264    HA   VAL  38           HA       VAL  38   6.042   9.962   4.625
  265    HB   VAL  38           HB       VAL  38   7.728   8.296   2.993
  266   1HG1  VAL  38          1HG1      VAL  38   5.968   7.865   1.483
  267   2HG1  VAL  38          2HG1      VAL  38   5.493   9.567   1.427
  268   3HG1  VAL  38          3HG1      VAL  38   7.059   9.043   0.760
  269   1HG2  VAL  38          1HG2      VAL  38   8.396  10.509   2.091
  270   2HG2  VAL  38          2HG2      VAL  38   7.094  11.255   3.043
  271   3HG2  VAL  38          3HG2      VAL  38   8.412  10.408   3.859
  272    H    LEU  39           H        LEU  39   5.024   6.628   4.062
  273    HA   LEU  39           HA       LEU  39   2.438   7.264   3.021
  274   1HB   LEU  39          1HB       LEU  39   3.990   4.827   3.793
  275   2HB   LEU  39          2HB       LEU  39   2.254   4.690   3.853
  276    HG   LEU  39           HG       LEU  39   1.952   5.044   1.571
  277   1HD1  LEU  39          1HD1      LEU  39   3.373   6.974   1.080
  278   2HD1  LEU  39          2HD1      LEU  39   4.822   5.980   1.323
  279   3HD1  LEU  39          3HD1      LEU  39   3.739   5.668  -0.040
  280   1HD2  LEU  39          1HD2      LEU  39   2.812   2.844   2.030
  281   2HD2  LEU  39          2HD2      LEU  39   3.540   3.365   0.513
  282   3HD2  LEU  39          3HD2      LEU  39   4.489   3.411   2.004
  283    H    GLU  40           H        GLU  40   3.749   6.794   6.296
  284    HA   GLU  40           HA       GLU  40   1.262   6.545   7.675
  285   1HB   GLU  40          1HB       GLU  40   3.776   6.338   8.477
  286   2HB   GLU  40          2HB       GLU  40   3.662   8.076   8.736
  287   1HG   GLU  40          1HG       GLU  40   3.105   7.265  10.811
  288   2HG   GLU  40          2HG       GLU  40   1.498   7.479  10.117
  289    H    GLU  41           H        GLU  41   3.216   9.375   6.709
  290    HA   GLU  41           HA       GLU  41   1.360  11.412   7.538
  291   1HB   GLU  41          1HB       GLU  41   3.336  11.351   5.250
  292   2HB   GLU  41          2HB       GLU  41   2.529  12.818   5.804
  293   1HG   GLU  41          1HG       GLU  41   3.693  12.665   7.957
  294   2HG   GLU  41          2HG       GLU  41   4.468  11.153   7.466
  295    H    PHE  42           H        PHE  42   1.759   9.669   4.397
  296    HA   PHE  42           HA       PHE  42  -0.344  10.993   3.009
  297   1HB   PHE  42          1HB       PHE  42   1.384   9.468   1.982
  298   2HB   PHE  42          2HB       PHE  42   0.524   8.096   2.669
  299    HD1  PHE  42           1HD      PHE  42  -1.772   7.482   1.902
  300    HD2  PHE  42           2HD      PHE  42   0.557  10.557  -0.028
  301    HE1  PHE  42           1HE      PHE  42  -3.313   7.440  -0.035
  302    HE2  PHE  42           2HE      PHE  42  -0.940  10.456  -1.989
  303    HZ   PHE  42           HZ       PHE  42  -2.919   8.924  -1.977
  304    H    ALA  43           H        ALA  43  -0.404   8.159   5.188
  305    HA   ALA  43           HA       ALA  43  -3.037   7.384   4.792
  306   1HB   ALA  43          1HB       ALA  43  -2.877   6.235   6.933
  307   2HB   ALA  43          2HB       ALA  43  -1.295   6.117   6.133
  308   3HB   ALA  43          3HB       ALA  43  -1.544   7.265   7.456
  309    H    GLU  44           H        GLU  44  -1.738   9.616   7.268
  310    HA   GLU  44           HA       GLU  44  -4.182  10.446   8.398
  311   1HB   GLU  44          1HB       GLU  44  -1.946  10.884   9.317
  312   2HB   GLU  44          2HB       GLU  44  -1.630  12.076   8.061
  313   1HG   GLU  44          1HG       GLU  44  -4.184  12.470   9.590
  314   2HG   GLU  44          2HG       GLU  44  -2.723  12.560  10.553
  315    H    ALA  45           H        ALA  45  -2.326  11.925   5.719
  316    HA   ALA  45           HA       ALA  45  -4.054  14.031   5.188
  317   1HB   ALA  45          1HB       ALA  45  -1.738  13.820   4.351
  318   2HB   ALA  45          2HB       ALA  45  -2.262  12.556   3.211
  319   3HB   ALA  45          3HB       ALA  45  -2.867  14.219   3.039
  320    H    HIS  46           H        HIS  46  -4.799  10.748   4.509
  321    HA   HIS  46           HA       HIS  46  -7.128  11.596   2.862
  322   1HB   HIS  46          1HB       HIS  46  -5.362   9.318   2.271
  323   2HB   HIS  46          2HB       HIS  46  -6.862   9.667   1.424
  324    HD1  HIS  46           1HD      HIS  46  -6.843  12.236   0.150
  325    HD2  HIS  46           2HD      HIS  46  -3.204  10.396   1.244
  326    HE1  HIS  46           1HE      HIS  46  -5.020  13.316  -1.296
  327    HE2  HIS  46           2HE      HIS  46  -2.812  12.200  -0.631
  328    H    ALA  47           H        ALA  47  -6.554  10.659   5.774
  329    HA   ALA  47           HA       ALA  47  -6.888   8.115   6.267
  330   1HB   ALA  47          1HB       ALA  47  -7.984  10.365   7.992
  331   2HB   ALA  47          2HB       ALA  47  -7.575   8.729   8.554
  332   3HB   ALA  47          3HB       ALA  47  -6.304   9.786   7.932
  333    H    ASP  48           H        ASP  48  -9.755   9.925   5.303
  334    HA   ASP  48           HA       ASP  48 -11.152   7.353   5.536
  335   1HB   ASP  48          1HB       ASP  48 -11.722   8.982   7.494
  336   2HB   ASP  48          2HB       ASP  48 -12.735   9.789   6.293
  337    H    LYS  49           H        LYS  49 -10.093   9.338   3.286
  338    HA   LYS  49           HA       LYS  49 -12.493   8.896   1.582
  339   1HB   LYS  49          1HB       LYS  49 -10.988  10.927   1.251
  340   2HB   LYS  49          2HB       LYS  49  -9.800   9.810   0.540
  341   1HG   LYS  49          1HG       LYS  49 -11.577   9.027  -1.064
  342   2HG   LYS  49          2HG       LYS  49 -12.695  10.206  -0.358
  343   1HD   LYS  49          1HD       LYS  49 -11.081  12.022  -1.097
  344   2HD   LYS  49          2HD       LYS  49 -10.135  10.785  -1.897
  345   1HE   LYS  49          1HE       LYS  49 -13.054  11.500  -2.461
  346   2HE   LYS  49          2HE       LYS  49 -11.677  11.919  -3.463
  347   1HZ   LYS  49          1HZ       LYS  49 -12.875   9.260  -3.115
  348   2HZ   LYS  49          2HZ       LYS  49 -12.580  10.113  -4.510
  349   3HZ   LYS  49          3HZ       LYS  49 -11.355   9.418  -3.741
  350    H    VAL  50           H        VAL  50  -9.549   7.333   2.663
  351    HA   VAL  50           HA       VAL  50 -10.117   5.061   0.851
  352    HB   VAL  50           HB       VAL  50  -7.720   4.676   0.559
  353   1HG1  VAL  50          1HG1      VAL  50  -8.408   7.521  -0.247
  354   2HG1  VAL  50          2HG1      VAL  50  -7.209   6.447  -1.009
  355   3HG1  VAL  50          3HG1      VAL  50  -8.940   6.082  -1.118
  356   1HG2  VAL  50          1HG2      VAL  50  -7.230   7.363   1.895
  357   2HG2  VAL  50          2HG2      VAL  50  -6.954   5.795   2.658
  358   3HG2  VAL  50          3HG2      VAL  50  -6.018   6.254   1.220
  359    H    THR  51           H        THR  51  -8.784   3.068   1.655
  360    HA   THR  51           HA       THR  51  -9.076   2.785   4.545
  361    HB   THR  51           HB       THR  51  -9.591   0.889   2.318
  362    HG1  THR  51           1HG      THR  51 -11.198   2.380   2.833
  363   1HG2  THR  51          1HG2      THR  51  -8.572  -0.442   4.096
  364   2HG2  THR  51          2HG2      THR  51  -9.632   0.320   5.308
  365   3HG2  THR  51          3HG2      THR  51 -10.312  -0.744   4.056
  366    H    VAL  52           H        VAL  52  -6.952   3.447   5.008
  367    HA   VAL  52           HA       VAL  52  -4.726   2.391   3.412
  368    HB   VAL  52           HB       VAL  52  -4.265   3.802   5.973
  369   1HG1  VAL  52          1HG1      VAL  52  -3.012   4.058   3.217
  370   2HG1  VAL  52          2HG1      VAL  52  -2.415   4.817   4.692
  371   3HG1  VAL  52          3HG1      VAL  52  -2.372   3.062   4.544
  372   1HG2  VAL  52          1HG2      VAL  52  -6.103   5.206   4.892
  373   2HG2  VAL  52          2HG2      VAL  52  -4.586   6.009   5.145
  374   3HG2  VAL  52          3HG2      VAL  52  -4.979   5.426   3.519
  375    H    ALA  53           H        ALA  53  -3.110   0.802   4.166
  376    HA   ALA  53           HA       ALA  53  -3.137   0.272   6.994
  377   1HB   ALA  53          1HB       ALA  53  -3.650  -1.954   4.973
  378   2HB   ALA  53          2HB       ALA  53  -3.262  -2.196   6.695
  379   3HB   ALA  53          3HB       ALA  53  -4.788  -1.420   6.227
  380    H    LYS  54           H        LYS  54  -1.274  -1.210   7.508
  381    HA   LYS  54           HA       LYS  54   0.783  -1.244   5.431
  382   1HB   LYS  54          1HB       LYS  54   2.488  -0.342   6.960
  383   2HB   LYS  54          2HB       LYS  54   1.175   0.816   6.757
  384   1HG   LYS  54          1HG       LYS  54   0.202  -0.199   8.966
  385   2HG   LYS  54          2HG       LYS  54   1.815  -0.906   9.172
  386   1HD   LYS  54          1HD       LYS  54   2.807   1.387   9.055
  387   2HD   LYS  54          2HD       LYS  54   1.180   2.059   8.784
  388   1HE   LYS  54          1HE       LYS  54   0.493   0.914  10.974
  389   2HE   LYS  54          2HE       LYS  54   2.219   0.640  11.269
  390   1HZ   LYS  54          1HZ       LYS  54   0.998   3.334  10.837
  391   2HZ   LYS  54          2HZ       LYS  54   1.433   2.702  12.311
  392   3HZ   LYS  54          3HZ       LYS  54   2.507   3.110  11.114
  393    H    LEU  55           H        LEU  55   2.295  -2.788   5.596
  394    HA   LEU  55           HA       LEU  55   2.191  -4.651   7.885
  395   1HB   LEU  55          1HB       LEU  55   1.499  -6.576   6.829
  396   2HB   LEU  55          2HB       LEU  55   0.306  -5.386   6.396
  397    HG   LEU  55           HG       LEU  55   2.579  -6.082   4.476
  398   1HD1  LEU  55          1HD1      LEU  55   1.030  -7.743   3.497
  399   2HD1  LEU  55          2HD1      LEU  55   1.582  -8.151   5.136
  400   3HD1  LEU  55          3HD1      LEU  55  -0.055  -7.526   4.896
  401   1HD2  LEU  55          1HD2      LEU  55  -0.274  -5.090   4.026
  402   2HD2  LEU  55          2HD2      LEU  55   1.189  -4.097   3.908
  403   3HD2  LEU  55          3HD2      LEU  55   0.949  -5.421   2.776
  404    H    ASN  56           H        ASN  56   3.774  -6.414   7.798
  405    HA   ASN  56           HA       ASN  56   6.305  -5.551   6.536
  406   1HB   ASN  56          1HB       ASN  56   6.443  -6.031   8.879
  407   2HB   ASN  56          2HB       ASN  56   5.462  -7.482   8.731
  408   1HD2  ASN  56          1HD2      ASN  56   6.599  -9.357   8.881
  409   2HD2  ASN  56          2HD2      ASN  56   8.248  -9.571   8.325
  410    H    VAL  57           H        VAL  57   6.375  -6.283   4.448
  411    HA   VAL  57           HA       VAL  57   4.589  -7.964   3.268
  412    HB   VAL  57           HB       VAL  57   6.083  -6.381   2.151
  413   1HG1  VAL  57          1HG1      VAL  57   8.330  -7.030   1.379
  414   2HG1  VAL  57          2HG1      VAL  57   8.259  -6.994   3.142
  415   3HG1  VAL  57          3HG1      VAL  57   8.230  -8.546   2.275
  416   1HG2  VAL  57          1HG2      VAL  57   6.227  -7.499   0.044
  417   2HG2  VAL  57          2HG2      VAL  57   6.264  -9.098   0.808
  418   3HG2  VAL  57          3HG2      VAL  57   4.793  -8.124   0.870
  419    H    ASP  58           H        ASP  58   7.564  -9.055   4.792
  420    HA   ASP  58           HA       ASP  58   7.817 -11.691   3.859
  421   1HB   ASP  58          1HB       ASP  58   9.385 -10.342   5.251
  422   2HB   ASP  58          2HB       ASP  58   8.319 -10.574   6.615
  423    H    GLU  59           H        GLU  59   5.685 -10.353   6.422
  424    HA   GLU  59           HA       GLU  59   4.842 -12.808   7.533
  425   1HB   GLU  59          1HB       GLU  59   3.793 -11.435   8.906
  426   2HB   GLU  59          2HB       GLU  59   4.824 -10.212   8.263
  427   1HG   GLU  59          1HG       GLU  59   2.881  -9.595   6.671
  428   2HG   GLU  59          2HG       GLU  59   1.891 -10.724   7.578
  429    H    ASN  60           H        ASN  60   3.988 -11.180   4.676
  430    HA   ASN  60           HA       ASN  60   1.365 -12.602   4.379
  431   1HB   ASN  60          1HB       ASN  60   1.072 -10.244   4.648
  432   2HB   ASN  60          2HB       ASN  60   2.264  -9.872   3.393
  433   1HD2  ASN  60          1HD2      ASN  60  -1.040 -10.740   4.045
  434   2HD2  ASN  60          2HD2      ASN  60  -1.577 -11.118   2.392
  435    HA   PRO  61           HA       PRO  61   4.064 -14.111   0.964
  436   1HB   PRO  61          1HB       PRO  61   3.586 -16.794   1.185
  437   2HB   PRO  61          2HB       PRO  61   4.789 -15.929   2.190
  438   1HG   PRO  61          1HG       PRO  61   1.943 -16.680   2.930
  439   2HG   PRO  61          2HG       PRO  61   3.438 -16.913   3.892
  440   1HD   PRO  61          1HD       PRO  61   1.765 -14.769   4.286
  441   2HD   PRO  61          2HD       PRO  61   3.533 -14.628   4.474
  442    H    GLU  62           H        GLU  62   0.689 -14.782   1.884
  443    HA   GLU  62           HA       GLU  62  -0.224 -15.775  -0.633
  444   1HB   GLU  62          1HB       GLU  62  -2.377 -15.619   0.146
  445   2HB   GLU  62          2HB       GLU  62  -1.346 -16.185   1.444
  446   1HG   GLU  62          1HG       GLU  62  -2.804 -14.744   2.406
  447   2HG   GLU  62          2HG       GLU  62  -1.290 -13.838   2.357
  448    H    THR  63           H        THR  63  -1.048 -14.661  -2.391
  449    HA   THR  63           HA       THR  63  -1.473 -13.125  -3.907
  450    HB   THR  63           HB       THR  63  -2.013 -11.252  -1.574
  451    HG1  THR  63           1HG      THR  63  -3.428 -12.845  -1.335
  452   1HG2  THR  63          1HG2      THR  63  -2.836 -11.122  -4.514
  453   2HG2  THR  63          2HG2      THR  63  -3.509 -10.115  -3.220
  454   3HG2  THR  63          3HG2      THR  63  -1.799  -9.957  -3.656
  455    H    THR  64           H        THR  64   0.788 -12.160  -1.552
  456    HA   THR  64           HA       THR  64   2.405 -10.310  -3.011
  457    HB   THR  64           HB       THR  64   2.759 -12.125  -0.624
  458    HG1  THR  64           1HG      THR  64   1.786 -10.424   0.221
  459   1HG2  THR  64          1HG2      THR  64   5.064 -11.771  -1.560
  460   2HG2  THR  64          2HG2      THR  64   4.788 -10.020  -1.437
  461   3HG2  THR  64          3HG2      THR  64   4.813 -11.017   0.017
  462    H    SER  65           H        SER  65   2.902 -13.856  -2.312
  463    HA   SER  65           HA       SER  65   4.994 -14.116  -4.252
  464   1HB   SER  65          1HB       SER  65   4.664 -15.632  -2.296
  465   2HB   SER  65          2HB       SER  65   3.196 -16.270  -3.072
  466    HG   SER  65           HG       SER  65   4.735 -16.589  -4.946
  467    H    GLN  66           H        GLN  66   1.583 -13.789  -4.744
  468    HA   GLN  66           HA       GLN  66   1.563 -15.192  -7.318
  469   1HB   GLN  66          1HB       GLN  66  -0.415 -15.146  -5.909
  470   2HB   GLN  66          2HB       GLN  66  -0.454 -13.401  -5.898
  471   1HG   GLN  66          1HG       GLN  66  -0.638 -14.899  -8.524
  472   2HG   GLN  66          2HG       GLN  66  -2.051 -14.691  -7.492
  473   1HE2  GLN  66          1HE2      GLN  66  -2.459 -12.277  -6.721
  474   2HE2  GLN  66          2HE2      GLN  66  -2.215 -11.099  -8.000
  475    H    PHE  67           H        PHE  67   1.440 -11.709  -6.109
  476    HA   PHE  67           HA       PHE  67   1.604 -10.899  -8.898
  477   1HB   PHE  67          1HB       PHE  67   0.068 -10.027  -6.973
  478   2HB   PHE  67          2HB       PHE  67   1.439  -9.057  -6.511
  479    HD1  PHE  67           1HD      PHE  67   1.235  -6.827  -7.274
  480    HD2  PHE  67           2HD      PHE  67  -0.363  -9.998  -9.721
  481    HE1  PHE  67           1HE      PHE  67   0.439  -5.155  -8.924
  482    HE2  PHE  67           2HE      PHE  67  -1.168  -8.324 -11.353
  483    HZ   PHE  67           HZ       PHE  67  -0.767  -5.897 -10.960
  484    H    GLY  68           H        GLY  68   4.012 -11.979  -7.148
  485   1HA   GLY  68          1HA       GLY  68   6.271 -11.895  -7.553
  486   2HA   GLY  68          2HA       GLY  68   5.988 -10.561  -8.676
  487    H    ILE  69           H        ILE  69   4.914 -10.410  -5.316
  488    HA   ILE  69           HA       ILE  69   6.151  -7.795  -5.212
  489    HB   ILE  69           HB       ILE  69   4.172  -9.295  -3.519
  490   1HG1  ILE  69          1HG1      ILE  69   3.488  -8.535  -5.811
  491   2HG1  ILE  69          2HG1      ILE  69   2.504  -7.898  -4.507
  492   1HG2  ILE  69          1HG2      ILE  69   5.089  -6.451  -3.041
  493   2HG2  ILE  69          2HG2      ILE  69   3.551  -7.139  -2.466
  494   3HG2  ILE  69          3HG2      ILE  69   5.054  -7.812  -1.897
  495   1HD1  ILE  69          1HD1      ILE  69   3.080  -6.218  -6.295
  496   2HD1  ILE  69          2HD1      ILE  69   3.543  -5.742  -4.660
  497   3HD1  ILE  69          3HD1      ILE  69   4.773  -6.312  -5.813
  498    H    MET  70           H        MET  70   8.293  -8.621  -5.255
  499    HA   MET  70           HA       MET  70   9.314  -8.759  -2.432
  500   1HB   MET  70          1HB       MET  70  10.015 -10.383  -4.647
  501   2HB   MET  70          2HB       MET  70  11.339  -9.227  -4.504
  502   1HG   MET  70          1HG       MET  70  11.882 -11.099  -3.141
  503   2HG   MET  70          2HG       MET  70  11.453  -9.779  -2.045
  504   1HE   MET  70          1HE       MET  70  11.675 -12.709  -0.968
  505   2HE   MET  70          2HE       MET  70  11.084 -11.370   0.048
  506   3HE   MET  70          3HE       MET  70  10.175 -12.894  -0.030
  507    H    SER  71           H        SER  71   8.691  -6.587  -4.885
  508    HA   SER  71           HA       SER  71  11.222  -5.245  -5.075
  509   1HB   SER  71          1HB       SER  71   9.937  -3.946  -6.768
  510   2HB   SER  71          2HB       SER  71   9.703  -5.692  -6.964
  511    HG   SER  71           HG       SER  71   7.957  -3.819  -5.748
  512    H    ILE  72           H        ILE  72   9.912  -5.113  -2.400
  513    HA   ILE  72           HA       ILE  72   8.410  -2.781  -2.303
  514    HB   ILE  72           HB       ILE  72   7.996  -3.200  -0.064
  515   1HG1  ILE  72          1HG1      ILE  72  10.183  -3.247   0.898
  516   2HG1  ILE  72          2HG1      ILE  72   9.201  -4.584   1.466
  517   1HG2  ILE  72          1HG2      ILE  72   8.459  -5.947  -1.237
  518   2HG2  ILE  72          2HG2      ILE  72   7.337  -5.463   0.040
  519   3HG2  ILE  72          3HG2      ILE  72   7.099  -4.861  -1.602
  520   1HD1  ILE  72          1HD1      ILE  72  10.433  -6.146  -0.022
  521   2HD1  ILE  72          2HD1      ILE  72  11.429  -4.790  -0.612
  522   3HD1  ILE  72          3HD1      ILE  72  11.502  -5.268   1.086
  523    HA   PRO  73           HA       PRO  73   8.131  -1.145   0.089
  524   1HB   PRO  73          1HB       PRO  73   7.591   1.453  -0.405
  525   2HB   PRO  73          2HB       PRO  73   8.636   0.884   0.895
  526   1HG   PRO  73          1HG       PRO  73   9.444   1.912  -1.845
  527   2HG   PRO  73          2HG       PRO  73  10.192   2.321  -0.277
  528   1HD   PRO  73          1HD       PRO  73  11.240   0.448  -1.981
  529   2HD   PRO  73          2HD       PRO  73  11.362   0.264  -0.216
  530    H    THR  74           H        THR  74   6.254  -1.729  -0.826
  531    HA   THR  74           HA       THR  74   5.585  -0.667  -3.532
  532    HB   THR  74           HB       THR  74   4.789  -3.401  -2.466
  533    HG1  THR  74           1HG      THR  74   6.173  -4.172  -4.038
  534   1HG2  THR  74          1HG2      THR  74   3.102  -2.535  -3.977
  535   2HG2  THR  74          2HG2      THR  74   4.328  -1.977  -5.121
  536   3HG2  THR  74          3HG2      THR  74   4.076  -3.697  -4.891
  537    H    LEU  75           H        LEU  75   3.525   0.058  -3.805
  538    HA   LEU  75           HA       LEU  75   1.732   0.342  -1.433
  539   1HB   LEU  75          1HB       LEU  75   2.978   2.383  -1.873
  540   2HB   LEU  75          2HB       LEU  75   2.316   2.439  -3.503
  541    HG   LEU  75           HG       LEU  75   0.551   2.239  -1.022
  542   1HD1  LEU  75          1HD1      LEU  75   1.493   4.678  -2.508
  543   2HD1  LEU  75          2HD1      LEU  75   0.329   4.658  -1.147
  544   3HD1  LEU  75          3HD1      LEU  75   2.006   4.174  -0.876
  545   1HD2  LEU  75          1HD2      LEU  75  -0.867   1.803  -2.886
  546   2HD2  LEU  75          2HD2      LEU  75  -1.058   3.535  -2.640
  547   3HD2  LEU  75          3HD2      LEU  75  -0.008   2.951  -3.934
  548    H    ILE  76           H        ILE  76   0.121  -1.218  -2.177
  549    HA   ILE  76           HA       ILE  76  -0.618  -0.994  -5.073
  550    HB   ILE  76           HB       ILE  76  -1.286  -3.306  -3.247
  551   1HG1  ILE  76          1HG1      ILE  76   0.722  -3.179  -5.555
  552   2HG1  ILE  76          2HG1      ILE  76   1.083  -3.463  -3.862
  553   1HG2  ILE  76          1HG2      ILE  76  -1.819  -2.833  -6.225
  554   2HG2  ILE  76          2HG2      ILE  76  -2.218  -4.309  -5.323
  555   3HG2  ILE  76          3HG2      ILE  76  -3.037  -2.839  -4.929
  556   1HD1  ILE  76          1HD1      ILE  76  -0.372  -5.594  -4.072
  557   2HD1  ILE  76          2HD1      ILE  76  -0.279  -5.328  -5.829
  558   3HD1  ILE  76          3HD1      ILE  76   1.195  -5.583  -4.897
  559    H    LEU  77           H        LEU  77  -2.735  -0.437  -5.454
  560    HA   LEU  77           HA       LEU  77  -4.418  -0.014  -3.067
  561   1HB   LEU  77          1HB       LEU  77  -3.719   2.103  -4.208
  562   2HB   LEU  77          2HB       LEU  77  -4.688   1.614  -5.610
  563    HG   LEU  77           HG       LEU  77  -5.910   1.578  -2.856
  564   1HD1  LEU  77          1HD1      LEU  77  -5.473   4.110  -4.450
  565   2HD1  LEU  77          2HD1      LEU  77  -6.506   3.957  -3.002
  566   3HD1  LEU  77          3HD1      LEU  77  -4.768   3.701  -2.872
  567   1HD2  LEU  77          1HD2      LEU  77  -7.292   0.785  -4.742
  568   2HD2  LEU  77          2HD2      LEU  77  -7.948   2.277  -4.080
  569   3HD2  LEU  77          3HD2      LEU  77  -7.028   2.326  -5.593
  570    H    PHE  78           H        PHE  78  -6.107  -1.308  -3.038
  571    HA   PHE  78           HA       PHE  78  -6.685  -3.038  -5.386
  572   1HB   PHE  78          1HB       PHE  78  -6.629  -3.534  -2.385
  573   2HB   PHE  78          2HB       PHE  78  -7.476  -4.601  -3.467
  574    HD1  PHE  78           1HD      PHE  78  -4.168  -3.641  -2.233
  575    HD2  PHE  78           2HD      PHE  78  -6.365  -6.134  -4.976
  576    HE1  PHE  78           1HE      PHE  78  -2.262  -5.229  -2.332
  577    HE2  PHE  78           2HE      PHE  78  -4.447  -7.681  -5.122
  578    HZ   PHE  78           HZ       PHE  78  -2.387  -7.244  -3.789
  579    H    LYS  79           H        LYS  79  -8.854  -3.828  -5.534
  580    HA   LYS  79           HA       LYS  79 -10.701  -3.434  -3.421
  581   1HB   LYS  79          1HB       LYS  79 -12.498  -2.359  -4.774
  582   2HB   LYS  79          2HB       LYS  79 -11.218  -1.288  -4.219
  583   1HG   LYS  79          1HG       LYS  79 -10.358  -0.957  -6.388
  584   2HG   LYS  79          2HG       LYS  79 -11.111  -2.425  -7.034
  585   1HD   LYS  79          1HD       LYS  79 -12.264  -0.323  -7.782
  586   2HD   LYS  79          2HD       LYS  79 -13.293  -1.501  -6.952
  587   1HE   LYS  79          1HE       LYS  79 -12.743  -0.121  -4.790
  588   2HE   LYS  79          2HE       LYS  79 -12.258   1.158  -5.884
  589   1HZ   LYS  79          1HZ       LYS  79 -14.529   1.196  -6.726
  590   2HZ   LYS  79          2HZ       LYS  79 -14.878  -0.256  -5.988
  591   3HZ   LYS  79          3HZ       LYS  79 -14.666   1.015  -5.062
  592    H    GLY  80           H        GLY  80 -12.431  -4.930  -3.621
  593   1HA   GLY  80          1HA       GLY  80 -13.454  -6.877  -4.359
  594   2HA   GLY  80          2HA       GLY  80 -13.188  -6.291  -5.999
  595    H    GLY  81           H        GLY  81 -10.382  -6.831  -3.937
  596   1HA   GLY  81          1HA       GLY  81  -8.732  -8.422  -3.988
  597   2HA   GLY  81          2HA       GLY  81  -9.695  -9.431  -5.070
  598    H    GLU  82           H        GLU  82  -9.782  -6.513  -6.668
  599    HA   GLU  82           HA       GLU  82  -7.668  -7.354  -8.499
  600   1HB   GLU  82          1HB       GLU  82  -9.897  -6.702  -9.340
  601   2HB   GLU  82          2HB       GLU  82  -9.689  -5.082  -8.658
  602   1HG   GLU  82          1HG       GLU  82  -7.675  -4.750 -10.108
  603   2HG   GLU  82          2HG       GLU  82  -7.929  -6.356 -10.799
  604    HA   PRO  83           HA       PRO  83  -5.054  -3.982  -6.744
  605   1HB   PRO  83          1HB       PRO  83  -2.778  -4.491  -8.138
  606   2HB   PRO  83          2HB       PRO  83  -3.310  -5.531  -6.782
  607   1HG   PRO  83          1HG       PRO  83  -3.666  -6.050  -9.735
  608   2HG   PRO  83          2HG       PRO  83  -3.101  -7.169  -8.458
  609   1HD   PRO  83          1HD       PRO  83  -5.709  -7.044  -9.360
  610   2HD   PRO  83          2HD       PRO  83  -5.276  -7.547  -7.698
  611    H    VAL  84           H        VAL  84  -6.346  -2.229  -7.695
  612    HA   VAL  84           HA       VAL  84  -6.686  -1.927 -10.486
  613    HB   VAL  84           HB       VAL  84  -7.207   0.475  -9.785
  614   1HG1  VAL  84          1HG1      VAL  84  -8.931  -1.225 -10.256
  615   2HG1  VAL  84          2HG1      VAL  84  -8.832  -1.809  -8.589
  616   3HG1  VAL  84          3HG1      VAL  84  -9.446  -0.172  -8.929
  617   1HG2  VAL  84          1HG2      VAL  84  -7.309  -0.588  -6.968
  618   2HG2  VAL  84          2HG2      VAL  84  -6.080   0.547  -7.581
  619   3HG2  VAL  84          3HG2      VAL  84  -7.788   1.009  -7.547
  620    H    LYS  85           H        LYS  85  -4.198  -0.685  -8.282
  621    HA   LYS  85           HA       LYS  85  -2.296  -0.376 -10.415
  622   1HB   LYS  85          1HB       LYS  85  -1.878   2.112  -9.941
  623   2HB   LYS  85          2HB       LYS  85  -3.273   1.739 -10.938
  624   1HG   LYS  85          1HG       LYS  85  -4.786   2.017  -9.005
  625   2HG   LYS  85          2HG       LYS  85  -3.395   2.321  -7.942
  626   1HD   LYS  85          1HD       LYS  85  -2.840   4.326  -9.233
  627   2HD   LYS  85          2HD       LYS  85  -4.184   4.036 -10.353
  628   1HE   LYS  85          1HE       LYS  85  -4.466   4.381  -7.341
  629   2HE   LYS  85          2HE       LYS  85  -4.574   5.705  -8.525
  630   1HZ   LYS  85          1HZ       LYS  85  -6.464   4.849  -9.475
  631   2HZ   LYS  85          2HZ       LYS  85  -6.381   3.388  -8.686
  632   3HZ   LYS  85          3HZ       LYS  85  -6.743   4.810  -7.895
  633    H    GLN  86           H        GLN  86  -0.150   0.327  -9.523
  634    HA   GLN  86           HA       GLN  86  -0.026   0.558  -6.641
  635   1HB   GLN  86          1HB       GLN  86   1.470  -1.204  -6.324
  636   2HB   GLN  86          2HB       GLN  86   0.221  -1.883  -7.372
  637   1HG   GLN  86          1HG       GLN  86   3.028  -1.027  -8.186
  638   2HG   GLN  86          2HG       GLN  86   2.476  -2.663  -7.880
  639   1HE2  GLN  86          1HE2      GLN  86   2.022   0.140 -10.127
  640   2HE2  GLN  86          2HE2      GLN  86   1.518  -0.907 -11.469
  641    H    LEU  87           H        LEU  87   2.033   1.326  -5.869
  642    HA   LEU  87           HA       LEU  87   3.850   2.522  -7.906
  643   1HB   LEU  87          1HB       LEU  87   3.458   3.432  -5.012
  644   2HB   LEU  87          2HB       LEU  87   4.723   3.952  -6.081
  645    HG   LEU  87           HG       LEU  87   3.254   5.711  -6.020
  646   1HD1  LEU  87          1HD1      LEU  87   4.032   5.015  -8.320
  647   2HD1  LEU  87          2HD1      LEU  87   2.401   4.357  -8.586
  648   3HD1  LEU  87          3HD1      LEU  87   2.639   6.093  -8.242
  649   1HD2  LEU  87          1HD2      LEU  87   0.875   5.711  -6.374
  650   2HD2  LEU  87          2HD2      LEU  87   0.853   3.968  -6.676
  651   3HD2  LEU  87          3HD2      LEU  87   1.270   4.592  -5.060
  652    H    ILE  88           H        ILE  88   6.085   2.157  -7.411
  653    HA   ILE  88           HA       ILE  88   6.773   0.201  -5.350
  654    HB   ILE  88           HB       ILE  88   8.287  -0.889  -7.044
  655   1HG1  ILE  88          1HG1      ILE  88   8.001   0.728  -8.941
  656   2HG1  ILE  88          2HG1      ILE  88   7.903  -0.980  -9.320
  657   1HG2  ILE  88          1HG2      ILE  88   5.313  -1.410  -7.259
  658   2HG2  ILE  88          2HG2      ILE  88   6.598  -2.524  -7.780
  659   3HG2  ILE  88          3HG2      ILE  88   6.459  -2.065  -6.077
  660   1HD1  ILE  88          1HD1      ILE  88   5.429  -0.821  -9.529
  661   2HD1  ILE  88          2HD1      ILE  88   5.537   0.933  -9.244
  662   3HD1  ILE  88          3HD1      ILE  88   6.310   0.216 -10.654
  663    H    GLY  89           H        GLY  89   8.696   0.689  -4.449
  664   1HA   GLY  89          1HA       GLY  89  10.675   1.801  -4.018
  665   2HA   GLY  89          2HA       GLY  89  10.654   2.511  -5.642
  666    H    TYR  90           H        TYR  90  11.366   4.074  -3.507
  667    HA   TYR  90           HA       TYR  90   9.292   5.513  -2.201
  668   1HB   TYR  90          1HB       TYR  90  11.587   5.368  -1.392
  669   2HB   TYR  90          2HB       TYR  90  12.153   6.255  -2.797
  670    HD1  TYR  90           1HD      TYR  90  11.766   8.696  -3.006
  671    HD2  TYR  90           2HD      TYR  90  10.460   6.500   0.465
  672    HE1  TYR  90           1HE      TYR  90  11.441  10.818  -1.805
  673    HE2  TYR  90           2HE      TYR  90  10.124   8.632   1.692
  674    HH   TYR  90           HH       TYR  90  10.880  11.816   0.227
  675    H    GLN  91           H        GLN  91   7.685   6.235  -3.643
  676    HA   GLN  91           HA       GLN  91   8.477   8.277  -5.628
  677   1HB   GLN  91          1HB       GLN  91   5.627   7.414  -4.978
  678   2HB   GLN  91          2HB       GLN  91   6.215   8.293  -6.353
  679   1HG   GLN  91          1HG       GLN  91   6.764   5.365  -5.808
  680   2HG   GLN  91          2HG       GLN  91   5.728   6.056  -7.054
  681   1HE2  GLN  91          1HE2      GLN  91   8.361   4.288  -7.214
  682   2HE2  GLN  91          2HE2      GLN  91   9.312   5.281  -8.305
  683    HA   PRO  92           HA       PRO  92   7.727  11.237  -2.283
  684   1HB   PRO  92          1HB       PRO  92   7.738  13.589  -3.690
  685   2HB   PRO  92          2HB       PRO  92   9.230  12.651  -3.370
  686   1HG   PRO  92          1HG       PRO  92   7.507  12.618  -5.869
  687   2HG   PRO  92          2HG       PRO  92   9.288  12.800  -5.759
  688   1HD   PRO  92          1HD       PRO  92   8.107  10.392  -6.266
  689   2HD   PRO  92          2HD       PRO  92   9.582  10.506  -5.260
  690    H    LYS  93           H        LYS  93   5.951  12.782  -1.678
  691    HA   LYS  93           HA       LYS  93   3.460  11.654  -2.144
  692   1HB   LYS  93          1HB       LYS  93   4.534  14.005  -0.731
  693   2HB   LYS  93          2HB       LYS  93   2.963  14.339  -1.415
  694   1HG   LYS  93          1HG       LYS  93   2.594  13.465   0.807
  695   2HG   LYS  93          2HG       LYS  93   2.007  12.310  -0.388
  696   1HD   LYS  93          1HD       LYS  93   3.122  10.931   1.150
  697   2HD   LYS  93          2HD       LYS  93   4.320  11.123  -0.114
  698   1HE   LYS  93          1HE       LYS  93   5.675  11.624   1.639
  699   2HE   LYS  93          2HE       LYS  93   5.031  13.252   1.408
  700   1HZ   LYS  93          1HZ       LYS  93   4.908  12.459   3.750
  701   2HZ   LYS  93          2HZ       LYS  93   3.413  12.774   3.142
  702   3HZ   LYS  93          3HZ       LYS  93   3.967  11.218   3.286
  703    H    GLU  94           H        GLU  94   4.865  14.442  -3.763
  704    HA   GLU  94           HA       GLU  94   2.652  15.213  -5.320
  705   1HB   GLU  94          1HB       GLU  94   4.804  16.442  -4.926
  706   2HB   GLU  94          2HB       GLU  94   5.634  15.304  -5.992
  707   1HG   GLU  94          1HG       GLU  94   4.265  16.090  -7.903
  708   2HG   GLU  94          2HG       GLU  94   3.364  17.168  -6.822
  709    H    GLN  95           H        GLN  95   4.642  12.289  -5.737
  710    HA   GLN  95           HA       GLN  95   3.729  11.926  -8.530
  711   1HB   GLN  95          1HB       GLN  95   6.156  11.656  -7.768
  712   2HB   GLN  95          2HB       GLN  95   5.656  10.331  -6.776
  713   1HG   GLN  95          1HG       GLN  95   6.601   9.513  -8.890
  714   2HG   GLN  95          2HG       GLN  95   4.912   9.039  -8.727
  715   1HE2  GLN  95          1HE2      GLN  95   6.664  12.007  -9.996
  716   2HE2  GLN  95          2HE2      GLN  95   5.728  12.013 -11.484
  717    H    LEU  96           H        LEU  96   3.866  10.581  -5.332
  718    HA   LEU  96           HA       LEU  96   2.370   8.215  -5.429
  719   1HB   LEU  96          1HB       LEU  96   3.714   9.457  -3.526
  720   2HB   LEU  96          2HB       LEU  96   2.168  10.140  -3.150
  721    HG   LEU  96           HG       LEU  96   2.361   8.392  -1.679
  722   1HD1  LEU  96          1HD1      LEU  96   0.163   8.356  -2.943
  723   2HD1  LEU  96          2HD1      LEU  96   0.805   7.008  -3.898
  724   3HD1  LEU  96          3HD1      LEU  96   0.604   6.858  -2.136
  725   1HD2  LEU  96          1HD2      LEU  96   4.330   7.365  -2.726
  726   2HD2  LEU  96          2HD2      LEU  96   3.150   6.163  -2.199
  727   3HD2  LEU  96          3HD2      LEU  96   3.285   6.566  -3.922
  728    H    GLU  97           H        GLU  97   1.138  11.432  -4.396
  729    HA   GLU  97           HA       GLU  97  -1.594  10.597  -4.494
  730   1HB   GLU  97          1HB       GLU  97  -0.236  12.698  -3.374
  731   2HB   GLU  97          2HB       GLU  97  -0.958  13.509  -4.749
  732   1HG   GLU  97          1HG       GLU  97  -2.524  11.822  -2.760
  733   2HG   GLU  97          2HG       GLU  97  -2.210  13.531  -2.527
  734    H    ALA  98           H        ALA  98   0.621  12.081  -6.892
  735    HA   ALA  98           HA       ALA  98  -1.502  12.819  -8.714
  736   1HB   ALA  98          1HB       ALA  98   0.261  12.876 -10.469
  737   2HB   ALA  98          2HB       ALA  98   0.681  13.800  -9.023
  738   3HB   ALA  98          3HB       ALA  98   1.421  12.201  -9.308
  739    H    GLN  99           H        GLN  99   0.475   9.827  -8.462
  740    HA   GLN  99           HA       GLN  99  -0.855   8.517 -10.666
  741   1HB   GLN  99          1HB       GLN  99   1.394   8.047  -9.325
  742   2HB   GLN  99          2HB       GLN  99   0.385   7.011  -8.340
  743   1HG   GLN  99          1HG       GLN  99   0.566   6.801 -11.384
  744   2HG   GLN  99          2HG       GLN  99   1.688   5.980 -10.322
  745   1HE2  GLN  99          1HE2      GLN  99  -1.017   5.402 -12.128
  746   2HE2  GLN  99          2HE2      GLN  99  -1.631   4.045 -11.202
  747    H    LEU 100           H        LEU 100  -1.757   9.068  -7.409
  748    HA   LEU 100           HA       LEU 100  -3.778   6.917  -7.402
  749   1HB   LEU 100          1HB       LEU 100  -1.831   7.642  -5.613
  750   2HB   LEU 100          2HB       LEU 100  -3.225   8.378  -4.913
  751    HG   LEU 100           HG       LEU 100  -4.291   5.995  -5.130
  752   1HD1  LEU 100          1HD1      LEU 100  -2.722   4.135  -5.409
  753   2HD1  LEU 100          2HD1      LEU 100  -2.492   5.203  -6.809
  754   3HD1  LEU 100          3HD1      LEU 100  -1.343   5.244  -5.477
  755   1HD2  LEU 100          1HD2      LEU 100  -1.819   6.486  -3.388
  756   2HD2  LEU 100          2HD2      LEU 100  -3.510   6.802  -2.956
  757   3HD2  LEU 100          3HD2      LEU 100  -2.949   5.141  -3.154
  758    H    ALA 101           H        ALA 101  -3.654  10.250  -7.860
  759    HA   ALA 101           HA       ALA 101  -5.869  11.358  -6.733
  760   1HB   ALA 101          1HB       ALA 101  -4.096  12.635  -7.783
  761   2HB   ALA 101          2HB       ALA 101  -4.537  12.004  -9.390
  762   3HB   ALA 101          3HB       ALA 101  -5.637  13.080  -8.505
  763    H    ASP 102           H        ASP 102  -6.159   8.892  -9.147
  764    HA   ASP 102           HA       ASP 102  -8.753   9.806 -10.193
  765   1HB   ASP 102          1HB       ASP 102  -8.609   7.711 -11.467
  766   2HB   ASP 102          2HB       ASP 102  -7.066   8.563 -11.619
  767    H    VAL 103           H        VAL 103  -7.538   8.103  -7.416
  768    HA   VAL 103           HA       VAL 103 -10.376   7.328  -6.867
  769    HB   VAL 103           HB       VAL 103  -8.390   5.495  -7.044
  770   1HG1  VAL 103          1HG1      VAL 103  -8.430   6.099  -4.080
  771   2HG1  VAL 103          2HG1      VAL 103  -7.702   4.713  -4.902
  772   3HG1  VAL 103          3HG1      VAL 103  -7.057   6.334  -5.197
  773   1HG2  VAL 103          1HG2      VAL 103 -10.727   5.374  -5.114
  774   2HG2  VAL 103          2HG2      VAL 103 -10.802   5.076  -6.864
  775   3HG2  VAL 103          3HG2      VAL 103  -9.863   3.988  -5.838
  776    H    LEU 104           H        LEU 104  -7.634   9.278  -5.864
  777    HA   LEU 104           HA       LEU 104  -9.079  10.117  -3.497
  778   1HB   LEU 104          1HB       LEU 104  -6.549  10.985  -4.885
  779   2HB   LEU 104          2HB       LEU 104  -7.267  11.911  -3.643
  780    HG   LEU 104           HG       LEU 104  -5.692  10.711  -2.448
  781   1HD1  LEU 104          1HD1      LEU 104  -7.895  10.189  -1.409
  782   2HD1  LEU 104          2HD1      LEU 104  -7.919   8.660  -2.335
  783   3HD1  LEU 104          3HD1      LEU 104  -6.642   8.953  -1.136
  784   1HD2  LEU 104          1HD2      LEU 104  -4.964   9.364  -4.320
  785   2HD2  LEU 104          2HD2      LEU 104  -5.027   8.423  -2.814
  786   3HD2  LEU 104          3HD2      LEU 104  -6.282   8.201  -4.046
  787    H    GLN 105           H        GLN 105  -9.502  10.510  -6.768
  788    HA   GLN 105           HA       GLN 105 -10.944  13.055  -6.675
  789   1HB   GLN 105          2HB       GLN 105 -10.209  11.051  -8.665
  790   2HB   GLN 105          3HB       GLN 105 -11.894  11.458  -8.791
  791   1HG   GLN 105          2HG       GLN 105 -11.419  13.820  -9.043
  792   2HG   GLN 105          3HG       GLN 105  -9.722  13.583  -8.610
  793   1HE2  GLN 105          1HE2      GLN 105  -8.447  12.118 -10.039
  794   2HE2  GLN 105          2HE2      GLN 105  -8.736  12.254 -11.792
  Start of MODEL   11
    1   1H    ALA   1           H        ALA   1 -11.078   3.091   5.248
    2   2H    ALA   1          2HN       ALA   1 -11.765   4.568   5.623
    3   3H    ALA   1          3HN       ALA   1 -10.231   4.488   5.009
    4    HA   ALA   1           HA       ALA   1 -10.306   5.018   7.323
    5   1HB   ALA   1          1HB       ALA   1 -11.025   3.307   8.914
    6   2HB   ALA   1          2HB       ALA   1 -12.344   3.713   7.805
    7   3HB   ALA   1          3HB       ALA   1 -11.441   2.207   7.563
    8    H    THR   2           H        THR   2  -9.405   2.017   8.488
    9    HA   THR   2           HA       THR   2  -7.026   1.598   6.936
   10    HB   THR   2           HB       THR   2  -6.903   2.653   9.796
   11    HG1  THR   2           1HG      THR   2  -6.835   3.887   7.516
   12   1HG2  THR   2          1HG2      THR   2  -4.584   1.629   8.099
   13   2HG2  THR   2          2HG2      THR   2  -4.462   2.422   9.677
   14   3HG2  THR   2          3HG2      THR   2  -5.232   0.834   9.554
   15    H    MET   3           H        MET   3  -6.427  -0.583   7.196
   16    HA   MET   3           HA       MET   3  -7.393  -2.078   9.506
   17   1HB   MET   3          1HB       MET   3  -9.299  -2.216   7.876
   18   2HB   MET   3          2HB       MET   3  -8.209  -2.973   6.699
   19   1HG   MET   3          1HG       MET   3  -7.747  -4.795   8.326
   20   2HG   MET   3          2HG       MET   3  -8.820  -4.033   9.495
   21   1HE   MET   3          1HE       MET   3 -12.366  -4.600   7.898
   22   2HE   MET   3          2HE       MET   3 -11.442  -3.845   9.216
   23   3HE   MET   3          3HE       MET   3 -11.366  -3.173   7.567
   24    H    THR   4           H        THR   4  -5.548  -3.124  10.146
   25    HA   THR   4           HA       THR   4  -3.273  -3.354   8.552
   26    HB   THR   4           HB       THR   4  -3.875  -4.965  11.030
   27    HG1  THR   4           1HG      THR   4  -3.158  -3.088  12.141
   28   1HG2  THR   4          1HG2      THR   4  -1.480  -4.567  11.503
   29   2HG2  THR   4          2HG2      THR   4  -1.675  -5.360   9.938
   30   3HG2  THR   4          3HG2      THR   4  -1.326  -3.621  10.005
   31    H    LEU   5           H        LEU   5  -3.832  -4.416   6.599
   32    HA   LEU   5           HA       LEU   5  -4.514  -7.160   6.323
   33   1HB   LEU   5          1HB       LEU   5  -2.345  -5.714   4.801
   34   2HB   LEU   5          2HB       LEU   5  -3.210  -7.166   4.286
   35    HG   LEU   5           HG       LEU   5  -4.202  -4.314   4.464
   36   1HD1  LEU   5          1HD1      LEU   5  -4.013  -6.173   2.068
   37   2HD1  LEU   5          2HD1      LEU   5  -4.448  -4.451   2.059
   38   3HD1  LEU   5          3HD1      LEU   5  -2.809  -4.950   2.496
   39   1HD2  LEU   5          1HD2      LEU   5  -6.331  -4.944   3.560
   40   2HD2  LEU   5          2HD2      LEU   5  -5.903  -6.661   3.670
   41   3HD2  LEU   5          3HD2      LEU   5  -6.080  -5.678   5.142
   42    H    THR   6           H        THR   6  -3.074  -9.116   6.421
   43    HA   THR   6           HA       THR   6  -0.399  -8.750   7.490
   44    HB   THR   6           HB       THR   6  -2.463 -10.038   9.316
   45    HG1  THR   6           1HG      THR   6  -1.657  -7.497   8.998
   46   1HG2  THR   6          1HG2      THR   6   0.506  -9.491   9.772
   47   2HG2  THR   6          2HG2      THR   6  -0.640 -10.056  11.003
   48   3HG2  THR   6          3HG2      THR   6  -0.248 -11.094   9.625
   49    H    ASP   7           H        ASP   7  -2.932 -10.908   6.569
   50    HA   ASP   7           HA       ASP   7  -1.439 -12.098   4.627
   51   1HB   ASP   7          1HB       ASP   7  -0.217 -13.452   6.348
   52   2HB   ASP   7          2HB       ASP   7  -1.753 -14.050   6.976
   53    H    ALA   8           H        ALA   8  -3.724 -13.995   6.628
   54    HA   ALA   8           HA       ALA   8  -5.673 -14.237   4.622
   55   1HB   ALA   8          1HB       ALA   8  -7.208 -14.819   6.473
   56   2HB   ALA   8          2HB       ALA   8  -5.611 -15.568   6.709
   57   3HB   ALA   8          3HB       ALA   8  -6.069 -14.124   7.648
   58    H    ASN   9           H        ASN   9  -5.008 -11.457   6.651
   59    HA   ASN   9           HA       ASN   9  -7.638 -10.291   6.215
   60   1HB   ASN   9          1HB       ASN   9  -6.415  -9.843   8.288
   61   2HB   ASN   9          2HB       ASN   9  -5.247  -8.910   7.357
   62   1HD2  ASN   9          1HD2      ASN   9  -8.863  -9.108   8.156
   63   2HD2  ASN   9          2HD2      ASN   9  -9.030  -7.373   7.899
   64    H    PHE  10           H        PHE  10  -4.696 -10.530   4.423
   65    HA   PHE  10           HA       PHE  10  -5.043  -8.325   2.616
   66   1HB   PHE  10          1HB       PHE  10  -2.952  -9.724   3.222
   67   2HB   PHE  10          2HB       PHE  10  -3.506 -10.887   2.064
   68    HD1  PHE  10           1HD      PHE  10  -1.640  -7.909   2.619
   69    HD2  PHE  10           2HD      PHE  10  -3.731 -10.066  -0.461
   70    HE1  PHE  10           1HE      PHE  10  -0.429  -6.630   0.891
   71    HE2  PHE  10           2HE      PHE  10  -2.617  -8.700  -2.169
   72    HZ   PHE  10           HZ       PHE  10  -0.946  -6.979  -1.508
   73    H    GLN  11           H        GLN  11  -7.057 -10.900   3.187
   74    HA   GLN  11           HA       GLN  11  -8.244 -10.580   0.473
   75   1HB   GLN  11          1HB       GLN  11  -8.182 -13.094   2.208
   76   2HB   GLN  11          2HB       GLN  11  -9.161 -12.914   0.750
   77   1HG   GLN  11          1HG       GLN  11  -6.124 -12.661   0.802
   78   2HG   GLN  11          2HG       GLN  11  -6.987 -14.159   0.479
   79   1HE2  GLN  11          1HE2      GLN  11  -6.233 -10.903  -0.823
   80   2HE2  GLN  11          2HE2      GLN  11  -6.662 -11.365  -2.479
   81    H    GLN  12           H        GLN  12  -8.876 -11.498   3.903
   82    HA   GLN  12           HA       GLN  12 -11.621 -11.153   3.967
   83   1HB   GLN  12          1HB       GLN  12 -10.107 -12.053   5.777
   84   2HB   GLN  12          2HB       GLN  12  -9.605 -10.386   6.076
   85   1HG   GLN  12          1HG       GLN  12 -11.976  -9.828   6.714
   86   2HG   GLN  12          2HG       GLN  12 -12.336 -11.558   6.603
   87   1HE2  GLN  12          1HE2      GLN  12 -12.591 -12.118   8.835
   88   2HE2  GLN  12          2HE2      GLN  12 -11.353 -11.754  10.028
   89    H    ALA  13           H        ALA  13  -9.117  -8.524   4.045
   90    HA   ALA  13           HA       ALA  13 -11.062  -6.563   4.929
   91   1HB   ALA  13          1HB       ALA  13  -8.637  -6.363   5.444
   92   2HB   ALA  13          2HB       ALA  13  -8.310  -6.200   3.707
   93   3HB   ALA  13          3HB       ALA  13  -9.249  -4.955   4.554
   94    H    ILE  14           H        ILE  14  -9.429  -7.484   1.905
   95    HA   ILE  14           HA       ILE  14 -10.373  -5.269   0.421
   96    HB   ILE  14           HB       ILE  14  -9.859  -7.626  -1.200
   97   1HG1  ILE  14          1HG1      ILE  14  -8.347  -8.286   0.662
   98   2HG1  ILE  14          2HG1      ILE  14  -7.631  -8.101  -0.923
   99   1HG2  ILE  14          1HG2      ILE  14  -9.890  -5.306  -2.032
  100   2HG2  ILE  14          2HG2      ILE  14  -8.511  -4.911  -1.018
  101   3HG2  ILE  14          3HG2      ILE  14  -8.316  -6.088  -2.338
  102   1HD1  ILE  14          1HD1      ILE  14  -6.608  -6.010  -0.346
  103   2HD1  ILE  14          2HD1      ILE  14  -7.479  -5.965   1.217
  104   3HD1  ILE  14          3HD1      ILE  14  -6.227  -7.193   0.904
  105    H    GLN  15           H        GLN  15 -11.912  -8.254   1.165
  106    HA   GLN  15           HA       GLN  15 -13.246  -8.948  -1.063
  107   1HB   GLN  15          1HB       GLN  15 -14.752 -10.230   0.243
  108   2HB   GLN  15          2HB       GLN  15 -13.213 -10.182   1.101
  109   1HG   GLN  15          1HG       GLN  15 -14.180  -8.351   2.575
  110   2HG   GLN  15          2HG       GLN  15 -15.731  -8.592   1.765
  111   1HE2  GLN  15          1HE2      GLN  15 -13.733  -9.665   4.328
  112   2HE2  GLN  15          2HE2      GLN  15 -14.732 -11.072   4.765
  113    H    GLY  16           H        GLY  16 -14.369  -6.309   1.045
  114   1HA   GLY  16          1HA       GLY  16 -15.454  -4.937  -1.137
  115   2HA   GLY  16          2HA       GLY  16 -16.807  -5.555  -0.180
  116    H    ASP  17           H        ASP  17 -15.094  -2.952  -0.558
  117    HA   ASP  17           HA       ASP  17 -15.255  -1.941   2.205
  118   1HB   ASP  17          1HB       ASP  17 -13.101  -3.235   2.105
  119   2HB   ASP  17          2HB       ASP  17 -12.541  -2.200   0.819
  120    H    GLY  18           H        GLY  18 -13.205  -1.094  -0.607
  121   1HA   GLY  18          1HA       GLY  18 -14.294   1.098  -1.830
  122   2HA   GLY  18          2HA       GLY  18 -13.717   1.641  -0.228
  123    HA   PRO  19           HA       PRO  19  -9.957   1.350  -3.032
  124   1HB   PRO  19          1HB       PRO  19  -8.936   3.858  -2.504
  125   2HB   PRO  19          2HB       PRO  19 -10.100   3.495  -3.805
  126   1HG   PRO  19          1HG       PRO  19 -10.669   4.573  -1.063
  127   2HG   PRO  19          2HG       PRO  19 -11.320   5.149  -2.624
  128   1HD   PRO  19          1HD       PRO  19 -12.712   3.505  -0.951
  129   2HD   PRO  19          2HD       PRO  19 -12.836   3.339  -2.729
  130    H    VAL  20           H        VAL  20  -9.293  -0.252  -1.646
  131    HA   VAL  20           HA       VAL  20  -8.050   0.168   0.959
  132    HB   VAL  20           HB       VAL  20  -8.332  -2.086  -1.056
  133   1HG1  VAL  20          1HG1      VAL  20  -6.831  -2.188   1.618
  134   2HG1  VAL  20          2HG1      VAL  20  -7.298  -3.609   0.666
  135   3HG1  VAL  20          3HG1      VAL  20  -6.126  -2.467   0.008
  136   1HG2  VAL  20          1HG2      VAL  20  -9.684  -3.141   0.682
  137   2HG2  VAL  20          2HG2      VAL  20  -9.358  -1.804   1.794
  138   3HG2  VAL  20          3HG2      VAL  20 -10.310  -1.528   0.328
  139    H    LEU  21           H        LEU  21  -5.790   0.264   1.334
  140    HA   LEU  21           HA       LEU  21  -3.980   0.739  -0.981
  141   1HB   LEU  21          1HB       LEU  21  -5.141   2.825  -0.244
  142   2HB   LEU  21          2HB       LEU  21  -4.606   2.562   1.394
  143    HG   LEU  21           HG       LEU  21  -3.364   4.308   0.325
  144   1HD1  LEU  21          1HD1      LEU  21  -1.152   3.797   0.916
  145   2HD1  LEU  21          2HD1      LEU  21  -2.130   2.740   1.942
  146   3HD1  LEU  21          3HD1      LEU  21  -1.311   2.094   0.507
  147   1HD2  LEU  21          1HD2      LEU  21  -2.338   2.285  -1.698
  148   2HD2  LEU  21          2HD2      LEU  21  -3.613   3.486  -1.997
  149   3HD2  LEU  21          3HD2      LEU  21  -1.974   4.026  -1.599
  150    H    VAL  22           H        VAL  22  -2.057  -0.423  -0.577
  151    HA   VAL  22           HA       VAL  22  -1.542  -1.174   2.270
  152    HB   VAL  22           HB       VAL  22  -2.113  -2.997   0.540
  153   1HG1  VAL  22          1HG1      VAL  22  -0.372  -3.908  -0.816
  154   2HG1  VAL  22          2HG1      VAL  22  -0.704  -2.234  -1.288
  155   3HG1  VAL  22          3HG1      VAL  22   0.755  -2.620  -0.353
  156   1HG2  VAL  22          1HG2      VAL  22   0.526  -3.233   2.068
  157   2HG2  VAL  22          2HG2      VAL  22  -1.078  -3.374   2.809
  158   3HG2  VAL  22          3HG2      VAL  22  -0.554  -4.551   1.596
  159    H    ASP  23           H        ASP  23   0.356  -0.619   3.234
  160    HA   ASP  23           HA       ASP  23   2.646   0.299   1.517
  161   1HB   ASP  23          1HB       ASP  23   1.955   1.512   3.688
  162   2HB   ASP  23          2HB       ASP  23   2.527   0.139   4.562
  163    H    PHE  24           H        PHE  24   3.720  -1.476   0.648
  164    HA   PHE  24           HA       PHE  24   4.313  -3.834   2.353
  165   1HB   PHE  24          1HB       PHE  24   4.834  -3.259  -0.570
  166   2HB   PHE  24          2HB       PHE  24   5.606  -4.543   0.283
  167    HD1  PHE  24           1HD      PHE  24   2.777  -3.857  -1.724
  168    HD2  PHE  24           2HD      PHE  24   4.219  -6.192   1.594
  169    HE1  PHE  24           1HE      PHE  24   1.267  -5.707  -2.363
  170    HE2  PHE  24           2HE      PHE  24   2.721  -8.040   0.961
  171    HZ   PHE  24           HZ       PHE  24   1.352  -7.884  -1.056
  172    H    TRP  25           H        TRP  25   5.827  -3.446   3.707
  173    HA   TRP  25           HA       TRP  25   8.368  -2.234   2.807
  174   1HB   TRP  25          1HB       TRP  25   8.579  -0.866   4.728
  175   2HB   TRP  25          2HB       TRP  25   6.988  -0.534   4.096
  176    HD1  TRP  25           HD       TRP  25   4.954  -1.935   5.476
  177    HE1  TRP  25           1HE      TRP  25   4.742  -2.503   7.964
  178    HE3  TRP  25           3HE      TRP  25   9.757  -0.947   6.931
  179    HZ2  TRP  25           2HZ      TRP  25   6.477  -2.567  10.304
  180    HZ3  TRP  25           3HZ      TRP  25  10.443  -1.241   9.285
  181    HH2  TRP  25           HH       TRP  25   8.819  -2.074  10.976
  182    H    ALA  26           H        ALA  26   9.910  -2.755   5.068
  183    HA   ALA  26           HA       ALA  26   9.235  -5.134   6.458
  184   1HB   ALA  26          1HB       ALA  26  11.583  -5.281   4.505
  185   2HB   ALA  26          2HB       ALA  26  11.158  -6.504   5.726
  186   3HB   ALA  26          3HB       ALA  26  10.076  -6.214   4.366
  187    H    ALA  27           H        ALA  27  11.079  -5.576   8.028
  188    HA   ALA  27           HA       ALA  27  11.804  -3.160   9.255
  189   1HB   ALA  27          1HB       ALA  27  12.992  -4.579  10.865
  190   2HB   ALA  27          2HB       ALA  27  11.418  -5.277  10.444
  191   3HB   ALA  27          3HB       ALA  27  12.910  -5.954   9.742
  192    H    TRP  28           H        TRP  28  13.529  -4.662   6.662
  193    HA   TRP  28           HA       TRP  28  16.102  -3.494   7.577
  194   1HB   TRP  28          1HB       TRP  28  17.148  -5.248   6.796
  195   2HB   TRP  28          2HB       TRP  28  15.587  -6.030   6.800
  196    HD1  TRP  28           HD       TRP  28  18.276  -4.604   4.586
  197    HE1  TRP  28           1HE      TRP  28  17.867  -5.088   2.111
  198    HE3  TRP  28           3HE      TRP  28  13.639  -6.780   4.931
  199    HZ2  TRP  28           2HZ      TRP  28  15.671  -5.960   0.458
  200    HZ3  TRP  28           3HZ      TRP  28  12.380  -7.369   2.845
  201    HH2  TRP  28           HH       TRP  28  13.381  -6.862   0.634
  202    H    CYS  29           H        CYS  29  13.671  -2.968   5.075
  203    HA   CYS  29           HA       CYS  29  15.561  -2.295   3.034
  204   1HB   CYS  29          1HB       CYS  29  13.452  -1.389   1.865
  205   2HB   CYS  29          2HB       CYS  29  13.753  -3.099   2.086
  206    H    GLY  30           H        GLY  30  16.897  -0.636   3.876
  207   1HA   GLY  30          1HA       GLY  30  16.805   1.735   4.895
  208   2HA   GLY  30          2HA       GLY  30  17.535   1.588   3.300
  209    HA   PRO  31           HA       PRO  31  14.596   4.438   1.652
  210   1HB   PRO  31          1HB       PRO  31  13.416   3.356  -0.596
  211   2HB   PRO  31          2HB       PRO  31  15.115   3.915  -0.514
  212   1HG   PRO  31          1HG       PRO  31  14.060   1.090  -0.194
  213   2HG   PRO  31          2HG       PRO  31  15.440   1.652  -1.189
  214   1HD   PRO  31          1HD       PRO  31  15.805   0.565   1.263
  215   2HD   PRO  31          2HD       PRO  31  16.809   1.940   0.722
  216    H    CYS  32           H        CYS  32  13.048   1.225   2.207
  217    HA   CYS  32           HA       CYS  32  10.361   2.312   2.099
  218   1HB   CYS  32          1HB       CYS  32   9.584   0.249   2.793
  219   2HB   CYS  32          2HB       CYS  32  10.998  -0.162   1.835
  220    H    ARG  33           H        ARG  33  12.834   1.801   4.589
  221    HA   ARG  33           HA       ARG  33  11.259   2.548   6.816
  222   1HB   ARG  33          1HB       ARG  33  13.815   1.615   6.410
  223   2HB   ARG  33          2HB       ARG  33  14.173   3.287   6.799
  224   1HG   ARG  33          1HG       ARG  33  12.629   1.290   8.522
  225   2HG   ARG  33          2HG       ARG  33  14.306   1.805   8.745
  226   1HD   ARG  33          1HD       ARG  33  13.430   4.183   9.015
  227   2HD   ARG  33          2HD       ARG  33  11.797   3.477   9.079
  228    HE   ARG  33           HE       ARG  33  13.425   2.130  10.944
  229   1HH1  ARG  33          2HH2      ARG  33  11.970   5.292  10.429
  230   2HH1  ARG  33          1HH2      ARG  33  11.866   5.729  12.102
  231   1HH2  ARG  33          2HH1      ARG  33  13.308   2.656  13.208
  232   2HH2  ARG  33          1HH1      ARG  33  12.652   4.166  13.722
  233    H    MET  34           H        MET  34  12.522   4.589   4.267
  234    HA   MET  34           HA       MET  34  11.948   7.028   5.815
  235   1HB   MET  34          1HB       MET  34  13.250   6.605   3.092
  236   2HB   MET  34          2HB       MET  34  13.063   8.163   3.905
  237   1HG   MET  34          1HG       MET  34  14.466   7.334   5.782
  238   2HG   MET  34          2HG       MET  34  14.751   5.836   4.892
  239   1HE   MET  34          1HE       MET  34  16.921   7.004   1.852
  240   2HE   MET  34          2HE       MET  34  16.204   5.626   2.717
  241   3HE   MET  34          3HE       MET  34  15.161   6.786   1.857
  242    H    MET  35           H        MET  35  10.458   4.928   3.599
  243    HA   MET  35           HA       MET  35   8.778   6.973   2.321
  244   1HB   MET  35          1HB       MET  35   9.841   5.100   1.013
  245   2HB   MET  35          2HB       MET  35   8.837   3.953   1.915
  246   1HG   MET  35          1HG       MET  35   6.813   4.992   1.088
  247   2HG   MET  35          2HG       MET  35   7.728   6.287   0.306
  248   1HE   MET  35          1HE       MET  35   5.437   4.613  -1.176
  249   2HE   MET  35          2HE       MET  35   6.394   5.954  -1.865
  250   3HE   MET  35          3HE       MET  35   6.243   4.414  -2.746
  251    H    ALA  36           H        ALA  36   8.612   4.182   4.570
  252    HA   ALA  36           HA       ALA  36   5.830   4.099   4.931
  253   1HB   ALA  36          1HB       ALA  36   7.295   2.382   5.803
  254   2HB   ALA  36          2HB       ALA  36   8.039   3.518   6.950
  255   3HB   ALA  36          3HB       ALA  36   6.327   3.061   7.119
  256    HA   PRO  37           HA       PRO  37   6.011   7.584   8.232
  257   1HB   PRO  37          1HB       PRO  37   8.100   9.394   8.162
  258   2HB   PRO  37          2HB       PRO  37   8.033   7.959   9.233
  259   1HG   PRO  37          1HG       PRO  37   9.420   8.230   6.561
  260   2HG   PRO  37          2HG       PRO  37  10.073   7.545   8.083
  261   1HD   PRO  37          1HD       PRO  37   9.118   5.933   6.171
  262   2HD   PRO  37          2HD       PRO  37   8.752   5.588   7.878
  263    H    VAL  38           H        VAL  38   7.425   8.142   4.941
  264    HA   VAL  38           HA       VAL  38   6.055  10.660   4.603
  265    HB   VAL  38           HB       VAL  38   7.877   9.056   3.123
  266   1HG1  VAL  38          1HG1      VAL  38   7.086   9.408   0.781
  267   2HG1  VAL  38          2HG1      VAL  38   6.162   8.191   1.657
  268   3HG1  VAL  38          3HG1      VAL  38   5.487   9.807   1.402
  269   1HG2  VAL  38          1HG2      VAL  38   8.310  11.140   1.945
  270   2HG2  VAL  38          2HG2      VAL  38   6.789  11.827   2.552
  271   3HG2  VAL  38          3HG2      VAL  38   8.106  11.426   3.676
  272    H    LEU  39           H        LEU  39   5.209   7.275   3.963
  273    HA   LEU  39           HA       LEU  39   2.645   7.706   2.879
  274   1HB   LEU  39          1HB       LEU  39   4.252   5.424   3.856
  275   2HB   LEU  39          2HB       LEU  39   2.524   5.214   4.026
  276    HG   LEU  39           HG       LEU  39   2.122   5.541   1.690
  277   1HD1  LEU  39          1HD1      LEU  39   3.971   5.855   0.043
  278   2HD1  LEU  39          2HD1      LEU  39   3.710   7.278   1.042
  279   3HD1  LEU  39          3HD1      LEU  39   5.070   6.195   1.394
  280   1HD2  LEU  39          1HD2      LEU  39   2.778   3.307   2.310
  281   2HD2  LEU  39          2HD2      LEU  39   3.503   3.658   0.735
  282   3HD2  LEU  39          3HD2      LEU  39   4.504   3.711   2.193
  283    H    GLU  40           H        GLU  40   3.757   7.988   6.177
  284    HA   GLU  40           HA       GLU  40   1.187   7.512   7.417
  285   1HB   GLU  40          1HB       GLU  40   3.789   7.688   8.327
  286   2HB   GLU  40          2HB       GLU  40   3.216   9.278   8.770
  287   1HG   GLU  40          1HG       GLU  40   2.842   7.854  10.654
  288   2HG   GLU  40          2HG       GLU  40   1.238   8.061   9.928
  289    H    GLU  41           H        GLU  41   3.036  10.457   6.548
  290    HA   GLU  41           HA       GLU  41   0.961  12.308   7.224
  291   1HB   GLU  41          1HB       GLU  41   3.390  12.819   6.931
  292   2HB   GLU  41          2HB       GLU  41   3.219  12.577   5.190
  293   1HG   GLU  41          1HG       GLU  41   1.588  14.460   5.102
  294   2HG   GLU  41          2HG       GLU  41   1.748  14.676   6.853
  295    H    PHE  42           H        PHE  42   1.817  10.679   4.170
  296    HA   PHE  42           HA       PHE  42  -0.209  11.658   2.422
  297   1HB   PHE  42          1HB       PHE  42   1.627  10.249   1.665
  298   2HB   PHE  42          2HB       PHE  42   1.152   8.999   2.778
  299    HD1  PHE  42           1HD      PHE  42  -0.021  10.748  -0.328
  300    HD2  PHE  42           2HD      PHE  42  -0.128   7.170   2.092
  301    HE1  PHE  42           1HE      PHE  42  -1.286   9.578  -2.099
  302    HE2  PHE  42           2HE      PHE  42  -1.411   6.018   0.301
  303    HZ   PHE  42           HZ       PHE  42  -2.079   7.273  -1.740
  304    H    ALA  43           H        ALA  43  -0.320   8.702   4.560
  305    HA   ALA  43           HA       ALA  43  -2.976   8.075   4.002
  306   1HB   ALA  43          1HB       ALA  43  -1.268   7.582   6.494
  307   2HB   ALA  43          2HB       ALA  43  -2.839   6.833   6.230
  308   3HB   ALA  43          3HB       ALA  43  -1.494   6.489   5.115
  309    H    GLU  44           H        GLU  44  -1.698  10.023   6.729
  310    HA   GLU  44           HA       GLU  44  -4.144  10.507   8.014
  311   1HB   GLU  44          1HB       GLU  44  -1.901  10.955   8.948
  312   2HB   GLU  44          2HB       GLU  44  -1.712  12.338   7.857
  313   1HG   GLU  44          1HG       GLU  44  -3.627  13.470   8.918
  314   2HG   GLU  44          2HG       GLU  44  -3.953  12.044   9.911
  315    H    ALA  45           H        ALA  45  -2.589  12.365   5.365
  316    HA   ALA  45           HA       ALA  45  -4.473  14.454   5.228
  317   1HB   ALA  45          1HB       ALA  45  -2.264  14.455   4.102
  318   2HB   ALA  45          2HB       ALA  45  -2.858  13.243   2.945
  319   3HB   ALA  45          3HB       ALA  45  -3.580  14.862   2.983
  320    H    HIS  46           H        HIS  46  -5.027  11.155   4.353
  321    HA   HIS  46           HA       HIS  46  -7.757  11.857   3.557
  322   1HB   HIS  46          1HB       HIS  46  -7.568  10.183   1.625
  323   2HB   HIS  46          2HB       HIS  46  -6.910  11.790   1.376
  324    HD1  HIS  46           1HD      HIS  46  -5.395   8.442   2.613
  325    HD2  HIS  46           2HD      HIS  46  -4.617  11.813   0.208
  326    HE1  HIS  46           1HE      HIS  46  -3.082   8.075   1.435
  327    HE2  HIS  46           2HE      HIS  46  -2.733  10.287  -0.056
  328    H    ALA  47           H        ALA  47  -7.155  10.992   5.947
  329    HA   ALA  47           HA       ALA  47  -6.584   8.357   6.431
  330   1HB   ALA  47          1HB       ALA  47  -6.556  10.158   8.116
  331   2HB   ALA  47          2HB       ALA  47  -8.336  10.197   8.117
  332   3HB   ALA  47          3HB       ALA  47  -7.473   8.754   8.690
  333    H    ASP  48           H        ASP  48  -9.740   9.537   5.417
  334    HA   ASP  48           HA       ASP  48 -10.684   6.728   5.583
  335   1HB   ASP  48          1HB       ASP  48 -11.563   8.180   7.468
  336   2HB   ASP  48          2HB       ASP  48 -12.487   9.062   6.244
  337    H    LYS  49           H        LYS  49 -10.096   9.177   3.385
  338    HA   LYS  49           HA       LYS  49 -12.273   8.498   1.547
  339   1HB   LYS  49          1HB       LYS  49 -10.902  10.549   1.184
  340   2HB   LYS  49          2HB       LYS  49  -9.479   9.523   0.928
  341   1HG   LYS  49          1HG       LYS  49 -10.558   8.470  -1.025
  342   2HG   LYS  49          2HG       LYS  49 -11.989   9.481  -0.812
  343   1HD   LYS  49          1HD       LYS  49  -9.245  10.736  -1.155
  344   2HD   LYS  49          2HD       LYS  49 -10.047  10.024  -2.543
  345   1HE   LYS  49          1HE       LYS  49 -11.352  12.192  -0.853
  346   2HE   LYS  49          2HE       LYS  49 -10.329  12.489  -2.272
  347   1HZ   LYS  49          1HZ       LYS  49 -12.316  12.414  -3.288
  348   2HZ   LYS  49          2HZ       LYS  49 -11.872  10.957  -3.507
  349   3HZ   LYS  49          3HZ       LYS  49 -12.979  11.223  -2.286
  350    H    VAL  50           H        VAL  50  -9.206   7.055   2.589
  351    HA   VAL  50           HA       VAL  50  -9.708   4.739   0.785
  352    HB   VAL  50           HB       VAL  50  -7.256   4.487   0.567
  353   1HG1  VAL  50          1HG1      VAL  50  -8.201   7.240  -0.338
  354   2HG1  VAL  50          2HG1      VAL  50  -6.887   6.274  -1.043
  355   3HG1  VAL  50          3HG1      VAL  50  -8.560   5.719  -1.166
  356   1HG2  VAL  50          1HG2      VAL  50  -7.023   7.247   1.806
  357   2HG2  VAL  50          2HG2      VAL  50  -6.609   5.746   2.657
  358   3HG2  VAL  50          3HG2      VAL  50  -5.706   6.217   1.207
  359    H    THR  51           H        THR  51  -8.685   2.733   1.568
  360    HA   THR  51           HA       THR  51  -8.800   2.504   4.471
  361    HB   THR  51           HB       THR  51  -9.523   0.667   2.283
  362    HG1  THR  51           1HG      THR  51 -11.473   0.807   3.097
  363   1HG2  THR  51          1HG2      THR  51  -9.261  -0.060   5.228
  364   2HG2  THR  51          2HG2      THR  51 -10.116  -1.028   4.007
  365   3HG2  THR  51          3HG2      THR  51  -8.378  -0.800   3.870
  366    H    VAL  52           H        VAL  52  -6.710   3.079   4.972
  367    HA   VAL  52           HA       VAL  52  -4.426   2.127   3.492
  368    HB   VAL  52           HB       VAL  52  -4.472   3.340   6.212
  369   1HG1  VAL  52          1HG1      VAL  52  -2.229   2.564   5.633
  370   2HG1  VAL  52          2HG1      VAL  52  -2.312   3.429   4.080
  371   3HG1  VAL  52          3HG1      VAL  52  -2.281   4.309   5.618
  372   1HG2  VAL  52          1HG2      VAL  52  -4.197   5.561   5.038
  373   2HG2  VAL  52          2HG2      VAL  52  -4.518   4.739   3.500
  374   3HG2  VAL  52          3HG2      VAL  52  -5.769   4.849   4.769
  375    H    ALA  53           H        ALA  53  -2.682   0.697   4.280
  376    HA   ALA  53           HA       ALA  53  -3.063  -0.782   6.747
  377   1HB   ALA  53          1HB       ALA  53  -2.752  -2.930   5.584
  378   2HB   ALA  53          2HB       ALA  53  -4.234  -2.135   4.976
  379   3HB   ALA  53          3HB       ALA  53  -2.760  -2.111   4.004
  380    H    LYS  54           H        LYS  54  -0.910  -1.714   7.323
  381    HA   LYS  54           HA       LYS  54   1.273  -1.142   5.472
  382   1HB   LYS  54          1HB       LYS  54   1.440  -0.325   8.413
  383   2HB   LYS  54          2HB       LYS  54   2.680  -0.112   7.168
  384   1HG   LYS  54          1HG       LYS  54   1.045   1.458   5.972
  385   2HG   LYS  54          2HG       LYS  54  -0.006   1.309   7.377
  386   1HD   LYS  54          1HD       LYS  54   1.032   3.098   8.159
  387   2HD   LYS  54          2HD       LYS  54   2.355   2.019   8.608
  388   1HE   LYS  54          1HE       LYS  54   3.618   2.596   6.635
  389   2HE   LYS  54          2HE       LYS  54   2.200   3.292   5.848
  390   1HZ   LYS  54          1HZ       LYS  54   2.151   5.013   7.550
  391   2HZ   LYS  54          2HZ       LYS  54   3.399   4.460   8.304
  392   3HZ   LYS  54          3HZ       LYS  54   3.644   5.038   6.764
  393    H    LEU  55           H        LEU  55   2.568  -2.875   5.368
  394    HA   LEU  55           HA       LEU  55   2.600  -4.766   7.666
  395   1HB   LEU  55          1HB       LEU  55   1.999  -6.681   6.108
  396   2HB   LEU  55          2HB       LEU  55   0.719  -5.625   6.679
  397    HG   LEU  55           HG       LEU  55   0.519  -4.519   4.554
  398   1HD1  LEU  55          1HD1      LEU  55   1.679  -5.452   2.529
  399   2HD1  LEU  55          2HD1      LEU  55   2.729  -4.545   3.597
  400   3HD1  LEU  55          3HD1      LEU  55   2.799  -6.318   3.621
  401   1HD2  LEU  55          1HD2      LEU  55   0.690  -7.450   3.884
  402   2HD2  LEU  55          2HD2      LEU  55  -0.484  -6.878   5.064
  403   3HD2  LEU  55          3HD2      LEU  55  -0.512  -6.239   3.400
  404    H    ASN  56           H        ASN  56   4.203  -6.383   7.620
  405    HA   ASN  56           HA       ASN  56   6.593  -5.670   6.074
  406   1HB   ASN  56          1HB       ASN  56   7.064  -6.265   8.271
  407   2HB   ASN  56          2HB       ASN  56   5.917  -7.573   8.304
  408   1HD2  ASN  56          1HD2      ASN  56   7.261  -9.282   8.835
  409   2HD2  ASN  56          2HD2      ASN  56   8.503  -9.935   7.805
  410    H    VAL  57           H        VAL  57   7.014  -6.558   4.161
  411    HA   VAL  57           HA       VAL  57   5.041  -8.011   2.787
  412    HB   VAL  57           HB       VAL  57   6.726  -6.451   1.879
  413   1HG1  VAL  57          1HG1      VAL  57   8.652  -8.819   2.019
  414   2HG1  VAL  57          2HG1      VAL  57   8.916  -7.335   1.117
  415   3HG1  VAL  57          3HG1      VAL  57   8.802  -7.273   2.889
  416   1HG2  VAL  57          1HG2      VAL  57   6.956  -7.447  -0.262
  417   2HG2  VAL  57          2HG2      VAL  57   6.718  -9.084   0.397
  418   3HG2  VAL  57          3HG2      VAL  57   5.387  -7.916   0.413
  419    H    ASP  58           H        ASP  58   7.837  -9.189   4.560
  420    HA   ASP  58           HA       ASP  58   7.838 -11.903   3.556
  421   1HB   ASP  58          1HB       ASP  58   9.834 -11.513   4.464
  422   2HB   ASP  58          2HB       ASP  58   9.297 -10.195   5.456
  423    H    GLU  59           H        GLU  59   6.577 -10.304   6.315
  424    HA   GLU  59           HA       GLU  59   5.303 -12.369   7.778
  425   1HB   GLU  59          1HB       GLU  59   5.399 -10.435   8.965
  426   2HB   GLU  59          2HB       GLU  59   5.173  -9.434   7.566
  427   1HG   GLU  59          1HG       GLU  59   2.724  -9.825   7.622
  428   2HG   GLU  59          2HG       GLU  59   2.950 -10.735   9.127
  429    H    ASN  60           H        ASN  60   4.138 -10.592   4.977
  430    HA   ASN  60           HA       ASN  60   1.541 -12.077   5.083
  431   1HB   ASN  60          1HB       ASN  60   1.528  -9.581   5.310
  432   2HB   ASN  60          2HB       ASN  60   2.207  -9.442   3.699
  433   1HD2  ASN  60          1HD2      ASN  60   0.740 -11.035   2.055
  434   2HD2  ASN  60          2HD2      ASN  60  -0.952 -10.651   2.123
  435    HA   PRO  61           HA       PRO  61   3.645 -13.750   1.319
  436   1HB   PRO  61          1HB       PRO  61   2.893 -16.392   1.592
  437   2HB   PRO  61          2HB       PRO  61   4.350 -15.660   2.327
  438   1HG   PRO  61          1HG       PRO  61   1.660 -16.159   3.612
  439   2HG   PRO  61          2HG       PRO  61   3.288 -16.487   4.281
  440   1HD   PRO  61          1HD       PRO  61   1.887 -14.243   4.954
  441   2HD   PRO  61          2HD       PRO  61   3.652 -14.196   4.768
  442    H    GLU  62           H        GLU  62   0.238 -14.220   2.478
  443    HA   GLU  62           HA       GLU  62  -0.990 -15.084   0.188
  444   1HB   GLU  62          1HB       GLU  62  -2.175 -14.871   2.233
  445   2HB   GLU  62          2HB       GLU  62  -1.903 -13.125   2.311
  446   1HG   GLU  62          1HG       GLU  62  -4.228 -13.763   1.715
  447   2HG   GLU  62          2HG       GLU  62  -3.459 -12.726   0.518
  448    H    THR  63           H        THR  63  -1.045 -14.407  -1.775
  449    HA   THR  63           HA       THR  63  -1.099 -13.334  -3.677
  450    HB   THR  63           HB       THR  63  -2.450 -11.302  -1.918
  451    HG1  THR  63           1HG      THR  63  -3.449 -13.439  -2.274
  452   1HG2  THR  63          1HG2      THR  63  -2.387 -11.357  -4.958
  453   2HG2  THR  63          2HG2      THR  63  -3.453 -10.350  -3.958
  454   3HG2  THR  63          3HG2      THR  63  -1.704 -10.066  -3.933
  455    H    THR  64           H        THR  64   0.723 -11.813  -1.246
  456    HA   THR  64           HA       THR  64   2.534 -10.184  -2.713
  457    HB   THR  64           HB       THR  64   3.059 -12.169  -0.466
  458    HG1  THR  64           1HG      THR  64   2.448 -10.701   0.863
  459   1HG2  THR  64          1HG2      THR  64   4.922 -10.865   0.225
  460   2HG2  THR  64          2HG2      THR  64   5.182 -11.254  -1.481
  461   3HG2  THR  64          3HG2      THR  64   4.613  -9.635  -1.004
  462    H    SER  65           H        SER  65   2.581 -13.717  -2.014
  463    HA   SER  65           HA       SER  65   4.707 -14.321  -3.842
  464   1HB   SER  65          1HB       SER  65   4.092 -15.682  -1.841
  465   2HB   SER  65          2HB       SER  65   2.579 -16.148  -2.653
  466    HG   SER  65           HG       SER  65   4.085 -16.787  -4.436
  467    H    GLN  66           H        GLN  66   1.579 -13.295  -4.670
  468    HA   GLN  66           HA       GLN  66   1.405 -15.071  -7.041
  469   1HB   GLN  66          1HB       GLN  66  -0.551 -14.683  -5.376
  470   2HB   GLN  66          2HB       GLN  66  -0.673 -13.073  -6.090
  471   1HG   GLN  66          1HG       GLN  66  -2.256 -14.449  -7.217
  472   2HG   GLN  66          2HG       GLN  66  -0.938 -14.188  -8.358
  473   1HE2  GLN  66          1HE2      GLN  66  -2.193 -16.572  -5.909
  474   2HE2  GLN  66          2HE2      GLN  66  -1.514 -17.955  -6.759
  475    H    PHE  67           H        PHE  67   1.660 -11.580  -6.018
  476    HA   PHE  67           HA       PHE  67   1.953 -10.832  -8.874
  477   1HB   PHE  67          1HB       PHE  67   1.537  -9.284  -6.316
  478   2HB   PHE  67          2HB       PHE  67   2.073  -8.495  -7.795
  479    HD1  PHE  67           1HD      PHE  67  -0.729 -10.212  -6.144
  480    HD2  PHE  67           2HD      PHE  67   0.612  -8.294  -9.755
  481    HE1  PHE  67           1HE      PHE  67  -3.086 -10.064  -6.939
  482    HE2  PHE  67           2HE      PHE  67  -1.734  -8.152 -10.553
  483    HZ   PHE  67           HZ       PHE  67  -3.587  -9.037  -9.146
  484    H    GLY  68           H        GLY  68   4.005 -12.264  -6.827
  485   1HA   GLY  68          1HA       GLY  68   6.293 -12.505  -6.876
  486   2HA   GLY  68          2HA       GLY  68   6.316 -11.440  -8.292
  487    H    ILE  69           H        ILE  69   5.051 -10.631  -5.068
  488    HA   ILE  69           HA       ILE  69   6.425  -8.079  -5.151
  489    HB   ILE  69           HB       ILE  69   4.528  -9.348  -3.177
  490   1HG1  ILE  69          1HG1      ILE  69   3.542  -9.019  -5.412
  491   2HG1  ILE  69          2HG1      ILE  69   2.745  -8.104  -4.153
  492   1HG2  ILE  69          1HG2      ILE  69   5.442  -6.451  -3.306
  493   2HG2  ILE  69          2HG2      ILE  69   4.009  -7.032  -2.422
  494   3HG2  ILE  69          3HG2      ILE  69   5.593  -7.591  -1.962
  495   1HD1  ILE  69          1HD1      ILE  69   2.999  -6.815  -6.249
  496   2HD1  ILE  69          2HD1      ILE  69   3.805  -6.032  -4.889
  497   3HD1  ILE  69          3HD1      ILE  69   4.767  -6.910  -6.102
  498    H    MET  70           H        MET  70   8.505  -9.319  -5.216
  499    HA   MET  70           HA       MET  70   9.684  -9.448  -2.469
  500   1HB   MET  70          1HB       MET  70  10.302 -11.135  -4.225
  501   2HB   MET  70          2HB       MET  70  11.041  -9.835  -5.170
  502   1HG   MET  70          1HG       MET  70  12.613  -9.377  -3.336
  503   2HG   MET  70          2HG       MET  70  11.829 -10.588  -2.321
  504   1HE   MET  70          1HE       MET  70  11.399 -13.149  -4.130
  505   2HE   MET  70          2HE       MET  70  12.947 -13.968  -3.850
  506   3HE   MET  70          3HE       MET  70  12.132 -13.136  -2.507
  507    H    SER  71           H        SER  71   9.085  -7.287  -5.083
  508    HA   SER  71           HA       SER  71  11.040  -5.225  -4.564
  509   1HB   SER  71          1HB       SER  71   9.801  -5.186  -6.639
  510   2HB   SER  71          2HB       SER  71   8.246  -5.283  -5.794
  511    HG   SER  71           HG       SER  71   8.419  -3.206  -5.147
  512    H    ILE  72           H        ILE  72  11.120  -3.865  -2.732
  513    HA   ILE  72           HA       ILE  72   8.736  -2.779  -1.815
  514    HB   ILE  72           HB       ILE  72   9.499  -2.893   0.553
  515   1HG1  ILE  72          1HG1      ILE  72  11.336  -5.100  -0.444
  516   2HG1  ILE  72          2HG1      ILE  72  11.770  -3.586   0.360
  517   1HG2  ILE  72          1HG2      ILE  72   8.232  -4.837   1.035
  518   2HG2  ILE  72          2HG2      ILE  72   7.617  -4.232  -0.501
  519   3HG2  ILE  72          3HG2      ILE  72   8.714  -5.623  -0.488
  520   1HD1  ILE  72          1HD1      ILE  72  10.156  -4.569   2.270
  521   2HD1  ILE  72          2HD1      ILE  72  10.636  -6.099   1.497
  522   3HD1  ILE  72          3HD1      ILE  72  11.863  -5.000   2.134
  523    HA   PRO  73           HA       PRO  73   8.585  -0.966  -0.014
  524   1HB   PRO  73          1HB       PRO  73   8.084   1.635  -0.574
  525   2HB   PRO  73          2HB       PRO  73   9.105   1.105   0.768
  526   1HG   PRO  73          1HG       PRO  73   9.974   2.074  -1.966
  527   2HG   PRO  73          2HG       PRO  73  10.687   2.487  -0.377
  528   1HD   PRO  73          1HD       PRO  73  11.763   0.582  -2.035
  529   2HD   PRO  73          2HD       PRO  73  11.822   0.419  -0.256
  530    H    THR  74           H        THR  74   6.773  -1.540  -0.940
  531    HA   THR  74           HA       THR  74   6.079  -0.614  -3.689
  532    HB   THR  74           HB       THR  74   5.680  -3.389  -2.499
  533    HG1  THR  74           1HG      THR  74   7.381  -3.870  -3.493
  534   1HG2  THR  74          1HG2      THR  74   4.820  -4.005  -4.748
  535   2HG2  THR  74          2HG2      THR  74   3.736  -2.901  -3.893
  536   3HG2  THR  74          3HG2      THR  74   4.786  -2.290  -5.190
  537    H    LEU  75           H        LEU  75   3.871  -0.171  -4.010
  538    HA   LEU  75           HA       LEU  75   2.059  -0.034  -1.672
  539   1HB   LEU  75          1HB       LEU  75   3.210   2.077  -1.895
  540   2HB   LEU  75          2HB       LEU  75   2.808   2.187  -3.575
  541    HG   LEU  75           HG       LEU  75   0.445   1.675  -1.791
  542   1HD1  LEU  75          1HD1      LEU  75   0.291   4.089  -1.130
  543   2HD1  LEU  75          2HD1      LEU  75   1.538   3.157  -0.298
  544   3HD1  LEU  75          3HD1      LEU  75   1.991   4.275  -1.606
  545   1HD2  LEU  75          1HD2      LEU  75   0.955   3.709  -3.974
  546   2HD2  LEU  75          2HD2      LEU  75   0.312   2.072  -4.239
  547   3HD2  LEU  75          3HD2      LEU  75  -0.616   3.225  -3.286
  548    H    ILE  76           H        ILE  76   0.024  -0.753  -2.295
  549    HA   ILE  76           HA       ILE  76  -0.612  -0.793  -5.174
  550    HB   ILE  76           HB       ILE  76  -1.201  -3.079  -3.260
  551   1HG1  ILE  76          1HG1      ILE  76   0.934  -2.830  -5.429
  552   2HG1  ILE  76          2HG1      ILE  76   1.165  -3.191  -3.717
  553   1HG2  ILE  76          1HG2      ILE  76  -2.899  -2.769  -5.060
  554   2HG2  ILE  76          2HG2      ILE  76  -1.612  -2.785  -6.291
  555   3HG2  ILE  76          3HG2      ILE  76  -2.001  -4.233  -5.357
  556   1HD1  ILE  76          1HD1      ILE  76   0.094  -5.030  -5.871
  557   2HD1  ILE  76          2HD1      ILE  76   1.527  -5.217  -4.858
  558   3HD1  ILE  76          3HD1      ILE  76  -0.087  -5.382  -4.136
  559    H    LEU  77           H        LEU  77  -2.753  -0.341  -5.525
  560    HA   LEU  77           HA       LEU  77  -4.417   0.301  -3.148
  561   1HB   LEU  77          1HB       LEU  77  -3.672   2.240  -4.635
  562   2HB   LEU  77          2HB       LEU  77  -4.732   1.591  -5.889
  563    HG   LEU  77           HG       LEU  77  -5.683   2.266  -3.082
  564   1HD1  LEU  77          1HD1      LEU  77  -6.411   4.462  -3.916
  565   2HD1  LEU  77          2HD1      LEU  77  -4.669   4.275  -3.920
  566   3HD1  LEU  77          3HD1      LEU  77  -5.556   4.143  -5.451
  567   1HD2  LEU  77          1HD2      LEU  77  -7.134   2.109  -5.762
  568   2HD2  LEU  77          2HD2      LEU  77  -7.345   0.998  -4.384
  569   3HD2  LEU  77          3HD2      LEU  77  -7.870   2.661  -4.257
  570    H    PHE  78           H        PHE  78  -6.408  -0.788  -3.142
  571    HA   PHE  78           HA       PHE  78  -7.076  -2.609  -5.386
  572   1HB   PHE  78          1HB       PHE  78  -7.090  -3.374  -2.436
  573   2HB   PHE  78          2HB       PHE  78  -7.623  -4.376  -3.760
  574    HD1  PHE  78           1HD      PHE  78  -6.106  -5.720  -5.045
  575    HD2  PHE  78           2HD      PHE  78  -4.681  -3.080  -1.945
  576    HE1  PHE  78           1HE      PHE  78  -3.969  -6.961  -4.975
  577    HE2  PHE  78           2HE      PHE  78  -2.580  -4.382  -1.820
  578    HZ   PHE  78           HZ       PHE  78  -2.210  -6.310  -3.355
  579    H    LYS  79           H        LYS  79  -9.301  -3.494  -5.123
  580    HA   LYS  79           HA       LYS  79 -10.917  -2.650  -2.931
  581   1HB   LYS  79          1HB       LYS  79 -12.490  -1.331  -3.815
  582   2HB   LYS  79          2HB       LYS  79 -11.199  -0.806  -4.851
  583   1HG   LYS  79          1HG       LYS  79 -13.586  -2.569  -5.479
  584   2HG   LYS  79          2HG       LYS  79 -13.191  -0.984  -6.111
  585   1HD   LYS  79          1HD       LYS  79 -12.156  -3.668  -6.957
  586   2HD   LYS  79          2HD       LYS  79 -12.835  -2.388  -7.924
  587   1HE   LYS  79          1HE       LYS  79 -10.834  -1.107  -7.898
  588   2HE   LYS  79          2HE       LYS  79 -10.197  -1.958  -6.506
  589   1HZ   LYS  79          1HZ       LYS  79 -10.643  -3.466  -9.017
  590   2HZ   LYS  79          2HZ       LYS  79  -9.212  -2.680  -8.722
  591   3HZ   LYS  79          3HZ       LYS  79  -9.727  -3.818  -7.698
  592    H    GLY  80           H        GLY  80 -12.778  -4.222  -2.793
  593   1HA   GLY  80          1HA       GLY  80 -13.697  -6.285  -3.034
  594   2HA   GLY  80          2HA       GLY  80 -13.824  -5.805  -4.705
  595    H    GLY  81           H        GLY  81 -10.841  -6.629  -2.907
  596   1HA   GLY  81          1HA       GLY  81  -9.309  -8.372  -3.112
  597   2HA   GLY  81          2HA       GLY  81 -10.527  -9.294  -3.962
  598    H    GLU  82           H        GLU  82  -9.698  -6.177  -5.341
  599    HA   GLU  82           HA       GLU  82  -8.028  -7.475  -7.447
  600   1HB   GLU  82          1HB       GLU  82 -10.428  -7.506  -8.059
  601   2HB   GLU  82          2HB       GLU  82 -10.540  -5.778  -7.731
  602   1HG   GLU  82          1HG       GLU  82  -8.749  -5.483  -9.590
  603   2HG   GLU  82          2HG       GLU  82  -9.075  -7.166 -10.003
  604    HA   PRO  83           HA       PRO  83  -5.788  -3.656  -6.647
  605   1HB   PRO  83          1HB       PRO  83  -3.987  -3.607  -8.704
  606   2HB   PRO  83          2HB       PRO  83  -3.908  -4.760  -7.339
  607   1HG   PRO  83          1HG       PRO  83  -5.127  -5.214 -10.083
  608   2HG   PRO  83          2HG       PRO  83  -3.953  -6.254  -9.208
  609   1HD   PRO  83          1HD       PRO  83  -6.626  -6.755  -9.153
  610   2HD   PRO  83          2HD       PRO  83  -5.614  -7.006  -7.697
  611    H    VAL  84           H        VAL  84  -5.322  -1.537  -7.588
  612    HA   VAL  84           HA       VAL  84  -6.806  -0.794 -10.066
  613    HB   VAL  84           HB       VAL  84  -6.582   1.330  -8.072
  614   1HG1  VAL  84          1HG1      VAL  84  -7.767   1.555 -10.251
  615   2HG1  VAL  84          2HG1      VAL  84  -8.909   0.289  -9.747
  616   3HG1  VAL  84          3HG1      VAL  84  -8.852   1.843  -8.884
  617   1HG2  VAL  84          1HG2      VAL  84  -7.262  -0.302  -6.443
  618   2HG2  VAL  84          2HG2      VAL  84  -8.701   0.622  -6.868
  619   3HG2  VAL  84          3HG2      VAL  84  -8.444  -0.997  -7.548
  620    H    LYS  85           H        LYS  85  -3.835  -0.812  -8.467
  621    HA   LYS  85           HA       LYS  85  -2.248  -0.704 -10.523
  622   1HB   LYS  85          1HB       LYS  85  -1.165   1.420 -10.759
  623   2HB   LYS  85          2HB       LYS  85  -2.846   1.582 -11.178
  624   1HG   LYS  85          1HG       LYS  85  -3.175   2.467  -8.722
  625   2HG   LYS  85          2HG       LYS  85  -1.410   2.510  -8.658
  626   1HD   LYS  85          1HD       LYS  85  -1.615   4.594  -9.484
  627   2HD   LYS  85          2HD       LYS  85  -1.838   3.835 -11.043
  628   1HE   LYS  85          1HE       LYS  85  -4.083   4.603  -9.105
  629   2HE   LYS  85          2HE       LYS  85  -3.548   5.583 -10.457
  630   1HZ   LYS  85          1HZ       LYS  85  -5.479   4.402 -11.029
  631   2HZ   LYS  85          2HZ       LYS  85  -4.257   3.845 -11.950
  632   3HZ   LYS  85          3HZ       LYS  85  -4.810   2.906 -10.700
  633    H    GLN  86           H        GLN  86   0.056  -0.080  -9.902
  634    HA   GLN  86           HA       GLN  86   0.607  -0.561  -7.050
  635   1HB   GLN  86          1HB       GLN  86   0.753  -2.724  -8.032
  636   2HB   GLN  86          2HB       GLN  86   1.628  -2.130  -9.448
  637   1HG   GLN  86          1HG       GLN  86   3.625  -1.714  -8.184
  638   2HG   GLN  86          2HG       GLN  86   2.814  -2.002  -6.645
  639   1HE2  GLN  86          1HE2      GLN  86   5.237  -3.394  -7.642
  640   2HE2  GLN  86          2HE2      GLN  86   4.743  -5.079  -7.781
  641    H    LEU  87           H        LEU  87   2.406   0.489  -6.341
  642    HA   LEU  87           HA       LEU  87   3.986   2.224  -8.119
  643   1HB   LEU  87          1HB       LEU  87   2.500   2.654  -5.531
  644   2HB   LEU  87          2HB       LEU  87   4.091   3.390  -5.645
  645    HG   LEU  87           HG       LEU  87   2.408   4.987  -6.150
  646   1HD1  LEU  87          1HD1      LEU  87   3.301   5.852  -8.149
  647   2HD1  LEU  87          2HD1      LEU  87   4.597   4.856  -7.463
  648   3HD1  LEU  87          3HD1      LEU  87   3.631   4.241  -8.821
  649   1HD2  LEU  87          1HD2      LEU  87   0.631   3.370  -6.897
  650   2HD2  LEU  87          2HD2      LEU  87   0.785   4.822  -7.911
  651   3HD2  LEU  87          3HD2      LEU  87   1.442   3.281  -8.473
  652    H    ILE  88           H        ILE  88   6.208   2.242  -7.544
  653    HA   ILE  88           HA       ILE  88   7.157   0.376  -5.500
  654    HB   ILE  88           HB       ILE  88   8.717  -0.548  -7.297
  655   1HG1  ILE  88          1HG1      ILE  88   7.920   1.039  -9.164
  656   2HG1  ILE  88          2HG1      ILE  88   8.239  -0.650  -9.527
  657   1HG2  ILE  88          1HG2      ILE  88   5.819  -1.428  -7.319
  658   2HG2  ILE  88          2HG2      ILE  88   7.235  -2.405  -7.811
  659   3HG2  ILE  88          3HG2      ILE  88   7.052  -1.858  -6.137
  660   1HD1  ILE  88          1HD1      ILE  88   5.442   0.506  -9.216
  661   2HD1  ILE  88          2HD1      ILE  88   6.289   0.196 -10.732
  662   3HD1  ILE  88          3HD1      ILE  88   5.866  -1.156  -9.680
  663    H    GLY  89           H        GLY  89   8.946   1.156  -4.574
  664   1HA   GLY  89          1HA       GLY  89  11.005   2.299  -4.456
  665   2HA   GLY  89          2HA       GLY  89  10.648   3.150  -5.969
  666    H    TYR  90           H        TYR  90  11.632   4.557  -3.865
  667    HA   TYR  90           HA       TYR  90   9.611   5.626  -2.122
  668   1HB   TYR  90          1HB       TYR  90  11.923   5.202  -1.436
  669   2HB   TYR  90          2HB       TYR  90  12.475   6.434  -2.560
  670    HD1  TYR  90           1HD      TYR  90  13.670   7.254  -0.491
  671    HD2  TYR  90           2HD      TYR  90   9.359   7.396  -0.849
  672    HE1  TYR  90           1HE      TYR  90  13.550   8.876   1.383
  673    HE2  TYR  90           2HE      TYR  90   9.258   8.969   1.012
  674    HH   TYR  90           HH       TYR  90  10.833   9.280   3.153
  675    H    GLN  91           H        GLN  91   8.246   6.216  -4.088
  676    HA   GLN  91           HA       GLN  91   8.928   8.744  -5.350
  677   1HB   GLN  91          1HB       GLN  91   6.058   7.844  -5.243
  678   2HB   GLN  91          2HB       GLN  91   6.940   8.663  -6.490
  679   1HG   GLN  91          1HG       GLN  91   7.276   5.710  -5.826
  680   2HG   GLN  91          2HG       GLN  91   6.308   6.380  -7.121
  681   1HE2  GLN  91          1HE2      GLN  91   7.322   7.522  -8.866
  682   2HE2  GLN  91          2HE2      GLN  91   9.018   7.151  -9.272
  683    HA   PRO  92           HA       PRO  92   7.477  11.167  -1.762
  684   1HB   PRO  92          1HB       PRO  92   7.483  13.686  -2.864
  685   2HB   PRO  92          2HB       PRO  92   8.977  12.818  -2.401
  686   1HG   PRO  92          1HG       PRO  92   7.691  12.974  -5.145
  687   2HG   PRO  92          2HG       PRO  92   9.405  13.279  -4.710
  688   1HD   PRO  92          1HD       PRO  92   8.600  10.870  -5.675
  689   2HD   PRO  92          2HD       PRO  92   9.826  10.968  -4.382
  690    H    LYS  93           H        LYS  93   5.588  12.852  -1.397
  691    HA   LYS  93           HA       LYS  93   3.215  11.465  -2.043
  692   1HB   LYS  93          1HB       LYS  93   3.956  14.071  -0.690
  693   2HB   LYS  93          2HB       LYS  93   2.344  13.945  -1.340
  694   1HG   LYS  93          1HG       LYS  93   2.015  13.181   0.819
  695   2HG   LYS  93          2HG       LYS  93   2.125  11.703  -0.121
  696   1HD   LYS  93          1HD       LYS  93   3.634  11.043   1.404
  697   2HD   LYS  93          2HD       LYS  93   4.793  12.075   0.589
  698   1HE   LYS  93          1HE       LYS  93   2.993  12.876   2.924
  699   2HE   LYS  93          2HE       LYS  93   4.685  12.425   3.077
  700   1HZ   LYS  93          1HZ       LYS  93   5.284  14.381   1.819
  701   2HZ   LYS  93          2HZ       LYS  93   3.691  14.756   1.553
  702   3HZ   LYS  93          3HZ       LYS  93   4.292  14.803   3.073
  703    H    GLU  94           H        GLU  94   4.575  14.494  -3.304
  704    HA   GLU  94           HA       GLU  94   2.422  15.113  -4.985
  705   1HB   GLU  94          1HB       GLU  94   5.342  15.898  -5.412
  706   2HB   GLU  94          2HB       GLU  94   3.901  16.759  -5.960
  707   1HG   GLU  94          1HG       GLU  94   4.273  18.000  -4.109
  708   2HG   GLU  94          2HG       GLU  94   3.340  16.754  -3.316
  709    H    GLN  95           H        GLN  95   4.646  12.577  -5.421
  710    HA   GLN  95           HA       GLN  95   4.190  12.387  -8.355
  711   1HB   GLN  95          1HB       GLN  95   6.530  12.157  -7.147
  712   2HB   GLN  95          2HB       GLN  95   5.959  10.612  -6.599
  713   1HG   GLN  95          1HG       GLN  95   6.448  11.512  -9.454
  714   2HG   GLN  95          2HG       GLN  95   7.383  10.357  -8.506
  715   1HE2  GLN  95          1HE2      GLN  95   4.466  10.767 -10.499
  716   2HE2  GLN  95          2HE2      GLN  95   4.177   9.050 -10.684
  717    H    LEU  96           H        LEU  96   4.154  10.517  -5.335
  718    HA   LEU  96           HA       LEU  96   2.776   8.217  -6.157
  719   1HB   LEU  96          1HB       LEU  96   4.147   8.811  -4.103
  720   2HB   LEU  96          2HB       LEU  96   2.672   9.467  -3.436
  721    HG   LEU  96           HG       LEU  96   2.695   6.638  -4.527
  722   1HD1  LEU  96          1HD1      LEU  96   3.679   7.471  -1.769
  723   2HD1  LEU  96          2HD1      LEU  96   3.457   5.802  -2.356
  724   3HD1  LEU  96          3HD1      LEU  96   4.682   6.841  -3.090
  725   1HD2  LEU  96          1HD2      LEU  96   1.243   7.925  -2.170
  726   2HD2  LEU  96          2HD2      LEU  96   0.524   7.629  -3.766
  727   3HD2  LEU  96          3HD2      LEU  96   1.017   6.266  -2.751
  728    H    GLU  97           H        GLU  97   1.403  11.075  -4.452
  729    HA   GLU  97           HA       GLU  97  -1.287  10.158  -4.732
  730   1HB   GLU  97          1HB       GLU  97  -0.210  11.752  -2.997
  731   2HB   GLU  97          2HB       GLU  97  -0.409  13.011  -4.213
  732   1HG   GLU  97          1HG       GLU  97  -2.756  12.955  -4.077
  733   2HG   GLU  97          2HG       GLU  97  -2.796  11.265  -3.572
  734    H    ALA  98           H        ALA  98   0.896  11.798  -6.960
  735    HA   ALA  98           HA       ALA  98  -1.327  12.854  -8.584
  736   1HB   ALA  98          1HB       ALA  98   1.617  12.496  -9.291
  737   2HB   ALA  98          2HB       ALA  98   0.387  13.303 -10.277
  738   3HB   ALA  98          3HB       ALA  98   0.839  13.983  -8.705
  739    H    GLN  99           H        GLN  99   0.966  10.100  -8.671
  740    HA   GLN  99           HA       GLN  99  -0.096   8.775 -10.931
  741   1HB   GLN  99          1HB       GLN  99   2.072   8.390  -9.328
  742   2HB   GLN  99          2HB       GLN  99   1.001   7.228  -8.563
  743   1HG   GLN  99          1HG       GLN  99   2.297   6.056 -10.210
  744   2HG   GLN  99          2HG       GLN  99   0.662   6.170 -10.860
  745   1HE2  GLN  99          1HE2      GLN  99   0.541   6.971 -12.998
  746   2HE2  GLN  99          2HE2      GLN  99   1.840   7.895 -13.741
  747    H    LEU 100           H        LEU 100  -1.072   8.746  -7.588
  748    HA   LEU 100           HA       LEU 100  -3.103   6.662  -7.959
  749   1HB   LEU 100          1HB       LEU 100  -1.335   7.408  -5.924
  750   2HB   LEU 100          2HB       LEU 100  -2.870   8.024  -5.365
  751    HG   LEU 100           HG       LEU 100  -3.763   5.643  -5.722
  752   1HD1  LEU 100          1HD1      LEU 100  -2.065   3.840  -5.914
  753   2HD1  LEU 100          2HD1      LEU 100  -1.994   4.887  -7.331
  754   3HD1  LEU 100          3HD1      LEU 100  -0.780   5.060  -6.050
  755   1HD2  LEU 100          1HD2      LEU 100  -1.374   6.118  -3.862
  756   2HD2  LEU 100          2HD2      LEU 100  -3.097   6.376  -3.496
  757   3HD2  LEU 100          3HD2      LEU 100  -2.474   4.740  -3.738
  758    H    ALA 101           H        ALA 101  -3.136   9.915  -8.627
  759    HA   ALA 101           HA       ALA 101  -5.162  11.011  -7.086
  760   1HB   ALA 101          1HB       ALA 101  -3.675  12.334  -8.550
  761   2HB   ALA 101          2HB       ALA 101  -4.451  11.637  -9.990
  762   3HB   ALA 101          3HB       ALA 101  -5.373  12.689  -8.894
  763    H    ASP 102           H        ASP 102  -5.550   8.789  -9.840
  764    HA   ASP 102           HA       ASP 102  -8.307   9.491 -10.418
  765   1HB   ASP 102          1HB       ASP 102  -8.248   7.420 -11.757
  766   2HB   ASP 102          2HB       ASP 102  -6.786   8.359 -12.057
  767    H    VAL 103           H        VAL 103  -6.840   7.763  -7.803
  768    HA   VAL 103           HA       VAL 103  -9.581   6.972  -6.959
  769    HB   VAL 103           HB       VAL 103  -7.593   5.337  -5.680
  770   1HG1  VAL 103          1HG1      VAL 103 -10.030   4.958  -5.703
  771   2HG1  VAL 103          2HG1      VAL 103  -9.968   4.644  -7.450
  772   3HG1  VAL 103          3HG1      VAL 103  -9.150   3.545  -6.315
  773   1HG2  VAL 103          1HG2      VAL 103  -6.296   5.383  -7.777
  774   2HG2  VAL 103          2HG2      VAL 103  -7.031   3.796  -7.517
  775   3HG2  VAL 103          3HG2      VAL 103  -7.747   4.914  -8.693
  776    H    LEU 104           H        LEU 104  -7.311   9.220  -6.420
  777    HA   LEU 104           HA       LEU 104  -8.249   9.491  -3.648
  778   1HB   LEU 104          1HB       LEU 104  -5.632  10.045  -4.997
  779   2HB   LEU 104          2HB       LEU 104  -6.182  11.240  -3.878
  780    HG   LEU 104           HG       LEU 104  -4.749   9.756  -2.685
  781   1HD1  LEU 104          1HD1      LEU 104  -7.532   8.813  -1.882
  782   2HD1  LEU 104          2HD1      LEU 104  -6.088   8.900  -0.885
  783   3HD1  LEU 104          3HD1      LEU 104  -6.853  10.406  -1.465
  784   1HD2  LEU 104          1HD2      LEU 104  -6.462   7.373  -3.475
  785   2HD2  LEU 104          2HD2      LEU 104  -4.923   7.805  -4.240
  786   3HD2  LEU 104          3HD2      LEU 104  -4.978   7.371  -2.513
  787    H    GLN 105           H        GLN 105  -8.720  10.657  -6.762
  788    HA   GLN 105           HA       GLN 105  -9.838  13.199  -6.367
  789   1HB   GLN 105          2HB       GLN 105  -9.542  12.027  -8.520
  790   2HB   GLN 105          3HB       GLN 105 -10.757  10.855  -8.037
  791   1HG   GLN 105          2HG       GLN 105 -12.475  12.648  -7.959
  792   2HG   GLN 105          3HG       GLN 105 -11.248  13.850  -8.372
  793   1HE2  GLN 105          1HE2      GLN 105  -9.842  12.793 -10.491
  794   2HE2  GLN 105          2HE2      GLN 105 -10.965  12.445 -11.805
  Start of MODEL   12
    1   1H    ALA   1           H        ALA   1  -8.838   6.184   6.634
    2   2H    ALA   1          2HN       ALA   1  -9.591   4.853   6.088
    3   3H    ALA   1          3HN       ALA   1 -10.376   5.894   7.130
    4    HA   ALA   1           HA       ALA   1  -8.993   5.415   8.913
    5   1HB   ALA   1          1HB       ALA   1 -10.946   3.946   8.577
    6   2HB   ALA   1          2HB       ALA   1  -9.963   2.844   7.588
    7   3HB   ALA   1          3HB       ALA   1  -9.605   3.057   9.315
    8    H    THR   2           H        THR   2  -7.368   3.593   9.804
    9    HA   THR   2           HA       THR   2  -5.764   2.375   7.819
   10    HB   THR   2           HB       THR   2  -4.365   4.273   9.753
   11    HG1  THR   2           1HG      THR   2  -5.449   4.666   7.340
   12   1HG2  THR   2          1HG2      THR   2  -3.300   2.368   7.610
   13   2HG2  THR   2          2HG2      THR   2  -2.346   3.694   8.304
   14   3HG2  THR   2          3HG2      THR   2  -2.907   2.377   9.337
   15    H    MET   3           H        MET   3  -4.541   0.592   8.770
   16    HA   MET   3           HA       MET   3  -4.398   0.312  11.583
   17   1HB   MET   3          1HB       MET   3  -6.745  -0.816  10.456
   18   2HB   MET   3          2HB       MET   3  -5.657  -2.185  10.622
   19   1HG   MET   3          1HG       MET   3  -6.416  -0.193  12.798
   20   2HG   MET   3          2HG       MET   3  -7.076  -1.816  12.618
   21   1HE   MET   3          1HE       MET   3  -4.950  -1.905  15.956
   22   2HE   MET   3          2HE       MET   3  -5.771  -0.470  15.300
   23   3HE   MET   3          3HE       MET   3  -6.576  -2.058  15.249
   24    H    THR   4           H        THR   4  -3.564  -2.217  11.779
   25    HA   THR   4           HA       THR   4  -1.268  -2.553   9.940
   26    HB   THR   4           HB       THR   4  -2.009  -4.050  12.463
   27    HG1  THR   4           1HG      THR   4  -1.437  -1.735  12.552
   28   1HG2  THR   4          1HG2      THR   4   0.596  -3.987  10.869
   29   2HG2  THR   4          2HG2      THR   4   0.411  -4.705  12.482
   30   3HG2  THR   4          3HG2      THR   4  -0.462  -5.396  11.117
   31    H    LEU   5           H        LEU   5  -1.121  -4.745   8.934
   32    HA   LEU   5           HA       LEU   5  -3.672  -6.266   8.741
   33   1HB   LEU   5          1HB       LEU   5  -2.918  -4.509   6.805
   34   2HB   LEU   5          2HB       LEU   5  -1.904  -5.839   6.346
   35    HG   LEU   5           HG       LEU   5  -3.951  -7.289   6.128
   36   1HD1  LEU   5          1HD1      LEU   5  -5.494  -6.037   7.633
   37   2HD1  LEU   5          2HD1      LEU   5  -5.431  -4.643   6.544
   38   3HD1  LEU   5          3HD1      LEU   5  -6.147  -6.169   6.002
   39   1HD2  LEU   5          1HD2      LEU   5  -3.687  -4.715   4.507
   40   2HD2  LEU   5          2HD2      LEU   5  -3.038  -6.315   4.125
   41   3HD2  LEU   5          3HD2      LEU   5  -4.784  -6.017   4.051
   42    H    THR   6           H        THR   6  -3.198  -8.577   7.877
   43    HA   THR   6           HA       THR   6  -0.557  -9.537   7.967
   44    HB   THR   6           HB       THR   6  -2.603 -10.249  10.110
   45    HG1  THR   6           1HG      THR   6   0.153  -9.389  10.147
   46   1HG2  THR   6          1HG2      THR   6  -1.041 -12.021  10.887
   47   2HG2  THR   6          2HG2      THR   6  -1.804 -12.396   9.340
   48   3HG2  THR   6          3HG2      THR   6  -0.101 -11.844   9.396
   49    H    ASP   7           H        ASP   7  -0.802 -11.716   7.284
   50    HA   ASP   7           HA       ASP   7  -1.582 -11.894   4.750
   51   1HB   ASP   7          1HB       ASP   7  -0.083 -13.483   5.984
   52   2HB   ASP   7          2HB       ASP   7  -1.501 -14.334   6.572
   53    H    ALA   8           H        ALA   8  -3.516 -13.515   7.246
   54    HA   ALA   8           HA       ALA   8  -5.631 -14.361   5.526
   55   1HB   ALA   8          1HB       ALA   8  -5.743 -13.681   8.502
   56   2HB   ALA   8          2HB       ALA   8  -6.958 -14.615   7.608
   57   3HB   ALA   8          3HB       ALA   8  -5.313 -15.263   7.802
   58    H    ASN   9           H        ASN   9  -5.128 -11.336   7.239
   59    HA   ASN   9           HA       ASN   9  -7.809 -10.300   6.693
   60   1HB   ASN   9          1HB       ASN   9  -6.264  -9.823   8.752
   61   2HB   ASN   9          2HB       ASN   9  -5.555  -8.610   7.685
   62   1HD2  ASN   9          1HD2      ASN   9  -8.007  -7.750   6.320
   63   2HD2  ASN   9          2HD2      ASN   9  -9.001  -6.986   7.575
   64    H    PHE  10           H        PHE  10  -4.686 -10.392   5.072
   65    HA   PHE  10           HA       PHE  10  -4.888  -8.074   3.453
   66   1HB   PHE  10          1HB       PHE  10  -2.906  -9.632   3.646
   67   2HB   PHE  10          2HB       PHE  10  -3.750 -10.760   2.599
   68    HD1  PHE  10           1HD      PHE  10  -1.540  -7.950   2.691
   69    HD2  PHE  10           2HD      PHE  10  -4.442  -9.976   0.206
   70    HE1  PHE  10           1HE      PHE  10  -0.547  -6.975   0.700
   71    HE2  PHE  10           2HE      PHE  10  -3.472  -8.888  -1.785
   72    HZ   PHE  10           HZ       PHE  10  -1.500  -7.394  -1.553
   73    H    GLN  11           H        GLN  11  -5.851 -11.437   2.637
   74    HA   GLN  11           HA       GLN  11  -7.187 -10.749   0.261
   75   1HB   GLN  11          1HB       GLN  11  -6.405 -13.012   1.036
   76   2HB   GLN  11          2HB       GLN  11  -7.857 -13.140   2.033
   77   1HG   GLN  11          1HG       GLN  11  -8.168 -12.435  -0.900
   78   2HG   GLN  11          2HG       GLN  11  -7.652 -14.062  -0.493
   79   1HE2  GLN  11          1HE2      GLN  11 -10.347 -11.696   0.147
   80   2HE2  GLN  11          2HE2      GLN  11 -11.527 -13.002   0.351
   81    H    GLN  12           H        GLN  12  -8.426 -10.963   3.608
   82    HA   GLN  12           HA       GLN  12 -11.185 -10.478   2.881
   83   1HB   GLN  12          1HB       GLN  12  -9.685 -10.280   5.531
   84   2HB   GLN  12          2HB       GLN  12 -11.443 -10.185   5.374
   85   1HG   GLN  12          1HG       GLN  12 -11.584 -12.456   4.547
   86   2HG   GLN  12          2HG       GLN  12  -9.827 -12.606   4.455
   87   1HE2  GLN  12          1HE2      GLN  12 -10.670 -14.625   5.805
   88   2HE2  GLN  12          2HE2      GLN  12 -10.606 -14.352   7.544
   89    H    ALA  13           H        ALA  13  -8.452  -8.284   3.332
   90    HA   ALA  13           HA       ALA  13 -10.178  -5.970   3.628
   91   1HB   ALA  13          1HB       ALA  13  -7.200  -6.192   3.017
   92   2HB   ALA  13          2HB       ALA  13  -8.093  -4.684   3.297
   93   3HB   ALA  13          3HB       ALA  13  -7.954  -5.875   4.596
   94    H    ILE  14           H        ILE  14  -8.020  -7.318   1.060
   95    HA   ILE  14           HA       ILE  14  -8.658  -5.366  -0.842
   96    HB   ILE  14           HB       ILE  14  -7.652  -6.861  -2.513
   97   1HG1  ILE  14          1HG1      ILE  14  -7.631  -8.966  -0.422
   98   2HG1  ILE  14          2HG1      ILE  14  -8.713  -8.966  -1.804
   99   1HG2  ILE  14          1HG2      ILE  14  -6.267  -5.555  -0.827
  100   2HG2  ILE  14          2HG2      ILE  14  -6.081  -7.051   0.090
  101   3HG2  ILE  14          3HG2      ILE  14  -5.452  -6.944  -1.555
  102   1HD1  ILE  14          1HD1      ILE  14  -6.737  -9.024  -3.336
  103   2HD1  ILE  14          2HD1      ILE  14  -5.697  -9.242  -1.910
  104   3HD1  ILE  14          3HD1      ILE  14  -6.913 -10.460  -2.309
  105    H    GLN  15           H        GLN  15 -10.532  -8.137  -0.024
  106    HA   GLN  15           HA       GLN  15 -12.199  -8.213  -2.366
  107   1HB   GLN  15          1HB       GLN  15 -13.627  -9.694  -1.119
  108   2HB   GLN  15          2HB       GLN  15 -11.937 -10.104  -0.875
  109   1HG   GLN  15          1HG       GLN  15 -12.949 -10.393   1.202
  110   2HG   GLN  15          2HG       GLN  15 -12.014  -8.904   1.308
  111   1HE2  GLN  15          1HE2      GLN  15 -13.139  -7.732   2.870
  112   2HE2  GLN  15          2HE2      GLN  15 -14.867  -7.354   2.717
  113    H    GLY  16           H        GLY  16 -12.082  -5.847   0.200
  114   1HA   GLY  16          1HA       GLY  16 -14.847  -5.181   0.325
  115   2HA   GLY  16          2HA       GLY  16 -13.464  -4.202   0.853
  116    H    ASP  17           H        ASP  17 -15.601  -2.915  -0.233
  117    HA   ASP  17           HA       ASP  17 -15.420  -2.620  -3.123
  118   1HB   ASP  17          1HB       ASP  17 -17.331  -1.164  -2.822
  119   2HB   ASP  17          2HB       ASP  17 -17.584  -2.652  -1.912
  120    H    GLY  18           H        GLY  18 -14.772  -0.654  -0.224
  121   1HA   GLY  18          1HA       GLY  18 -14.056   1.702  -1.638
  122   2HA   GLY  18          2HA       GLY  18 -13.681   1.369   0.061
  123    HA   PRO  19           HA       PRO  19  -9.836   1.256  -2.756
  124   1HB   PRO  19          1HB       PRO  19  -8.675   3.700  -2.106
  125   2HB   PRO  19          2HB       PRO  19  -9.766   3.384  -3.487
  126   1HG   PRO  19          1HG       PRO  19 -10.454   4.553  -0.816
  127   2HG   PRO  19          2HG       PRO  19 -10.988   5.093  -2.430
  128   1HD   PRO  19          1HD       PRO  19 -12.538   3.549  -0.792
  129   2HD   PRO  19          2HD       PRO  19 -12.567   3.354  -2.571
  130    H    VAL  20           H        VAL  20  -8.995  -0.362  -1.618
  131    HA   VAL  20           HA       VAL  20  -7.926  -0.029   1.112
  132    HB   VAL  20           HB       VAL  20  -8.340  -2.344  -0.836
  133   1HG1  VAL  20          1HG1      VAL  20  -6.208  -2.854   0.299
  134   2HG1  VAL  20          2HG1      VAL  20  -6.905  -2.426   1.880
  135   3HG1  VAL  20          3HG1      VAL  20  -7.487  -3.849   0.986
  136   1HG2  VAL  20          1HG2      VAL  20  -9.334  -1.877   2.021
  137   2HG2  VAL  20          2HG2      VAL  20 -10.257  -1.430   0.573
  138   3HG2  VAL  20          3HG2      VAL  20  -9.866  -3.120   0.878
  139    H    LEU  21           H        LEU  21  -5.866   0.581   1.408
  140    HA   LEU  21           HA       LEU  21  -3.949   0.367  -0.891
  141   1HB   LEU  21          1HB       LEU  21  -4.834   2.641  -0.297
  142   2HB   LEU  21          2HB       LEU  21  -4.063   2.516   1.258
  143    HG   LEU  21           HG       LEU  21  -2.515   2.236  -1.366
  144   1HD1  LEU  21          1HD1      LEU  21  -3.715   4.419  -1.217
  145   2HD1  LEU  21          2HD1      LEU  21  -2.957   4.680   0.372
  146   3HD1  LEU  21          3HD1      LEU  21  -1.965   4.620  -1.102
  147   1HD2  LEU  21          1HD2      LEU  21  -0.635   3.129   0.195
  148   2HD2  LEU  21          2HD2      LEU  21  -1.711   2.761   1.530
  149   3HD2  LEU  21          3HD2      LEU  21  -1.127   1.466   0.462
  150    H    VAL  22           H        VAL  22  -2.363  -1.125  -0.500
  151    HA   VAL  22           HA       VAL  22  -1.839  -1.842   2.343
  152    HB   VAL  22           HB       VAL  22  -1.020  -3.228  -0.241
  153   1HG1  VAL  22          1HG1      VAL  22  -0.621  -3.988   2.697
  154   2HG1  VAL  22          2HG1      VAL  22  -0.266  -5.027   1.302
  155   3HG1  VAL  22          3HG1      VAL  22   0.661  -3.570   1.538
  156   1HG2  VAL  22          1HG2      VAL  22  -2.602  -4.992   0.524
  157   2HG2  VAL  22          2HG2      VAL  22  -3.084  -3.968   1.891
  158   3HG2  VAL  22          3HG2      VAL  22  -3.440  -3.466   0.225
  159    H    ASP  23           H        ASP  23   0.007  -1.053   3.339
  160    HA   ASP  23           HA       ASP  23   2.187   0.051   1.604
  161   1HB   ASP  23          1HB       ASP  23   1.353   1.358   3.602
  162   2HB   ASP  23          2HB       ASP  23   1.834   0.040   4.616
  163    H    PHE  24           H        PHE  24   3.335  -1.692   0.835
  164    HA   PHE  24           HA       PHE  24   3.846  -4.057   2.561
  165   1HB   PHE  24          1HB       PHE  24   4.296  -3.428  -0.355
  166   2HB   PHE  24          2HB       PHE  24   5.155  -4.721   0.392
  167    HD1  PHE  24           1HD      PHE  24   3.764  -6.449   1.750
  168    HD2  PHE  24           2HD      PHE  24   2.280  -4.047  -1.505
  169    HE1  PHE  24           1HE      PHE  24   2.385  -8.353   0.976
  170    HE2  PHE  24           2HE      PHE  24   0.849  -5.935  -2.234
  171    HZ   PHE  24           HZ       PHE  24   1.041  -8.161  -1.043
  172    H    TRP  25           H        TRP  25   5.430  -3.734   3.889
  173    HA   TRP  25           HA       TRP  25   7.974  -2.468   2.991
  174   1HB   TRP  25          1HB       TRP  25   8.132  -1.101   4.906
  175   2HB   TRP  25          2HB       TRP  25   6.504  -0.849   4.303
  176    HD1  TRP  25           HD       TRP  25   4.537  -2.263   5.688
  177    HE1  TRP  25           1HE      TRP  25   4.410  -3.074   8.117
  178    HE3  TRP  25           3HE      TRP  25   9.379  -1.401   7.060
  179    HZ2  TRP  25           2HZ      TRP  25   6.293  -3.555  10.316
  180    HZ3  TRP  25           3HZ      TRP  25  10.186  -2.036   9.316
  181    HH2  TRP  25           HH       TRP  25   8.655  -3.144  10.932
  182    H    ALA  26           H        ALA  26   9.692  -2.852   4.962
  183    HA   ALA  26           HA       ALA  26   9.325  -5.231   6.479
  184   1HB   ALA  26          1HB       ALA  26  11.467  -5.257   4.284
  185   2HB   ALA  26          2HB       ALA  26  11.168  -6.523   5.493
  186   3HB   ALA  26          3HB       ALA  26   9.977  -6.213   4.233
  187    H    ALA  27           H        ALA  27  11.328  -5.717   7.745
  188    HA   ALA  27           HA       ALA  27  12.195  -3.242   8.921
  189   1HB   ALA  27          1HB       ALA  27  12.980  -6.120   9.526
  190   2HB   ALA  27          2HB       ALA  27  13.262  -4.706  10.571
  191   3HB   ALA  27          3HB       ALA  27  11.605  -5.231  10.230
  192    H    TRP  28           H        TRP  28  13.510  -4.812   6.220
  193    HA   TRP  28           HA       TRP  28  16.242  -3.785   6.863
  194   1HB   TRP  28          1HB       TRP  28  17.196  -5.657   6.220
  195   2HB   TRP  28          2HB       TRP  28  15.642  -6.384   6.546
  196    HD1  TRP  28           HD       TRP  28  18.067  -5.489   3.823
  197    HE1  TRP  28           1HE      TRP  28  17.314  -6.308   1.525
  198    HE3  TRP  28           3HE      TRP  28  13.406  -7.248   5.068
  199    HZ2  TRP  28           2HZ      TRP  28  14.893  -7.311   0.314
  200    HZ3  TRP  28           3HZ      TRP  28  11.871  -8.068   3.287
  201    HH2  TRP  28           HH       TRP  28  12.609  -8.023   0.916
  202    H    CYS  29           H        CYS  29  13.635  -3.316   4.663
  203    HA   CYS  29           HA       CYS  29  15.088  -3.160   2.218
  204   1HB   CYS  29          1HB       CYS  29  12.854  -2.276   1.383
  205   2HB   CYS  29          2HB       CYS  29  12.963  -3.897   2.040
  206    H    GLY  30           H        GLY  30  16.289  -1.337   4.006
  207   1HA   GLY  30          1HA       GLY  30  16.799   0.854   4.546
  208   2HA   GLY  30          2HA       GLY  30  17.181   0.831   2.835
  209    HA   PRO  31           HA       PRO  31  14.635   4.418   2.499
  210   1HB   PRO  31          1HB       PRO  31  13.616   4.201  -0.084
  211   2HB   PRO  31          2HB       PRO  31  15.252   4.781   0.363
  212   1HG   PRO  31          1HG       PRO  31  14.399   2.021  -0.534
  213   2HG   PRO  31          2HG       PRO  31  15.834   2.967  -1.051
  214   1HD   PRO  31          1HD       PRO  31  16.039   1.018   0.807
  215   2HD   PRO  31          2HD       PRO  31  16.955   2.541   0.997
  216    H    CYS  32           H        CYS  32  13.080   1.314   2.123
  217    HA   CYS  32           HA       CYS  32  10.364   2.207   2.106
  218   1HB   CYS  32          1HB       CYS  32   9.784   0.116   3.153
  219   2HB   CYS  32          2HB       CYS  32  11.002  -0.169   1.924
  220    H    ARG  33           H        ARG  33  12.780   2.264   4.718
  221    HA   ARG  33           HA       ARG  33  10.941   2.911   6.827
  222   1HB   ARG  33          1HB       ARG  33  13.394   2.046   6.927
  223   2HB   ARG  33          2HB       ARG  33  13.854   3.713   6.619
  224   1HG   ARG  33          1HG       ARG  33  12.030   3.874   8.795
  225   2HG   ARG  33          2HG       ARG  33  12.897   2.378   9.076
  226   1HD   ARG  33          1HD       ARG  33  14.064   4.153  10.221
  227   2HD   ARG  33          2HD       ARG  33  15.064   3.593   8.884
  228    HE   ARG  33           HE       ARG  33  14.945   5.637   7.908
  229   1HH1  ARG  33          2HH2      ARG  33  12.315   5.506  10.252
  230   2HH1  ARG  33          1HH2      ARG  33  11.911   7.184  10.155
  231   1HH2  ARG  33          2HH1      ARG  33  14.443   7.884   7.754
  232   2HH2  ARG  33          1HH1      ARG  33  13.148   8.553   8.680
  233    H    MET  34           H        MET  34  11.939   4.793   4.105
  234    HA   MET  34           HA       MET  34  11.254   7.322   5.456
  235   1HB   MET  34          1HB       MET  34  12.841   6.713   2.944
  236   2HB   MET  34          2HB       MET  34  12.432   8.338   3.490
  237   1HG   MET  34          1HG       MET  34  14.086   8.423   4.962
  238   2HG   MET  34          2HG       MET  34  13.688   6.857   5.651
  239   1HE   MET  34          1HE       MET  34  15.510   8.657   2.646
  240   2HE   MET  34          2HE       MET  34  16.457   7.323   1.945
  241   3HE   MET  34          3HE       MET  34  14.691   7.327   1.790
  242    H    MET  35           H        MET  35  10.207   5.009   3.086
  243    HA   MET  35           HA       MET  35   8.221   6.780   1.880
  244   1HB   MET  35          1HB       MET  35   9.294   4.878   0.617
  245   2HB   MET  35          2HB       MET  35   8.385   3.748   1.629
  246   1HG   MET  35          1HG       MET  35   6.300   4.698   0.806
  247   2HG   MET  35          2HG       MET  35   7.151   6.013  -0.003
  248   1HE   MET  35          1HE       MET  35   4.991   4.616  -1.684
  249   2HE   MET  35          2HE       MET  35   6.149   5.828  -2.297
  250   3HE   MET  35          3HE       MET  35   5.897   4.303  -3.181
  251    H    ALA  36           H        ALA  36   8.345   4.058   4.276
  252    HA   ALA  36           HA       ALA  36   5.629   3.864   4.811
  253   1HB   ALA  36          1HB       ALA  36   7.216   2.311   5.735
  254   2HB   ALA  36          2HB       ALA  36   8.022   3.580   6.682
  255   3HB   ALA  36          3HB       ALA  36   6.374   3.080   7.093
  256    HA   PRO  37           HA       PRO  37   5.545   7.589   7.822
  257   1HB   PRO  37          1HB       PRO  37   7.488   9.513   7.716
  258   2HB   PRO  37          2HB       PRO  37   7.523   8.111   8.828
  259   1HG   PRO  37          1HG       PRO  37   8.907   8.404   6.153
  260   2HG   PRO  37          2HG       PRO  37   9.604   7.827   7.698
  261   1HD   PRO  37          1HD       PRO  37   8.769   6.080   5.824
  262   2HD   PRO  37          2HD       PRO  37   8.469   5.757   7.550
  263    H    VAL  38           H        VAL  38   6.896   7.963   4.453
  264    HA   VAL  38           HA       VAL  38   5.349  10.368   3.974
  265    HB   VAL  38           HB       VAL  38   7.239   8.691   2.581
  266   1HG1  VAL  38          1HG1      VAL  38   6.546   9.129   0.266
  267   2HG1  VAL  38          2HG1      VAL  38   5.463   8.007   1.091
  268   3HG1  VAL  38          3HG1      VAL  38   4.969   9.699   0.848
  269   1HG2  VAL  38          1HG2      VAL  38   7.645  10.978   3.265
  270   2HG2  VAL  38          2HG2      VAL  38   7.802  10.828   1.507
  271   3HG2  VAL  38          3HG2      VAL  38   6.346  11.561   2.210
  272    H    LEU  39           H        LEU  39   4.717   6.860   3.808
  273    HA   LEU  39           HA       LEU  39   2.133   7.164   2.649
  274   1HB   LEU  39          1HB       LEU  39   3.649   4.883   3.956
  275   2HB   LEU  39          2HB       LEU  39   2.064   4.703   3.285
  276    HG   LEU  39           HG       LEU  39   4.603   5.446   1.804
  277   1HD1  LEU  39          1HD1      LEU  39   2.770   3.040   1.585
  278   2HD1  LEU  39          2HD1      LEU  39   4.159   3.363   0.521
  279   3HD1  LEU  39          3HD1      LEU  39   4.423   3.091   2.241
  280   1HD2  LEU  39          1HD2      LEU  39   3.010   6.785   0.698
  281   2HD2  LEU  39          2HD2      LEU  39   3.354   5.389  -0.302
  282   3HD2  LEU  39          3HD2      LEU  39   1.834   5.436   0.628
  283    H    GLU  40           H        GLU  40   3.387   7.427   5.900
  284    HA   GLU  40           HA       GLU  40   0.749   7.450   7.142
  285   1HB   GLU  40          1HB       GLU  40   3.534   7.726   7.970
  286   2HB   GLU  40          2HB       GLU  40   2.597   8.992   8.679
  287   1HG   GLU  40          1HG       GLU  40   2.502   7.198  10.223
  288   2HG   GLU  40          2HG       GLU  40   0.934   7.129   9.417
  289    H    GLU  41           H        GLU  41   3.052   9.937   5.886
  290    HA   GLU  41           HA       GLU  41   1.334  12.190   6.156
  291   1HB   GLU  41          1HB       GLU  41   3.893  11.944   5.540
  292   2HB   GLU  41          2HB       GLU  41   3.308  11.809   3.893
  293   1HG   GLU  41          1HG       GLU  41   3.806  14.039   4.033
  294   2HG   GLU  41          2HG       GLU  41   2.078  14.082   4.370
  295    H    PHE  42           H        PHE  42   1.219   9.534   3.996
  296    HA   PHE  42           HA       PHE  42  -0.847  10.675   2.190
  297   1HB   PHE  42          1HB       PHE  42   0.957   8.969   1.522
  298   2HB   PHE  42          2HB       PHE  42   0.058   7.774   2.428
  299    HD1  PHE  42           1HD      PHE  42  -2.131   6.948   1.657
  300    HD2  PHE  42           2HD      PHE  42   0.173   9.818  -0.603
  301    HE1  PHE  42           1HE      PHE  42  -3.651   6.666  -0.298
  302    HE2  PHE  42           2HE      PHE  42  -1.281   9.433  -2.564
  303    HZ   PHE  42           HZ       PHE  42  -3.199   7.881  -2.416
  304    H    ALA  43           H        ALA  43  -0.719   8.179   4.843
  305    HA   ALA  43           HA       ALA  43  -3.478   7.781   4.939
  306   1HB   ALA  43          1HB       ALA  43  -3.082   6.891   7.188
  307   2HB   ALA  43          2HB       ALA  43  -1.763   6.378   6.118
  308   3HB   ALA  43          3HB       ALA  43  -1.517   7.708   7.275
  309    H    GLU  44           H        GLU  44  -1.653  10.456   6.490
  310    HA   GLU  44           HA       GLU  44  -3.970  11.430   7.843
  311   1HB   GLU  44          1HB       GLU  44  -1.687  12.158   8.414
  312   2HB   GLU  44          2HB       GLU  44  -1.581  13.061   6.889
  313   1HG   GLU  44          1HG       GLU  44  -3.475  14.483   7.556
  314   2HG   GLU  44          2HG       GLU  44  -3.762  13.497   8.989
  315    H    ALA  45           H        ALA  45  -2.544  12.464   4.727
  316    HA   ALA  45           HA       ALA  45  -3.995  14.730   4.392
  317   1HB   ALA  45          1HB       ALA  45  -2.875  12.929   2.202
  318   2HB   ALA  45          2HB       ALA  45  -3.272  14.648   2.020
  319   3HB   ALA  45          3HB       ALA  45  -1.977  14.158   3.126
  320    H    HIS  46           H        HIS  46  -5.240  11.591   3.696
  321    HA   HIS  46           HA       HIS  46  -7.857  12.752   2.919
  322   1HB   HIS  46          1HB       HIS  46  -7.851  10.855   1.039
  323   2HB   HIS  46          2HB       HIS  46  -7.207  12.468   0.753
  324    HD1  HIS  46           1HD      HIS  46  -4.738  12.455  -0.372
  325    HD2  HIS  46           2HD      HIS  46  -5.644   9.184   2.221
  326    HE1  HIS  46           1HE      HIS  46  -2.794  10.880  -0.368
  327    HE2  HIS  46           2HE      HIS  46  -3.330   8.940   1.132
  328    H    ALA  47           H        ALA  47  -6.812  11.505   5.291
  329    HA   ALA  47           HA       ALA  47  -6.796   9.119   6.026
  330   1HB   ALA  47          1HB       ALA  47  -6.963  10.954   7.619
  331   2HB   ALA  47          2HB       ALA  47  -8.721  11.054   7.364
  332   3HB   ALA  47          3HB       ALA  47  -8.007   9.611   8.111
  333    H    ASP  48           H        ASP  48 -10.184  10.250   5.695
  334    HA   ASP  48           HA       ASP  48 -10.927   7.375   5.606
  335   1HB   ASP  48          1HB       ASP  48 -12.368   9.790   6.687
  336   2HB   ASP  48          2HB       ASP  48 -13.150   8.217   6.461
  337    H    LYS  49           H        LYS  49 -10.373   9.477   3.219
  338    HA   LYS  49           HA       LYS  49 -12.655   8.570   1.570
  339   1HB   LYS  49          1HB       LYS  49 -11.425  10.619   0.945
  340   2HB   LYS  49          2HB       LYS  49  -9.926   9.692   0.766
  341   1HG   LYS  49          1HG       LYS  49 -10.790   8.419  -1.072
  342   2HG   LYS  49          2HG       LYS  49 -12.438   8.989  -0.811
  343   1HD   LYS  49          1HD       LYS  49 -10.152  10.796  -1.703
  344   2HD   LYS  49          2HD       LYS  49 -11.212   9.906  -2.803
  345   1HE   LYS  49          1HE       LYS  49 -13.189  11.037  -1.626
  346   2HE   LYS  49          2HE       LYS  49 -11.993  12.118  -0.874
  347   1HZ   LYS  49          1HZ       LYS  49 -11.245  12.597  -3.219
  348   2HZ   LYS  49          2HZ       LYS  49 -12.468  11.735  -3.786
  349   3HZ   LYS  49          3HZ       LYS  49 -12.814  13.097  -2.941
  350    H    VAL  50           H        VAL  50  -9.602   7.359   2.833
  351    HA   VAL  50           HA       VAL  50  -9.766   4.973   1.050
  352    HB   VAL  50           HB       VAL  50  -7.312   4.974   1.048
  353   1HG1  VAL  50          1HG1      VAL  50  -6.922   6.840  -0.453
  354   2HG1  VAL  50          2HG1      VAL  50  -8.543   6.197  -0.757
  355   3HG1  VAL  50          3HG1      VAL  50  -8.349   7.704   0.161
  356   1HG2  VAL  50          1HG2      VAL  50  -6.907   6.158   3.219
  357   2HG2  VAL  50          2HG2      VAL  50  -5.984   6.840   1.875
  358   3HG2  VAL  50          3HG2      VAL  50  -7.440   7.674   2.474
  359    H    THR  51           H        THR  51  -8.565   2.938   2.007
  360    HA   THR  51           HA       THR  51  -8.147   3.327   4.844
  361    HB   THR  51           HB       THR  51 -10.180   2.084   4.701
  362    HG1  THR  51           1HG      THR  51  -7.949   0.637   5.691
  363   1HG2  THR  51          1HG2      THR  51  -8.583  -0.198   3.510
  364   2HG2  THR  51          2HG2      THR  51 -10.290  -0.199   3.994
  365   3HG2  THR  51          3HG2      THR  51  -9.764   0.793   2.616
  366    H    VAL  52           H        VAL  52  -6.082   3.559   4.985
  367    HA   VAL  52           HA       VAL  52  -4.224   2.036   3.306
  368    HB   VAL  52           HB       VAL  52  -3.700   3.688   5.719
  369   1HG1  VAL  52          1HG1      VAL  52  -1.776   2.589   3.666
  370   2HG1  VAL  52          2HG1      VAL  52  -1.359   3.875   4.816
  371   3HG1  VAL  52          3HG1      VAL  52  -1.798   2.278   5.410
  372   1HG2  VAL  52          1HG2      VAL  52  -3.528   4.469   2.783
  373   2HG2  VAL  52          2HG2      VAL  52  -4.641   5.150   3.994
  374   3HG2  VAL  52          3HG2      VAL  52  -2.913   5.460   4.122
  375    H    ALA  53           H        ALA  53  -2.913   0.354   4.193
  376    HA   ALA  53           HA       ALA  53  -3.547  -0.702   6.860
  377   1HB   ALA  53          1HB       ALA  53  -3.938  -2.369   4.347
  378   2HB   ALA  53          2HB       ALA  53  -4.104  -2.900   6.043
  379   3HB   ALA  53          3HB       ALA  53  -5.241  -1.732   5.383
  380    H    LYS  54           H        LYS  54  -1.555  -0.909   7.725
  381    HA   LYS  54           HA       LYS  54   0.717  -1.039   5.839
  382   1HB   LYS  54          1HB       LYS  54   0.225   0.316   8.332
  383   2HB   LYS  54          2HB       LYS  54   1.424  -0.911   8.715
  384   1HG   LYS  54          1HG       LYS  54   2.868  -0.036   6.858
  385   2HG   LYS  54          2HG       LYS  54   1.638   1.216   6.549
  386   1HD   LYS  54          1HD       LYS  54   1.940   2.094   8.851
  387   2HD   LYS  54          2HD       LYS  54   3.155   0.845   9.164
  388   1HE   LYS  54          1HE       LYS  54   4.249   2.937   8.678
  389   2HE   LYS  54          2HE       LYS  54   4.584   1.787   7.358
  390   1HZ   LYS  54          1HZ       LYS  54   2.446   3.834   7.260
  391   2HZ   LYS  54          2HZ       LYS  54   3.942   4.164   6.772
  392   3HZ   LYS  54          3HZ       LYS  54   3.152   2.956   5.960
  393    H    LEU  55           H        LEU  55   1.976  -2.891   5.516
  394    HA   LEU  55           HA       LEU  55   1.907  -4.923   7.660
  395   1HB   LEU  55          1HB       LEU  55   0.263  -6.002   6.890
  396   2HB   LEU  55          2HB       LEU  55   0.093  -5.048   5.436
  397    HG   LEU  55           HG       LEU  55   1.991  -7.426   5.590
  398   1HD1  LEU  55          1HD1      LEU  55   0.045  -8.645   4.534
  399   2HD1  LEU  55          2HD1      LEU  55  -0.205  -8.205   6.226
  400   3HD1  LEU  55          3HD1      LEU  55  -0.984  -7.279   4.921
  401   1HD2  LEU  55          1HD2      LEU  55   2.215  -5.810   3.641
  402   2HD2  LEU  55          2HD2      LEU  55   1.684  -7.435   3.169
  403   3HD2  LEU  55          3HD2      LEU  55   0.513  -6.110   3.264
  404    H    ASN  56           H        ASN  56   3.471  -6.542   7.597
  405    HA   ASN  56           HA       ASN  56   5.869  -5.600   6.187
  406   1HB   ASN  56          1HB       ASN  56   6.177  -6.072   8.520
  407   2HB   ASN  56          2HB       ASN  56   5.411  -7.655   8.365
  408   1HD2  ASN  56          1HD2      ASN  56   7.751  -6.547   5.804
  409   2HD2  ASN  56          2HD2      ASN  56   8.879  -7.838   6.196
  410    H    VAL  57           H        VAL  57   6.262  -6.445   4.223
  411    HA   VAL  57           HA       VAL  57   4.648  -8.260   2.934
  412    HB   VAL  57           HB       VAL  57   6.226  -6.553   2.049
  413   1HG1  VAL  57          1HG1      VAL  57   8.306  -7.292   3.199
  414   2HG1  VAL  57          2HG1      VAL  57   8.326  -8.768   2.224
  415   3HG1  VAL  57          3HG1      VAL  57   8.532  -7.197   1.448
  416   1HG2  VAL  57          1HG2      VAL  57   5.006  -8.109   0.581
  417   2HG2  VAL  57          2HG2      VAL  57   6.555  -7.592  -0.086
  418   3HG2  VAL  57          3HG2      VAL  57   6.377  -9.215   0.619
  419    H    ASP  58           H        ASP  58   7.483  -9.104   4.939
  420    HA   ASP  58           HA       ASP  58   7.880 -11.723   4.096
  421   1HB   ASP  58          1HB       ASP  58   8.265 -10.163   6.645
  422   2HB   ASP  58          2HB       ASP  58   8.999 -11.708   6.303
  423    H    GLU  59           H        GLU  59   5.479 -10.250   6.400
  424    HA   GLU  59           HA       GLU  59   4.889 -12.645   7.792
  425   1HB   GLU  59          1HB       GLU  59   3.753 -11.204   9.021
  426   2HB   GLU  59          2HB       GLU  59   4.599  -9.963   8.177
  427   1HG   GLU  59          1HG       GLU  59   2.573  -9.798   6.605
  428   2HG   GLU  59          2HG       GLU  59   1.744 -10.926   7.664
  429    H    ASN  60           H        ASN  60   3.961 -11.326   4.804
  430    HA   ASN  60           HA       ASN  60   1.434 -12.905   4.617
  431   1HB   ASN  60          1HB       ASN  60   0.736 -10.756   4.944
  432   2HB   ASN  60          2HB       ASN  60   2.081 -10.052   4.040
  433   1HD2  ASN  60          1HD2      ASN  60  -0.309 -12.644   2.887
  434   2HD2  ASN  60          2HD2      ASN  60  -0.614 -11.701   1.442
  435    HA   PRO  61           HA       PRO  61   3.837 -14.287   0.974
  436   1HB   PRO  61          1HB       PRO  61   3.018 -16.918   1.054
  437   2HB   PRO  61          2HB       PRO  61   4.412 -16.271   1.971
  438   1HG   PRO  61          1HG       PRO  61   1.573 -16.711   2.954
  439   2HG   PRO  61          2HG       PRO  61   3.109 -17.192   3.750
  440   1HD   PRO  61          1HD       PRO  61   1.791 -14.924   4.453
  441   2HD   PRO  61          2HD       PRO  61   3.568 -14.946   4.399
  442    H    GLU  62           H        GLU  62   0.327 -14.618   1.907
  443    HA   GLU  62           HA       GLU  62  -0.370 -15.582  -0.704
  444   1HB   GLU  62          1HB       GLU  62  -1.669 -16.115   1.327
  445   2HB   GLU  62          2HB       GLU  62  -2.147 -14.417   1.476
  446   1HG   GLU  62          1HG       GLU  62  -3.924 -15.810   0.464
  447   2HG   GLU  62          2HG       GLU  62  -3.400 -14.518  -0.607
  448    H    THR  63           H        THR  63  -1.259 -14.571  -2.372
  449    HA   THR  63           HA       THR  63  -1.408 -13.133  -4.040
  450    HB   THR  63           HB       THR  63  -2.045 -11.002  -1.976
  451    HG1  THR  63           1HG      THR  63  -3.237 -13.061  -2.061
  452   1HG2  THR  63          1HG2      THR  63  -3.406 -10.027  -3.836
  453   2HG2  THR  63          2HG2      THR  63  -1.673 -10.008  -4.208
  454   3HG2  THR  63          3HG2      THR  63  -2.732 -11.233  -4.945
  455    H    THR  64           H        THR  64   0.656 -12.143  -1.494
  456    HA   THR  64           HA       THR  64   2.425 -10.349  -2.772
  457    HB   THR  64           HB       THR  64   3.021 -12.477  -0.683
  458    HG1  THR  64           1HG      THR  64   2.369 -11.092   0.745
  459   1HG2  THR  64          1HG2      THR  64   4.459  -9.837  -1.013
  460   2HG2  THR  64          2HG2      THR  64   4.802 -11.121   0.152
  461   3HG2  THR  64          3HG2      THR  64   5.118 -11.397  -1.569
  462    H    SER  65           H        SER  65   2.787 -13.924  -2.328
  463    HA   SER  65           HA       SER  65   5.024 -14.230  -4.027
  464   1HB   SER  65          1HB       SER  65   4.168 -15.886  -2.360
  465   2HB   SER  65          2HB       SER  65   2.789 -16.220  -3.420
  466    HG   SER  65           HG       SER  65   5.545 -16.647  -3.983
  467    H    GLN  66           H        GLN  66   1.516 -14.442  -4.753
  468    HA   GLN  66           HA       GLN  66   1.701 -15.281  -7.404
  469   1HB   GLN  66          1HB       GLN  66  -0.344 -15.254  -6.017
  470   2HB   GLN  66          2HB       GLN  66  -0.404 -13.507  -6.099
  471   1HG   GLN  66          1HG       GLN  66  -2.020 -14.534  -7.625
  472   2HG   GLN  66          2HG       GLN  66  -0.860 -13.534  -8.483
  473   1HE2  GLN  66          1HE2      GLN  66   0.943 -14.672  -9.669
  474   2HE2  GLN  66          2HE2      GLN  66   0.578 -16.294 -10.290
  475    H    PHE  67           H        PHE  67   1.903 -11.942  -6.110
  476    HA   PHE  67           HA       PHE  67   2.227 -10.922  -8.892
  477   1HB   PHE  67          1HB       PHE  67   1.464  -9.659  -6.265
  478   2HB   PHE  67          2HB       PHE  67   2.068  -8.684  -7.596
  479    HD1  PHE  67           1HD      PHE  67   0.691  -8.039  -9.407
  480    HD2  PHE  67           2HD      PHE  67  -0.661 -11.078  -6.661
  481    HE1  PHE  67           1HE      PHE  67  -1.570  -7.952 -10.415
  482    HE2  PHE  67           2HE      PHE  67  -2.921 -10.986  -7.670
  483    HZ   PHE  67           HZ       PHE  67  -3.382  -9.425  -9.551
  484    H    GLY  68           H        GLY  68   4.348 -12.369  -6.923
  485   1HA   GLY  68          1HA       GLY  68   6.627 -12.329  -6.818
  486   2HA   GLY  68          2HA       GLY  68   6.608 -11.177  -8.160
  487    H    ILE  69           H        ILE  69   5.066 -10.578  -5.036
  488    HA   ILE  69           HA       ILE  69   6.237  -7.949  -4.988
  489    HB   ILE  69           HB       ILE  69   4.314  -9.398  -3.170
  490   1HG1  ILE  69          1HG1      ILE  69   3.476  -9.100  -5.448
  491   2HG1  ILE  69          2HG1      ILE  69   2.541  -8.200  -4.277
  492   1HG2  ILE  69          1HG2      ILE  69   3.549  -7.114  -2.478
  493   2HG2  ILE  69          2HG2      ILE  69   5.070  -7.642  -1.800
  494   3HG2  ILE  69          3HG2      ILE  69   5.066  -6.466  -3.136
  495   1HD1  ILE  69          1HD1      ILE  69   4.662  -6.996  -6.117
  496   2HD1  ILE  69          2HD1      ILE  69   2.903  -6.879  -6.309
  497   3HD1  ILE  69          3HD1      ILE  69   3.684  -6.108  -4.931
  498    H    MET  70           H        MET  70   8.434  -8.701  -4.849
  499    HA   MET  70           HA       MET  70   9.312  -8.510  -1.983
  500   1HB   MET  70          1HB       MET  70  10.616  -9.814  -4.393
  501   2HB   MET  70          2HB       MET  70  11.512  -9.433  -2.929
  502   1HG   MET  70          1HG       MET  70   9.016 -11.169  -2.856
  503   2HG   MET  70          2HG       MET  70  10.616 -11.801  -3.205
  504   1HE   MET  70          1HE       MET  70   8.066 -11.265  -0.551
  505   2HE   MET  70          2HE       MET  70   8.956 -10.901   0.944
  506   3HE   MET  70          3HE       MET  70   8.728  -9.638  -0.276
  507    H    SER  71           H        SER  71   8.785  -6.679  -4.668
  508    HA   SER  71           HA       SER  71  11.231  -5.138  -4.817
  509   1HB   SER  71          1HB       SER  71   9.778  -5.595  -6.775
  510   2HB   SER  71          2HB       SER  71   8.450  -4.710  -5.993
  511    HG   SER  71           HG       SER  71   9.946  -2.930  -5.885
  512    H    ILE  72           H        ILE  72  10.054  -5.142  -2.104
  513    HA   ILE  72           HA       ILE  72   8.508  -2.832  -1.808
  514    HB   ILE  72           HB       ILE  72   8.469  -3.182   0.502
  515   1HG1  ILE  72          1HG1      ILE  72  10.718  -3.565   1.072
  516   2HG1  ILE  72          2HG1      ILE  72   9.682  -4.809   1.751
  517   1HG2  ILE  72          1HG2      ILE  72   7.468  -5.305   0.590
  518   2HG2  ILE  72          2HG2      ILE  72   7.147  -4.632  -1.009
  519   3HG2  ILE  72          3HG2      ILE  72   8.369  -5.903  -0.821
  520   1HD1  ILE  72          1HD1      ILE  72  11.784  -5.731   1.018
  521   2HD1  ILE  72          2HD1      ILE  72  10.494  -6.401   0.003
  522   3HD1  ILE  72          3HD1      ILE  72  11.576  -5.118  -0.617
  523    HA   PRO  73           HA       PRO  73   8.300  -1.082   0.282
  524   1HB   PRO  73          1HB       PRO  73   7.879   1.522  -0.273
  525   2HB   PRO  73          2HB       PRO  73   8.942   0.958   1.026
  526   1HG   PRO  73          1HG       PRO  73   9.723   1.851  -1.766
  527   2HG   PRO  73          2HG       PRO  73  10.494   2.312  -0.219
  528   1HD   PRO  73          1HD       PRO  73  11.479   0.325  -1.837
  529   2HD   PRO  73          2HD       PRO  73  11.612   0.229  -0.064
  530    H    THR  74           H        THR  74   6.436  -1.672  -0.620
  531    HA   THR  74           HA       THR  74   5.809  -0.794  -3.401
  532    HB   THR  74           HB       THR  74   5.292  -3.531  -2.171
  533    HG1  THR  74           1HG      THR  74   7.353  -2.539  -3.561
  534   1HG2  THR  74          1HG2      THR  74   3.437  -3.048  -3.653
  535   2HG2  THR  74          2HG2      THR  74   4.526  -2.436  -4.907
  536   3HG2  THR  74          3HG2      THR  74   4.548  -4.145  -4.482
  537    H    LEU  75           H        LEU  75   3.652  -0.489  -3.849
  538    HA   LEU  75           HA       LEU  75   1.709  -0.109  -1.610
  539   1HB   LEU  75          1HB       LEU  75   2.895   2.009  -2.280
  540   2HB   LEU  75          2HB       LEU  75   2.265   1.809  -3.900
  541    HG   LEU  75           HG       LEU  75   0.283   1.655  -1.627
  542   1HD1  LEU  75          1HD1      LEU  75   1.661   4.151  -2.630
  543   2HD1  LEU  75          2HD1      LEU  75   0.180   4.159  -1.642
  544   3HD1  LEU  75          3HD1      LEU  75   1.683   3.496  -0.973
  545   1HD2  LEU  75          1HD2      LEU  75  -0.550   1.390  -3.947
  546   2HD2  LEU  75          2HD2      LEU  75  -1.147   2.888  -3.239
  547   3HD2  LEU  75          3HD2      LEU  75   0.195   2.931  -4.403
  548    H    ILE  76           H        ILE  76  -0.192  -1.240  -2.250
  549    HA   ILE  76           HA       ILE  76  -0.785  -1.186  -5.134
  550    HB   ILE  76           HB       ILE  76  -1.313  -3.566  -3.366
  551   1HG1  ILE  76          1HG1      ILE  76   0.849  -3.206  -5.466
  552   2HG1  ILE  76          2HG1      ILE  76   1.044  -3.598  -3.760
  553   1HG2  ILE  76          1HG2      ILE  76  -1.706  -3.129  -6.378
  554   2HG2  ILE  76          2HG2      ILE  76  -2.067  -4.637  -5.525
  555   3HG2  ILE  76          3HG2      ILE  76  -3.007  -3.211  -5.167
  556   1HD1  ILE  76          1HD1      ILE  76   0.063  -5.413  -5.972
  557   2HD1  ILE  76          2HD1      ILE  76   1.446  -5.604  -4.888
  558   3HD1  ILE  76          3HD1      ILE  76  -0.195  -5.790  -4.250
  559    H    LEU  77           H        LEU  77  -2.872  -0.728  -5.516
  560    HA   LEU  77           HA       LEU  77  -4.588  -0.070  -3.177
  561   1HB   LEU  77          1HB       LEU  77  -3.739   1.841  -4.602
  562   2HB   LEU  77          2HB       LEU  77  -4.673   1.188  -5.923
  563    HG   LEU  77           HG       LEU  77  -5.958   2.921  -5.043
  564   1HD1  LEU  77          1HD1      LEU  77  -7.348   0.748  -5.180
  565   2HD1  LEU  77          2HD1      LEU  77  -7.228   0.684  -3.420
  566   3HD1  LEU  77          3HD1      LEU  77  -8.005   2.050  -4.210
  567   1HD2  LEU  77          1HD2      LEU  77  -4.650   3.196  -2.942
  568   2HD2  LEU  77          2HD2      LEU  77  -6.393   3.369  -2.700
  569   3HD2  LEU  77          3HD2      LEU  77  -5.577   1.864  -2.230
  570    H    PHE  78           H        PHE  78  -6.231  -1.396  -3.030
  571    HA   PHE  78           HA       PHE  78  -7.085  -3.127  -5.304
  572   1HB   PHE  78          1HB       PHE  78  -6.974  -3.699  -2.320
  573   2HB   PHE  78          2HB       PHE  78  -7.693  -4.762  -3.506
  574    HD1  PHE  78           1HD      PHE  78  -6.353  -6.119  -5.025
  575    HD2  PHE  78           2HD      PHE  78  -4.541  -3.601  -2.032
  576    HE1  PHE  78           1HE      PHE  78  -4.269  -7.446  -5.181
  577    HE2  PHE  78           2HE      PHE  78  -2.500  -5.004  -2.106
  578    HZ   PHE  78           HZ       PHE  78  -2.347  -6.908  -3.711
  579    H    LYS  79           H        LYS  79  -9.226  -3.916  -5.264
  580    HA   LYS  79           HA       LYS  79 -11.052  -3.457  -3.215
  581   1HB   LYS  79          1HB       LYS  79 -12.837  -2.368  -4.776
  582   2HB   LYS  79          2HB       LYS  79 -11.728  -1.394  -3.844
  583   1HG   LYS  79          1HG       LYS  79 -12.123  -0.441  -5.997
  584   2HG   LYS  79          2HG       LYS  79 -10.428  -0.794  -5.781
  585   1HD   LYS  79          1HD       LYS  79 -12.185  -2.751  -7.314
  586   2HD   LYS  79          2HD       LYS  79 -11.670  -1.230  -8.057
  587   1HE   LYS  79          1HE       LYS  79  -9.273  -1.862  -7.338
  588   2HE   LYS  79          2HE       LYS  79  -9.905  -3.476  -7.056
  589   1HZ   LYS  79          1HZ       LYS  79 -10.550  -3.628  -9.395
  590   2HZ   LYS  79          2HZ       LYS  79 -10.088  -2.083  -9.664
  591   3HZ   LYS  79          3HZ       LYS  79  -8.970  -3.229  -9.296
  592    H    GLY  80           H        GLY  80 -12.985  -4.785  -3.604
  593   1HA   GLY  80          1HA       GLY  80 -14.130  -6.590  -4.419
  594   2HA   GLY  80          2HA       GLY  80 -13.691  -6.012  -6.026
  595    H    GLY  81           H        GLY  81 -10.985  -6.908  -4.025
  596   1HA   GLY  81          1HA       GLY  81  -9.888  -8.978  -3.793
  597   2HA   GLY  81          2HA       GLY  81 -10.829  -9.662  -5.116
  598    H    GLU  82           H        GLU  82  -9.928  -6.683  -6.404
  599    HA   GLU  82           HA       GLU  82  -7.460  -7.785  -7.566
  600   1HB   GLU  82          1HB       GLU  82  -8.415  -6.685  -9.629
  601   2HB   GLU  82          2HB       GLU  82  -9.233  -8.163  -9.085
  602   1HG   GLU  82          1HG       GLU  82 -11.136  -6.956  -8.331
  603   2HG   GLU  82          2HG       GLU  82 -10.242  -5.435  -8.301
  604    HA   PRO  83           HA       PRO  83  -5.888  -3.659  -6.855
  605   1HB   PRO  83          1HB       PRO  83  -3.913  -3.397  -8.691
  606   2HB   PRO  83          2HB       PRO  83  -3.827  -4.588  -7.357
  607   1HG   PRO  83          1HG       PRO  83  -4.726  -5.081 -10.214
  608   2HG   PRO  83          2HG       PRO  83  -3.515  -6.003  -9.261
  609   1HD   PRO  83          1HD       PRO  83  -6.125  -6.791  -9.461
  610   2HD   PRO  83          2HD       PRO  83  -5.186  -7.027  -7.956
  611    H    VAL  84           H        VAL  84  -5.802  -1.462  -7.825
  612    HA   VAL  84           HA       VAL  84  -6.908  -1.195 -10.591
  613    HB   VAL  84           HB       VAL  84  -6.748   1.352  -9.721
  614   1HG1  VAL  84          1HG1      VAL  84  -9.233  -0.300  -9.219
  615   2HG1  VAL  84          2HG1      VAL  84  -9.139   1.431  -9.560
  616   3HG1  VAL  84          3HG1      VAL  84  -8.711   0.272 -10.825
  617   1HG2  VAL  84          1HG2      VAL  84  -7.755   1.657  -7.537
  618   2HG2  VAL  84          2HG2      VAL  84  -7.698  -0.088  -7.243
  619   3HG2  VAL  84          3HG2      VAL  84  -6.189   0.842  -7.425
  620    H    LYS  85           H        LYS  85  -4.169  -0.538  -8.343
  621    HA   LYS  85           HA       LYS  85  -2.363  -0.560 -10.522
  622   1HB   LYS  85          1HB       LYS  85  -1.386   1.717 -10.148
  623   2HB   LYS  85          2HB       LYS  85  -2.956   1.700 -10.927
  624   1HG   LYS  85          1HG       LYS  85  -4.029   2.305  -8.716
  625   2HG   LYS  85          2HG       LYS  85  -2.413   2.370  -8.001
  626   1HD   LYS  85          1HD       LYS  85  -3.122   4.623  -8.566
  627   2HD   LYS  85          2HD       LYS  85  -1.790   4.165  -9.625
  628   1HE   LYS  85          1HE       LYS  85  -3.405   5.313 -10.958
  629   2HE   LYS  85          2HE       LYS  85  -3.528   3.602 -11.401
  630   1HZ   LYS  85          1HZ       LYS  85  -5.334   5.211  -9.707
  631   2HZ   LYS  85          2HZ       LYS  85  -5.717   4.611 -11.071
  632   3HZ   LYS  85          3HZ       LYS  85  -5.478   3.536  -9.814
  633    H    GLN  86           H        GLN  86  -0.119  -0.164  -9.714
  634    HA   GLN  86           HA       GLN  86   0.378  -0.810  -6.906
  635   1HB   GLN  86          1HB       GLN  86   0.405  -2.992  -7.809
  636   2HB   GLN  86          2HB       GLN  86   1.067  -2.468  -9.355
  637   1HG   GLN  86          1HG       GLN  86   3.264  -2.140  -8.448
  638   2HG   GLN  86          2HG       GLN  86   2.725  -2.402  -6.795
  639   1HE2  GLN  86          1HE2      GLN  86   4.868  -3.900  -7.710
  640   2HE2  GLN  86          2HE2      GLN  86   4.315  -5.547  -7.985
  641    H    LEU  87           H        LEU  87   2.340   0.119  -6.248
  642    HA   LEU  87           HA       LEU  87   4.065   1.445  -8.262
  643   1HB   LEU  87          1HB       LEU  87   3.270   2.679  -5.597
  644   2HB   LEU  87          2HB       LEU  87   4.318   3.392  -6.813
  645    HG   LEU  87           HG       LEU  87   1.351   2.835  -7.182
  646   1HD1  LEU  87          1HD1      LEU  87   1.097   5.278  -6.968
  647   2HD1  LEU  87          2HD1      LEU  87   1.707   4.527  -5.480
  648   3HD1  LEU  87          3HD1      LEU  87   2.818   5.418  -6.547
  649   1HD2  LEU  87          1HD2      LEU  87   1.520   4.150  -9.195
  650   2HD2  LEU  87          2HD2      LEU  87   3.237   4.534  -8.872
  651   3HD2  LEU  87          3HD2      LEU  87   2.740   2.895  -9.310
  652    H    ILE  88           H        ILE  88   6.272   1.688  -7.477
  653    HA   ILE  88           HA       ILE  88   7.055   0.046  -5.185
  654    HB   ILE  88           HB       ILE  88   8.695  -1.142  -6.688
  655   1HG1  ILE  88          1HG1      ILE  88   6.940  -0.048  -8.942
  656   2HG1  ILE  88          2HG1      ILE  88   8.667   0.224  -8.693
  657   1HG2  ILE  88          1HG2      ILE  88   5.791  -1.794  -7.307
  658   2HG2  ILE  88          2HG2      ILE  88   7.175  -2.918  -7.223
  659   3HG2  ILE  88          3HG2      ILE  88   6.601  -2.127  -5.765
  660   1HD1  ILE  88          1HD1      ILE  88   9.024  -2.255  -9.047
  661   2HD1  ILE  88          2HD1      ILE  88   7.299  -2.378  -9.480
  662   3HD1  ILE  88          3HD1      ILE  88   8.379  -1.380 -10.457
  663    H    GLY  89           H        GLY  89   8.936   0.716  -4.319
  664   1HA   GLY  89          1HA       GLY  89  10.958   1.880  -4.115
  665   2HA   GLY  89          2HA       GLY  89  10.728   2.604  -5.716
  666    H    TYR  90           H        TYR  90  11.578   4.122  -3.560
  667    HA   TYR  90           HA       TYR  90   9.424   5.311  -2.098
  668   1HB   TYR  90          1HB       TYR  90  11.628   4.995  -1.144
  669   2HB   TYR  90          2HB       TYR  90  12.331   6.065  -2.351
  670    HD1  TYR  90           1HD      TYR  90   9.055   7.046  -0.853
  671    HD2  TYR  90           2HD      TYR  90  13.360   7.382  -0.550
  672    HE1  TYR  90           1HE      TYR  90   8.799   8.790   0.817
  673    HE2  TYR  90           2HE      TYR  90  13.077   9.192   1.135
  674    HH   TYR  90           HH       TYR  90  10.166   9.493   2.808
  675    H    GLN  91           H        GLN  91   8.105   5.927  -4.009
  676    HA   GLN  91           HA       GLN  91   8.832   8.354  -5.419
  677   1HB   GLN  91          1HB       GLN  91   5.953   7.661  -4.765
  678   2HB   GLN  91          2HB       GLN  91   6.604   8.533  -6.127
  679   1HG   GLN  91          1HG       GLN  91   6.985   5.537  -5.740
  680   2HG   GLN  91          2HG       GLN  91   5.765   6.295  -6.749
  681   1HE2  GLN  91          1HE2      GLN  91   6.310   6.620  -8.927
  682   2HE2  GLN  91          2HE2      GLN  91   7.983   6.635  -9.474
  683    HA   PRO  92           HA       PRO  92   8.114  11.024  -1.855
  684   1HB   PRO  92          1HB       PRO  92   7.926  13.491  -3.037
  685   2HB   PRO  92          2HB       PRO  92   9.468  12.600  -2.872
  686   1HG   PRO  92          1HG       PRO  92   7.649  12.757  -5.276
  687   2HG   PRO  92          2HG       PRO  92   9.428  12.932  -5.226
  688   1HD   PRO  92          1HD       PRO  92   8.192  10.572  -5.904
  689   2HD   PRO  92          2HD       PRO  92   9.752  10.610  -5.029
  690    H    LYS  93           H        LYS  93   6.423  12.344  -0.949
  691    HA   LYS  93           HA       LYS  93   3.986  11.188  -1.070
  692   1HB   LYS  93          1HB       LYS  93   5.153  13.496   0.238
  693   2HB   LYS  93          2HB       LYS  93   3.604  14.007  -0.356
  694   1HG   LYS  93          1HG       LYS  93   4.159  11.760   1.578
  695   2HG   LYS  93          2HG       LYS  93   3.309  13.272   1.869
  696   1HD   LYS  93          1HD       LYS  93   2.326  10.931   0.186
  697   2HD   LYS  93          2HD       LYS  93   1.776  11.384   1.764
  698   1HE   LYS  93          1HE       LYS  93   1.472  13.178  -0.681
  699   2HE   LYS  93          2HE       LYS  93   0.259  12.029  -0.122
  700   1HZ   LYS  93          1HZ       LYS  93  -0.371  13.985   0.694
  701   2HZ   LYS  93          2HZ       LYS  93   0.315  13.279   2.050
  702   3HZ   LYS  93          3HZ       LYS  93   1.126  14.476   1.198
  703    H    GLU  94           H        GLU  94   4.802  14.210  -2.718
  704    HA   GLU  94           HA       GLU  94   2.198  14.663  -3.695
  705   1HB   GLU  94          1HB       GLU  94   4.788  15.830  -4.651
  706   2HB   GLU  94          2HB       GLU  94   3.157  16.421  -5.034
  707   1HG   GLU  94          1HG       GLU  94   4.465  16.235  -2.295
  708   2HG   GLU  94          2HG       GLU  94   4.003  17.689  -3.198
  709    H    GLN  95           H        GLN  95   4.729  12.537  -4.954
  710    HA   GLN  95           HA       GLN  95   3.729  12.476  -7.701
  711   1HB   GLN  95          1HB       GLN  95   6.147  11.980  -6.704
  712   2HB   GLN  95          2HB       GLN  95   5.484  10.421  -6.308
  713   1HG   GLN  95          1HG       GLN  95   6.595  10.211  -8.433
  714   2HG   GLN  95          2HG       GLN  95   4.859  10.088  -8.724
  715   1HE2  GLN  95          1HE2      GLN  95   7.684  12.357  -8.931
  716   2HE2  GLN  95          2HE2      GLN  95   6.912  13.356 -10.156
  717    H    LEU  96           H        LEU  96   3.589  10.806  -4.626
  718    HA   LEU  96           HA       LEU  96   2.087   8.511  -5.335
  719   1HB   LEU  96          1HB       LEU  96   3.320   9.389  -3.094
  720   2HB   LEU  96          2HB       LEU  96   1.698   9.808  -2.700
  721    HG   LEU  96           HG       LEU  96   1.802   7.748  -1.738
  722   1HD1  LEU  96          1HD1      LEU  96   0.516   6.127  -2.912
  723   2HD1  LEU  96          2HD1      LEU  96  -0.058   7.680  -3.492
  724   3HD1  LEU  96          3HD1      LEU  96   1.031   6.723  -4.500
  725   1HD2  LEU  96          1HD2      LEU  96   3.510   6.754  -4.048
  726   2HD2  LEU  96          2HD2      LEU  96   4.084   7.273  -2.443
  727   3HD2  LEU  96          3HD2      LEU  96   3.073   5.836  -2.590
  728    H    GLU  97           H        GLU  97   0.906  11.660  -3.816
  729    HA   GLU  97           HA       GLU  97  -1.810  10.930  -4.236
  730   1HB   GLU  97          1HB       GLU  97  -0.272  13.301  -3.229
  731   2HB   GLU  97          2HB       GLU  97  -1.849  13.634  -3.921
  732   1HG   GLU  97          1HG       GLU  97  -2.748  11.702  -2.483
  733   2HG   GLU  97          2HG       GLU  97  -1.187  11.718  -1.672
  734    H    ALA  98           H        ALA  98   0.534  12.443  -6.374
  735    HA   ALA  98           HA       ALA  98  -1.546  13.323  -8.245
  736   1HB   ALA  98          1HB       ALA  98   0.321  13.525  -9.868
  737   2HB   ALA  98          2HB       ALA  98   0.701  14.332  -8.336
  738   3HB   ALA  98          3HB       ALA  98   1.423  12.750  -8.710
  739    H    GLN  99           H        GLN  99   0.672  10.480  -8.146
  740    HA   GLN  99           HA       GLN  99  -0.342   9.300 -10.503
  741   1HB   GLN  99          1HB       GLN  99   1.792   8.766  -9.391
  742   2HB   GLN  99          2HB       GLN  99   0.946   8.013  -8.051
  743   1HG   GLN  99          1HG       GLN  99   1.906   6.389  -9.606
  744   2HG   GLN  99          2HG       GLN  99   0.160   6.200  -9.452
  745   1HE2  GLN  99          1HE2      GLN  99  -1.200   7.162 -11.283
  746   2HE2  GLN  99          2HE2      GLN  99  -0.462   7.099 -12.895
  747    H    LEU 100           H        LEU 100  -1.359   8.951  -7.143
  748    HA   LEU 100           HA       LEU 100  -3.447   7.002  -7.829
  749   1HB   LEU 100          1HB       LEU 100  -1.896   7.703  -5.490
  750   2HB   LEU 100          2HB       LEU 100  -3.570   7.909  -5.124
  751    HG   LEU 100           HG       LEU 100  -3.866   5.500  -6.149
  752   1HD1  LEU 100          1HD1      LEU 100  -1.533   5.542  -7.207
  753   2HD1  LEU 100          2HD1      LEU 100  -0.863   5.460  -5.573
  754   3HD1  LEU 100          3HD1      LEU 100  -1.850   4.120  -6.186
  755   1HD2  LEU 100          1HD2      LEU 100  -4.030   5.895  -3.737
  756   2HD2  LEU 100          2HD2      LEU 100  -3.100   4.418  -4.048
  757   3HD2  LEU 100          3HD2      LEU 100  -2.254   5.905  -3.587
  758    H    ALA 101           H        ALA 101  -3.401  10.349  -8.228
  759    HA   ALA 101           HA       ALA 101  -5.541  11.352  -6.848
  760   1HB   ALA 101          1HB       ALA 101  -5.739  13.005  -8.665
  761   2HB   ALA 101          2HB       ALA 101  -4.046  12.713  -8.253
  762   3HB   ALA 101          3HB       ALA 101  -4.737  11.987  -9.718
  763    H    ASP 102           H        ASP 102  -5.784   9.180  -9.667
  764    HA   ASP 102           HA       ASP 102  -8.534   9.790 -10.316
  765   1HB   ASP 102          1HB       ASP 102  -8.391   7.869 -11.755
  766   2HB   ASP 102          2HB       ASP 102  -6.857   8.730 -11.873
  767    H    VAL 103           H        VAL 103  -7.092   8.018  -7.727
  768    HA   VAL 103           HA       VAL 103  -9.711   6.792  -7.007
  769    HB   VAL 103           HB       VAL 103  -6.901   6.040  -6.365
  770   1HG1  VAL 103          1HG1      VAL 103  -9.459   4.922  -5.193
  771   2HG1  VAL 103          2HG1      VAL 103  -7.893   4.085  -5.145
  772   3HG1  VAL 103          3HG1      VAL 103  -8.082   5.622  -4.305
  773   1HG2  VAL 103          1HG2      VAL 103  -7.450   3.945  -7.468
  774   2HG2  VAL 103          2HG2      VAL 103  -9.123   4.493  -7.736
  775   3HG2  VAL 103          3HG2      VAL 103  -7.774   5.285  -8.566
  776    H    LEU 104           H        LEU 104  -7.853   9.549  -6.404
  777    HA   LEU 104           HA       LEU 104  -9.033   9.852  -3.712
  778   1HB   LEU 104          1HB       LEU 104  -6.435  10.632  -5.014
  779   2HB   LEU 104          2HB       LEU 104  -7.101  11.725  -3.860
  780    HG   LEU 104           HG       LEU 104  -5.536  10.331  -2.727
  781   1HD1  LEU 104          1HD1      LEU 104  -8.205   9.094  -1.955
  782   2HD1  LEU 104          2HD1      LEU 104  -6.765   9.302  -0.963
  783   3HD1  LEU 104          3HD1      LEU 104  -7.686  10.736  -1.489
  784   1HD2  LEU 104          1HD2      LEU 104  -7.021   7.820  -3.586
  785   2HD2  LEU 104          2HD2      LEU 104  -5.542   8.424  -4.343
  786   3HD2  LEU 104          3HD2      LEU 104  -5.530   7.926  -2.642
  787    H    GLN 105           H        GLN 105  -9.422  10.849  -6.894
  788    HA   GLN 105           HA       GLN 105 -10.595  13.376  -6.720
  789   1HB   GLN 105          2HB       GLN 105 -10.128  12.055  -8.752
  790   2HB   GLN 105          3HB       GLN 105 -11.467  10.998  -8.364
  791   1HG   GLN 105          2HG       GLN 105 -11.984  13.978  -8.583
  792   2HG   GLN 105          3HG       GLN 105 -11.637  13.082 -10.051
  793   1HE2  GLN 105          1HE2      GLN 105 -13.885  13.011  -7.204
  794   2HE2  GLN 105          2HE2      GLN 105 -15.235  12.372  -8.170
  Start of MODEL   13
    1   1H    ALA   1           H        ALA   1 -10.834   3.088   5.514
    2   2H    ALA   1          2HN       ALA   1 -11.398   4.640   5.713
    3   3H    ALA   1          3HN       ALA   1  -9.808   4.351   5.415
    4    HA   ALA   1           HA       ALA   1 -10.284   4.887   7.758
    5   1HB   ALA   1          1HB       ALA   1 -12.388   3.603   7.946
    6   2HB   ALA   1          2HB       ALA   1 -11.491   2.089   7.663
    7   3HB   ALA   1          3HB       ALA   1 -11.188   3.044   9.129
    8    H    THR   2           H        THR   2  -8.592   4.157   9.298
    9    HA   THR   2           HA       THR   2  -6.540   2.532   7.867
   10    HB   THR   2           HB       THR   2  -6.062   4.722   9.916
   11    HG1  THR   2           1HG      THR   2  -7.110   5.490   7.917
   12   1HG2  THR   2          1HG2      THR   2  -4.298   3.333   7.832
   13   2HG2  THR   2          2HG2      THR   2  -3.787   4.683   8.865
   14   3HG2  THR   2          3HG2      THR   2  -4.202   3.119   9.588
   15    H    MET   3           H        MET   3  -6.033   0.625   8.865
   16    HA   MET   3           HA       MET   3  -5.975   0.564  11.795
   17   1HB   MET   3          1HB       MET   3  -8.338  -0.153  10.756
   18   2HB   MET   3          2HB       MET   3  -7.491  -1.668  10.442
   19   1HG   MET   3          1HG       MET   3  -6.873  -1.628  12.965
   20   2HG   MET   3          2HG       MET   3  -7.979  -0.266  13.097
   21   1HE   MET   3          1HE       MET   3  -9.076  -4.685  12.286
   22   2HE   MET   3          2HE       MET   3  -8.098  -3.757  11.128
   23   3HE   MET   3          3HE       MET   3  -7.476  -4.068  12.765
   24    H    THR   4           H        THR   4  -4.361  -0.128   9.144
   25    HA   THR   4           HA       THR   4  -2.885  -1.641   8.353
   26    HB   THR   4           HB       THR   4  -2.241  -0.956  11.017
   27    HG1  THR   4           1HG      THR   4  -0.372  -1.754   9.071
   28   1HG2  THR   4          1HG2      THR   4  -2.131  -3.397  11.536
   29   2HG2  THR   4          2HG2      THR   4  -0.876  -3.562  10.278
   30   3HG2  THR   4          3HG2      THR   4  -0.597  -2.521  11.677
   31    H    LEU   5           H        LEU   5  -1.926  -4.121   8.791
   32    HA   LEU   5           HA       LEU   5  -4.236  -5.942   8.721
   33   1HB   LEU   5          1HB       LEU   5  -2.334  -5.337   6.434
   34   2HB   LEU   5          2HB       LEU   5  -3.505  -6.657   6.419
   35    HG   LEU   5           HG       LEU   5  -4.243  -3.717   6.568
   36   1HD1  LEU   5          1HD1      LEU   5  -3.057  -4.208   4.464
   37   2HD1  LEU   5          2HD1      LEU   5  -4.173  -5.540   4.139
   38   3HD1  LEU   5          3HD1      LEU   5  -4.774  -3.871   4.174
   39   1HD2  LEU   5          1HD2      LEU   5  -6.010  -5.110   7.419
   40   2HD2  LEU   5          2HD2      LEU   5  -6.456  -4.395   5.873
   41   3HD2  LEU   5          3HD2      LEU   5  -5.964  -6.098   5.937
   42    H    THR   6           H        THR   6  -3.298  -8.187   8.209
   43    HA   THR   6           HA       THR   6  -0.492  -8.471   9.114
   44    HB   THR   6           HB       THR   6  -2.843 -10.130  10.062
   45    HG1  THR   6           1HG      THR   6  -1.056  -8.337  11.320
   46   1HG2  THR   6          1HG2      THR   6  -0.811 -11.565   9.812
   47   2HG2  THR   6          2HG2      THR   6   0.101 -10.416  10.809
   48   3HG2  THR   6          3HG2      THR   6  -1.262 -11.316  11.505
   49    H    ASP   7           H        ASP   7  -2.703 -11.065   8.189
   50    HA   ASP   7           HA       ASP   7  -1.526 -11.150   5.466
   51   1HB   ASP   7          1HB       ASP   7  -0.090 -12.629   6.733
   52   2HB   ASP   7          2HB       ASP   7  -1.478 -13.430   7.475
   53    H    ALA   8           H        ALA   8  -3.651 -13.283   7.429
   54    HA   ALA   8           HA       ALA   8  -5.619 -13.707   5.530
   55   1HB   ALA   8          1HB       ALA   8  -5.999 -13.295   8.533
   56   2HB   ALA   8          2HB       ALA   8  -7.116 -14.147   7.448
   57   3HB   ALA   8          3HB       ALA   8  -5.493 -14.813   7.748
   58    H    ASN   9           H        ASN   9  -5.031 -10.789   7.350
   59    HA   ASN   9           HA       ASN   9  -7.674  -9.618   6.976
   60   1HB   ASN   9          1HB       ASN   9  -5.947  -9.182   8.863
   61   2HB   ASN   9          2HB       ASN   9  -5.206  -8.083   7.683
   62   1HD2  ASN   9          1HD2      ASN   9  -5.994  -6.889  10.010
   63   2HD2  ASN   9          2HD2      ASN   9  -7.479  -6.015   9.700
   64    H    PHE  10           H        PHE  10  -4.700  -9.854   5.098
   65    HA   PHE  10           HA       PHE  10  -4.917  -7.457   3.544
   66   1HB   PHE  10          1HB       PHE  10  -2.868  -8.764   3.725
   67   2HB   PHE  10          2HB       PHE  10  -3.604 -10.132   2.914
   68    HD1  PHE  10           1HD      PHE  10  -1.876  -6.974   2.439
   69    HD2  PHE  10           2HD      PHE  10  -4.156 -10.044   0.445
   70    HE1  PHE  10           1HE      PHE  10  -1.054  -6.178   0.253
   71    HE2  PHE  10           2HE      PHE  10  -3.347  -9.223  -1.721
   72    HZ   PHE  10           HZ       PHE  10  -1.762  -7.311  -1.828
   73    H    GLN  11           H        GLN  11  -5.769 -10.833   2.641
   74    HA   GLN  11           HA       GLN  11  -7.173 -10.110   0.299
   75   1HB   GLN  11          1HB       GLN  11  -6.267 -12.375   1.002
   76   2HB   GLN  11          2HB       GLN  11  -7.760 -12.591   1.932
   77   1HG   GLN  11          1HG       GLN  11  -9.055 -12.227  -0.194
   78   2HG   GLN  11          2HG       GLN  11  -7.534 -12.023  -1.077
   79   1HE2  GLN  11          1HE2      GLN  11  -5.942 -13.974  -1.094
   80   2HE2  GLN  11          2HE2      GLN  11  -6.733 -15.539  -1.016
   81    H    GLN  12           H        GLN  12  -8.335 -10.607   3.661
   82    HA   GLN  12           HA       GLN  12 -11.109 -10.272   3.158
   83   1HB   GLN  12          1HB       GLN  12 -10.118 -11.340   5.158
   84   2HB   GLN  12          2HB       GLN  12  -9.379  -9.807   5.630
   85   1HG   GLN  12          1HG       GLN  12 -11.566  -8.828   6.088
   86   2HG   GLN  12          2HG       GLN  12 -12.373 -10.279   5.469
   87   1HE2  GLN  12          1HE2      GLN  12 -13.431 -10.848   7.455
   88   2HE2  GLN  12          2HE2      GLN  12 -12.489 -11.315   8.868
   89    H    ALA  13           H        ALA  13  -8.549  -7.788   3.633
   90    HA   ALA  13           HA       ALA  13 -10.469  -5.652   3.720
   91   1HB   ALA  13          1HB       ALA  13  -7.480  -5.622   3.128
   92   2HB   ALA  13          2HB       ALA  13  -8.507  -4.200   3.431
   93   3HB   ALA  13          3HB       ALA  13  -8.262  -5.403   4.709
   94    H    ILE  14           H        ILE  14  -8.152  -6.777   1.174
   95    HA   ILE  14           HA       ILE  14  -8.933  -4.851  -0.705
   96    HB   ILE  14           HB       ILE  14  -7.736  -6.184  -2.386
   97   1HG1  ILE  14          1HG1      ILE  14  -7.427  -8.282  -0.318
   98   2HG1  ILE  14          2HG1      ILE  14  -8.546  -8.419  -1.666
   99   1HG2  ILE  14          1HG2      ILE  14  -6.499  -4.724  -0.811
  100   2HG2  ILE  14          2HG2      ILE  14  -6.273  -6.094   0.291
  101   3HG2  ILE  14          3HG2      ILE  14  -5.532  -6.107  -1.311
  102   1HD1  ILE  14          1HD1      ILE  14  -5.520  -8.287  -1.858
  103   2HD1  ILE  14          2HD1      ILE  14  -6.566  -9.665  -2.222
  104   3HD1  ILE  14          3HD1      ILE  14  -6.614  -8.219  -3.254
  105    H    GLN  15           H        GLN  15 -10.581  -7.771   0.009
  106    HA   GLN  15           HA       GLN  15 -12.116  -8.130  -2.345
  107   1HB   GLN  15          1HB       GLN  15 -13.523  -9.523  -0.975
  108   2HB   GLN  15          2HB       GLN  15 -11.861  -9.723  -0.448
  109   1HG   GLN  15          1HG       GLN  15 -12.906  -9.583   1.578
  110   2HG   GLN  15          2HG       GLN  15 -12.440  -7.899   1.324
  111   1HE2  GLN  15          1HE2      GLN  15 -14.047  -6.619   2.189
  112   2HE2  GLN  15          2HE2      GLN  15 -15.770  -6.914   1.928
  113    H    GLY  16           H        GLY  16 -12.292  -5.471  -0.037
  114   1HA   GLY  16          1HA       GLY  16 -15.065  -4.882  -0.233
  115   2HA   GLY  16          2HA       GLY  16 -13.759  -3.774   0.235
  116    H    ASP  17           H        ASP  17 -16.001  -3.007  -1.302
  117    HA   ASP  17           HA       ASP  17 -15.324  -2.795  -4.133
  118   1HB   ASP  17          1HB       ASP  17 -17.385  -1.538  -4.259
  119   2HB   ASP  17          2HB       ASP  17 -17.674  -2.985  -3.293
  120    H    GLY  18           H        GLY  18 -15.291  -0.781  -1.220
  121   1HA   GLY  18          1HA       GLY  18 -14.471   1.655  -2.409
  122   2HA   GLY  18          2HA       GLY  18 -14.217   1.206  -0.712
  123    HA   PRO  19           HA       PRO  19 -10.103   1.214  -3.199
  124   1HB   PRO  19          1HB       PRO  19  -9.024   3.578  -2.284
  125   2HB   PRO  19          2HB       PRO  19 -10.019   3.446  -3.764
  126   1HG   PRO  19          1HG       PRO  19 -10.936   4.253  -0.995
  127   2HG   PRO  19          2HG       PRO  19 -11.263   5.077  -2.553
  128   1HD   PRO  19          1HD       PRO  19 -13.047   3.396  -1.400
  129   2HD   PRO  19          2HD       PRO  19 -12.816   3.396  -3.175
  130    H    VAL  20           H        VAL  20  -9.206  -0.430  -2.055
  131    HA   VAL  20           HA       VAL  20  -8.296   0.078   0.750
  132    HB   VAL  20           HB       VAL  20  -8.452  -2.450  -0.944
  133   1HG1  VAL  20          1HG1      VAL  20  -7.737  -3.676   1.114
  134   2HG1  VAL  20          2HG1      VAL  20  -6.465  -2.646   0.464
  135   3HG1  VAL  20          3HG1      VAL  20  -7.379  -2.123   1.892
  136   1HG2  VAL  20          1HG2      VAL  20 -10.605  -1.496   0.181
  137   2HG2  VAL  20          2HG2      VAL  20 -10.193  -3.189   0.375
  138   3HG2  VAL  20          3HG2      VAL  20  -9.860  -2.064   1.694
  139    H    LEU  21           H        LEU  21  -6.036   0.125   1.114
  140    HA   LEU  21           HA       LEU  21  -4.332  -0.590  -1.124
  141   1HB   LEU  21          1HB       LEU  21  -3.052   1.413  -1.327
  142   2HB   LEU  21          2HB       LEU  21  -4.737   1.773  -1.587
  143    HG   LEU  21           HG       LEU  21  -4.727   2.516   0.951
  144   1HD1  LEU  21          1HD1      LEU  21  -2.431   1.857   1.562
  145   2HD1  LEU  21          2HD1      LEU  21  -1.777   2.715   0.161
  146   3HD1  LEU  21          3HD1      LEU  21  -2.500   3.615   1.505
  147   1HD2  LEU  21          1HD2      LEU  21  -4.106   4.799   0.222
  148   2HD2  LEU  21          2HD2      LEU  21  -3.478   4.126  -1.301
  149   3HD2  LEU  21          3HD2      LEU  21  -5.207   3.997  -0.901
  150    H    VAL  22           H        VAL  22  -2.148  -0.968  -0.581
  151    HA   VAL  22           HA       VAL  22  -1.750  -1.432   2.346
  152    HB   VAL  22           HB       VAL  22  -1.194  -3.439   0.107
  153   1HG1  VAL  22          1HG1      VAL  22  -0.926  -3.530   3.143
  154   2HG1  VAL  22          2HG1      VAL  22  -0.817  -4.964   2.111
  155   3HG1  VAL  22          3HG1      VAL  22   0.380  -3.691   1.946
  156   1HG2  VAL  22          1HG2      VAL  22  -3.591  -3.343   0.375
  157   2HG2  VAL  22          2HG2      VAL  22  -3.034  -4.772   1.241
  158   3HG2  VAL  22          3HG2      VAL  22  -3.454  -3.303   2.142
  159    H    ASP  23           H        ASP  23   0.117  -0.663   3.063
  160    HA   ASP  23           HA       ASP  23   2.418  -0.159   1.230
  161   1HB   ASP  23          1HB       ASP  23   2.068   1.294   3.243
  162   2HB   ASP  23          2HB       ASP  23   2.189  -0.101   4.229
  163    H    PHE  24           H        PHE  24   3.685  -1.788   0.642
  164    HA   PHE  24           HA       PHE  24   4.149  -4.098   2.464
  165   1HB   PHE  24          1HB       PHE  24   4.772  -3.597  -0.455
  166   2HB   PHE  24          2HB       PHE  24   5.411  -4.959   0.436
  167    HD1  PHE  24           1HD      PHE  24   2.768  -4.008  -1.730
  168    HD2  PHE  24           2HD      PHE  24   3.660  -6.383   1.757
  169    HE1  PHE  24           1HE      PHE  24   1.044  -5.650  -2.409
  170    HE2  PHE  24           2HE      PHE  24   1.951  -8.023   1.075
  171    HZ   PHE  24           HZ       PHE  24   0.748  -7.755  -1.018
  172    H    TRP  25           H        TRP  25   5.646  -3.506   3.822
  173    HA   TRP  25           HA       TRP  25   8.202  -2.385   2.812
  174   1HB   TRP  25          1HB       TRP  25   8.487  -1.002   4.712
  175   2HB   TRP  25          2HB       TRP  25   6.872  -0.660   4.131
  176    HD1  TRP  25           HD       TRP  25   4.853  -1.905   5.589
  177    HE1  TRP  25           1HE      TRP  25   4.709  -2.557   8.062
  178    HE3  TRP  25           3HE      TRP  25   9.762  -1.274   6.862
  179    HZ2  TRP  25           2HZ      TRP  25   6.557  -2.888  10.307
  180    HZ3  TRP  25           3HZ      TRP  25  10.534  -1.708   9.167
  181    HH2  TRP  25           HH       TRP  25   8.947  -2.544  10.890
  182    H    ALA  26           H        ALA  26   9.894  -2.923   4.883
  183    HA   ALA  26           HA       ALA  26   9.232  -5.242   6.405
  184   1HB   ALA  26          1HB       ALA  26  11.410  -5.497   4.274
  185   2HB   ALA  26          2HB       ALA  26  11.039  -6.695   5.537
  186   3HB   ALA  26          3HB       ALA  26   9.864  -6.371   4.264
  187    H    ALA  27           H        ALA  27  11.148  -5.769   7.821
  188    HA   ALA  27           HA       ALA  27  12.116  -3.372   8.963
  189   1HB   ALA  27          1HB       ALA  27  12.957  -6.245   9.507
  190   2HB   ALA  27          2HB       ALA  27  13.199  -4.850  10.582
  191   3HB   ALA  27          3HB       ALA  27  11.556  -5.409  10.224
  192    H    TRP  28           H        TRP  28  13.447  -4.754   6.205
  193    HA   TRP  28           HA       TRP  28  16.205  -3.878   6.940
  194   1HB   TRP  28          1HB       TRP  28  17.076  -5.699   6.105
  195   2HB   TRP  28          2HB       TRP  28  15.480  -6.390   6.247
  196    HD1  TRP  28           HD       TRP  28  18.028  -5.084   3.794
  197    HE1  TRP  28           1HE      TRP  28  17.395  -5.583   1.370
  198    HE3  TRP  28           3HE      TRP  28  13.377  -7.124   4.560
  199    HZ2  TRP  28           2HZ      TRP  28  15.048  -6.423  -0.078
  200    HZ3  TRP  28           3HZ      TRP  28  11.928  -7.698   2.598
  201    HH2  TRP  28           HH       TRP  28  12.760  -7.265   0.301
  202    H    CYS  29           H        CYS  29  13.592  -3.257   4.646
  203    HA   CYS  29           HA       CYS  29  15.317  -2.769   2.422
  204   1HB   CYS  29          1HB       CYS  29  13.146  -1.771   1.437
  205   2HB   CYS  29          2HB       CYS  29  13.365  -3.489   1.699
  206    H    GLY  30           H        GLY  30  16.820  -1.134   3.050
  207   1HA   GLY  30          1HA       GLY  30  17.016   1.248   3.941
  208   2HA   GLY  30          2HA       GLY  30  17.446   1.047   2.247
  209    HA   PRO  31           HA       PRO  31  14.476   4.134   1.114
  210   1HB   PRO  31          1HB       PRO  31  13.029   3.139  -1.021
  211   2HB   PRO  31          2HB       PRO  31  14.742   3.659  -1.116
  212   1HG   PRO  31          1HG       PRO  31  13.647   0.854  -0.773
  213   2HG   PRO  31          2HG       PRO  31  14.926   1.415  -1.895
  214   1HD   PRO  31          1HD       PRO  31  15.519   0.231   0.470
  215   2HD   PRO  31          2HD       PRO  31  16.502   1.596  -0.137
  216    H    CYS  32           H        CYS  32  12.963   0.994   1.893
  217    HA   CYS  32           HA       CYS  32  10.290   2.120   1.977
  218   1HB   CYS  32          1HB       CYS  32   9.510   0.130   2.802
  219   2HB   CYS  32          2HB       CYS  32  10.801  -0.349   1.711
  220    H    ARG  33           H        ARG  33  13.062   2.000   4.176
  221    HA   ARG  33           HA       ARG  33  11.599   2.802   6.504
  222   1HB   ARG  33          1HB       ARG  33  13.898   1.813   6.450
  223   2HB   ARG  33          2HB       ARG  33  14.516   3.356   5.863
  224   1HG   ARG  33          1HG       ARG  33  12.875   3.360   8.390
  225   2HG   ARG  33          2HG       ARG  33  14.483   2.648   8.465
  226   1HD   ARG  33          1HD       ARG  33  15.572   4.658   7.813
  227   2HD   ARG  33          2HD       ARG  33  14.080   5.452   7.346
  228    HE   ARG  33           HE       ARG  33  15.193   5.152  10.001
  229   1HH1  ARG  33          2HH2      ARG  33  12.144   5.793   8.239
  230   2HH1  ARG  33          1HH2      ARG  33  11.388   6.575   9.587
  231   1HH2  ARG  33          2HH1      ARG  33  14.160   6.194  11.773
  232   2HH2  ARG  33          1HH1      ARG  33  12.554   6.805  11.619
  233    H    MET  34           H        MET  34  12.444   4.631   3.632
  234    HA   MET  34           HA       MET  34  11.856   7.172   5.003
  235   1HB   MET  34          1HB       MET  34  13.133   6.486   2.322
  236   2HB   MET  34          2HB       MET  34  12.596   8.108   2.742
  237   1HG   MET  34          1HG       MET  34  14.791   8.254   3.353
  238   2HG   MET  34          2HG       MET  34  14.029   7.859   4.886
  239   1HE   MET  34          1HE       MET  34  16.659   5.117   2.258
  240   2HE   MET  34          2HE       MET  34  15.254   6.029   1.664
  241   3HE   MET  34          3HE       MET  34  16.693   6.896   2.222
  242    H    MET  35           H        MET  35  10.508   4.876   2.817
  243    HA   MET  35           HA       MET  35   8.395   6.558   1.760
  244   1HB   MET  35          1HB       MET  35   9.393   4.586   0.568
  245   2HB   MET  35          2HB       MET  35   8.696   3.528   1.799
  246   1HG   MET  35          1HG       MET  35   7.396   3.512  -0.218
  247   2HG   MET  35          2HG       MET  35   6.466   4.193   1.097
  248   1HE   MET  35          1HE       MET  35   4.949   4.580  -1.358
  249   2HE   MET  35          2HE       MET  35   5.569   5.673  -2.620
  250   3HE   MET  35          3HE       MET  35   6.381   4.128  -2.292
  251    H    ALA  36           H        ALA  36   8.715   3.969   4.311
  252    HA   ALA  36           HA       ALA  36   6.079   3.852   5.121
  253   1HB   ALA  36          1HB       ALA  36   6.953   3.112   7.316
  254   2HB   ALA  36          2HB       ALA  36   7.756   2.331   5.944
  255   3HB   ALA  36          3HB       ALA  36   8.585   3.629   6.827
  256    HA   PRO  37           HA       PRO  37   6.317   7.643   7.979
  257   1HB   PRO  37          1HB       PRO  37   8.232   9.584   7.617
  258   2HB   PRO  37          2HB       PRO  37   8.372   8.224   8.774
  259   1HG   PRO  37          1HG       PRO  37   9.505   8.422   5.980
  260   2HG   PRO  37          2HG       PRO  37  10.338   7.880   7.468
  261   1HD   PRO  37          1HD       PRO  37   9.319   6.087   5.721
  262   2HD   PRO  37          2HD       PRO  37   9.190   5.810   7.476
  263    H    VAL  38           H        VAL  38   7.382   7.988   4.501
  264    HA   VAL  38           HA       VAL  38   5.752  10.383   4.173
  265    HB   VAL  38           HB       VAL  38   7.603   8.909   2.600
  266   1HG1  VAL  38          1HG1      VAL  38   5.038   9.352   1.024
  267   2HG1  VAL  38          2HG1      VAL  38   6.622   8.899   0.365
  268   3HG1  VAL  38          3HG1      VAL  38   5.763   7.775   1.414
  269   1HG2  VAL  38          1HG2      VAL  38   7.599  11.327   2.970
  270   2HG2  VAL  38          2HG2      VAL  38   7.623  10.952   1.239
  271   3HG2  VAL  38          3HG2      VAL  38   6.113  11.490   2.015
  272    H    LEU  39           H        LEU  39   5.162   6.872   3.948
  273    HA   LEU  39           HA       LEU  39   2.531   7.045   2.953
  274   1HB   LEU  39          1HB       LEU  39   4.103   4.907   4.414
  275   2HB   LEU  39          2HB       LEU  39   2.484   4.674   3.818
  276    HG   LEU  39           HG       LEU  39   4.903   5.357   2.094
  277   1HD1  LEU  39          1HD1      LEU  39   4.621   3.071   1.225
  278   2HD1  LEU  39          2HD1      LEU  39   4.859   3.039   2.978
  279   3HD1  LEU  39          3HD1      LEU  39   3.232   2.845   2.279
  280   1HD2  LEU  39          1HD2      LEU  39   2.018   4.940   1.314
  281   2HD2  LEU  39          2HD2      LEU  39   3.081   6.338   0.970
  282   3HD2  LEU  39          3HD2      LEU  39   3.397   4.779   0.206
  283    H    GLU  40           H        GLU  40   3.914   7.471   6.165
  284    HA   GLU  40           HA       GLU  40   1.458   7.168   7.625
  285   1HB   GLU  40          1HB       GLU  40   4.057   7.405   8.390
  286   2HB   GLU  40          2HB       GLU  40   3.595   9.096   8.545
  287   1HG   GLU  40          1HG       GLU  40   3.185   8.232  10.671
  288   2HG   GLU  40          2HG       GLU  40   1.572   8.177   9.949
  289    H    GLU  41           H        GLU  41   3.225  10.043   6.314
  290    HA   GLU  41           HA       GLU  41   1.016  11.808   6.920
  291   1HB   GLU  41          1HB       GLU  41   2.207  13.521   5.871
  292   2HB   GLU  41          2HB       GLU  41   3.384  12.550   6.760
  293   1HG   GLU  41          1HG       GLU  41   4.411  11.778   4.853
  294   2HG   GLU  41          2HG       GLU  41   2.993  12.018   3.820
  295    H    PHE  42           H        PHE  42   1.694   9.750   4.214
  296    HA   PHE  42           HA       PHE  42  -0.392  10.717   2.438
  297   1HB   PHE  42          1HB       PHE  42   1.476   9.144   1.789
  298   2HB   PHE  42          2HB       PHE  42   0.740   7.940   2.839
  299    HD1  PHE  42           1HD      PHE  42  -0.470   6.250   1.839
  300    HD2  PHE  42           2HD      PHE  42  -0.234  10.114  -0.064
  301    HE1  PHE  42           1HE      PHE  42  -1.818   5.410  -0.060
  302    HE2  PHE  42           2HE      PHE  42  -1.639   9.285  -1.922
  303    HZ   PHE  42           HZ       PHE  42  -2.483   6.959  -1.896
  304    H    ALA  43           H        ALA  43  -0.369   7.934   4.791
  305    HA   ALA  43           HA       ALA  43  -3.091   7.412   4.589
  306   1HB   ALA  43          1HB       ALA  43  -1.320   7.144   7.078
  307   2HB   ALA  43          2HB       ALA  43  -2.840   6.275   6.779
  308   3HB   ALA  43          3HB       ALA  43  -1.412   5.952   5.772
  309    H    GLU  44           H        GLU  44  -1.459   9.621   6.889
  310    HA   GLU  44           HA       GLU  44  -3.680  10.438   8.380
  311   1HB   GLU  44          1HB       GLU  44  -1.331  10.927   8.912
  312   2HB   GLU  44          2HB       GLU  44  -1.227  12.028   7.530
  313   1HG   GLU  44          1HG       GLU  44  -2.876  13.533   8.569
  314   2HG   GLU  44          2HG       GLU  44  -3.116  12.390   9.898
  315    H    ALA  45           H        ALA  45  -2.535  11.695   5.230
  316    HA   ALA  45           HA       ALA  45  -4.314  13.927   5.140
  317   1HB   ALA  45          1HB       ALA  45  -3.670  14.058   2.764
  318   2HB   ALA  45          2HB       ALA  45  -2.253  13.769   3.790
  319   3HB   ALA  45          3HB       ALA  45  -2.960  12.437   2.846
  320    H    HIS  46           H        HIS  46  -5.026  10.576   4.694
  321    HA   HIS  46           HA       HIS  46  -7.804  11.162   4.026
  322   1HB   HIS  46          1HB       HIS  46  -7.683   9.632   2.023
  323   2HB   HIS  46          2HB       HIS  46  -6.956  11.223   1.809
  324    HD1  HIS  46           1HD      HIS  46  -5.708   7.736   2.826
  325    HD2  HIS  46           2HD      HIS  46  -4.568  11.207   0.776
  326    HE1  HIS  46           1HE      HIS  46  -3.362   7.250   1.714
  327    HE2  HIS  46           2HE      HIS  46  -2.738   9.508   0.483
  328    H    ALA  47           H        ALA  47  -7.103  10.279   6.339
  329    HA   ALA  47           HA       ALA  47  -6.417   7.535   6.605
  330   1HB   ALA  47          1HB       ALA  47  -6.887   7.897   8.995
  331   2HB   ALA  47          2HB       ALA  47  -5.986   9.267   8.321
  332   3HB   ALA  47          3HB       ALA  47  -7.736   9.412   8.621
  333    H    ASP  48           H        ASP  48  -9.389   9.017   5.869
  334    HA   ASP  48           HA       ASP  48 -11.154   6.888   6.806
  335   1HB   ASP  48          1HB       ASP  48 -12.854   8.645   6.566
  336   2HB   ASP  48          2HB       ASP  48 -11.545   9.183   7.617
  337    H    LYS  49           H        LYS  49 -10.668   9.038   3.992
  338    HA   LYS  49           HA       LYS  49 -12.514   8.004   2.257
  339   1HB   LYS  49          1HB       LYS  49 -11.236  10.061   1.870
  340   2HB   LYS  49          2HB       LYS  49  -9.761   9.128   1.595
  341   1HG   LYS  49          1HG       LYS  49 -10.717   8.111  -0.426
  342   2HG   LYS  49          2HG       LYS  49 -12.241   8.957  -0.164
  343   1HD   LYS  49          1HD       LYS  49  -9.539  10.254  -0.772
  344   2HD   LYS  49          2HD       LYS  49 -10.823   9.934  -1.938
  345   1HE   LYS  49          1HE       LYS  49 -12.353  11.388  -0.448
  346   2HE   LYS  49          2HE       LYS  49 -10.879  11.867   0.411
  347   1HZ   LYS  49          1HZ       LYS  49 -11.129  13.474  -1.257
  348   2HZ   LYS  49          2HZ       LYS  49 -10.077  12.403  -1.991
  349   3HZ   LYS  49          3HZ       LYS  49 -11.613  12.390  -2.410
  350    H    VAL  50           H        VAL  50  -9.427   6.477   3.021
  351    HA   VAL  50           HA       VAL  50 -10.119   4.319   1.088
  352    HB   VAL  50           HB       VAL  50  -7.872   4.084   0.298
  353   1HG1  VAL  50          1HG1      VAL  50  -9.325   5.794  -0.860
  354   2HG1  VAL  50          2HG1      VAL  50  -8.514   7.043   0.086
  355   3HG1  VAL  50          3HG1      VAL  50  -7.592   6.040  -1.065
  356   1HG2  VAL  50          1HG2      VAL  50  -7.150   6.345   2.187
  357   2HG2  VAL  50          2HG2      VAL  50  -6.504   4.694   2.143
  358   3HG2  VAL  50          3HG2      VAL  50  -6.108   5.821   0.841
  359    H    THR  51           H        THR  51  -9.435   2.252   1.687
  360    HA   THR  51           HA       THR  51  -8.969   1.888   4.509
  361    HB   THR  51           HB       THR  51  -9.599   0.005   2.327
  362    HG1  THR  51           1HG      THR  51 -11.578   0.034   3.284
  363   1HG2  THR  51          1HG2      THR  51  -8.330  -1.276   4.006
  364   2HG2  THR  51          2HG2      THR  51  -9.286  -0.546   5.311
  365   3HG2  THR  51          3HG2      THR  51 -10.044  -1.665   4.152
  366    H    VAL  52           H        VAL  52  -6.928   3.092   4.329
  367    HA   VAL  52           HA       VAL  52  -4.680   1.818   2.982
  368    HB   VAL  52           HB       VAL  52  -4.481   4.069   2.972
  369   1HG1  VAL  52          1HG1      VAL  52  -4.674   5.609   4.993
  370   2HG1  VAL  52          2HG1      VAL  52  -6.192   4.881   4.485
  371   3HG1  VAL  52          3HG1      VAL  52  -5.318   4.210   5.870
  372   1HG2  VAL  52          1HG2      VAL  52  -2.556   4.758   4.157
  373   2HG2  VAL  52          2HG2      VAL  52  -2.813   3.552   5.434
  374   3HG2  VAL  52          3HG2      VAL  52  -2.361   3.044   3.794
  375    H    ALA  53           H        ALA  53  -2.924   0.793   3.926
  376    HA   ALA  53           HA       ALA  53  -2.991   0.296   6.794
  377   1HB   ALA  53          1HB       ALA  53  -3.209  -1.807   4.574
  378   2HB   ALA  53          2HB       ALA  53  -2.717  -2.199   6.226
  379   3HB   ALA  53          3HB       ALA  53  -4.355  -1.547   5.908
  380    H    LYS  54           H        LYS  54  -0.900  -0.683   7.468
  381    HA   LYS  54           HA       LYS  54   0.946  -1.187   5.269
  382   1HB   LYS  54          1HB       LYS  54   2.880  -0.343   6.506
  383   2HB   LYS  54          2HB       LYS  54   1.717   0.940   6.164
  384   1HG   LYS  54          1HG       LYS  54   0.884   0.743   8.535
  385   2HG   LYS  54          2HG       LYS  54   2.204  -0.417   8.843
  386   1HD   LYS  54          1HD       LYS  54   3.860   1.303   8.139
  387   2HD   LYS  54          2HD       LYS  54   2.536   2.422   7.761
  388   1HE   LYS  54          1HE       LYS  54   1.818   2.230  10.198
  389   2HE   LYS  54          2HE       LYS  54   3.364   1.407  10.504
  390   1HZ   LYS  54          1HZ       LYS  54   3.476   3.888  10.844
  391   2HZ   LYS  54          2HZ       LYS  54   4.447   3.441   9.560
  392   3HZ   LYS  54          3HZ       LYS  54   2.948   4.131   9.410
  393    H    LEU  55           H        LEU  55   2.214  -2.911   5.389
  394    HA   LEU  55           HA       LEU  55   2.215  -4.468   7.885
  395   1HB   LEU  55          1HB       LEU  55   1.421  -6.528   6.768
  396   2HB   LEU  55          2HB       LEU  55   0.211  -5.272   7.000
  397    HG   LEU  55           HG       LEU  55   0.267  -4.697   4.651
  398   1HD1  LEU  55          1HD1      LEU  55   2.410  -5.274   3.806
  399   2HD1  LEU  55          2HD1      LEU  55   2.275  -6.958   4.376
  400   3HD1  LEU  55          3HD1      LEU  55   1.277  -6.361   3.024
  401   1HD2  LEU  55          1HD2      LEU  55  -0.811  -7.046   5.856
  402   2HD2  LEU  55          2HD2      LEU  55  -1.409  -6.149   4.452
  403   3HD2  LEU  55          3HD2      LEU  55  -0.306  -7.516   4.246
  404    H    ASN  56           H        ASN  56   3.806  -6.205   7.862
  405    HA   ASN  56           HA       ASN  56   6.154  -5.461   6.251
  406   1HB   ASN  56          1HB       ASN  56   6.653  -5.893   8.482
  407   2HB   ASN  56          2HB       ASN  56   5.592  -7.268   8.603
  408   1HD2  ASN  56          1HD2      ASN  56   7.053  -8.929   9.183
  409   2HD2  ASN  56          2HD2      ASN  56   8.398  -9.375   8.147
  410    H    VAL  57           H        VAL  57   6.676  -6.504   4.380
  411    HA   VAL  57           HA       VAL  57   4.759  -8.302   3.251
  412    HB   VAL  57           HB       VAL  57   6.202  -6.620   2.098
  413   1HG1  VAL  57          1HG1      VAL  57   8.433  -7.302   2.870
  414   2HG1  VAL  57          2HG1      VAL  57   8.245  -8.897   2.112
  415   3HG1  VAL  57          3HG1      VAL  57   8.325  -7.457   1.103
  416   1HG2  VAL  57          1HG2      VAL  57   6.122  -9.337   0.795
  417   2HG2  VAL  57          2HG2      VAL  57   4.711  -8.290   0.974
  418   3HG2  VAL  57          3HG2      VAL  57   6.095  -7.739   0.021
  419    H    ASP  58           H        ASP  58   7.572  -8.910   5.263
  420    HA   ASP  58           HA       ASP  58   7.759 -11.747   4.589
  421   1HB   ASP  58          1HB       ASP  58   9.276  -9.784   6.053
  422   2HB   ASP  58          2HB       ASP  58   8.852 -11.055   7.177
  423    H    GLU  59           H        GLU  59   5.621  -9.787   6.504
  424    HA   GLU  59           HA       GLU  59   4.705 -11.953   8.265
  425   1HB   GLU  59          1HB       GLU  59   4.568 -10.038   9.473
  426   2HB   GLU  59          2HB       GLU  59   4.544  -9.016   8.086
  427   1HG   GLU  59          1HG       GLU  59   2.101  -9.502   7.745
  428   2HG   GLU  59          2HG       GLU  59   2.123 -10.375   9.281
  429    H    ASN  60           H        ASN  60   3.828 -10.172   5.361
  430    HA   ASN  60           HA       ASN  60   1.353 -11.797   5.043
  431   1HB   ASN  60          1HB       ASN  60   1.117  -9.330   4.960
  432   2HB   ASN  60          2HB       ASN  60   2.238  -9.237   3.621
  433   1HD2  ASN  60          1HD2      ASN  60   1.521 -10.153   1.439
  434   2HD2  ASN  60          2HD2      ASN  60  -0.165 -10.517   1.217
  435    HA   PRO  61           HA       PRO  61   3.601 -13.782   1.606
  436   1HB   PRO  61          1HB       PRO  61   2.616 -16.317   2.004
  437   2HB   PRO  61          2HB       PRO  61   4.099 -15.678   2.768
  438   1HG   PRO  61          1HG       PRO  61   1.300 -15.824   3.940
  439   2HG   PRO  61          2HG       PRO  61   2.844 -16.310   4.711
  440   1HD   PRO  61          1HD       PRO  61   1.698 -13.903   5.219
  441   2HD   PRO  61          2HD       PRO  61   3.445 -14.024   5.099
  442    H    GLU  62           H        GLU  62   0.152 -13.723   2.735
  443    HA   GLU  62           HA       GLU  62  -1.038 -14.865   0.499
  444   1HB   GLU  62          1HB       GLU  62  -2.392 -14.573   2.358
  445   2HB   GLU  62          2HB       GLU  62  -1.961 -12.869   2.554
  446   1HG   GLU  62          1HG       GLU  62  -4.308 -13.307   1.767
  447   2HG   GLU  62          2HG       GLU  62  -3.361 -12.134   0.859
  448    H    THR  63           H        THR  63  -1.151 -14.341  -1.525
  449    HA   THR  63           HA       THR  63  -0.980 -13.366  -3.490
  450    HB   THR  63           HB       THR  63  -2.341 -11.185  -1.939
  451    HG1  THR  63           1HG      THR  63  -3.718 -12.856  -2.272
  452   1HG2  THR  63          1HG2      THR  63  -3.026 -10.172  -4.087
  453   2HG2  THR  63          2HG2      THR  63  -1.293  -9.972  -3.787
  454   3HG2  THR  63          3HG2      THR  63  -1.865 -11.201  -4.948
  455    H    THR  64           H        THR  64   0.943 -12.039  -1.028
  456    HA   THR  64           HA       THR  64   2.774 -10.426  -2.447
  457    HB   THR  64           HB       THR  64   3.186 -12.450  -0.235
  458    HG1  THR  64           1HG      THR  64   3.155 -10.793   1.055
  459   1HG2  THR  64          1HG2      THR  64   5.333 -11.520   0.305
  460   2HG2  THR  64          2HG2      THR  64   5.391 -12.183  -1.327
  461   3HG2  THR  64          3HG2      THR  64   5.268 -10.428  -1.087
  462    H    SER  65           H        SER  65   2.796 -13.950  -1.917
  463    HA   SER  65           HA       SER  65   4.873 -14.485  -3.838
  464   1HB   SER  65          1HB       SER  65   4.422 -15.874  -1.820
  465   2HB   SER  65          2HB       SER  65   2.860 -16.355  -2.511
  466    HG   SER  65           HG       SER  65   4.239 -16.971  -4.409
  467    H    GLN  66           H        GLN  66   1.763 -13.449  -4.533
  468    HA   GLN  66           HA       GLN  66   1.463 -15.230  -6.891
  469   1HB   GLN  66          1HB       GLN  66  -0.361 -14.958  -5.039
  470   2HB   GLN  66          2HB       GLN  66  -0.637 -13.367  -5.753
  471   1HG   GLN  66          1HG       GLN  66  -2.228 -14.864  -6.720
  472   2HG   GLN  66          2HG       GLN  66  -1.045 -14.502  -7.976
  473   1HE2  GLN  66          1HE2      GLN  66  -1.901 -16.980  -5.457
  474   2HE2  GLN  66          2HE2      GLN  66  -1.194 -18.307  -6.375
  475    H    PHE  67           H        PHE  67   1.671 -11.739  -5.821
  476    HA   PHE  67           HA       PHE  67   1.506 -10.981  -8.686
  477   1HB   PHE  67          1HB       PHE  67   0.001 -10.080  -6.755
  478   2HB   PHE  67          2HB       PHE  67   1.383  -9.120  -6.337
  479    HD1  PHE  67           1HD      PHE  67   1.965  -7.129  -7.754
  480    HD2  PHE  67           2HD      PHE  67  -1.161  -9.867  -8.927
  481    HE1  PHE  67           1HE      PHE  67   1.127  -5.481  -9.385
  482    HE2  PHE  67           2HE      PHE  67  -1.967  -8.219 -10.592
  483    HZ   PHE  67           HZ       PHE  67  -0.837  -6.016 -10.816
  484    H    GLY  68           H        GLY  68   3.931 -12.020  -6.869
  485   1HA   GLY  68          1HA       GLY  68   6.204 -11.883  -7.190
  486   2HA   GLY  68          2HA       GLY  68   5.910 -10.677  -8.451
  487    H    ILE  69           H        ILE  69   4.846 -10.407  -5.059
  488    HA   ILE  69           HA       ILE  69   5.818  -7.687  -4.989
  489    HB   ILE  69           HB       ILE  69   4.555  -9.363  -2.824
  490   1HG1  ILE  69          1HG1      ILE  69   3.014  -9.338  -4.701
  491   2HG1  ILE  69          2HG1      ILE  69   2.401  -8.362  -3.380
  492   1HG2  ILE  69          1HG2      ILE  69   3.898  -7.323  -1.780
  493   2HG2  ILE  69          2HG2      ILE  69   5.645  -7.297  -2.012
  494   3HG2  ILE  69          3HG2      ILE  69   4.632  -6.337  -3.074
  495   1HD1  ILE  69          1HD1      ILE  69   3.098  -6.288  -4.550
  496   2HD1  ILE  69          2HD1      ILE  69   3.721  -7.270  -5.902
  497   3HD1  ILE  69          3HD1      ILE  69   1.993  -7.263  -5.487
  498    H    MET  70           H        MET  70   8.058  -8.239  -5.321
  499    HA   MET  70           HA       MET  70   9.443  -8.461  -2.658
  500   1HB   MET  70          1HB       MET  70   9.810 -10.377  -4.220
  501   2HB   MET  70          2HB       MET  70  10.526  -9.256  -5.387
  502   1HG   MET  70          1HG       MET  70  12.359  -8.771  -3.847
  503   2HG   MET  70          2HG       MET  70  11.551  -9.657  -2.551
  504   1HE   MET  70          1HE       MET  70  13.463  -9.906  -5.975
  505   2HE   MET  70          2HE       MET  70  13.513 -11.662  -6.255
  506   3HE   MET  70          3HE       MET  70  11.972 -10.793  -6.387
  507    H    SER  71           H        SER  71   8.608  -6.312  -5.117
  508    HA   SER  71           HA       SER  71  11.150  -4.839  -5.171
  509   1HB   SER  71          1HB       SER  71   9.756  -5.381  -7.230
  510   2HB   SER  71          2HB       SER  71   8.566  -4.218  -6.635
  511    HG   SER  71           HG       SER  71  11.290  -3.740  -7.323
  512    H    ILE  72           H        ILE  72  10.520  -4.772  -2.678
  513    HA   ILE  72           HA       ILE  72   8.555  -2.789  -2.069
  514    HB   ILE  72           HB       ILE  72   9.025  -3.208   0.274
  515   1HG1  ILE  72          1HG1      ILE  72  11.135  -5.172  -0.718
  516   2HG1  ILE  72          2HG1      ILE  72  11.417  -3.671   0.171
  517   1HG2  ILE  72          1HG2      ILE  72   8.655  -5.792  -1.291
  518   2HG2  ILE  72          2HG2      ILE  72   7.989  -5.357   0.300
  519   3HG2  ILE  72          3HG2      ILE  72   7.410  -4.534  -1.140
  520   1HD1  ILE  72          1HD1      ILE  72   9.806  -4.713   1.975
  521   2HD1  ILE  72          2HD1      ILE  72  10.211  -6.244   1.158
  522   3HD1  ILE  72          3HD1      ILE  72  11.487  -5.240   1.862
  523    HA   PRO  73           HA       PRO  73   8.248  -1.173  -0.039
  524   1HB   PRO  73          1HB       PRO  73   7.527   1.418  -0.428
  525   2HB   PRO  73          2HB       PRO  73   8.648   0.891   0.849
  526   1HG   PRO  73          1HG       PRO  73   9.310   2.044  -1.865
  527   2HG   PRO  73          2HG       PRO  73  10.058   2.459  -0.297
  528   1HD   PRO  73          1HD       PRO  73  11.218   0.729  -2.066
  529   2HD   PRO  73          2HD       PRO  73  11.362   0.493  -0.303
  530    H    THR  74           H        THR  74   6.476  -1.953  -1.031
  531    HA   THR  74           HA       THR  74   5.776  -1.018  -3.786
  532    HB   THR  74           HB       THR  74   4.963  -3.634  -2.468
  533    HG1  THR  74           1HG      THR  74   7.233  -3.060  -3.990
  534   1HG2  THR  74          1HG2      THR  74   3.359  -3.022  -4.125
  535   2HG2  THR  74          2HG2      THR  74   4.620  -2.639  -5.303
  536   3HG2  THR  74          3HG2      THR  74   4.373  -4.313  -4.783
  537    H    LEU  75           H        LEU  75   3.650  -0.304  -4.086
  538    HA   LEU  75           HA       LEU  75   1.809  -0.346  -1.773
  539   1HB   LEU  75          1HB       LEU  75   2.947   1.921  -2.125
  540   2HB   LEU  75          2HB       LEU  75   2.102   2.006  -3.654
  541    HG   LEU  75           HG       LEU  75   0.368   1.266  -1.313
  542   1HD1  LEU  75          1HD1      LEU  75   1.802   2.867  -0.224
  543   2HD1  LEU  75          2HD1      LEU  75   1.596   4.021  -1.562
  544   3HD1  LEU  75          3HD1      LEU  75   0.222   3.609  -0.517
  545   1HD2  LEU  75          1HD2      LEU  75  -0.580   1.670  -3.573
  546   2HD2  LEU  75          2HD2      LEU  75  -1.196   2.814  -2.378
  547   3HD2  LEU  75          3HD2      LEU  75   0.053   3.327  -3.535
  548    H    ILE  76           H        ILE  76  -0.189  -1.172  -2.462
  549    HA   ILE  76           HA       ILE  76  -0.817  -0.914  -5.346
  550    HB   ILE  76           HB       ILE  76  -1.277  -3.410  -3.691
  551   1HG1  ILE  76          1HG1      ILE  76   0.733  -2.813  -5.881
  552   2HG1  ILE  76          2HG1      ILE  76   1.055  -3.345  -4.232
  553   1HG2  ILE  76          1HG2      ILE  76  -1.796  -2.913  -6.667
  554   2HG2  ILE  76          2HG2      ILE  76  -2.141  -4.397  -5.767
  555   3HG2  ILE  76          3HG2      ILE  76  -3.063  -2.961  -5.419
  556   1HD1  ILE  76          1HD1      ILE  76   1.472  -5.127  -5.758
  557   2HD1  ILE  76          2HD1      ILE  76   0.066  -5.569  -4.765
  558   3HD1  ILE  76          3HD1      ILE  76  -0.129  -5.045  -6.462
  559    H    LEU  77           H        LEU  77  -2.951  -0.541  -5.716
  560    HA   LEU  77           HA       LEU  77  -4.705  -0.142  -3.359
  561   1HB   LEU  77          1HB       LEU  77  -3.913   1.985  -4.393
  562   2HB   LEU  77          2HB       LEU  77  -4.770   1.562  -5.881
  563    HG   LEU  77           HG       LEU  77  -6.186   1.665  -3.213
  564   1HD1  LEU  77          1HD1      LEU  77  -6.763   4.037  -3.622
  565   2HD1  LEU  77          2HD1      LEU  77  -5.049   3.775  -3.316
  566   3HD1  LEU  77          3HD1      LEU  77  -5.611   4.054  -4.977
  567   1HD2  LEU  77          1HD2      LEU  77  -7.528   0.776  -5.091
  568   2HD2  LEU  77          2HD2      LEU  77  -8.144   2.334  -4.563
  569   3HD2  LEU  77          3HD2      LEU  77  -7.153   2.240  -6.022
  570    H    PHE  78           H        PHE  78  -6.632  -1.171  -3.495
  571    HA   PHE  78           HA       PHE  78  -7.194  -2.871  -5.871
  572   1HB   PHE  78          1HB       PHE  78  -7.257  -3.577  -2.904
  573   2HB   PHE  78          2HB       PHE  78  -7.807  -4.625  -4.184
  574    HD1  PHE  78           1HD      PHE  78  -4.810  -3.243  -2.504
  575    HD2  PHE  78           2HD      PHE  78  -6.339  -6.030  -5.424
  576    HE1  PHE  78           1HE      PHE  78  -2.717  -4.559  -2.362
  577    HE2  PHE  78           2HE      PHE  78  -4.228  -7.301  -5.324
  578    HZ   PHE  78           HZ       PHE  78  -2.402  -6.565  -3.817
  579    H    LYS  79           H        LYS  79  -9.360  -3.722  -5.936
  580    HA   LYS  79           HA       LYS  79 -11.123  -3.425  -3.756
  581   1HB   LYS  79          1HB       LYS  79 -13.046  -2.485  -5.040
  582   2HB   LYS  79          2HB       LYS  79 -11.868  -1.346  -4.451
  583   1HG   LYS  79          1HG       LYS  79 -11.605  -2.327  -7.307
  584   2HG   LYS  79          2HG       LYS  79 -12.957  -1.278  -6.922
  585   1HD   LYS  79          1HD       LYS  79 -10.010  -0.608  -6.609
  586   2HD   LYS  79          2HD       LYS  79 -11.147   0.060  -7.775
  587   1HE   LYS  79          1HE       LYS  79 -11.062   0.520  -4.777
  588   2HE   LYS  79          2HE       LYS  79 -10.790   1.703  -6.063
  589   1HZ   LYS  79          1HZ       LYS  79 -12.962   2.018  -5.207
  590   2HZ   LYS  79          2HZ       LYS  79 -13.174   1.305  -6.677
  591   3HZ   LYS  79          3HZ       LYS  79 -13.355   0.435  -5.283
  592    H    GLY  80           H        GLY  80 -12.846  -4.944  -3.948
  593   1HA   GLY  80          1HA       GLY  80 -13.702  -7.002  -4.564
  594   2HA   GLY  80          2HA       GLY  80 -13.450  -6.517  -6.246
  595    H    GLY  81           H        GLY  81 -10.665  -6.641  -4.096
  596   1HA   GLY  81          1HA       GLY  81  -8.831  -8.015  -4.047
  597   2HA   GLY  81          2HA       GLY  81  -9.696  -9.241  -4.977
  598    H    GLU  82           H        GLU  82 -10.080  -6.489  -6.853
  599    HA   GLU  82           HA       GLU  82  -8.002  -7.367  -8.697
  600   1HB   GLU  82          1HB       GLU  82 -10.389  -6.909  -9.370
  601   2HB   GLU  82          2HB       GLU  82 -10.138  -5.213  -8.967
  602   1HG   GLU  82          1HG       GLU  82  -9.863  -5.309 -11.285
  603   2HG   GLU  82          2HG       GLU  82  -8.216  -5.211 -10.673
  604    HA   PRO  83           HA       PRO  83  -5.513  -3.825  -7.129
  605   1HB   PRO  83          1HB       PRO  83  -3.205  -4.318  -8.502
  606   2HB   PRO  83          2HB       PRO  83  -3.705  -5.262  -7.069
  607   1HG   PRO  83          1HG       PRO  83  -4.026  -6.024  -9.971
  608   2HG   PRO  83          2HG       PRO  83  -3.441  -7.024  -8.602
  609   1HD   PRO  83          1HD       PRO  83  -6.019  -7.092  -9.519
  610   2HD   PRO  83          2HD       PRO  83  -5.602  -7.379  -7.807
  611    H    VAL  84           H        VAL  84  -6.309  -1.883  -8.027
  612    HA   VAL  84           HA       VAL  84  -6.683  -1.640 -10.895
  613    HB   VAL  84           HB       VAL  84  -7.075   0.785 -10.198
  614   1HG1  VAL  84          1HG1      VAL  84  -9.396   0.292  -9.510
  615   2HG1  VAL  84          2HG1      VAL  84  -8.873  -0.807 -10.792
  616   3HG1  VAL  84          3HG1      VAL  84  -8.925  -1.385  -9.117
  617   1HG2  VAL  84          1HG2      VAL  84  -7.749   1.314  -7.990
  618   2HG2  VAL  84          2HG2      VAL  84  -7.404  -0.321  -7.408
  619   3HG2  VAL  84          3HG2      VAL  84  -6.074   0.744  -7.934
  620    H    LYS  85           H        LYS  85  -4.241  -0.582  -8.527
  621    HA   LYS  85           HA       LYS  85  -2.321  -0.480 -10.676
  622   1HB   LYS  85          1HB       LYS  85  -1.507   1.861 -10.194
  623   2HB   LYS  85          2HB       LYS  85  -3.023   1.716 -11.070
  624   1HG   LYS  85          1HG       LYS  85  -4.300   2.266  -9.029
  625   2HG   LYS  85          2HG       LYS  85  -2.810   2.304  -8.076
  626   1HD   LYS  85          1HD       LYS  85  -3.696   4.555  -8.712
  627   2HD   LYS  85          2HD       LYS  85  -2.030   4.271  -9.268
  628   1HE   LYS  85          1HE       LYS  85  -2.671   3.958 -11.500
  629   2HE   LYS  85          2HE       LYS  85  -4.369   3.683 -11.073
  630   1HZ   LYS  85          1HZ       LYS  85  -4.588   6.006 -10.515
  631   2HZ   LYS  85          2HZ       LYS  85  -3.013   6.303 -10.781
  632   3HZ   LYS  85          3HZ       LYS  85  -4.079   5.873 -12.019
  633    H    GLN  86           H        GLN  86  -0.130  -0.074  -9.959
  634    HA   GLN  86           HA       GLN  86   0.455  -0.688  -7.143
  635   1HB   GLN  86          1HB       GLN  86   0.654  -2.806  -8.274
  636   2HB   GLN  86          2HB       GLN  86   1.425  -2.068  -9.678
  637   1HG   GLN  86          1HG       GLN  86   3.461  -1.613  -8.419
  638   2HG   GLN  86          2HG       GLN  86   2.736  -2.184  -6.925
  639   1HE2  GLN  86          1HE2      GLN  86   3.494  -3.322 -10.312
  640   2HE2  GLN  86          2HE2      GLN  86   3.880  -4.950  -9.761
  641    H    LEU  87           H        LEU  87   2.244   0.403  -6.411
  642    HA   LEU  87           HA       LEU  87   3.976   1.930  -8.274
  643   1HB   LEU  87          1HB       LEU  87   2.952   2.660  -5.490
  644   2HB   LEU  87          2HB       LEU  87   4.421   3.334  -6.142
  645    HG   LEU  87           HG       LEU  87   2.684   4.916  -6.347
  646   1HD1  LEU  87          1HD1      LEU  87   4.424   4.577  -8.198
  647   2HD1  LEU  87          2HD1      LEU  87   3.096   3.900  -9.169
  648   3HD1  LEU  87          3HD1      LEU  87   3.016   5.576  -8.551
  649   1HD2  LEU  87          1HD2      LEU  87   0.722   3.349  -6.464
  650   2HD2  LEU  87          2HD2      LEU  87   0.679   4.709  -7.619
  651   3HD2  LEU  87          3HD2      LEU  87   1.090   3.091  -8.183
  652    H    ILE  88           H        ILE  88   6.208   1.800  -7.663
  653    HA   ILE  88           HA       ILE  88   6.987   0.067  -5.450
  654    HB   ILE  88           HB       ILE  88   8.635  -1.069  -7.036
  655   1HG1  ILE  88          1HG1      ILE  88   6.640  -0.182  -9.183
  656   2HG1  ILE  88          2HG1      ILE  88   8.328   0.319  -9.052
  657   1HG2  ILE  88          1HG2      ILE  88   6.733  -2.147  -5.928
  658   2HG2  ILE  88          2HG2      ILE  88   5.689  -1.771  -7.319
  659   3HG2  ILE  88          3HG2      ILE  88   7.062  -2.880  -7.489
  660   1HD1  ILE  88          1HD1      ILE  88   8.995  -2.097  -9.357
  661   2HD1  ILE  88          2HD1      ILE  88   7.284  -2.462  -9.695
  662   3HD1  ILE  88          3HD1      ILE  88   8.171  -1.359 -10.750
  663    H    GLY  89           H        GLY  89   8.656   0.930  -4.458
  664   1HA   GLY  89          1HA       GLY  89  10.835   2.005  -4.432
  665   2HA   GLY  89          2HA       GLY  89  10.370   2.960  -5.849
  666    H    TYR  90           H        TYR  90  11.400   4.286  -3.744
  667    HA   TYR  90           HA       TYR  90   9.374   5.264  -1.891
  668   1HB   TYR  90          1HB       TYR  90  11.594   5.022  -1.064
  669   2HB   TYR  90          2HB       TYR  90  12.268   5.913  -2.418
  670    HD1  TYR  90           1HD      TYR  90   9.321   6.987  -0.329
  671    HD2  TYR  90           2HD      TYR  90  13.481   7.599  -1.291
  672    HE1  TYR  90           1HE      TYR  90   9.322   9.017   1.039
  673    HE2  TYR  90           2HE      TYR  90  13.483   9.667   0.079
  674    HH   TYR  90           HH       TYR  90  10.615  10.725   1.936
  675    H    GLN  91           H        GLN  91   7.891   5.831  -3.726
  676    HA   GLN  91           HA       GLN  91   8.501   8.271  -5.200
  677   1HB   GLN  91          1HB       GLN  91   5.638   7.454  -4.804
  678   2HB   GLN  91          2HB       GLN  91   6.431   8.171  -6.161
  679   1HG   GLN  91          1HG       GLN  91   6.772   5.250  -5.380
  680   2HG   GLN  91          2HG       GLN  91   5.678   5.872  -6.603
  681   1HE2  GLN  91          1HE2      GLN  91   6.587   7.044  -8.478
  682   2HE2  GLN  91          2HE2      GLN  91   8.206   6.549  -9.023
  683    HA   PRO  92           HA       PRO  92   7.511  10.661  -1.464
  684   1HB   PRO  92          1HB       PRO  92   7.726  13.215  -2.442
  685   2HB   PRO  92          2HB       PRO  92   9.146  12.173  -2.115
  686   1HG   PRO  92          1HG       PRO  92   7.738  12.621  -4.765
  687   2HG   PRO  92          2HG       PRO  92   9.496  12.709  -4.420
  688   1HD   PRO  92          1HD       PRO  92   8.343  10.468  -5.457
  689   2HD   PRO  92          2HD       PRO  92   9.677  10.355  -4.270
  690    H    LYS  93           H        LYS  93   5.782  12.292  -0.826
  691    HA   LYS  93           HA       LYS  93   3.285  11.390  -1.424
  692   1HB   LYS  93          1HB       LYS  93   4.498  13.768  -0.099
  693   2HB   LYS  93          2HB       LYS  93   2.868  14.045  -0.665
  694   1HG   LYS  93          1HG       LYS  93   3.496  11.528   0.882
  695   2HG   LYS  93          2HG       LYS  93   3.308  13.060   1.721
  696   1HD   LYS  93          1HD       LYS  93   1.187  11.991  -0.146
  697   2HD   LYS  93          2HD       LYS  93   1.292  11.544   1.550
  698   1HE   LYS  93          1HE       LYS  93   0.999  14.409   0.579
  699   2HE   LYS  93          2HE       LYS  93  -0.350  13.371   1.028
  700   1HZ   LYS  93          1HZ       LYS  93   1.814  14.180   2.904
  701   2HZ   LYS  93          2HZ       LYS  93   0.306  14.803   2.830
  702   3HZ   LYS  93          3HZ       LYS  93   0.493  13.240   3.271
  703    H    GLU  94           H        GLU  94   4.764  14.320  -2.920
  704    HA   GLU  94           HA       GLU  94   2.481  14.956  -4.458
  705   1HB   GLU  94          1HB       GLU  94   4.389  16.455  -3.849
  706   2HB   GLU  94          2HB       GLU  94   5.442  15.559  -4.946
  707   1HG   GLU  94          1HG       GLU  94   4.112  16.313  -6.880
  708   2HG   GLU  94          2HG       GLU  94   2.949  17.098  -5.799
  709    H    GLN  95           H        GLN  95   4.742  12.344  -4.974
  710    HA   GLN  95           HA       GLN  95   4.123  12.166  -7.862
  711   1HB   GLN  95          1HB       GLN  95   6.473  11.765  -6.677
  712   2HB   GLN  95          2HB       GLN  95   5.793  10.261  -6.139
  713   1HG   GLN  95          1HG       GLN  95   6.434  11.151  -8.953
  714   2HG   GLN  95          2HG       GLN  95   7.145   9.835  -8.027
  715   1HE2  GLN  95          1HE2      GLN  95   4.563  10.743 -10.209
  716   2HE2  GLN  95          2HE2      GLN  95   3.939   9.126 -10.442
  717    H    LEU  96           H        LEU  96   4.002  10.305  -4.850
  718    HA   LEU  96           HA       LEU  96   2.507   8.085  -5.700
  719   1HB   LEU  96          1HB       LEU  96   3.894   8.696  -3.557
  720   2HB   LEU  96          2HB       LEU  96   2.350   9.244  -2.950
  721    HG   LEU  96           HG       LEU  96   3.024   6.437  -3.912
  722   1HD1  LEU  96          1HD1      LEU  96   2.347   7.493  -1.132
  723   2HD1  LEU  96          2HD1      LEU  96   2.882   5.860  -1.590
  724   3HD1  LEU  96          3HD1      LEU  96   4.001   7.224  -1.721
  725   1HD2  LEU  96          1HD2      LEU  96   0.796   5.819  -2.874
  726   2HD2  LEU  96          2HD2      LEU  96   0.423   7.546  -2.778
  727   3HD2  LEU  96          3HD2      LEU  96   0.653   6.764  -4.358
  728    H    GLU  97           H        GLU  97   1.378  11.006  -3.919
  729    HA   GLU  97           HA       GLU  97  -1.366  10.234  -4.104
  730   1HB   GLU  97          1HB       GLU  97  -0.062  11.616  -2.337
  731   2HB   GLU  97          2HB       GLU  97  -0.324  12.990  -3.412
  732   1HG   GLU  97          1HG       GLU  97  -2.629  13.002  -3.010
  733   2HG   GLU  97          2HG       GLU  97  -2.681  11.270  -2.636
  734    H    ALA  98           H        ALA  98   0.785  11.827  -6.388
  735    HA   ALA  98           HA       ALA  98  -1.497  12.973  -7.873
  736   1HB   ALA  98          1HB       ALA  98   1.418  12.593  -8.668
  737   2HB   ALA  98          2HB       ALA  98   0.163  13.359  -9.662
  738   3HB   ALA  98          3HB       ALA  98   0.636  14.096  -8.124
  739    H    GLN  99           H        GLN  99   0.808  10.209  -8.198
  740    HA   GLN  99           HA       GLN  99  -0.379   9.101 -10.499
  741   1HB   GLN  99          1HB       GLN  99   1.897   8.574  -9.169
  742   2HB   GLN  99          2HB       GLN  99   0.913   7.330  -8.411
  743   1HG   GLN  99          1HG       GLN  99   1.964   6.293 -10.283
  744   2HG   GLN  99          2HG       GLN  99   0.307   6.561 -10.804
  745   1HE2  GLN  99          1HE2      GLN  99   0.148   7.544 -12.878
  746   2HE2  GLN  99          2HE2      GLN  99   1.456   8.497 -13.564
  747    H    LEU 100           H        LEU 100  -1.263   8.782  -7.125
  748    HA   LEU 100           HA       LEU 100  -3.317   6.739  -7.673
  749   1HB   LEU 100          1HB       LEU 100  -1.551   7.311  -5.514
  750   2HB   LEU 100          2HB       LEU 100  -3.143   7.691  -4.930
  751    HG   LEU 100           HG       LEU 100  -3.803   5.323  -5.854
  752   1HD1  LEU 100          1HD1      LEU 100  -0.769   5.027  -5.721
  753   2HD1  LEU 100          2HD1      LEU 100  -1.943   3.758  -6.141
  754   3HD1  LEU 100          3HD1      LEU 100  -1.674   5.136  -7.232
  755   1HD2  LEU 100          1HD2      LEU 100  -2.794   4.176  -3.865
  756   2HD2  LEU 100          2HD2      LEU 100  -1.783   5.604  -3.579
  757   3HD2  LEU 100          3HD2      LEU 100  -3.561   5.717  -3.457
  758    H    ALA 101           H        ALA 101  -3.326  10.053  -7.987
  759    HA   ALA 101           HA       ALA 101  -5.309  11.026  -6.323
  760   1HB   ALA 101          1HB       ALA 101  -3.894  12.444  -7.763
  761   2HB   ALA 101          2HB       ALA 101  -4.744  11.844  -9.204
  762   3HB   ALA 101          3HB       ALA 101  -5.609  12.814  -7.989
  763    H    ASP 102           H        ASP 102  -5.762   9.102  -9.273
  764    HA   ASP 102           HA       ASP 102  -8.525   9.794  -9.764
  765   1HB   ASP 102          1HB       ASP 102  -8.391   7.933 -11.369
  766   2HB   ASP 102          2HB       ASP 102  -7.036   9.042 -11.546
  767    H    VAL 103           H        VAL 103  -6.985   7.732  -7.410
  768    HA   VAL 103           HA       VAL 103  -9.669   6.771  -6.653
  769    HB   VAL 103           HB       VAL 103  -7.850   4.970  -5.564
  770   1HG1  VAL 103          1HG1      VAL 103 -10.102   4.468  -6.381
  771   2HG1  VAL 103          2HG1      VAL 103  -9.567   4.701  -8.057
  772   3HG1  VAL 103          3HG1      VAL 103  -8.928   3.348  -7.103
  773   1HG2  VAL 103          1HG2      VAL 103  -7.071   5.241  -8.483
  774   2HG2  VAL 103          2HG2      VAL 103  -6.029   5.626  -7.091
  775   3HG2  VAL 103          3HG2      VAL 103  -6.573   3.971  -7.367
  776    H    LEU 104           H        LEU 104  -7.652   9.143  -5.940
  777    HA   LEU 104           HA       LEU 104  -8.571   9.074  -3.149
  778   1HB   LEU 104          1HB       LEU 104  -6.025   9.969  -4.476
  779   2HB   LEU 104          2HB       LEU 104  -6.642  11.004  -3.233
  780    HG   LEU 104           HG       LEU 104  -5.020   9.578  -2.253
  781   1HD1  LEU 104          1HD1      LEU 104  -7.048  10.003  -0.880
  782   2HD1  LEU 104          2HD1      LEU 104  -7.733   8.466  -1.444
  783   3HD1  LEU 104          3HD1      LEU 104  -6.259   8.442  -0.494
  784   1HD2  LEU 104          1HD2      LEU 104  -5.128   7.731  -3.940
  785   2HD2  LEU 104          2HD2      LEU 104  -5.035   7.175  -2.254
  786   3HD2  LEU 104          3HD2      LEU 104  -6.574   7.117  -3.127
  787    H    GLN 105           H        GLN 105  -9.322  10.350  -6.095
  788    HA   GLN 105           HA       GLN 105 -10.182  12.982  -5.346
  789   1HB   GLN 105          2HB       GLN 105  -9.648  12.404  -7.637
  790   2HB   GLN 105          3HB       GLN 105 -10.822  11.107  -7.611
  791   1HG   GLN 105          2HG       GLN 105 -12.159  13.621  -6.943
  792   2HG   GLN 105          3HG       GLN 105 -11.186  13.840  -8.386
  793   1HE2  GLN 105          1HE2      GLN 105 -13.215  11.125  -7.082
  794   2HE2  GLN 105          2HE2      GLN 105 -14.174  10.950  -8.571
  Start of MODEL   14
    1   1H    ALA   1           H        ALA   1  -9.738   4.403   6.576
    2   2H    ALA   1          2HN       ALA   1  -8.329   5.224   6.737
    3   3H    ALA   1          3HN       ALA   1  -8.380   3.870   5.794
    4    HA   ALA   1           HA       ALA   1  -8.980   3.964   8.658
    5   1HB   ALA   1          1HB       ALA   1 -10.001   2.077   7.516
    6   2HB   ALA   1          2HB       ALA   1  -8.436   1.571   6.852
    7   3HB   ALA   1          3HB       ALA   1  -8.728   1.513   8.611
    8    H    THR   2           H        THR   2  -6.532   1.853   7.372
    9    HA   THR   2           HA       THR   2  -4.266   1.989   7.282
   10    HB   THR   2           HB       THR   2  -4.061   3.683   9.773
   11    HG1  THR   2           1HG      THR   2  -4.982   4.907   8.218
   12   1HG2  THR   2          1HG2      THR   2  -2.139   2.184   9.142
   13   2HG2  THR   2          2HG2      THR   2  -2.115   2.904   7.527
   14   3HG2  THR   2          3HG2      THR   2  -1.726   3.894   8.948
   15    H    MET   3           H        MET   3  -5.566  -0.051   7.713
   16    HA   MET   3           HA       MET   3  -5.632  -0.981  10.474
   17   1HB   MET   3          1HB       MET   3  -6.126  -2.373   7.813
   18   2HB   MET   3          2HB       MET   3  -6.287  -3.165   9.390
   19   1HG   MET   3          1HG       MET   3  -7.978  -1.497  10.062
   20   2HG   MET   3          2HG       MET   3  -7.819  -0.692   8.496
   21   1HE   MET   3          1HE       MET   3 -10.416  -0.738   8.202
   22   2HE   MET   3          2HE       MET   3 -11.404  -2.212   8.331
   23   3HE   MET   3          3HE       MET   3 -10.584  -1.566   9.771
   24    H    THR   4           H        THR   4  -4.107  -2.145  11.555
   25    HA   THR   4           HA       THR   4  -1.563  -2.873  10.406
   26    HB   THR   4           HB       THR   4  -2.823  -3.801  12.992
   27    HG1  THR   4           1HG      THR   4  -1.721  -2.010  13.885
   28   1HG2  THR   4          1HG2      THR   4   0.092  -3.452  12.143
   29   2HG2  THR   4          2HG2      THR   4  -0.469  -4.005  13.738
   30   3HG2  THR   4          3HG2      THR   4  -0.751  -5.006  12.306
   31    H    LEU   5           H        LEU   5  -2.304  -4.016   8.578
   32    HA   LEU   5           HA       LEU   5  -3.874  -6.466   8.735
   33   1HB   LEU   5          1HB       LEU   5  -2.430  -4.845   6.704
   34   2HB   LEU   5          2HB       LEU   5  -2.172  -6.562   6.482
   35    HG   LEU   5           HG       LEU   5  -4.439  -7.054   6.160
   36   1HD1  LEU   5          1HD1      LEU   5  -6.214  -5.322   6.127
   37   2HD1  LEU   5          2HD1      LEU   5  -5.582  -5.627   7.736
   38   3HD1  LEU   5          3HD1      LEU   5  -5.082  -4.177   6.879
   39   1HD2  LEU   5          1HD2      LEU   5  -3.451  -4.594   4.659
   40   2HD2  LEU   5          2HD2      LEU   5  -3.296  -6.284   4.195
   41   3HD2  LEU   5          3HD2      LEU   5  -4.888  -5.502   4.162
   42    H    THR   6           H        THR   6  -3.050  -8.638   8.412
   43    HA   THR   6           HA       THR   6  -0.120  -8.871   8.551
   44    HB   THR   6           HB       THR   6  -0.197 -10.976   9.649
   45    HG1  THR   6           1HG      THR   6  -1.894 -12.076   9.473
   46   1HG2  THR   6          1HG2      THR   6  -0.831 -10.321  11.895
   47   2HG2  THR   6          2HG2      THR   6  -0.075  -8.944  11.072
   48   3HG2  THR   6          3HG2      THR   6  -1.843  -8.997  11.281
   49    H    ASP   7           H        ASP   7  -2.427 -11.324   7.912
   50    HA   ASP   7           HA       ASP   7  -1.564 -11.513   5.077
   51   1HB   ASP   7          1HB       ASP   7  -1.078 -13.918   5.612
   52   2HB   ASP   7          2HB       ASP   7  -0.079 -12.813   6.555
   53    H    ALA   8           H        ALA   8  -3.598 -13.643   7.195
   54    HA   ALA   8           HA       ALA   8  -5.698 -13.984   5.446
   55   1HB   ALA   8          1HB       ALA   8  -7.011 -14.493   7.491
   56   2HB   ALA   8          2HB       ALA   8  -5.372 -15.181   7.598
   57   3HB   ALA   8          3HB       ALA   8  -5.774 -13.694   8.487
   58    H    ASN   9           H        ASN   9  -4.941 -11.110   7.355
   59    HA   ASN   9           HA       ASN   9  -7.682 -10.111   6.908
   60   1HB   ASN   9          1HB       ASN   9  -6.380  -9.653   9.082
   61   2HB   ASN   9          2HB       ASN   9  -5.590  -8.377   8.136
   62   1HD2  ASN   9          1HD2      ASN   9  -8.922  -9.711   8.799
   63   2HD2  ASN   9          2HD2      ASN   9  -9.731  -8.175   8.563
   64    H    PHE  10           H        PHE  10  -4.742 -10.095   5.148
   65    HA   PHE  10           HA       PHE  10  -5.237  -7.630   3.671
   66   1HB   PHE  10          1HB       PHE  10  -2.972  -8.647   3.740
   67   2HB   PHE  10          2HB       PHE  10  -3.604 -10.115   3.053
   68    HD1  PHE  10           1HD      PHE  10  -4.607  -6.768   1.641
   69    HD2  PHE  10           2HD      PHE  10  -2.110 -10.266   1.283
   70    HE1  PHE  10           1HE      PHE  10  -4.160  -6.223  -0.716
   71    HE2  PHE  10           2HE      PHE  10  -1.577  -9.657  -1.043
   72    HZ   PHE  10           HZ       PHE  10  -2.642  -7.674  -2.072
   73    H    GLN  11           H        GLN  11  -5.717 -11.113   3.061
   74    HA   GLN  11           HA       GLN  11  -7.265 -10.772   0.685
   75   1HB   GLN  11          1HB       GLN  11  -5.998 -12.798   1.382
   76   2HB   GLN  11          2HB       GLN  11  -7.163 -13.091   2.681
   77   1HG   GLN  11          1HG       GLN  11  -8.940 -13.489   1.057
   78   2HG   GLN  11          2HG       GLN  11  -7.888 -12.981  -0.278
   79   1HE2  GLN  11          1HE2      GLN  11  -6.461 -14.519  -1.189
   80   2HE2  GLN  11          2HE2      GLN  11  -5.993 -15.991  -0.391
   81    H    GLN  12           H        GLN  12  -8.192 -10.663   4.141
   82    HA   GLN  12           HA       GLN  12 -11.040 -10.623   3.579
   83   1HB   GLN  12          1HB       GLN  12 -10.071 -11.182   5.787
   84   2HB   GLN  12          2HB       GLN  12  -9.516  -9.516   5.971
   85   1HG   GLN  12          1HG       GLN  12 -12.451 -10.008   5.439
   86   2HG   GLN  12          2HG       GLN  12 -11.799 -10.397   7.025
   87   1HE2  GLN  12          1HE2      GLN  12 -12.437  -7.685   4.770
   88   2HE2  GLN  12          2HE2      GLN  12 -12.259  -6.462   6.036
   89    H    ALA  13           H        ALA  13  -8.559  -8.008   4.107
   90    HA   ALA  13           HA       ALA  13 -10.440  -5.906   4.022
   91   1HB   ALA  13          1HB       ALA  13  -8.453  -4.447   3.741
   92   2HB   ALA  13          2HB       ALA  13  -8.235  -5.658   5.018
   93   3HB   ALA  13          3HB       ALA  13  -7.450  -5.883   3.434
   94    H    ILE  14           H        ILE  14  -8.478  -7.353   1.430
   95    HA   ILE  14           HA       ILE  14  -8.968  -5.523  -0.642
   96    HB   ILE  14           HB       ILE  14  -7.345  -7.480  -0.433
   97   1HG1  ILE  14          1HG1      ILE  14  -8.643  -7.141  -3.137
   98   2HG1  ILE  14          2HG1      ILE  14  -7.341  -6.167  -2.439
   99   1HG2  ILE  14          1HG2      ILE  14  -9.273  -9.083  -0.001
  100   2HG2  ILE  14          2HG2      ILE  14  -9.557  -9.068  -1.751
  101   3HG2  ILE  14          3HG2      ILE  14  -8.008  -9.649  -1.091
  102   1HD1  ILE  14          1HD1      ILE  14  -5.937  -8.259  -2.231
  103   2HD1  ILE  14          2HD1      ILE  14  -7.204  -9.154  -3.096
  104   3HD1  ILE  14          3HD1      ILE  14  -6.354  -7.856  -3.913
  105    H    GLN  15           H        GLN  15 -11.236  -7.695   0.747
  106    HA   GLN  15           HA       GLN  15 -12.454  -8.836  -1.401
  107   1HB   GLN  15          1HB       GLN  15 -14.226  -9.487   0.068
  108   2HB   GLN  15          2HB       GLN  15 -12.731  -9.439   0.996
  109   1HG   GLN  15          1HG       GLN  15 -13.482  -7.051   1.725
  110   2HG   GLN  15          2HG       GLN  15 -15.059  -7.472   1.051
  111   1HE2  GLN  15          1HE2      GLN  15 -14.780  -6.749   3.722
  112   2HE2  GLN  15          2HE2      GLN  15 -15.080  -8.177   4.712
  113    H    GLY  16           H        GLY  16 -13.290  -5.657  -0.091
  114   1HA   GLY  16          1HA       GLY  16 -14.428  -4.351  -2.179
  115   2HA   GLY  16          2HA       GLY  16 -15.755  -5.381  -1.593
  116    H    ASP  17           H        ASP  17 -15.014  -2.418  -1.406
  117    HA   ASP  17           HA       ASP  17 -15.767  -1.677   1.285
  118   1HB   ASP  17          1HB       ASP  17 -13.524  -2.512   1.841
  119   2HB   ASP  17          2HB       ASP  17 -12.824  -1.688   0.459
  120    H    GLY  18           H        GLY  18 -13.537  -0.784  -1.334
  121   1HA   GLY  18          1HA       GLY  18 -14.494   1.354  -2.718
  122   2HA   GLY  18          2HA       GLY  18 -13.991   1.958  -1.103
  123    HA   PRO  19           HA       PRO  19  -9.940   1.416  -3.459
  124   1HB   PRO  19          1HB       PRO  19  -8.765   3.601  -2.110
  125   2HB   PRO  19          2HB       PRO  19  -9.452   3.598  -3.743
  126   1HG   PRO  19          1HG       PRO  19 -10.756   4.447  -1.171
  127   2HG   PRO  19          2HG       PRO  19 -10.873   5.219  -2.780
  128   1HD   PRO  19          1HD       PRO  19 -12.828   3.660  -1.732
  129   2HD   PRO  19          2HD       PRO  19 -12.462   3.621  -3.484
  130    H    VAL  20           H        VAL  20  -9.236  -0.398  -2.534
  131    HA   VAL  20           HA       VAL  20  -8.481  -0.467   0.335
  132    HB   VAL  20           HB       VAL  20  -8.583  -2.790  -1.699
  133   1HG1  VAL  20          1HG1      VAL  20  -7.681  -2.530   1.225
  134   2HG1  VAL  20          2HG1      VAL  20  -8.073  -4.072   0.491
  135   3HG1  VAL  20          3HG1      VAL  20  -6.725  -3.132  -0.147
  136   1HG2  VAL  20          1HG2      VAL  20 -10.794  -1.913  -0.802
  137   2HG2  VAL  20          2HG2      VAL  20 -10.400  -3.612  -0.511
  138   3HG2  VAL  20          3HG2      VAL  20 -10.229  -2.443   0.796
  139    H    LEU  21           H        LEU  21  -6.439  -0.148   0.851
  140    HA   LEU  21           HA       LEU  21  -4.412   0.000  -1.363
  141   1HB   LEU  21          1HB       LEU  21  -5.431   2.178  -0.952
  142   2HB   LEU  21          2HB       LEU  21  -4.968   2.132   0.738
  143    HG   LEU  21           HG       LEU  21  -2.964   2.004  -1.564
  144   1HD1  LEU  21          1HD1      LEU  21  -3.878   4.432   0.041
  145   2HD1  LEU  21          2HD1      LEU  21  -2.640   4.389  -1.238
  146   3HD1  LEU  21          3HD1      LEU  21  -4.330   4.082  -1.643
  147   1HD2  LEU  21          1HD2      LEU  21  -1.849   1.306   0.482
  148   2HD2  LEU  21          2HD2      LEU  21  -1.412   2.978   0.233
  149   3HD2  LEU  21          3HD2      LEU  21  -2.659   2.578   1.420
  150    H    VAL  22           H        VAL  22  -2.577  -1.144  -0.879
  151    HA   VAL  22           HA       VAL  22  -2.273  -1.891   1.986
  152    HB   VAL  22           HB       VAL  22  -3.067  -3.593  -0.043
  153   1HG1  VAL  22          1HG1      VAL  22  -0.145  -4.212   0.435
  154   2HG1  VAL  22          2HG1      VAL  22  -1.334  -5.231  -0.399
  155   3HG1  VAL  22          3HG1      VAL  22  -0.853  -3.681  -1.108
  156   1HG2  VAL  22          1HG2      VAL  22  -2.498  -5.347   1.687
  157   2HG2  VAL  22          2HG2      VAL  22  -1.643  -4.097   2.595
  158   3HG2  VAL  22          3HG2      VAL  22  -3.393  -3.950   2.312
  159    H    ASP  23           H        ASP  23  -0.511  -1.117   2.896
  160    HA   ASP  23           HA       ASP  23   1.638  -0.120   1.176
  161   1HB   ASP  23          1HB       ASP  23   0.271   0.971   3.246
  162   2HB   ASP  23          2HB       ASP  23   1.556   0.237   4.161
  163    H    PHE  24           H        PHE  24   2.962  -1.795   0.611
  164    HA   PHE  24           HA       PHE  24   3.624  -3.992   2.475
  165   1HB   PHE  24          1HB       PHE  24   4.068  -3.475  -0.450
  166   2HB   PHE  24          2HB       PHE  24   5.025  -4.663   0.349
  167    HD1  PHE  24           1HD      PHE  24   3.824  -6.441   1.744
  168    HD2  PHE  24           2HD      PHE  24   2.011  -4.213  -1.461
  169    HE1  PHE  24           1HE      PHE  24   2.424  -8.387   1.197
  170    HE2  PHE  24           2HE      PHE  24   0.557  -6.139  -1.975
  171    HZ   PHE  24           HZ       PHE  24   0.854  -8.304  -0.681
  172    H    TRP  25           H        TRP  25   5.134  -3.585   3.824
  173    HA   TRP  25           HA       TRP  25   7.643  -2.270   2.928
  174   1HB   TRP  25          1HB       TRP  25   7.859  -1.023   4.920
  175   2HB   TRP  25          2HB       TRP  25   6.247  -0.686   4.320
  176    HD1  TRP  25           HD       TRP  25   4.212  -2.132   5.632
  177    HE1  TRP  25           1HE      TRP  25   4.029  -2.862   8.080
  178    HE3  TRP  25           3HE      TRP  25   9.065  -1.479   7.001
  179    HZ2  TRP  25           2HZ      TRP  25   5.908  -3.417  10.307
  180    HZ3  TRP  25           3HZ      TRP  25   9.858  -2.101   9.285
  181    HH2  TRP  25           HH       TRP  25   8.274  -3.084  10.920
  182    H    ALA  26           H        ALA  26   9.389  -2.881   4.835
  183    HA   ALA  26           HA       ALA  26   8.977  -5.578   5.853
  184   1HB   ALA  26          1HB       ALA  26  11.338  -4.933   4.020
  185   2HB   ALA  26          2HB       ALA  26  10.961  -6.468   4.807
  186   3HB   ALA  26          3HB       ALA  26   9.928  -5.875   3.514
  187    H    ALA  27           H        ALA  27  10.842  -6.141   7.294
  188    HA   ALA  27           HA       ALA  27  11.397  -3.842   8.936
  189   1HB   ALA  27          1HB       ALA  27  10.922  -6.031   9.873
  190   2HB   ALA  27          2HB       ALA  27  12.417  -6.690   9.163
  191   3HB   ALA  27          3HB       ALA  27  12.493  -5.432  10.426
  192    H    TRP  28           H        TRP  28  13.128  -4.918   6.185
  193    HA   TRP  28           HA       TRP  28  15.653  -3.682   7.209
  194   1HB   TRP  28          1HB       TRP  28  16.859  -5.369   6.403
  195   2HB   TRP  28          2HB       TRP  28  15.377  -6.272   6.622
  196    HD1  TRP  28           HD       TRP  28  17.793  -4.974   4.069
  197    HE1  TRP  28           1HE      TRP  28  17.207  -5.712   1.693
  198    HE3  TRP  28           3HE      TRP  28  13.243  -7.207   4.982
  199    HZ2  TRP  28           2HZ      TRP  28  14.940  -6.839   0.311
  200    HZ3  TRP  28           3HZ      TRP  28  11.891  -8.046   3.094
  201    HH2  TRP  28           HH       TRP  28  12.710  -7.825   0.763
  202    H    CYS  29           H        CYS  29  13.265  -3.203   4.832
  203    HA   CYS  29           HA       CYS  29  14.761  -2.961   2.496
  204   1HB   CYS  29          1HB       CYS  29  12.578  -2.037   1.593
  205   2HB   CYS  29          2HB       CYS  29  12.599  -3.626   2.317
  206    H    GLY  30           H        GLY  30  16.047  -1.085   4.200
  207   1HA   GLY  30          1HA       GLY  30  16.935   1.048   4.263
  208   2HA   GLY  30          2HA       GLY  30  17.055   0.716   2.549
  209    HA   PRO  31           HA       PRO  31  14.806   4.578   1.973
  210   1HB   PRO  31          1HB       PRO  31  13.513   4.088  -0.430
  211   2HB   PRO  31          2HB       PRO  31  15.243   4.532  -0.268
  212   1HG   PRO  31          1HG       PRO  31  14.021   1.769  -0.558
  213   2HG   PRO  31          2HG       PRO  31  15.418   2.464  -1.449
  214   1HD   PRO  31          1HD       PRO  31  15.817   0.848   0.660
  215   2HD   PRO  31          2HD       PRO  31  16.815   2.321   0.479
  216    H    CYS  32           H        CYS  32  13.060   1.505   2.107
  217    HA   CYS  32           HA       CYS  32  10.437   2.667   2.319
  218   1HB   CYS  32          1HB       CYS  32   9.725   0.670   3.316
  219   2HB   CYS  32          2HB       CYS  32  10.922   0.225   2.107
  220    H    ARG  33           H        ARG  33  13.198   2.785   4.562
  221    HA   ARG  33           HA       ARG  33  11.554   3.520   6.836
  222   1HB   ARG  33          1HB       ARG  33  14.094   2.625   6.668
  223   2HB   ARG  33          2HB       ARG  33  14.439   4.341   6.607
  224   1HG   ARG  33          1HG       ARG  33  14.478   4.262   8.811
  225   2HG   ARG  33          2HG       ARG  33  12.724   4.342   8.717
  226   1HD   ARG  33          1HD       ARG  33  14.495   1.878   8.975
  227   2HD   ARG  33          2HD       ARG  33  13.416   2.568  10.177
  228    HE   ARG  33           HE       ARG  33  12.806   0.696   8.100
  229   1HH1  ARG  33          2HH2      ARG  33  11.251   3.319   9.891
  230   2HH1  ARG  33          1HH2      ARG  33   9.638   2.738   9.647
  231   1HH2  ARG  33          2HH1      ARG  33  10.706  -0.090   7.759
  232   2HH2  ARG  33          1HH1      ARG  33   9.332   0.713   8.423
  233    H    MET  34           H        MET  34  12.472   5.212   3.971
  234    HA   MET  34           HA       MET  34  11.969   7.850   5.190
  235   1HB   MET  34          1HB       MET  34  13.108   6.980   2.486
  236   2HB   MET  34          2HB       MET  34  12.760   8.654   2.921
  237   1HG   MET  34          1HG       MET  34  14.305   8.425   4.880
  238   2HG   MET  34          2HG       MET  34  14.753   6.819   4.302
  239   1HE   MET  34          1HE       MET  34  16.209   6.347   2.152
  240   2HE   MET  34          2HE       MET  34  14.981   7.145   1.132
  241   3HE   MET  34          3HE       MET  34  16.692   7.598   0.985
  242    H    MET  35           H        MET  35  10.713   5.485   2.880
  243    HA   MET  35           HA       MET  35   8.531   7.159   2.009
  244   1HB   MET  35          1HB       MET  35   9.562   4.950   0.889
  245   2HB   MET  35          2HB       MET  35   8.349   4.145   1.869
  246   1HG   MET  35          1HG       MET  35   6.610   5.521   0.780
  247   2HG   MET  35          2HG       MET  35   7.841   6.423  -0.105
  248   1HE   MET  35          1HE       MET  35   5.171   4.555  -1.209
  249   2HE   MET  35          2HE       MET  35   6.080   5.768  -2.145
  250   3HE   MET  35          3HE       MET  35   5.904   4.103  -2.760
  251    H    ALA  36           H        ALA  36   8.929   4.561   4.552
  252    HA   ALA  36           HA       ALA  36   6.284   4.322   5.285
  253   1HB   ALA  36          1HB       ALA  36   7.955   2.851   6.185
  254   2HB   ALA  36          2HB       ALA  36   8.749   4.181   7.058
  255   3HB   ALA  36          3HB       ALA  36   7.121   3.648   7.530
  256    HA   PRO  37           HA       PRO  37   6.286   8.211   8.002
  257   1HB   PRO  37          1HB       PRO  37   8.181  10.181   7.546
  258   2HB   PRO  37          2HB       PRO  37   8.244   8.966   8.862
  259   1HG   PRO  37          1HG       PRO  37   9.654   8.940   6.215
  260   2HG   PRO  37          2HG       PRO  37  10.289   8.469   7.815
  261   1HD   PRO  37          1HD       PRO  37   9.436   6.619   6.010
  262   2HD   PRO  37          2HD       PRO  37   9.205   6.393   7.761
  263    H    VAL  38           H        VAL  38   7.695   8.683   4.578
  264    HA   VAL  38           HA       VAL  38   6.018  10.977   4.214
  265    HB   VAL  38           HB       VAL  38   8.036   9.806   2.760
  266   1HG1  VAL  38          1HG1      VAL  38   5.621   9.595   0.922
  267   2HG1  VAL  38          2HG1      VAL  38   7.327   9.322   0.519
  268   3HG1  VAL  38          3HG1      VAL  38   6.488   8.205   1.600
  269   1HG2  VAL  38          1HG2      VAL  38   6.068  11.922   1.833
  270   2HG2  VAL  38          2HG2      VAL  38   7.477  12.184   2.875
  271   3HG2  VAL  38          3HG2      VAL  38   7.718  11.674   1.196
  272    H    LEU  39           H        LEU  39   5.339   7.585   3.937
  273    HA   LEU  39           HA       LEU  39   2.835   7.605   2.656
  274   1HB   LEU  39          1HB       LEU  39   4.371   5.711   4.434
  275   2HB   LEU  39          2HB       LEU  39   2.773   5.313   3.864
  276    HG   LEU  39           HG       LEU  39   4.938   6.134   1.911
  277   1HD1  LEU  39          1HD1      LEU  39   5.258   3.628   1.513
  278   2HD1  LEU  39          2HD1      LEU  39   5.946   4.237   3.017
  279   3HD1  LEU  39          3HD1      LEU  39   4.427   3.366   3.049
  280   1HD2  LEU  39          1HD2      LEU  39   2.420   4.491   1.630
  281   2HD2  LEU  39          2HD2      LEU  39   2.718   6.126   0.985
  282   3HD2  LEU  39          3HD2      LEU  39   3.628   4.731   0.368
  283    H    GLU  40           H        GLU  40   3.708   8.746   5.834
  284    HA   GLU  40           HA       GLU  40   1.101   8.090   6.992
  285   1HB   GLU  40          1HB       GLU  40   3.371   7.873   8.146
  286   2HB   GLU  40          2HB       GLU  40   3.354   9.629   8.324
  287   1HG   GLU  40          1HG       GLU  40   1.567   9.571   9.844
  288   2HG   GLU  40          2HG       GLU  40   0.898   8.083   9.177
  289    H    GLU  41           H        GLU  41   3.032  11.137   6.270
  290    HA   GLU  41           HA       GLU  41   0.884  12.941   6.358
  291   1HB   GLU  41          1HB       GLU  41   3.067  12.842   4.212
  292   2HB   GLU  41          2HB       GLU  41   1.973  14.185   4.509
  293   1HG   GLU  41          1HG       GLU  41   3.886  14.895   5.554
  294   2HG   GLU  41          2HG       GLU  41   2.942  14.264   6.904
  295    H    PHE  42           H        PHE  42   1.751  10.674   3.760
  296    HA   PHE  42           HA       PHE  42  -0.339  11.266   1.896
  297   1HB   PHE  42          1HB       PHE  42   1.565   9.884   1.309
  298   2HB   PHE  42          2HB       PHE  42   1.162   8.758   2.583
  299    HD1  PHE  42           1HD      PHE  42  -0.163  10.130  -0.622
  300    HD2  PHE  42           2HD      PHE  42  -0.128   6.829   2.161
  301    HE1  PHE  42           1HE      PHE  42  -1.496   8.762  -2.207
  302    HE2  PHE  42           2HE      PHE  42  -1.465   5.484   0.572
  303    HZ   PHE  42           HZ       PHE  42  -2.214   6.535  -1.611
  304    H    ALA  43           H        ALA  43  -0.309   8.649   4.443
  305    HA   ALA  43           HA       ALA  43  -2.969   7.929   4.085
  306   1HB   ALA  43          1HB       ALA  43  -1.345   7.882   6.667
  307   2HB   ALA  43          2HB       ALA  43  -2.827   6.957   6.357
  308   3HB   ALA  43          3HB       ALA  43  -1.361   6.616   5.418
  309    H    GLU  44           H        GLU  44  -1.699  10.392   6.356
  310    HA   GLU  44           HA       GLU  44  -4.053  11.089   7.697
  311   1HB   GLU  44          1HB       GLU  44  -1.801  11.864   8.320
  312   2HB   GLU  44          2HB       GLU  44  -1.707  12.844   6.852
  313   1HG   GLU  44          1HG       GLU  44  -3.685  14.182   7.670
  314   2HG   GLU  44          2HG       GLU  44  -3.674  13.223   9.153
  315    H    ALA  45           H        ALA  45  -2.754  12.438   4.657
  316    HA   ALA  45           HA       ALA  45  -4.728  14.417   4.271
  317   1HB   ALA  45          1HB       ALA  45  -3.895  14.499   1.957
  318   2HB   ALA  45          2HB       ALA  45  -2.558  14.355   3.122
  319   3HB   ALA  45          3HB       ALA  45  -3.088  12.931   2.184
  320    H    HIS  46           H        HIS  46  -5.185  11.020   3.982
  321    HA   HIS  46           HA       HIS  46  -7.945  11.470   3.160
  322   1HB   HIS  46          1HB       HIS  46  -7.731   9.571   1.471
  323   2HB   HIS  46          2HB       HIS  46  -7.110  11.155   0.997
  324    HD1  HIS  46           1HD      HIS  46  -5.599   7.990   2.625
  325    HD2  HIS  46           2HD      HIS  46  -4.773  11.125  -0.056
  326    HE1  HIS  46           1HE      HIS  46  -3.261   7.478   1.511
  327    HE2  HIS  46           2HE      HIS  46  -2.899   9.496  -0.200
  328    H    ALA  47           H        ALA  47  -7.364  11.075   5.531
  329    HA   ALA  47           HA       ALA  47  -6.439   8.836   6.678
  330   1HB   ALA  47          1HB       ALA  47  -7.774   9.433   8.673
  331   2HB   ALA  47          2HB       ALA  47  -7.063  10.869   7.912
  332   3HB   ALA  47          3HB       ALA  47  -8.790  10.505   7.685
  333    H    ASP  48           H        ASP  48  -9.888   9.271   5.760
  334    HA   ASP  48           HA       ASP  48 -10.111   6.320   5.686
  335   1HB   ASP  48          1HB       ASP  48 -10.994   7.514   7.856
  336   2HB   ASP  48          2HB       ASP  48 -12.376   7.936   6.839
  337    H    LYS  49           H        LYS  49 -10.179   8.777   3.651
  338    HA   LYS  49           HA       LYS  49 -12.511   8.037   2.066
  339   1HB   LYS  49          1HB       LYS  49 -11.360  10.128   1.570
  340   2HB   LYS  49          2HB       LYS  49  -9.845   9.274   1.262
  341   1HG   LYS  49          1HG       LYS  49 -10.753   8.143  -0.674
  342   2HG   LYS  49          2HG       LYS  49 -12.370   8.772  -0.366
  343   1HD   LYS  49          1HD       LYS  49  -9.969  10.524  -1.085
  344   2HD   LYS  49          2HD       LYS  49 -11.053   9.773  -2.261
  345   1HE   LYS  49          1HE       LYS  49 -12.980  10.915  -0.899
  346   2HE   LYS  49          2HE       LYS  49 -11.687  11.955  -0.260
  347   1HZ   LYS  49          1HZ       LYS  49 -11.128  12.394  -2.668
  348   2HZ   LYS  49          2HZ       LYS  49 -12.414  11.584  -3.127
  349   3HZ   LYS  49          3HZ       LYS  49 -12.632  12.958  -2.262
  350    H    VAL  50           H        VAL  50  -9.285   6.667   2.655
  351    HA   VAL  50           HA       VAL  50 -10.051   4.418   0.835
  352    HB   VAL  50           HB       VAL  50  -7.795   4.073   0.191
  353   1HG1  VAL  50          1HG1      VAL  50  -8.190   7.083  -0.031
  354   2HG1  VAL  50          2HG1      VAL  50  -7.318   5.999  -1.141
  355   3HG1  VAL  50          3HG1      VAL  50  -9.077   5.917  -1.014
  356   1HG2  VAL  50          1HG2      VAL  50  -5.938   5.638   0.835
  357   2HG2  VAL  50          2HG2      VAL  50  -7.006   6.314   2.091
  358   3HG2  VAL  50          3HG2      VAL  50  -6.513   4.610   2.142
  359    H    THR  51           H        THR  51  -9.738   2.295   1.593
  360    HA   THR  51           HA       THR  51  -9.116   2.135   4.419
  361    HB   THR  51           HB       THR  51 -11.124   1.027   3.506
  362    HG1  THR  51           1HG      THR  51 -10.938  -0.486   5.009
  363   1HG2  THR  51          1HG2      THR  51  -9.159  -1.140   2.696
  364   2HG2  THR  51          2HG2      THR  51 -10.907  -1.278   2.791
  365   3HG2  THR  51          3HG2      THR  51 -10.199  -0.166   1.602
  366    H    VAL  52           H        VAL  52  -7.147   3.094   3.937
  367    HA   VAL  52           HA       VAL  52  -4.994   1.566   2.772
  368    HB   VAL  52           HB       VAL  52  -4.471   3.757   2.904
  369   1HG1  VAL  52          1HG1      VAL  52  -4.541   5.225   4.933
  370   2HG1  VAL  52          2HG1      VAL  52  -6.140   4.705   4.411
  371   3HG1  VAL  52          3HG1      VAL  52  -5.359   3.917   5.793
  372   1HG2  VAL  52          1HG2      VAL  52  -2.572   2.394   3.703
  373   2HG2  VAL  52          2HG2      VAL  52  -2.531   4.063   4.284
  374   3HG2  VAL  52          3HG2      VAL  52  -3.041   2.766   5.373
  375    H    ALA  53           H        ALA  53  -3.526   0.245   3.738
  376    HA   ALA  53           HA       ALA  53  -3.690  -0.336   6.570
  377   1HB   ALA  53          1HB       ALA  53  -4.155  -2.402   4.361
  378   2HB   ALA  53          2HB       ALA  53  -3.728  -2.795   6.042
  379   3HB   ALA  53          3HB       ALA  53  -5.281  -1.996   5.673
  380    H    LYS  54           H        LYS  54  -1.773  -1.587   7.200
  381    HA   LYS  54           HA       LYS  54   0.459  -1.270   5.247
  382   1HB   LYS  54          1HB       LYS  54   0.362   0.734   6.631
  383   2HB   LYS  54          2HB       LYS  54   0.252  -0.208   8.117
  384   1HG   LYS  54          1HG       LYS  54   2.490  -0.789   8.120
  385   2HG   LYS  54          2HG       LYS  54   2.674  -0.591   6.373
  386   1HD   LYS  54          1HD       LYS  54   2.118   1.813   8.158
  387   2HD   LYS  54          2HD       LYS  54   3.778   1.213   7.903
  388   1HE   LYS  54          1HE       LYS  54   3.688   1.543   5.545
  389   2HE   LYS  54          2HE       LYS  54   1.938   1.615   5.556
  390   1HZ   LYS  54          1HZ       LYS  54   2.629   3.619   5.085
  391   2HZ   LYS  54          2HZ       LYS  54   2.079   3.779   6.630
  392   3HZ   LYS  54          3HZ       LYS  54   3.717   3.796   6.348
  393    H    LEU  55           H        LEU  55   1.651  -3.082   5.138
  394    HA   LEU  55           HA       LEU  55   1.672  -4.917   7.451
  395   1HB   LEU  55          1HB       LEU  55   1.269  -6.878   5.888
  396   2HB   LEU  55          2HB       LEU  55  -0.072  -5.947   6.502
  397    HG   LEU  55           HG       LEU  55  -0.563  -4.982   4.401
  398   1HD1  LEU  55          1HD1      LEU  55   0.797  -5.471   2.336
  399   2HD1  LEU  55          2HD1      LEU  55   1.599  -4.410   3.485
  400   3HD1  LEU  55          3HD1      LEU  55   2.069  -6.120   3.403
  401   1HD2  LEU  55          1HD2      LEU  55  -0.954  -6.953   2.977
  402   2HD2  LEU  55          2HD2      LEU  55   0.273  -7.874   3.875
  403   3HD2  LEU  55          3HD2      LEU  55  -1.217  -7.383   4.674
  404    H    ASN  56           H        ASN  56   3.167  -6.516   7.455
  405    HA   ASN  56           HA       ASN  56   5.756  -5.706   6.352
  406   1HB   ASN  56          1HB       ASN  56   5.570  -6.164   8.740
  407   2HB   ASN  56          2HB       ASN  56   4.824  -7.743   8.426
  408   1HD2  ASN  56          1HD2      ASN  56   6.358  -9.222   9.178
  409   2HD2  ASN  56          2HD2      ASN  56   8.029  -9.191   8.632
  410    H    VAL  57           H        VAL  57   6.226  -6.482   4.363
  411    HA   VAL  57           HA       VAL  57   4.781  -8.505   3.077
  412    HB   VAL  57           HB       VAL  57   6.118  -6.562   2.190
  413   1HG1  VAL  57          1HG1      VAL  57   8.392  -8.600   2.082
  414   2HG1  VAL  57          2HG1      VAL  57   8.427  -6.946   1.476
  415   3HG1  VAL  57          3HG1      VAL  57   8.304  -7.247   3.220
  416   1HG2  VAL  57          1HG2      VAL  57   6.316  -7.475   0.014
  417   2HG2  VAL  57          2HG2      VAL  57   6.419  -9.137   0.640
  418   3HG2  VAL  57          3HG2      VAL  57   4.920  -8.229   0.784
  419    H    ASP  58           H        ASP  58   7.619  -8.813   5.159
  420    HA   ASP  58           HA       ASP  58   8.592 -11.316   4.334
  421   1HB   ASP  58          1HB       ASP  58   8.668  -9.517   6.752
  422   2HB   ASP  58          2HB       ASP  58   9.529 -11.020   6.702
  423    H    GLU  59           H        GLU  59   5.828 -10.281   6.243
  424    HA   GLU  59           HA       GLU  59   5.570 -12.845   7.698
  425   1HB   GLU  59          1HB       GLU  59   5.190 -10.870   8.976
  426   2HB   GLU  59          2HB       GLU  59   4.114 -10.205   7.752
  427   1HG   GLU  59          1HG       GLU  59   2.412 -11.898   8.232
  428   2HG   GLU  59          2HG       GLU  59   3.490 -12.664   9.413
  429    H    ASN  60           H        ASN  60   4.034 -10.986   5.058
  430    HA   ASN  60           HA       ASN  60   1.901 -13.052   4.929
  431   1HB   ASN  60          1HB       ASN  60   0.995 -10.911   5.189
  432   2HB   ASN  60          2HB       ASN  60   1.957 -10.226   3.865
  433   1HD2  ASN  60          1HD2      ASN  60   0.673 -10.001   1.979
  434   2HD2  ASN  60          2HD2      ASN  60  -0.337 -11.307   1.398
  435    HA   PRO  61           HA       PRO  61   3.752 -14.215   0.903
  436   1HB   PRO  61          1HB       PRO  61   2.984 -16.819   0.846
  437   2HB   PRO  61          2HB       PRO  61   4.368 -16.254   1.827
  438   1HG   PRO  61          1HG       PRO  61   1.510 -16.745   2.743
  439   2HG   PRO  61          2HG       PRO  61   3.024 -17.330   3.500
  440   1HD   PRO  61          1HD       PRO  61   1.721 -15.069   4.353
  441   2HD   PRO  61          2HD       PRO  61   3.499 -15.211   4.406
  442    H    GLU  62           H        GLU  62   0.403 -14.272   2.133
  443    HA   GLU  62           HA       GLU  62  -0.812 -15.449  -0.189
  444   1HB   GLU  62          1HB       GLU  62  -1.969 -15.651   1.860
  445   2HB   GLU  62          2HB       GLU  62  -1.891 -13.925   2.193
  446   1HG   GLU  62          1HG       GLU  62  -4.140 -14.637   1.558
  447   2HG   GLU  62          2HG       GLU  62  -3.492 -13.392   0.503
  448    H    THR  63           H        THR  63  -1.129 -14.570  -2.043
  449    HA   THR  63           HA       THR  63  -1.211 -13.289  -3.817
  450    HB   THR  63           HB       THR  63  -2.644 -11.554  -1.803
  451    HG1  THR  63           1HG      THR  63  -3.471 -13.711  -2.392
  452   1HG2  THR  63          1HG2      THR  63  -2.614 -11.234  -4.831
  453   2HG2  THR  63          2HG2      THR  63  -3.732 -10.431  -3.707
  454   3HG2  THR  63          3HG2      THR  63  -2.004 -10.042  -3.655
  455    H    THR  64           H        THR  64   0.643 -12.083  -1.244
  456    HA   THR  64           HA       THR  64   2.369 -10.243  -2.528
  457    HB   THR  64           HB       THR  64   3.048 -12.509  -0.608
  458    HG1  THR  64           1HG      THR  64   2.609 -11.197   0.987
  459   1HG2  THR  64          1HG2      THR  64   5.077 -11.374  -1.559
  460   2HG2  THR  64          2HG2      THR  64   4.469  -9.853  -0.863
  461   3HG2  THR  64          3HG2      THR  64   4.894 -11.205   0.194
  462    H    SER  65           H        SER  65   2.521 -13.843  -2.279
  463    HA   SER  65           HA       SER  65   4.683 -14.256  -4.036
  464   1HB   SER  65          1HB       SER  65   3.713 -15.884  -2.413
  465   2HB   SER  65          2HB       SER  65   2.304 -16.083  -3.468
  466    HG   SER  65           HG       SER  65   3.932 -17.681  -3.794
  467    H    GLN  66           H        GLN  66   1.163 -14.159  -4.725
  468    HA   GLN  66           HA       GLN  66   1.188 -14.996  -7.361
  469   1HB   GLN  66          1HB       GLN  66  -0.816 -14.696  -5.950
  470   2HB   GLN  66          2HB       GLN  66  -0.647 -12.950  -6.045
  471   1HG   GLN  66          1HG       GLN  66  -2.410 -13.754  -7.532
  472   2HG   GLN  66          2HG       GLN  66  -1.138 -12.936  -8.422
  473   1HE2  GLN  66          1HE2      GLN  66   0.446 -14.306  -9.639
  474   2HE2  GLN  66          2HE2      GLN  66  -0.141 -15.872 -10.234
  475    H    PHE  67           H        PHE  67   1.824 -11.707  -6.134
  476    HA   PHE  67           HA       PHE  67   2.297 -10.816  -8.944
  477   1HB   PHE  67          1HB       PHE  67   1.473  -9.294  -6.464
  478   2HB   PHE  67          2HB       PHE  67   1.925  -8.538  -7.986
  479    HD1  PHE  67           1HD      PHE  67   0.602  -9.227 -10.120
  480    HD2  PHE  67           2HD      PHE  67  -0.778  -9.979  -6.104
  481    HE1  PHE  67           1HE      PHE  67  -1.716  -9.487 -10.961
  482    HE2  PHE  67           2HE      PHE  67  -3.097 -10.232  -6.955
  483    HZ   PHE  67           HZ       PHE  67  -3.568  -9.992  -9.380
  484    H    GLY  68           H        GLY  68   4.226 -12.236  -6.864
  485   1HA   GLY  68          1HA       GLY  68   6.499 -12.227  -6.617
  486   2HA   GLY  68          2HA       GLY  68   6.567 -11.085  -7.966
  487    H    ILE  69           H        ILE  69   4.938 -10.475  -4.881
  488    HA   ILE  69           HA       ILE  69   6.075  -7.835  -4.831
  489    HB   ILE  69           HB       ILE  69   4.198  -9.296  -2.973
  490   1HG1  ILE  69          1HG1      ILE  69   3.270  -9.165  -5.198
  491   2HG1  ILE  69          2HG1      ILE  69   2.379  -8.129  -4.108
  492   1HG2  ILE  69          1HG2      ILE  69   4.845  -6.338  -3.045
  493   2HG2  ILE  69          2HG2      ILE  69   3.351  -7.013  -2.368
  494   3HG2  ILE  69          3HG2      ILE  69   4.884  -7.464  -1.668
  495   1HD1  ILE  69          1HD1      ILE  69   3.662  -6.151  -4.984
  496   2HD1  ILE  69          2HD1      ILE  69   4.454  -7.216  -6.155
  497   3HD1  ILE  69          3HD1      ILE  69   2.694  -6.980  -6.206
  498    H    MET  70           H        MET  70   8.319  -8.544  -4.645
  499    HA   MET  70           HA       MET  70   9.060  -8.154  -1.773
  500   1HB   MET  70          1HB       MET  70  10.403  -9.843  -3.915
  501   2HB   MET  70          2HB       MET  70  11.282  -9.258  -2.502
  502   1HG   MET  70          1HG       MET  70   8.729 -10.888  -2.370
  503   2HG   MET  70          2HG       MET  70  10.354 -11.554  -2.209
  504   1HE   MET  70          1HE       MET  70   7.508 -11.270  -0.225
  505   2HE   MET  70          2HE       MET  70   8.755 -12.506   0.086
  506   3HE   MET  70          3HE       MET  70   8.282 -11.368   1.372
  507    H    SER  71           H        SER  71   8.640  -6.539  -4.512
  508    HA   SER  71           HA       SER  71  11.146  -5.082  -4.777
  509   1HB   SER  71          1HB       SER  71   9.467  -5.787  -6.595
  510   2HB   SER  71          2HB       SER  71   8.422  -4.494  -5.996
  511    HG   SER  71           HG       SER  71  11.058  -4.265  -7.065
  512    H    ILE  72           H        ILE  72  10.172  -4.954  -2.088
  513    HA   ILE  72           HA       ILE  72   8.468  -2.708  -1.877
  514    HB   ILE  72           HB       ILE  72   8.208  -3.111   0.378
  515   1HG1  ILE  72          1HG1      ILE  72  10.422  -3.340   1.185
  516   2HG1  ILE  72          2HG1      ILE  72   9.384  -4.626   1.760
  517   1HG2  ILE  72          1HG2      ILE  72   7.122  -4.666  -1.196
  518   2HG2  ILE  72          2HG2      ILE  72   8.403  -5.848  -0.888
  519   3HG2  ILE  72          3HG2      ILE  72   7.346  -5.293   0.430
  520   1HD1  ILE  72          1HD1      ILE  72  11.599  -5.469   1.254
  521   2HD1  ILE  72          2HD1      ILE  72  10.442  -6.203   0.135
  522   3HD1  ILE  72          3HD1      ILE  72  11.512  -4.883  -0.410
  523    HA   PRO  73           HA       PRO  73   8.172  -1.017   0.368
  524   1HB   PRO  73          1HB       PRO  73   7.725   1.601  -0.130
  525   2HB   PRO  73          2HB       PRO  73   8.799   1.019   1.164
  526   1HG   PRO  73          1HG       PRO  73   9.576   1.972  -1.603
  527   2HG   PRO  73          2HG       PRO  73  10.329   2.411  -0.042
  528   1HD   PRO  73          1HD       PRO  73  11.353   0.474  -1.689
  529   2HD   PRO  73          2HD       PRO  73  11.467   0.334   0.081
  530    H    THR  74           H        THR  74   6.363  -1.713  -0.606
  531    HA   THR  74           HA       THR  74   5.762  -0.850  -3.393
  532    HB   THR  74           HB       THR  74   5.209  -3.567  -2.133
  533    HG1  THR  74           1HG      THR  74   7.293  -2.685  -3.696
  534   1HG2  THR  74          1HG2      THR  74   4.571  -4.225  -4.464
  535   2HG2  THR  74          2HG2      THR  74   3.426  -3.134  -3.674
  536   3HG2  THR  74          3HG2      THR  74   4.553  -2.515  -4.900
  537    H    LEU  75           H        LEU  75   3.495  -0.606  -3.816
  538    HA   LEU  75           HA       LEU  75   1.634  -0.345  -1.538
  539   1HB   LEU  75          1HB       LEU  75   3.012   1.770  -1.897
  540   2HB   LEU  75          2HB       LEU  75   2.272   1.889  -3.474
  541    HG   LEU  75           HG       LEU  75   0.349   1.453  -1.201
  542   1HD1  LEU  75          1HD1      LEU  75   2.004   3.970  -1.506
  543   2HD1  LEU  75          2HD1      LEU  75   0.462   3.915  -0.620
  544   3HD1  LEU  75          3HD1      LEU  75   1.833   2.924  -0.086
  545   1HD2  LEU  75          1HD2      LEU  75  -0.451   1.804  -3.513
  546   2HD2  LEU  75          2HD2      LEU  75  -0.963   3.120  -2.451
  547   3HD2  LEU  75          3HD2      LEU  75   0.389   3.370  -3.575
  548    H    ILE  76           H        ILE  76  -0.213  -1.351  -2.307
  549    HA   ILE  76           HA       ILE  76  -0.637  -1.261  -5.262
  550    HB   ILE  76           HB       ILE  76  -1.340  -3.595  -3.497
  551   1HG1  ILE  76          1HG1      ILE  76   1.081  -3.265  -5.325
  552   2HG1  ILE  76          2HG1      ILE  76   1.078  -3.498  -3.574
  553   1HG2  ILE  76          1HG2      ILE  76  -1.290  -3.173  -6.549
  554   2HG2  ILE  76          2HG2      ILE  76  -1.694  -4.711  -5.770
  555   3HG2  ILE  76          3HG2      ILE  76  -2.745  -3.331  -5.543
  556   1HD1  ILE  76          1HD1      ILE  76  -0.131  -5.748  -4.060
  557   2HD1  ILE  76          2HD1      ILE  76   0.496  -5.539  -5.708
  558   3HD1  ILE  76          3HD1      ILE  76   1.606  -5.603  -4.322
  559    H    LEU  77           H        LEU  77  -2.599  -0.846  -5.929
  560    HA   LEU  77           HA       LEU  77  -4.604   0.101  -3.951
  561   1HB   LEU  77          1HB       LEU  77  -3.335   1.676  -5.543
  562   2HB   LEU  77          2HB       LEU  77  -4.209   0.903  -6.852
  563    HG   LEU  77           HG       LEU  77  -5.107   2.824  -4.721
  564   1HD1  LEU  77          1HD1      LEU  77  -4.400   3.437  -7.067
  565   2HD1  LEU  77          2HD1      LEU  77  -5.837   2.599  -7.671
  566   3HD1  LEU  77          3HD1      LEU  77  -6.008   4.010  -6.626
  567   1HD2  LEU  77          1HD2      LEU  77  -6.781   1.173  -4.300
  568   2HD2  LEU  77          2HD2      LEU  77  -7.530   2.402  -5.306
  569   3HD2  LEU  77          3HD2      LEU  77  -7.044   0.877  -6.027
  570    H    PHE  78           H        PHE  78  -6.303  -1.133  -3.903
  571    HA   PHE  78           HA       PHE  78  -7.225  -2.796  -6.185
  572   1HB   PHE  78          1HB       PHE  78  -7.505  -3.585  -3.268
  573   2HB   PHE  78          2HB       PHE  78  -7.878  -4.560  -4.657
  574    HD1  PHE  78           1HD      PHE  78  -5.193  -3.159  -2.513
  575    HD2  PHE  78           2HD      PHE  78  -6.154  -5.943  -5.655
  576    HE1  PHE  78           1HE      PHE  78  -3.024  -4.290  -2.196
  577    HE2  PHE  78           2HE      PHE  78  -3.947  -7.025  -5.390
  578    HZ   PHE  78           HZ       PHE  78  -2.371  -6.194  -3.660
  579    H    LYS  79           H        LYS  79  -9.611  -3.310  -5.813
  580    HA   LYS  79           HA       LYS  79 -11.083  -1.422  -4.133
  581   1HB   LYS  79          1HB       LYS  79 -12.348  -0.382  -6.093
  582   2HB   LYS  79          2HB       LYS  79 -10.739   0.173  -5.740
  583   1HG   LYS  79          1HG       LYS  79 -10.965   0.130  -8.077
  584   2HG   LYS  79          2HG       LYS  79  -9.813  -1.122  -7.654
  585   1HD   LYS  79          1HD       LYS  79 -12.757  -1.666  -8.214
  586   2HD   LYS  79          2HD       LYS  79 -11.521  -1.674  -9.486
  587   1HE   LYS  79          1HE       LYS  79 -10.393  -3.549  -8.607
  588   2HE   LYS  79          2HE       LYS  79 -11.045  -3.301  -7.023
  589   1HZ   LYS  79          1HZ       LYS  79 -13.292  -3.852  -8.003
  590   2HZ   LYS  79          2HZ       LYS  79 -12.436  -4.542  -9.289
  591   3HZ   LYS  79          3HZ       LYS  79 -12.240  -5.093  -7.779
  592    H    GLY  80           H        GLY  80 -11.037  -4.063  -3.890
  593   1HA   GLY  80          1HA       GLY  80 -12.862  -5.619  -3.514
  594   2HA   GLY  80          2HA       GLY  80 -13.653  -5.049  -4.975
  595    H    GLY  81           H        GLY  81 -10.932  -6.780  -3.697
  596   1HA   GLY  81          1HA       GLY  81 -10.191  -8.844  -4.019
  597   2HA   GLY  81          2HA       GLY  81 -11.328  -9.043  -5.354
  598    H    GLU  82           H        GLU  82 -10.067  -6.658  -6.715
  599    HA   GLU  82           HA       GLU  82  -7.633  -7.960  -7.760
  600   1HB   GLU  82          1HB       GLU  82  -8.457  -7.582  -9.909
  601   2HB   GLU  82          2HB       GLU  82  -9.827  -8.239  -9.024
  602   1HG   GLU  82          1HG       GLU  82 -10.468  -5.783  -8.637
  603   2HG   GLU  82          2HG       GLU  82  -9.313  -5.361  -9.898
  604    HA   PRO  83           HA       PRO  83  -5.824  -3.906  -7.336
  605   1HB   PRO  83          1HB       PRO  83  -3.636  -4.067  -8.936
  606   2HB   PRO  83          2HB       PRO  83  -3.803  -5.062  -7.459
  607   1HG   PRO  83          1HG       PRO  83  -4.416  -5.870 -10.322
  608   2HG   PRO  83          2HG       PRO  83  -3.441  -6.759  -9.106
  609   1HD   PRO  83          1HD       PRO  83  -6.087  -7.306  -9.571
  610   2HD   PRO  83          2HD       PRO  83  -5.359  -7.458  -7.943
  611    H    VAL  84           H        VAL  84  -5.559  -1.880  -8.444
  612    HA   VAL  84           HA       VAL  84  -6.317  -1.783 -11.317
  613    HB   VAL  84           HB       VAL  84  -6.583   0.737 -10.598
  614   1HG1  VAL  84          1HG1      VAL  84  -8.357  -0.643 -11.628
  615   2HG1  VAL  84          2HG1      VAL  84  -8.713  -1.382 -10.057
  616   3HG1  VAL  84          3HG1      VAL  84  -9.035   0.348 -10.326
  617   1HG2  VAL  84          1HG2      VAL  84  -5.999   0.437  -8.232
  618   2HG2  VAL  84          2HG2      VAL  84  -7.614   1.134  -8.472
  619   3HG2  VAL  84          3HG2      VAL  84  -7.445  -0.567  -8.006
  620    H    LYS  85           H        LYS  85  -3.938  -0.708  -8.803
  621    HA   LYS  85           HA       LYS  85  -1.887  -0.771 -10.778
  622   1HB   LYS  85          1HB       LYS  85  -1.123   1.589 -10.598
  623   2HB   LYS  85          2HB       LYS  85  -2.592   1.350 -11.514
  624   1HG   LYS  85          1HG       LYS  85  -3.950   2.133  -9.607
  625   2HG   LYS  85          2HG       LYS  85  -2.479   2.377  -8.642
  626   1HD   LYS  85          1HD       LYS  85  -1.669   4.083 -10.102
  627   2HD   LYS  85          2HD       LYS  85  -2.816   3.685 -11.384
  628   1HE   LYS  85          1HE       LYS  85  -3.580   4.820  -8.669
  629   2HE   LYS  85          2HE       LYS  85  -3.384   5.759 -10.162
  630   1HZ   LYS  85          1HZ       LYS  85  -5.214   4.518 -11.123
  631   2HZ   LYS  85          2HZ       LYS  85  -5.420   3.664  -9.709
  632   3HZ   LYS  85          3HZ       LYS  85  -5.648   5.297  -9.811
  633    H    GLN  86           H        GLN  86   0.193   0.117  -9.839
  634    HA   GLN  86           HA       GLN  86   0.521  -0.474  -6.976
  635   1HB   GLN  86          1HB       GLN  86   0.830  -2.608  -8.020
  636   2HB   GLN  86          2HB       GLN  86   1.704  -1.910  -9.384
  637   1HG   GLN  86          1HG       GLN  86   3.633  -1.410  -7.962
  638   2HG   GLN  86          2HG       GLN  86   2.815  -2.076  -6.552
  639   1HE2  GLN  86          1HE2      GLN  86   2.005  -4.504  -6.918
  640   2HE2  GLN  86          2HE2      GLN  86   3.166  -5.489  -7.802
  641    H    LEU  87           H        LEU  87   2.390   0.501  -6.116
  642    HA   LEU  87           HA       LEU  87   4.241   1.963  -7.915
  643   1HB   LEU  87          1HB       LEU  87   3.255   2.753  -5.134
  644   2HB   LEU  87          2HB       LEU  87   4.764   3.324  -5.788
  645    HG   LEU  87           HG       LEU  87   3.149   5.025  -5.998
  646   1HD1  LEU  87          1HD1      LEU  87   3.497   3.924  -8.801
  647   2HD1  LEU  87          2HD1      LEU  87   3.470   5.623  -8.261
  648   3HD1  LEU  87          3HD1      LEU  87   4.843   4.587  -7.854
  649   1HD2  LEU  87          1HD2      LEU  87   1.085   3.620  -6.048
  650   2HD2  LEU  87          2HD2      LEU  87   1.113   4.972  -7.199
  651   3HD2  LEU  87          3HD2      LEU  87   1.384   3.324  -7.775
  652    H    ILE  88           H        ILE  88   6.451   1.726  -7.270
  653    HA   ILE  88           HA       ILE  88   7.144  -0.141  -5.136
  654    HB   ILE  88           HB       ILE  88   8.712  -1.307  -6.778
  655   1HG1  ILE  88          1HG1      ILE  88   6.794  -0.165  -8.873
  656   2HG1  ILE  88          2HG1      ILE  88   8.518   0.187  -8.716
  657   1HG2  ILE  88          1HG2      ILE  88   6.722  -2.316  -5.733
  658   2HG2  ILE  88          2HG2      ILE  88   5.745  -1.836  -7.132
  659   3HG2  ILE  88          3HG2      ILE  88   7.066  -3.007  -7.308
  660   1HD1  ILE  88          1HD1      ILE  88   7.243  -2.454  -9.512
  661   2HD1  ILE  88          2HD1      ILE  88   8.232  -1.377 -10.502
  662   3HD1  ILE  88          3HD1      ILE  88   8.979  -2.260  -9.149
  663    H    GLY  89           H        GLY  89   8.977   0.474  -4.184
  664   1HA   GLY  89          1HA       GLY  89  11.002   1.555  -3.803
  665   2HA   GLY  89          2HA       GLY  89  11.004   2.181  -5.464
  666    H    TYR  90           H        TYR  90  11.730   3.883  -3.464
  667    HA   TYR  90           HA       TYR  90   9.748   5.289  -2.084
  668   1HB   TYR  90          1HB       TYR  90  12.071   5.481  -1.507
  669   2HB   TYR  90          2HB       TYR  90  12.430   6.249  -3.050
  670    HD1  TYR  90           1HD      TYR  90  11.844   8.605  -3.461
  671    HD2  TYR  90           2HD      TYR  90  10.835   6.695   0.268
  672    HE1  TYR  90           1HE      TYR  90  11.259  10.802  -2.507
  673    HE2  TYR  90           2HE      TYR  90  10.201   8.906   1.227
  674    HH   TYR  90           HH       TYR  90  10.628  11.959  -0.548
  675    H    GLN  91           H        GLN  91   7.989   6.216  -2.939
  676    HA   GLN  91           HA       GLN  91   8.335   8.146  -5.160
  677   1HB   GLN  91          1HB       GLN  91   5.692   7.378  -3.888
  678   2HB   GLN  91          2HB       GLN  91   5.992   8.157  -5.419
  679   1HG   GLN  91          1HG       GLN  91   6.431   5.228  -4.741
  680   2HG   GLN  91          2HG       GLN  91   5.190   5.927  -5.767
  681   1HE2  GLN  91          1HE2      GLN  91   8.177   4.357  -5.824
  682   2HE2  GLN  91          2HE2      GLN  91   8.603   4.783  -7.472
  683    HA   PRO  92           HA       PRO  92   7.924  10.950  -1.530
  684   1HB   PRO  92          1HB       PRO  92   7.691  13.342  -2.844
  685   2HB   PRO  92          2HB       PRO  92   9.263  12.512  -2.631
  686   1HG   PRO  92          1HG       PRO  92   7.437  12.457  -5.045
  687   2HG   PRO  92          2HG       PRO  92   9.206  12.736  -5.006
  688   1HD   PRO  92          1HD       PRO  92   8.118  10.285  -5.561
  689   2HD   PRO  92          2HD       PRO  92   9.651  10.443  -4.658
  690    H    LYS  93           H        LYS  93   6.123  12.108  -0.715
  691    HA   LYS  93           HA       LYS  93   3.557  11.242  -1.000
  692   1HB   LYS  93          1HB       LYS  93   4.885  13.289   0.380
  693   2HB   LYS  93          2HB       LYS  93   3.744  14.195  -0.558
  694   1HG   LYS  93          1HG       LYS  93   2.994  11.873   1.268
  695   2HG   LYS  93          2HG       LYS  93   2.949  13.577   1.698
  696   1HD   LYS  93          1HD       LYS  93   1.442  13.500  -0.679
  697   2HD   LYS  93          2HD       LYS  93   1.023  11.980   0.109
  698   1HE   LYS  93          1HE       LYS  93   0.458  13.194   2.194
  699   2HE   LYS  93          2HE       LYS  93   1.015  14.715   1.495
  700   1HZ   LYS  93          1HZ       LYS  93  -0.787  14.609  -0.075
  701   2HZ   LYS  93          2HZ       LYS  93  -1.274  13.136   0.454
  702   3HZ   LYS  93          3HZ       LYS  93  -1.398  14.431   1.451
  703    H    GLU  94           H        GLU  94   4.871  14.070  -2.619
  704    HA   GLU  94           HA       GLU  94   2.664  14.883  -4.105
  705   1HB   GLU  94          1HB       GLU  94   5.630  15.101  -4.750
  706   2HB   GLU  94          2HB       GLU  94   4.364  16.077  -5.508
  707   1HG   GLU  94          1HG       GLU  94   3.819  17.164  -3.417
  708   2HG   GLU  94          2HG       GLU  94   4.844  16.067  -2.489
  709    H    GLN  95           H        GLN  95   4.851  12.173  -4.910
  710    HA   GLN  95           HA       GLN  95   4.029  12.185  -7.742
  711   1HB   GLN  95          1HB       GLN  95   6.378  11.691  -7.077
  712   2HB   GLN  95          2HB       GLN  95   5.861  10.378  -6.076
  713   1HG   GLN  95          1HG       GLN  95   6.806   9.570  -8.193
  714   2HG   GLN  95          2HG       GLN  95   5.150   9.041  -7.966
  715   1HE2  GLN  95          1HE2      GLN  95   3.394  10.345  -9.171
  716   2HE2  GLN  95          2HE2      GLN  95   3.904  11.030 -10.726
  717    H    LEU  96           H        LEU  96   3.982  10.293  -4.874
  718    HA   LEU  96           HA       LEU  96   2.453   8.014  -5.561
  719   1HB   LEU  96          1HB       LEU  96   3.925   8.839  -3.473
  720   2HB   LEU  96          2HB       LEU  96   2.347   9.225  -2.841
  721    HG   LEU  96           HG       LEU  96   3.248   6.488  -3.845
  722   1HD1  LEU  96          1HD1      LEU  96   3.328   5.895  -1.488
  723   2HD1  LEU  96          2HD1      LEU  96   4.388   7.288  -1.755
  724   3HD1  LEU  96          3HD1      LEU  96   2.800   7.519  -1.003
  725   1HD2  LEU  96          1HD2      LEU  96   1.162   5.703  -2.667
  726   2HD2  LEU  96          2HD2      LEU  96   0.739   7.396  -2.411
  727   3HD2  LEU  96          3HD2      LEU  96   0.804   6.742  -4.058
  728    H    GLU  97           H        GLU  97   1.371  10.957  -3.791
  729    HA   GLU  97           HA       GLU  97  -1.398  10.310  -3.905
  730   1HB   GLU  97          1HB       GLU  97  -0.028  11.880  -2.353
  731   2HB   GLU  97          2HB       GLU  97  -0.190  13.058  -3.658
  732   1HG   GLU  97          1HG       GLU  97  -1.869  13.636  -2.197
  733   2HG   GLU  97          2HG       GLU  97  -2.746  12.682  -3.408
  734    H    ALA  98           H        ALA  98   0.768  11.962  -6.242
  735    HA   ALA  98           HA       ALA  98  -1.477  13.009  -7.804
  736   1HB   ALA  98          1HB       ALA  98   0.218  13.397  -9.570
  737   2HB   ALA  98          2HB       ALA  98   0.672  14.114  -8.019
  738   3HB   ALA  98          3HB       ALA  98   1.447  12.605  -8.562
  739    H    GLN  99           H        GLN  99   0.744  10.193  -8.104
  740    HA   GLN  99           HA       GLN  99  -0.408   9.070 -10.446
  741   1HB   GLN  99          1HB       GLN  99   1.743   8.383  -9.464
  742   2HB   GLN  99          2HB       GLN  99   0.944   7.761  -8.036
  743   1HG   GLN  99          1HG       GLN  99   1.634   5.957  -9.551
  744   2HG   GLN  99          2HG       GLN  99  -0.099   5.968  -9.274
  745   1HE2  GLN  99          1HE2      GLN  99   2.123   7.706 -11.615
  746   2HE2  GLN  99          2HE2      GLN  99   1.181   7.202 -13.012
  747    H    LEU 100           H        LEU 100  -1.203   8.594  -7.032
  748    HA   LEU 100           HA       LEU 100  -3.406   6.779  -7.647
  749   1HB   LEU 100          1HB       LEU 100  -1.635   7.297  -5.463
  750   2HB   LEU 100          2HB       LEU 100  -3.236   7.626  -4.889
  751    HG   LEU 100           HG       LEU 100  -3.884   5.316  -5.840
  752   1HD1  LEU 100          1HD1      LEU 100  -0.836   5.078  -5.929
  753   2HD1  LEU 100          2HD1      LEU 100  -1.979   3.753  -6.218
  754   3HD1  LEU 100          3HD1      LEU 100  -1.869   5.101  -7.365
  755   1HD2  LEU 100          1HD2      LEU 100  -1.738   5.454  -3.672
  756   2HD2  LEU 100          2HD2      LEU 100  -3.492   5.691  -3.441
  757   3HD2  LEU 100          3HD2      LEU 100  -2.872   4.108  -3.934
  758    H    ALA 101           H        ALA 101  -3.319  10.086  -7.899
  759    HA   ALA 101           HA       ALA 101  -5.315  11.129  -6.325
  760   1HB   ALA 101          1HB       ALA 101  -4.600  11.911  -9.182
  761   2HB   ALA 101          2HB       ALA 101  -5.477  12.920  -8.013
  762   3HB   ALA 101          3HB       ALA 101  -3.794  12.484  -7.704
  763    H    ASP 102           H        ASP 102  -5.788   9.130  -9.200
  764    HA   ASP 102           HA       ASP 102  -8.440  10.015  -9.870
  765   1HB   ASP 102          1HB       ASP 102  -8.502   8.096 -11.314
  766   2HB   ASP 102          2HB       ASP 102  -6.890   8.800 -11.426
  767    H    VAL 103           H        VAL 103  -7.240   7.890  -7.369
  768    HA   VAL 103           HA       VAL 103 -10.066   7.075  -6.815
  769    HB   VAL 103           HB       VAL 103  -7.919   5.402  -7.098
  770   1HG1  VAL 103          1HG1      VAL 103  -8.218   5.778  -4.080
  771   2HG1  VAL 103          2HG1      VAL 103  -7.306   4.512  -4.881
  772   3HG1  VAL 103          3HG1      VAL 103  -6.787   6.190  -5.053
  773   1HG2  VAL 103          1HG2      VAL 103  -9.352   3.695  -6.104
  774   2HG2  VAL 103          2HG2      VAL 103 -10.393   4.968  -5.407
  775   3HG2  VAL 103          3HG2      VAL 103 -10.252   4.782  -7.167
  776    H    LEU 104           H        LEU 104  -7.566   9.157  -5.724
  777    HA   LEU 104           HA       LEU 104  -8.782   9.609  -3.090
  778   1HB   LEU 104          1HB       LEU 104  -6.409  10.613  -4.674
  779   2HB   LEU 104          2HB       LEU 104  -6.988  11.552  -3.371
  780    HG   LEU 104           HG       LEU 104  -5.456  10.447  -2.218
  781   1HD1  LEU 104          1HD1      LEU 104  -7.457   9.510  -1.145
  782   2HD1  LEU 104          2HD1      LEU 104  -7.387   8.111  -2.258
  783   3HD1  LEU 104          3HD1      LEU 104  -6.091   8.372  -1.084
  784   1HD2  LEU 104          1HD2      LEU 104  -4.419   8.313  -2.755
  785   2HD2  LEU 104          2HD2      LEU 104  -5.643   8.008  -4.013
  786   3HD2  LEU 104          3HD2      LEU 104  -4.485   9.360  -4.170
  787    H    GLN 105           H        GLN 105  -9.199  10.630  -6.296
  788    HA   GLN 105           HA       GLN 105 -10.519  12.954  -6.474
  789   1HB   GLN 105          2HB       GLN 105 -10.284  11.401  -8.238
  790   2HB   GLN 105          3HB       GLN 105 -11.202  10.175  -7.363
  791   1HG   GLN 105          2HG       GLN 105 -13.272  11.399  -7.678
  792   2HG   GLN 105          3HG       GLN 105 -12.395  12.776  -8.358
  793   1HE2  GLN 105          1HE2      GLN 105 -11.328   9.441  -9.361
  794   2HE2  GLN 105          2HE2      GLN 105 -12.091   9.610 -10.934
  Start of MODEL   15
    1   1H    ALA   1           H        ALA   1  -9.972   5.248   7.892
    2   2H    ALA   1          2HN       ALA   1  -8.783   6.157   8.581
    3   3H    ALA   1          3HN       ALA   1  -9.140   6.363   6.983
    4    HA   ALA   1           HA       ALA   1  -8.472   4.014   6.645
    5   1HB   ALA   1          1HB       ALA   1  -6.044   4.595   6.651
    6   2HB   ALA   1          2HB       ALA   1  -7.024   5.896   5.953
    7   3HB   ALA   1          3HB       ALA   1  -6.396   6.038   7.609
    8    H    THR   2           H        THR   2  -7.604   2.135   7.575
    9    HA   THR   2           HA       THR   2  -6.821   2.196  10.433
   10    HB   THR   2           HB       THR   2  -8.127   0.270   9.738
   11    HG1  THR   2           1HG      THR   2  -6.734  -1.256  10.601
   12   1HG2  THR   2          1HG2      THR   2  -7.257   0.018   7.345
   13   2HG2  THR   2          2HG2      THR   2  -5.822  -0.751   8.058
   14   3HG2  THR   2          3HG2      THR   2  -7.420  -1.465   8.294
   15    H    MET   3           H        MET   3  -4.566   0.493  10.154
   16    HA   MET   3           HA       MET   3  -2.776   1.661   8.234
   17   1HB   MET   3          1HB       MET   3  -1.185   2.763   9.633
   18   2HB   MET   3          2HB       MET   3  -2.765   3.408  10.033
   19   1HG   MET   3          1HG       MET   3  -2.024   3.124  12.142
   20   2HG   MET   3          2HG       MET   3  -2.668   1.499  11.927
   21   1HE   MET   3          1HE       MET   3  -0.656   2.262  14.224
   22   2HE   MET   3          2HE       MET   3  -1.258   0.609  13.947
   23   3HE   MET   3          3HE       MET   3   0.485   0.898  14.159
   24    H    THR   4           H        THR   4  -3.751  -1.022   9.627
   25    HA   THR   4           HA       THR   4  -1.119  -2.366   9.418
   26    HB   THR   4           HB       THR   4  -3.089  -3.059  11.589
   27    HG1  THR   4           1HG      THR   4  -1.757  -1.900  13.005
   28   1HG2  THR   4          1HG2      THR   4  -1.412  -4.802  11.131
   29   2HG2  THR   4          2HG2      THR   4  -0.103  -3.601  11.244
   30   3HG2  THR   4          3HG2      THR   4  -1.055  -4.041  12.678
   31    H    LEU   5           H        LEU   5  -1.386  -4.724   8.955
   32    HA   LEU   5           HA       LEU   5  -4.048  -5.715   8.335
   33   1HB   LEU   5          1HB       LEU   5  -2.015  -5.064   6.248
   34   2HB   LEU   5          2HB       LEU   5  -2.532  -6.730   6.206
   35    HG   LEU   5           HG       LEU   5  -4.453  -4.371   6.069
   36   1HD1  LEU   5          1HD1      LEU   5  -3.018  -4.611   4.050
   37   2HD1  LEU   5          2HD1      LEU   5  -3.475  -6.315   3.925
   38   3HD1  LEU   5          3HD1      LEU   5  -4.699  -5.042   3.703
   39   1HD2  LEU   5          1HD2      LEU   5  -6.063  -6.152   5.338
   40   2HD2  LEU   5          2HD2      LEU   5  -4.883  -7.334   5.977
   41   3HD2  LEU   5          3HD2      LEU   5  -5.645  -6.130   7.041
   42    H    THR   6           H        THR   6  -3.817  -8.136   7.717
   43    HA   THR   6           HA       THR   6  -1.524  -9.452   8.779
   44    HB   THR   6           HB       THR   6  -3.000 -11.233   9.679
   45    HG1  THR   6           1HG      THR   6  -5.186 -10.752  10.028
   46   1HG2  THR   6          1HG2      THR   6  -3.610  -8.573  11.036
   47   2HG2  THR   6          2HG2      THR   6  -3.659 -10.188  11.772
   48   3HG2  THR   6          3HG2      THR   6  -2.112  -9.506  11.238
   49    H    ASP   7           H        ASP   7  -1.868 -11.649   7.884
   50    HA   ASP   7           HA       ASP   7  -1.923 -11.725   5.019
   51   1HB   ASP   7          1HB       ASP   7  -1.554 -14.128   5.330
   52   2HB   ASP   7          2HB       ASP   7  -0.520 -13.234   6.445
   53    H    ALA   8           H        ALA   8  -4.091 -13.186   7.456
   54    HA   ALA   8           HA       ALA   8  -6.053 -14.070   5.634
   55   1HB   ALA   8          1HB       ALA   8  -7.565 -14.149   7.603
   56   2HB   ALA   8          2HB       ALA   8  -5.953 -14.787   7.997
   57   3HB   ALA   8          3HB       ALA   8  -6.418 -13.155   8.526
   58    H    ASN   9           H        ASN   9  -5.764 -10.954   7.302
   59    HA   ASN   9           HA       ASN   9  -8.380 -10.116   6.349
   60   1HB   ASN   9          1HB       ASN   9  -7.519  -9.446   8.581
   61   2HB   ASN   9          2HB       ASN   9  -6.336  -8.430   7.757
   62   1HD2  ASN   9          1HD2      ASN   9  -9.941  -9.049   7.337
   63   2HD2  ASN   9          2HD2      ASN   9 -10.300  -7.332   7.335
   64    H    PHE  10           H        PHE  10  -5.096  -9.910   5.155
   65    HA   PHE  10           HA       PHE  10  -5.395  -7.693   3.416
   66   1HB   PHE  10          1HB       PHE  10  -3.223  -8.773   3.803
   67   2HB   PHE  10          2HB       PHE  10  -3.799 -10.256   3.078
   68    HD1  PHE  10           1HD      PHE  10  -4.533  -6.970   1.403
   69    HD2  PHE  10           2HD      PHE  10  -1.897 -10.389   1.605
   70    HE1  PHE  10           1HE      PHE  10  -3.629  -6.424  -0.810
   71    HE2  PHE  10           2HE      PHE  10  -0.924  -9.759  -0.561
   72    HZ   PHE  10           HZ       PHE  10  -1.824  -7.796  -1.811
   73    H    GLN  11           H        GLN  11  -5.789 -11.169   2.582
   74    HA   GLN  11           HA       GLN  11  -7.159 -10.674   0.131
   75   1HB   GLN  11          1HB       GLN  11  -5.965 -12.742   0.686
   76   2HB   GLN  11          2HB       GLN  11  -7.123 -13.131   1.953
   77   1HG   GLN  11          1HG       GLN  11  -8.299 -12.665  -0.768
   78   2HG   GLN  11          2HG       GLN  11  -7.200 -14.033  -0.642
   79   1HE2  GLN  11          1HE2      GLN  11  -8.235 -15.954  -0.218
   80   2HE2  GLN  11          2HE2      GLN  11  -9.706 -16.071   0.742
   81    H    GLN  12           H        GLN  12  -8.449 -11.423   3.457
   82    HA   GLN  12           HA       GLN  12 -11.118 -11.527   2.559
   83   1HB   GLN  12          1HB       GLN  12  -9.984 -10.975   5.308
   84   2HB   GLN  12          2HB       GLN  12 -11.700 -11.214   5.011
   85   1HG   GLN  12          1HG       GLN  12 -11.376 -13.455   4.219
   86   2HG   GLN  12          2HG       GLN  12  -9.625 -13.305   4.237
   87   1HE2  GLN  12          1HE2      GLN  12 -11.277 -15.303   5.680
   88   2HE2  GLN  12          2HE2      GLN  12 -10.903 -15.040   7.380
   89    H    ALA  13           H        ALA  13  -9.188  -8.620   3.296
   90    HA   ALA  13           HA       ALA  13 -11.515  -6.906   3.110
   91   1HB   ALA  13          1HB       ALA  13  -9.569  -6.195   4.431
   92   2HB   ALA  13          2HB       ALA  13  -8.537  -6.272   2.986
   93   3HB   ALA  13          3HB       ALA  13  -9.862  -5.089   3.077
   94    H    ILE  14           H        ILE  14  -8.615  -7.637   0.994
   95    HA   ILE  14           HA       ILE  14  -9.572  -5.895  -1.001
   96    HB   ILE  14           HB       ILE  14  -7.928  -6.788  -2.503
   97   1HG1  ILE  14          1HG1      ILE  14  -6.565  -8.666  -0.724
   98   2HG1  ILE  14          2HG1      ILE  14  -8.144  -9.248  -1.268
   99   1HG2  ILE  14          1HG2      ILE  14  -5.941  -6.171  -1.264
  100   2HG2  ILE  14          2HG2      ILE  14  -7.295  -5.117  -0.825
  101   3HG2  ILE  14          3HG2      ILE  14  -6.785  -6.399   0.280
  102   1HD1  ILE  14          1HD1      ILE  14  -5.914  -8.258  -3.084
  103   2HD1  ILE  14          2HD1      ILE  14  -6.356  -9.953  -2.787
  104   3HD1  ILE  14          3HD1      ILE  14  -7.499  -8.877  -3.611
  105    H    GLN  15           H        GLN  15 -10.576  -9.148  -0.453
  106    HA   GLN  15           HA       GLN  15 -11.654  -9.797  -2.982
  107   1HB   GLN  15          1HB       GLN  15 -13.090 -11.335  -1.855
  108   2HB   GLN  15          2HB       GLN  15 -11.553 -11.324  -0.987
  109   1HG   GLN  15          1HG       GLN  15 -12.552  -9.772   0.689
  110   2HG   GLN  15          2HG       GLN  15 -14.102  -9.849  -0.149
  111   1HE2  GLN  15          1HE2      GLN  15 -13.370 -10.626   2.627
  112   2HE2  GLN  15          2HE2      GLN  15 -13.992 -12.290   2.743
  113    H    GLY  16           H        GLY  16 -12.789  -7.310  -0.707
  114   1HA   GLY  16          1HA       GLY  16 -14.451  -6.001  -2.503
  115   2HA   GLY  16          2HA       GLY  16 -15.501  -7.135  -1.681
  116    H    ASP  17           H        ASP  17 -14.322  -4.191  -1.606
  117    HA   ASP  17           HA       ASP  17 -15.122  -3.515   1.115
  118   1HB   ASP  17          1HB       ASP  17 -12.857  -4.391   1.530
  119   2HB   ASP  17          2HB       ASP  17 -12.173  -3.295   0.343
  120    H    GLY  18           H        GLY  18 -12.688  -1.997  -1.014
  121   1HA   GLY  18          1HA       GLY  18 -13.941   0.086  -2.335
  122   2HA   GLY  18          2HA       GLY  18 -13.828   0.500  -0.598
  123    HA   PRO  19           HA       PRO  19  -9.661   1.319  -2.643
  124   1HB   PRO  19          1HB       PRO  19  -9.193   3.826  -1.599
  125   2HB   PRO  19          2HB       PRO  19 -10.104   3.546  -3.081
  126   1HG   PRO  19          1HG       PRO  19 -11.244   3.917  -0.303
  127   2HG   PRO  19          2HG       PRO  19 -11.765   4.702  -1.827
  128   1HD   PRO  19          1HD       PRO  19 -13.053   2.564  -0.779
  129   2HD   PRO  19          2HD       PRO  19 -12.834   2.713  -2.550
  130    H    VAL  20           H        VAL  20  -9.107  -0.444  -1.308
  131    HA   VAL  20           HA       VAL  20  -7.844   0.141   1.322
  132    HB   VAL  20           HB       VAL  20  -8.310  -2.388  -0.324
  133   1HG1  VAL  20          1HG1      VAL  20  -6.862  -2.097   2.366
  134   2HG1  VAL  20          2HG1      VAL  20  -7.403  -3.639   1.663
  135   3HG1  VAL  20          3HG1      VAL  20  -6.160  -2.694   0.844
  136   1HG2  VAL  20          1HG2      VAL  20  -9.765  -3.018   1.532
  137   2HG2  VAL  20          2HG2      VAL  20  -9.321  -1.556   2.432
  138   3HG2  VAL  20          3HG2      VAL  20 -10.251  -1.424   0.928
  139    H    LEU  21           H        LEU  21  -5.774   0.740   1.342
  140    HA   LEU  21           HA       LEU  21  -4.045  -0.256  -0.867
  141   1HB   LEU  21          1HB       LEU  21  -2.617   1.652  -0.809
  142   2HB   LEU  21          2HB       LEU  21  -4.237   2.080  -1.276
  143    HG   LEU  21           HG       LEU  21  -3.933   2.383   1.607
  144   1HD1  LEU  21          1HD1      LEU  21  -1.579   2.722   1.152
  145   2HD1  LEU  21          2HD1      LEU  21  -1.971   3.887  -0.124
  146   3HD1  LEU  21          3HD1      LEU  21  -2.319   4.276   1.571
  147   1HD2  LEU  21          1HD2      LEU  21  -5.687   3.440   0.187
  148   2HD2  LEU  21          2HD2      LEU  21  -4.829   4.577   1.225
  149   3HD2  LEU  21          3HD2      LEU  21  -4.434   4.509  -0.498
  150    H    VAL  22           H        VAL  22  -2.041  -0.896  -0.469
  151    HA   VAL  22           HA       VAL  22  -1.620  -1.853   2.321
  152    HB   VAL  22           HB       VAL  22  -1.484  -3.345  -0.335
  153   1HG1  VAL  22          1HG1      VAL  22  -1.181  -4.381   2.509
  154   2HG1  VAL  22          2HG1      VAL  22  -1.211  -5.373   1.036
  155   3HG1  VAL  22          3HG1      VAL  22   0.123  -4.249   1.301
  156   1HG2  VAL  22          1HG2      VAL  22  -3.450  -4.618   0.643
  157   2HG2  VAL  22          2HG2      VAL  22  -3.549  -3.381   1.908
  158   3HG2  VAL  22          3HG2      VAL  22  -3.809  -2.952   0.205
  159    H    ASP  23           H        ASP  23   0.241  -0.969   3.037
  160    HA   ASP  23           HA       ASP  23   2.507  -0.368   1.226
  161   1HB   ASP  23          1HB       ASP  23   1.920   1.156   3.116
  162   2HB   ASP  23          2HB       ASP  23   2.202  -0.094   4.226
  163    H    PHE  24           H        PHE  24   3.441  -2.224   0.560
  164    HA   PHE  24           HA       PHE  24   4.152  -4.385   2.447
  165   1HB   PHE  24          1HB       PHE  24   4.854  -3.840  -0.442
  166   2HB   PHE  24          2HB       PHE  24   5.359  -5.250   0.455
  167    HD1  PHE  24           1HD      PHE  24   3.429  -6.597   1.664
  168    HD2  PHE  24           2HD      PHE  24   2.829  -4.021  -1.745
  169    HE1  PHE  24           1HE      PHE  24   1.616  -8.069   0.863
  170    HE2  PHE  24           2HE      PHE  24   1.010  -5.479  -2.536
  171    HZ   PHE  24           HZ       PHE  24   0.519  -7.623  -1.259
  172    H    TRP  25           H        TRP  25   5.676  -3.868   3.848
  173    HA   TRP  25           HA       TRP  25   8.112  -2.456   2.907
  174   1HB   TRP  25          1HB       TRP  25   8.223  -1.244   4.994
  175   2HB   TRP  25          2HB       TRP  25   6.641  -0.967   4.326
  176    HD1  TRP  25           HD       TRP  25   4.598  -2.080   5.614
  177    HE1  TRP  25           1HE      TRP  25   4.288  -2.961   8.008
  178    HE3  TRP  25           3HE      TRP  25   9.498  -2.182   7.054
  179    HZ2  TRP  25           2HZ      TRP  25   6.012  -3.766  10.234
  180    HZ3  TRP  25           3HZ      TRP  25  10.132  -2.983   9.310
  181    HH2  TRP  25           HH       TRP  25   8.404  -3.805  10.887
  182    H    ALA  26           H        ALA  26   9.960  -3.165   4.761
  183    HA   ALA  26           HA       ALA  26   9.249  -5.493   6.243
  184   1HB   ALA  26          1HB       ALA  26   9.751  -6.617   4.062
  185   2HB   ALA  26          2HB       ALA  26  11.357  -5.850   4.074
  186   3HB   ALA  26          3HB       ALA  26  10.917  -7.046   5.316
  187    H    ALA  27           H        ALA  27  10.877  -6.078   7.748
  188    HA   ALA  27           HA       ALA  27  12.185  -3.813   8.812
  189   1HB   ALA  27          1HB       ALA  27  12.487  -6.749   9.559
  190   2HB   ALA  27          2HB       ALA  27  12.914  -5.353  10.575
  191   3HB   ALA  27          3HB       ALA  27  11.220  -5.644  10.144
  192    H    TRP  28           H        TRP  28  13.475  -5.916   6.385
  193    HA   TRP  28           HA       TRP  28  16.258  -5.295   7.176
  194   1HB   TRP  28          1HB       TRP  28  16.927  -7.051   6.033
  195   2HB   TRP  28          2HB       TRP  28  15.266  -7.575   6.148
  196    HD1  TRP  28           HD       TRP  28  17.897  -6.273   3.774
  197    HE1  TRP  28           1HE      TRP  28  17.148  -6.373   1.338
  198    HE3  TRP  28           3HE      TRP  28  13.082  -7.880   4.475
  199    HZ2  TRP  28           2HZ      TRP  28  14.669  -6.730  -0.105
  200    HZ3  TRP  28           3HZ      TRP  28  11.528  -8.031   2.533
  201    HH2  TRP  28           HH       TRP  28  12.302  -7.354   0.275
  202    H    CYS  29           H        CYS  29  13.819  -3.747   5.364
  203    HA   CYS  29           HA       CYS  29  15.127  -3.324   2.903
  204   1HB   CYS  29          1HB       CYS  29  13.268  -2.004   2.357
  205   2HB   CYS  29          2HB       CYS  29  12.640  -3.139   3.551
  206    H    GLY  30           H        GLY  30  15.479  -1.021   1.999
  207   1HA   GLY  30          1HA       GLY  30  16.776   0.855   3.934
  208   2HA   GLY  30          2HA       GLY  30  16.997   0.879   2.187
  209    HA   PRO  31           HA       PRO  31  14.153   4.059   1.922
  210   1HB   PRO  31          1HB       PRO  31  12.733   3.658  -0.436
  211   2HB   PRO  31          2HB       PRO  31  14.447   4.178  -0.334
  212   1HG   PRO  31          1HG       PRO  31  13.349   1.387  -0.761
  213   2HG   PRO  31          2HG       PRO  31  14.675   2.203  -1.648
  214   1HD   PRO  31          1HD       PRO  31  15.188   0.451   0.350
  215   2HD   PRO  31          2HD       PRO  31  16.167   1.942   0.181
  216    H    CYS  32           H        CYS  32  12.535   0.916   1.957
  217    HA   CYS  32           HA       CYS  32   9.885   1.939   2.165
  218   1HB   CYS  32          1HB       CYS  32   9.166  -0.105   2.816
  219   2HB   CYS  32          2HB       CYS  32  10.630  -0.541   1.950
  220    H    ARG  33           H        ARG  33  12.491   1.805   4.560
  221    HA   ARG  33           HA       ARG  33  10.789   2.560   6.766
  222   1HB   ARG  33          1HB       ARG  33  12.970   1.256   6.813
  223   2HB   ARG  33          2HB       ARG  33  13.808   2.783   6.573
  224   1HG   ARG  33          1HG       ARG  33  11.801   2.703   8.811
  225   2HG   ARG  33          2HG       ARG  33  13.188   1.630   8.992
  226   1HD   ARG  33          1HD       ARG  33  14.751   3.473   8.774
  227   2HD   ARG  33          2HD       ARG  33  13.429   4.619   8.475
  228    HE   ARG  33           HE       ARG  33  12.805   3.366  10.865
  229   1HH1  ARG  33          2HH2      ARG  33  15.422   5.411   9.696
  230   2HH1  ARG  33          1HH2      ARG  33  15.797   6.116  11.232
  231   1HH2  ARG  33          2HH1      ARG  33  13.258   4.284  12.936
  232   2HH2  ARG  33          1HH1      ARG  33  14.515   5.451  13.120
  233    H    MET  34           H        MET  34  11.981   4.393   4.101
  234    HA   MET  34           HA       MET  34  11.710   6.900   5.616
  235   1HB   MET  34          1HB       MET  34  13.249   7.872   4.253
  236   2HB   MET  34          2HB       MET  34  13.809   6.211   4.100
  237   1HG   MET  34          1HG       MET  34  12.306   6.117   1.983
  238   2HG   MET  34          2HG       MET  34  12.209   7.859   2.117
  239   1HE   MET  34          1HE       MET  34  15.066   8.861   2.945
  240   2HE   MET  34          2HE       MET  34  15.784   9.060   1.329
  241   3HE   MET  34          3HE       MET  34  14.080   9.489   1.603
  242    H    MET  35           H        MET  35  10.205   4.901   3.277
  243    HA   MET  35           HA       MET  35   8.399   6.923   2.220
  244   1HB   MET  35          1HB       MET  35   9.271   5.009   0.877
  245   2HB   MET  35          2HB       MET  35   8.404   3.881   1.925
  246   1HG   MET  35          1HG       MET  35   6.279   4.847   1.224
  247   2HG   MET  35          2HG       MET  35   7.108   6.135   0.331
  248   1HE   MET  35          1HE       MET  35   4.847   4.371  -1.078
  249   2HE   MET  35          2HE       MET  35   5.804   5.677  -1.834
  250   3HE   MET  35          3HE       MET  35   5.658   4.094  -2.637
  251    H    ALA  36           H        ALA  36   8.299   4.087   4.502
  252    HA   ALA  36           HA       ALA  36   5.582   4.158   5.102
  253   1HB   ALA  36          1HB       ALA  36   6.188   3.127   7.263
  254   2HB   ALA  36          2HB       ALA  36   7.032   2.396   5.887
  255   3HB   ALA  36          3HB       ALA  36   7.900   3.513   6.965
  256    HA   PRO  37           HA       PRO  37   6.005   7.639   8.328
  257   1HB   PRO  37          1HB       PRO  37   8.108   9.422   8.174
  258   2HB   PRO  37          2HB       PRO  37   8.066   7.988   9.245
  259   1HG   PRO  37          1HG       PRO  37   9.353   8.249   6.525
  260   2HG   PRO  37          2HG       PRO  37  10.052   7.539   8.014
  261   1HD   PRO  37          1HD       PRO  37   8.980   5.970   6.105
  262   2HD   PRO  37          2HD       PRO  37   8.719   5.594   7.826
  263    H    VAL  38           H        VAL  38   7.219   8.105   4.936
  264    HA   VAL  38           HA       VAL  38   5.845  10.650   4.671
  265    HB   VAL  38           HB       VAL  38   7.604   9.086   3.092
  266   1HG1  VAL  38          1HG1      VAL  38   6.643   9.198   0.826
  267   2HG1  VAL  38          2HG1      VAL  38   5.744   8.079   1.831
  268   3HG1  VAL  38          3HG1      VAL  38   5.085   9.683   1.488
  269   1HG2  VAL  38          1HG2      VAL  38   6.310  11.774   2.543
  270   2HG2  VAL  38          2HG2      VAL  38   7.736  11.479   3.556
  271   3HG2  VAL  38          3HG2      VAL  38   7.812  11.171   1.823
  272    H    LEU  39           H        LEU  39   4.929   7.222   4.198
  273    HA   LEU  39           HA       LEU  39   2.399   7.717   3.087
  274   1HB   LEU  39          1HB       LEU  39   3.620   5.350   4.542
  275   2HB   LEU  39          2HB       LEU  39   2.049   5.315   3.809
  276    HG   LEU  39           HG       LEU  39   4.662   5.761   2.335
  277   1HD1  LEU  39          1HD1      LEU  39   4.199   3.531   1.373
  278   2HD1  LEU  39          2HD1      LEU  39   4.352   3.467   3.127
  279   3HD1  LEU  39          3HD1      LEU  39   2.743   3.407   2.388
  280   1HD2  LEU  39          1HD2      LEU  39   3.382   5.516   0.258
  281   2HD2  LEU  39          2HD2      LEU  39   1.871   5.639   1.191
  282   3HD2  LEU  39          3HD2      LEU  39   3.021   7.004   1.118
  283    H    GLU  40           H        GLU  40   3.528   7.912   6.397
  284    HA   GLU  40           HA       GLU  40   0.963   7.610   7.657
  285   1HB   GLU  40          1HB       GLU  40   3.301   7.416   8.663
  286   2HB   GLU  40          2HB       GLU  40   3.358   9.180   8.694
  287   1HG   GLU  40          1HG       GLU  40   1.514   9.290  10.242
  288   2HG   GLU  40          2HG       GLU  40   1.106   7.590   9.983
  289    H    GLU  41           H        GLU  41   2.843  10.470   6.524
  290    HA   GLU  41           HA       GLU  41   0.806  12.437   7.080
  291   1HB   GLU  41          1HB       GLU  41   3.052  12.296   5.056
  292   2HB   GLU  41          2HB       GLU  41   1.974  13.693   5.191
  293   1HG   GLU  41          1HG       GLU  41   2.735  14.022   7.525
  294   2HG   GLU  41          2HG       GLU  41   3.839  12.647   7.353
  295    H    PHE  42           H        PHE  42   1.516  10.418   4.178
  296    HA   PHE  42           HA       PHE  42  -0.581  11.399   2.519
  297   1HB   PHE  42          1HB       PHE  42   1.223   9.925   1.720
  298   2HB   PHE  42          2HB       PHE  42   0.611   8.633   2.733
  299    HD1  PHE  42           1HD      PHE  42  -0.846  10.892   0.039
  300    HD2  PHE  42           2HD      PHE  42  -0.370   6.888   1.608
  301    HE1  PHE  42           1HE      PHE  42  -2.106   9.970  -1.876
  302    HE2  PHE  42           2HE      PHE  42  -1.620   5.999  -0.331
  303    HZ   PHE  42           HZ       PHE  42  -2.514   7.528  -2.066
  304    H    ALA  43           H        ALA  43  -0.636   8.709   4.948
  305    HA   ALA  43           HA       ALA  43  -3.259   7.874   4.603
  306   1HB   ALA  43          1HB       ALA  43  -3.166   7.000   6.861
  307   2HB   ALA  43          2HB       ALA  43  -1.611   6.728   6.051
  308   3HB   ALA  43          3HB       ALA  43  -1.777   8.027   7.249
  309    H    GLU  44           H        GLU  44  -2.101  10.414   6.829
  310    HA   GLU  44           HA       GLU  44  -4.635  11.236   7.768
  311   1HB   GLU  44          1HB       GLU  44  -2.468  11.774   8.827
  312   2HB   GLU  44          2HB       GLU  44  -2.071  12.860   7.485
  313   1HG   GLU  44          1HG       GLU  44  -4.018  14.279   8.035
  314   2HG   GLU  44          2HG       GLU  44  -4.507  13.151   9.304
  315    H    ALA  45           H        ALA  45  -2.675  12.486   5.024
  316    HA   ALA  45           HA       ALA  45  -4.120  14.697   4.320
  317   1HB   ALA  45          1HB       ALA  45  -1.952  13.977   3.318
  318   2HB   ALA  45          2HB       ALA  45  -2.819  12.748   2.368
  319   3HB   ALA  45          3HB       ALA  45  -3.135  14.462   2.084
  320    H    HIS  46           H        HIS  46  -5.109  11.447   3.714
  321    HA   HIS  46           HA       HIS  46  -7.640  12.401   2.433
  322   1HB   HIS  46          1HB       HIS  46  -7.547  10.433   0.922
  323   2HB   HIS  46          2HB       HIS  46  -6.272  11.608   0.646
  324    HD1  HIS  46           1HD      HIS  46  -6.004   8.812   3.354
  325    HD2  HIS  46           2HD      HIS  46  -4.368  10.186  -0.283
  326    HE1  HIS  46           1HE      HIS  46  -3.987   7.305   2.814
  327    HE2  HIS  46           2HE      HIS  46  -2.957   8.238   0.643
  328    H    ALA  47           H        ALA  47  -6.986  11.716   5.156
  329    HA   ALA  47           HA       ALA  47  -7.182   9.751   6.594
  330   1HB   ALA  47          1HB       ALA  47  -9.395  11.833   6.746
  331   2HB   ALA  47          2HB       ALA  47  -8.891  10.768   8.075
  332   3HB   ALA  47          3HB       ALA  47  -7.760  11.965   7.424
  333    H    ASP  48           H        ASP  48 -10.463  10.500   5.190
  334    HA   ASP  48           HA       ASP  48 -11.339   7.776   5.887
  335   1HB   ASP  48          1HB       ASP  48 -13.496   8.837   6.140
  336   2HB   ASP  48          2HB       ASP  48 -12.302   9.767   7.046
  337    H    LYS  49           H        LYS  49 -10.651   9.732   3.105
  338    HA   LYS  49           HA       LYS  49 -12.729   8.635   1.392
  339   1HB   LYS  49          1HB       LYS  49 -11.526  10.720   0.814
  340   2HB   LYS  49          2HB       LYS  49 -10.019   9.808   0.608
  341   1HG   LYS  49          1HG       LYS  49 -10.953   8.555  -1.261
  342   2HG   LYS  49          2HG       LYS  49 -12.558   9.234  -0.995
  343   1HD   LYS  49          1HD       LYS  49 -10.118  10.866  -1.807
  344   2HD   LYS  49          2HD       LYS  49 -11.278  10.161  -2.947
  345   1HE   LYS  49          1HE       LYS  49 -13.114  11.455  -1.795
  346   2HE   LYS  49          2HE       LYS  49 -11.867  12.247  -0.812
  347   1HZ   LYS  49          1HZ       LYS  49 -12.277  12.464  -3.751
  348   2HZ   LYS  49          2HZ       LYS  49 -12.237  13.669  -2.639
  349   3HZ   LYS  49          3HZ       LYS  49 -10.866  12.841  -3.098
  350    H    VAL  50           H        VAL  50  -9.554   7.506   2.485
  351    HA   VAL  50           HA       VAL  50 -10.123   4.926   1.127
  352    HB   VAL  50           HB       VAL  50  -7.846   4.679   0.339
  353   1HG1  VAL  50          1HG1      VAL  50  -8.805   7.408  -0.593
  354   2HG1  VAL  50          2HG1      VAL  50  -7.827   6.222  -1.497
  355   3HG1  VAL  50          3HG1      VAL  50  -9.537   5.916  -1.133
  356   1HG2  VAL  50          1HG2      VAL  50  -6.222   6.532   0.395
  357   2HG2  VAL  50          2HG2      VAL  50  -7.366   7.502   1.348
  358   3HG2  VAL  50          3HG2      VAL  50  -6.652   6.027   2.039
  359    H    THR  51           H        THR  51  -8.540   3.115   2.025
  360    HA   THR  51           HA       THR  51  -7.876   3.787   4.770
  361    HB   THR  51           HB       THR  51 -10.024   2.542   4.646
  362    HG1  THR  51           1HG      THR  51  -9.310   1.052   6.266
  363   1HG2  THR  51          1HG2      THR  51  -9.986   0.143   4.304
  364   2HG2  THR  51          2HG2      THR  51  -9.437   0.965   2.835
  365   3HG2  THR  51          3HG2      THR  51  -8.249   0.184   3.912
  366    H    VAL  52           H        VAL  52  -6.005   2.946   5.594
  367    HA   VAL  52           HA       VAL  52  -4.096   1.969   3.566
  368    HB   VAL  52           HB       VAL  52  -3.490   3.544   6.028
  369   1HG1  VAL  52          1HG1      VAL  52  -1.809   2.856   3.597
  370   2HG1  VAL  52          2HG1      VAL  52  -1.326   4.044   4.826
  371   3HG1  VAL  52          3HG1      VAL  52  -1.537   2.361   5.279
  372   1HG2  VAL  52          1HG2      VAL  52  -3.080   5.519   4.519
  373   2HG2  VAL  52          2HG2      VAL  52  -3.859   4.613   3.212
  374   3HG2  VAL  52          3HG2      VAL  52  -4.784   5.081   4.649
  375    H    ALA  53           H        ALA  53  -2.603   0.387   4.276
  376    HA   ALA  53           HA       ALA  53  -2.784  -0.613   7.027
  377   1HB   ALA  53          1HB       ALA  53  -3.251  -2.263   4.515
  378   2HB   ALA  53          2HB       ALA  53  -2.823  -2.909   6.117
  379   3HB   ALA  53          3HB       ALA  53  -4.362  -2.038   5.892
  380    H    LYS  54           H        LYS  54  -0.525  -1.027   7.592
  381    HA   LYS  54           HA       LYS  54   1.262  -1.500   5.272
  382   1HB   LYS  54          1HB       LYS  54   3.038  -0.374   6.327
  383   2HB   LYS  54          2HB       LYS  54   1.640   0.678   6.480
  384   1HG   LYS  54          1HG       LYS  54   1.485  -0.530   8.893
  385   2HG   LYS  54          2HG       LYS  54   3.184  -0.847   8.566
  386   1HD   LYS  54          1HD       LYS  54   3.505   1.633   8.138
  387   2HD   LYS  54          2HD       LYS  54   1.799   1.878   8.535
  388   1HE   LYS  54          1HE       LYS  54   3.041   2.439  10.488
  389   2HE   LYS  54          2HE       LYS  54   2.200   0.915  10.804
  390   1HZ   LYS  54          1HZ       LYS  54   4.269  -0.237  10.334
  391   2HZ   LYS  54          2HZ       LYS  54   5.038   1.185  10.028
  392   3HZ   LYS  54          3HZ       LYS  54   4.490   0.859  11.547
  393    H    LEU  55           H        LEU  55   2.504  -3.172   5.235
  394    HA   LEU  55           HA       LEU  55   2.634  -4.872   7.672
  395   1HB   LEU  55          1HB       LEU  55   1.622  -6.783   6.943
  396   2HB   LEU  55          2HB       LEU  55   0.516  -5.511   6.478
  397    HG   LEU  55           HG       LEU  55   2.385  -7.088   4.644
  398   1HD1  LEU  55          1HD1      LEU  55   0.288  -7.989   3.738
  399   2HD1  LEU  55          2HD1      LEU  55   0.363  -8.288   5.485
  400   3HD1  LEU  55          3HD1      LEU  55  -0.658  -6.986   4.842
  401   1HD2  LEU  55          1HD2      LEU  55   2.220  -4.904   3.649
  402   2HD2  LEU  55          2HD2      LEU  55   1.068  -5.928   2.799
  403   3HD2  LEU  55          3HD2      LEU  55   0.492  -4.782   4.031
  404    H    ASN  56           H        ASN  56   4.124  -6.427   7.801
  405    HA   ASN  56           HA       ASN  56   6.602  -5.923   6.390
  406   1HB   ASN  56          1HB       ASN  56   6.603  -6.283   8.807
  407   2HB   ASN  56          2HB       ASN  56   5.721  -7.803   8.632
  408   1HD2  ASN  56          1HD2      ASN  56   7.243  -9.120   9.665
  409   2HD2  ASN  56          2HD2      ASN  56   8.807  -9.454   8.900
  410    H    VAL  57           H        VAL  57   6.674  -6.718   4.339
  411    HA   VAL  57           HA       VAL  57   4.874  -8.719   3.479
  412    HB   VAL  57           HB       VAL  57   5.796  -6.771   2.243
  413   1HG1  VAL  57          1HG1      VAL  57   8.187  -6.989   2.449
  414   2HG1  VAL  57          2HG1      VAL  57   8.175  -8.635   1.774
  415   3HG1  VAL  57          3HG1      VAL  57   7.786  -7.277   0.742
  416   1HG2  VAL  57          1HG2      VAL  57   5.987  -9.266   0.589
  417   2HG2  VAL  57          2HG2      VAL  57   4.434  -8.700   1.249
  418   3HG2  VAL  57          3HG2      VAL  57   5.352  -7.670   0.154
  419    H    ASP  58           H        ASP  58   8.056  -9.062   4.757
  420    HA   ASP  58           HA       ASP  58   8.852 -11.658   3.830
  421   1HB   ASP  58          1HB       ASP  58  10.357 -10.184   4.988
  422   2HB   ASP  58          2HB       ASP  58   9.257 -10.039   6.347
  423    H    GLU  59           H        GLU  59   6.819 -10.481   6.427
  424    HA   GLU  59           HA       GLU  59   6.306 -13.092   7.614
  425   1HB   GLU  59          1HB       GLU  59   6.869 -11.264   8.962
  426   2HB   GLU  59          2HB       GLU  59   5.697 -10.205   8.169
  427   1HG   GLU  59          1HG       GLU  59   3.848 -11.413   9.209
  428   2HG   GLU  59          2HG       GLU  59   5.010 -12.451  10.055
  429    H    ASN  60           H        ASN  60   4.599 -10.818   5.518
  430    HA   ASN  60           HA       ASN  60   2.352 -12.802   5.439
  431   1HB   ASN  60          1HB       ASN  60   1.357 -10.691   5.843
  432   2HB   ASN  60          2HB       ASN  60   2.263  -9.941   4.500
  433   1HD2  ASN  60          1HD2      ASN  60   0.869  -9.754   2.642
  434   2HD2  ASN  60          2HD2      ASN  60  -0.035 -11.165   2.091
  435    HA   PRO  61           HA       PRO  61   4.321 -13.677   1.410
  436   1HB   PRO  61          1HB       PRO  61   4.161 -16.397   1.521
  437   2HB   PRO  61          2HB       PRO  61   5.495 -15.468   2.262
  438   1HG   PRO  61          1HG       PRO  61   2.994 -16.546   3.611
  439   2HG   PRO  61          2HG       PRO  61   4.697 -16.701   4.156
  440   1HD   PRO  61          1HD       PRO  61   3.017 -14.770   5.136
  441   2HD   PRO  61          2HD       PRO  61   4.754 -14.460   4.912
  442    H    GLU  62           H        GLU  62   1.177 -14.098   2.938
  443    HA   GLU  62           HA       GLU  62  -0.020 -15.630   0.807
  444   1HB   GLU  62          1HB       GLU  62  -0.734 -15.341   3.357
  445   2HB   GLU  62          2HB       GLU  62  -1.628 -13.953   2.737
  446   1HG   GLU  62          1HG       GLU  62  -1.948 -16.891   2.069
  447   2HG   GLU  62          2HG       GLU  62  -3.155 -15.782   2.722
  448    H    THR  63           H        THR  63  -1.064 -14.864  -0.919
  449    HA   THR  63           HA       THR  63  -1.441 -13.699  -2.750
  450    HB   THR  63           HB       THR  63  -2.438 -11.764  -0.653
  451    HG1  THR  63           1HG      THR  63  -3.560 -13.780  -0.709
  452   1HG2  THR  63          1HG2      THR  63  -2.152 -10.496  -2.794
  453   2HG2  THR  63          2HG2      THR  63  -3.084 -11.761  -3.630
  454   3HG2  THR  63          3HG2      THR  63  -3.850 -10.762  -2.379
  455    H    THR  64           H        THR  64   0.703 -12.202  -0.592
  456    HA   THR  64           HA       THR  64   2.206 -10.356  -2.116
  457    HB   THR  64           HB       THR  64   2.916 -12.449  -0.055
  458    HG1  THR  64           1HG      THR  64   2.814 -10.893   1.363
  459   1HG2  THR  64          1HG2      THR  64   4.753 -10.239  -0.959
  460   2HG2  THR  64          2HG2      THR  64   5.005 -11.332   0.422
  461   3HG2  THR  64          3HG2      THR  64   5.016 -11.970  -1.219
  462    H    SER  65           H        SER  65   2.817 -13.899  -1.696
  463    HA   SER  65           HA       SER  65   4.782 -14.111  -3.700
  464   1HB   SER  65          1HB       SER  65   4.313 -15.739  -1.881
  465   2HB   SER  65          2HB       SER  65   2.810 -16.213  -2.693
  466    HG   SER  65           HG       SER  65   4.614 -17.587  -3.154
  467    H    GLN  66           H        GLN  66   1.249 -14.597  -3.896
  468    HA   GLN  66           HA       GLN  66   1.084 -15.500  -6.545
  469   1HB   GLN  66          1HB       GLN  66  -0.676 -15.536  -4.729
  470   2HB   GLN  66          2HB       GLN  66  -0.981 -13.832  -5.050
  471   1HG   GLN  66          1HG       GLN  66  -1.581 -14.380  -7.405
  472   2HG   GLN  66          2HG       GLN  66  -1.288 -16.092  -7.076
  473   1HE2  GLN  66          1HE2      GLN  66  -2.641 -16.993  -5.081
  474   2HE2  GLN  66          2HE2      GLN  66  -4.277 -16.360  -4.997
  475    H    PHE  67           H        PHE  67   1.168 -12.077  -5.314
  476    HA   PHE  67           HA       PHE  67   0.834 -11.149  -8.115
  477   1HB   PHE  67          1HB       PHE  67   0.554  -9.845  -5.412
  478   2HB   PHE  67          2HB       PHE  67   0.774  -8.886  -6.866
  479    HD1  PHE  67           1HD      PHE  67  -1.074  -8.266  -8.178
  480    HD2  PHE  67           2HD      PHE  67  -1.434 -11.632  -5.508
  481    HE1  PHE  67           1HE      PHE  67  -3.496  -8.444  -8.698
  482    HE2  PHE  67           2HE      PHE  67  -3.837 -11.804  -6.039
  483    HZ   PHE  67           HZ       PHE  67  -4.882 -10.195  -7.620
  484    H    GLY  68           H        GLY  68   3.417 -12.413  -6.693
  485   1HA   GLY  68          1HA       GLY  68   5.639 -12.251  -7.168
  486   2HA   GLY  68          2HA       GLY  68   5.234 -11.052  -8.406
  487    H    ILE  69           H        ILE  69   4.383 -10.585  -5.017
  488    HA   ILE  69           HA       ILE  69   5.485  -7.932  -5.101
  489    HB   ILE  69           HB       ILE  69   4.181  -9.538  -2.904
  490   1HG1  ILE  69          1HG1      ILE  69   2.658  -9.319  -4.764
  491   2HG1  ILE  69          2HG1      ILE  69   2.108  -8.355  -3.412
  492   1HG2  ILE  69          1HG2      ILE  69   3.709  -7.523  -1.748
  493   2HG2  ILE  69          2HG2      ILE  69   5.447  -7.636  -1.996
  494   3HG2  ILE  69          3HG2      ILE  69   4.500  -6.525  -2.997
  495   1HD1  ILE  69          1HD1      ILE  69   1.792  -7.205  -5.550
  496   2HD1  ILE  69          2HD1      ILE  69   2.907  -6.300  -4.518
  497   3HD1  ILE  69          3HD1      ILE  69   3.527  -7.261  -5.884
  498    H    MET  70           H        MET  70   7.650  -8.168  -5.363
  499    HA   MET  70           HA       MET  70   9.198  -8.810  -2.874
  500   1HB   MET  70          1HB       MET  70   9.378 -10.213  -5.116
  501   2HB   MET  70          2HB       MET  70  10.380  -8.876  -5.671
  502   1HG   MET  70          1HG       MET  70  10.838 -10.468  -3.121
  503   2HG   MET  70          2HG       MET  70  11.525 -10.898  -4.681
  504   1HE   MET  70          1HE       MET  70  12.940 -10.342  -1.740
  505   2HE   MET  70          2HE       MET  70  13.675  -8.729  -1.589
  506   3HE   MET  70          3HE       MET  70  11.910  -8.915  -1.477
  507    H    SER  71           H        SER  71   8.291  -6.358  -5.175
  508    HA   SER  71           HA       SER  71  10.756  -4.936  -5.353
  509   1HB   SER  71          1HB       SER  71   9.103  -3.539  -6.812
  510   2HB   SER  71          2HB       SER  71   9.490  -5.197  -7.291
  511    HG   SER  71           HG       SER  71   7.153  -4.568  -7.251
  512    H    ILE  72           H        ILE  72  10.209  -4.895  -2.664
  513    HA   ILE  72           HA       ILE  72   8.443  -2.802  -2.013
  514    HB   ILE  72           HB       ILE  72   9.085  -3.097   0.311
  515   1HG1  ILE  72          1HG1      ILE  72  11.048  -5.213  -0.647
  516   2HG1  ILE  72          2HG1      ILE  72  11.489  -3.619  -0.011
  517   1HG2  ILE  72          1HG2      ILE  72   8.604  -5.777  -1.009
  518   2HG2  ILE  72          2HG2      ILE  72   7.975  -5.123   0.534
  519   3HG2  ILE  72          3HG2      ILE  72   7.387  -4.484  -0.990
  520   1HD1  ILE  72          1HD1      ILE  72  10.084  -5.856   1.473
  521   2HD1  ILE  72          2HD1      ILE  72  11.651  -5.098   1.826
  522   3HD1  ILE  72          3HD1      ILE  72  10.157  -4.185   2.082
  523    HA   PRO  73           HA       PRO  73   8.158  -1.225   0.039
  524   1HB   PRO  73          1HB       PRO  73   7.406   1.362  -0.321
  525   2HB   PRO  73          2HB       PRO  73   8.502   0.816   0.952
  526   1HG   PRO  73          1HG       PRO  73   9.213   2.033  -1.726
  527   2HG   PRO  73          2HG       PRO  73   9.927   2.421  -0.134
  528   1HD   PRO  73          1HD       PRO  73  11.146   0.747  -1.911
  529   2HD   PRO  73          2HD       PRO  73  11.227   0.435  -0.155
  530    H    THR  74           H        THR  74   6.327  -1.937  -0.927
  531    HA   THR  74           HA       THR  74   5.649  -0.981  -3.677
  532    HB   THR  74           HB       THR  74   4.849  -3.652  -2.486
  533    HG1  THR  74           1HG      THR  74   7.147  -3.042  -3.997
  534   1HG2  THR  74          1HG2      THR  74   4.375  -4.272  -4.814
  535   2HG2  THR  74          2HG2      THR  74   3.391  -2.906  -4.265
  536   3HG2  THR  74          3HG2      THR  74   4.764  -2.622  -5.334
  537    H    LEU  75           H        LEU  75   3.641  -0.068  -3.851
  538    HA   LEU  75           HA       LEU  75   1.787  -0.243  -1.540
  539   1HB   LEU  75          1HB       LEU  75   3.042   1.914  -1.582
  540   2HB   LEU  75          2HB       LEU  75   2.322   2.271  -3.130
  541    HG   LEU  75           HG       LEU  75   0.421   1.415  -0.941
  542   1HD1  LEU  75          1HD1      LEU  75   1.734   4.149  -1.039
  543   2HD1  LEU  75          2HD1      LEU  75   0.372   3.679   0.004
  544   3HD1  LEU  75          3HD1      LEU  75   1.945   2.909   0.222
  545   1HD2  LEU  75          1HD2      LEU  75  -0.458   1.977  -3.197
  546   2HD2  LEU  75          2HD2      LEU  75  -1.012   3.148  -2.006
  547   3HD2  LEU  75          3HD2      LEU  75   0.321   3.566  -3.096
  548    H    ILE  76           H        ILE  76   0.007  -1.273  -2.313
  549    HA   ILE  76           HA       ILE  76  -0.792  -0.720  -5.139
  550    HB   ILE  76           HB       ILE  76  -1.164  -3.347  -3.674
  551   1HG1  ILE  76          1HG1      ILE  76   0.871  -2.473  -5.748
  552   2HG1  ILE  76          2HG1      ILE  76   1.164  -3.149  -4.145
  553   1HG2  ILE  76          1HG2      ILE  76  -1.979  -4.194  -5.830
  554   2HG2  ILE  76          2HG2      ILE  76  -2.947  -2.822  -5.349
  555   3HG2  ILE  76          3HG2      ILE  76  -1.687  -2.618  -6.592
  556   1HD1  ILE  76          1HD1      ILE  76   0.126  -4.662  -6.562
  557   2HD1  ILE  76          2HD1      ILE  76   1.708  -4.777  -5.791
  558   3HD1  ILE  76          3HD1      ILE  76   0.261  -5.335  -4.914
  559    H    LEU  77           H        LEU  77  -2.943  -0.345  -5.421
  560    HA   LEU  77           HA       LEU  77  -4.587  -0.109  -2.958
  561   1HB   LEU  77          1HB       LEU  77  -3.782   2.080  -3.763
  562   2HB   LEU  77          2HB       LEU  77  -4.678   1.852  -5.273
  563    HG   LEU  77           HG       LEU  77  -6.028   1.644  -2.571
  564   1HD1  LEU  77          1HD1      LEU  77  -6.562   4.042  -2.649
  565   2HD1  LEU  77          2HD1      LEU  77  -4.815   3.784  -2.581
  566   3HD1  LEU  77          3HD1      LEU  77  -5.554   4.210  -4.108
  567   1HD2  LEU  77          1HD2      LEU  77  -7.031   2.434  -5.325
  568   2HD2  LEU  77          2HD2      LEU  77  -7.461   0.963  -4.426
  569   3HD2  LEU  77          3HD2      LEU  77  -8.004   2.532  -3.842
  570    H    PHE  78           H        PHE  78  -6.283  -1.333  -3.024
  571    HA   PHE  78           HA       PHE  78  -7.042  -2.710  -5.545
  572   1HB   PHE  78          1HB       PHE  78  -7.269  -3.587  -2.643
  573   2HB   PHE  78          2HB       PHE  78  -7.743  -4.544  -4.030
  574    HD1  PHE  78           1HD      PHE  78  -4.851  -3.201  -2.128
  575    HD2  PHE  78           2HD      PHE  78  -6.131  -5.812  -5.319
  576    HE1  PHE  78           1HE      PHE  78  -2.641  -4.311  -2.116
  577    HE2  PHE  78           2HE      PHE  78  -3.915  -6.921  -5.297
  578    HZ   PHE  78           HZ       PHE  78  -2.165  -6.173  -3.698
  579    H    LYS  79           H        LYS  79  -9.301  -3.384  -5.652
  580    HA   LYS  79           HA       LYS  79 -11.098  -2.904  -3.484
  581   1HB   LYS  79          1HB       LYS  79 -12.829  -1.671  -4.750
  582   2HB   LYS  79          2HB       LYS  79 -11.405  -0.721  -4.408
  583   1HG   LYS  79          1HG       LYS  79 -10.790  -1.692  -6.956
  584   2HG   LYS  79          2HG       LYS  79 -12.549  -1.625  -7.019
  585   1HD   LYS  79          1HD       LYS  79 -11.630   0.435  -7.855
  586   2HD   LYS  79          2HD       LYS  79 -12.414   0.792  -6.298
  587   1HE   LYS  79          1HE       LYS  79 -10.234   0.757  -5.151
  588   2HE   LYS  79          2HE       LYS  79  -9.441   0.164  -6.606
  589   1HZ   LYS  79          1HZ       LYS  79  -9.983   2.242  -7.695
  590   2HZ   LYS  79          2HZ       LYS  79 -10.750   2.801  -6.351
  591   3HZ   LYS  79          3HZ       LYS  79  -9.126   2.525  -6.322
  592    H    GLY  80           H        GLY  80 -12.301  -4.788  -3.494
  593   1HA   GLY  80          1HA       GLY  80 -13.206  -6.749  -4.195
  594   2HA   GLY  80          2HA       GLY  80 -13.833  -5.793  -5.533
  595    H    GLY  81           H        GLY  81 -10.531  -6.873  -4.695
  596   1HA   GLY  81          1HA       GLY  81  -9.089  -8.332  -5.722
  597   2HA   GLY  81          2HA       GLY  81 -10.320  -8.714  -6.922
  598    H    GLU  82           H        GLU  82 -10.176  -5.404  -7.236
  599    HA   GLU  82           HA       GLU  82  -8.344  -5.682  -9.518
  600   1HB   GLU  82          1HB       GLU  82 -10.649  -4.988  -9.894
  601   2HB   GLU  82          2HB       GLU  82 -10.439  -3.602  -8.828
  602   1HG   GLU  82          1HG       GLU  82 -10.302  -2.866 -11.118
  603   2HG   GLU  82          2HG       GLU  82  -8.724  -2.663 -10.369
  604    HA   PRO  83           HA       PRO  83  -5.496  -2.944  -7.135
  605   1HB   PRO  83          1HB       PRO  83  -3.171  -3.648  -8.328
  606   2HB   PRO  83          2HB       PRO  83  -3.970  -4.676  -7.098
  607   1HG   PRO  83          1HG       PRO  83  -4.147  -4.942 -10.119
  608   2HG   PRO  83          2HG       PRO  83  -3.761  -6.206  -8.912
  609   1HD   PRO  83          1HD       PRO  83  -6.278  -5.851  -9.892
  610   2HD   PRO  83          2HD       PRO  83  -5.989  -6.340  -8.195
  611    H    VAL  84           H        VAL  84  -6.508  -1.077  -8.077
  612    HA   VAL  84           HA       VAL  84  -6.418  -0.386 -10.826
  613    HB   VAL  84           HB       VAL  84  -6.866   1.925  -9.824
  614   1HG1  VAL  84          1HG1      VAL  84  -9.232   1.372  -9.419
  615   2HG1  VAL  84          2HG1      VAL  84  -8.613   0.389 -10.744
  616   3HG1  VAL  84          3HG1      VAL  84  -8.801  -0.338  -9.138
  617   1HG2  VAL  84          1HG2      VAL  84  -7.446   0.506  -7.236
  618   2HG2  VAL  84          2HG2      VAL  84  -5.947   1.396  -7.530
  619   3HG2  VAL  84          3HG2      VAL  84  -7.480   2.252  -7.625
  620    H    LYS  85           H        LYS  85  -4.064   0.076  -8.374
  621    HA   LYS  85           HA       LYS  85  -2.151   0.467 -10.457
  622   1HB   LYS  85          1HB       LYS  85  -0.973   2.478  -9.455
  623   2HB   LYS  85          2HB       LYS  85  -2.396   2.803 -10.385
  624   1HG   LYS  85          1HG       LYS  85  -2.576   2.545  -7.363
  625   2HG   LYS  85          2HG       LYS  85  -1.932   4.008  -8.085
  626   1HD   LYS  85          1HD       LYS  85  -4.743   2.966  -8.670
  627   2HD   LYS  85          2HD       LYS  85  -4.335   4.143  -7.460
  628   1HE   LYS  85          1HE       LYS  85  -4.939   5.539  -9.157
  629   2HE   LYS  85          2HE       LYS  85  -3.194   5.465  -9.423
  630   1HZ   LYS  85          1HZ       LYS  85  -3.713   4.846 -11.434
  631   2HZ   LYS  85          2HZ       LYS  85  -4.330   3.393 -10.891
  632   3HZ   LYS  85          3HZ       LYS  85  -5.348   4.694 -11.039
  633    H    GLN  86           H        GLN  86   0.034   0.268  -9.775
  634    HA   GLN  86           HA       GLN  86   0.591  -0.550  -7.008
  635   1HB   GLN  86          1HB       GLN  86   0.804  -2.588  -8.257
  636   2HB   GLN  86          2HB       GLN  86   1.599  -1.778  -9.615
  637   1HG   GLN  86          1HG       GLN  86   3.597  -1.354  -8.306
  638   2HG   GLN  86          2HG       GLN  86   2.872  -1.999  -6.847
  639   1HE2  GLN  86          1HE2      GLN  86   1.662  -4.422  -8.300
  640   2HE2  GLN  86          2HE2      GLN  86   3.082  -5.409  -8.609
  641    H    LEU  87           H        LEU  87   2.204   0.655  -6.171
  642    HA   LEU  87           HA       LEU  87   3.920   2.372  -7.890
  643   1HB   LEU  87          1HB       LEU  87   2.830   2.714  -5.070
  644   2HB   LEU  87          2HB       LEU  87   4.199   3.625  -5.650
  645    HG   LEU  87           HG       LEU  87   2.177   4.934  -5.608
  646   1HD1  LEU  87          1HD1      LEU  87   3.954   5.383  -7.259
  647   2HD1  LEU  87          2HD1      LEU  87   3.055   4.443  -8.470
  648   3HD1  LEU  87          3HD1      LEU  87   2.361   5.935  -7.786
  649   1HD2  LEU  87          1HD2      LEU  87   0.507   3.120  -6.109
  650   2HD2  LEU  87          2HD2      LEU  87   0.277   4.635  -7.009
  651   3HD2  LEU  87          3HD2      LEU  87   0.982   3.240  -7.822
  652    H    ILE  88           H        ILE  88   6.161   2.250  -7.273
  653    HA   ILE  88           HA       ILE  88   6.947   0.368  -5.193
  654    HB   ILE  88           HB       ILE  88   8.657  -0.604  -6.804
  655   1HG1  ILE  88          1HG1      ILE  88   6.745   0.476  -8.935
  656   2HG1  ILE  88          2HG1      ILE  88   8.428   0.951  -8.684
  657   1HG2  ILE  88          1HG2      ILE  88   6.763  -1.826  -5.872
  658   2HG2  ILE  88          2HG2      ILE  88   5.741  -1.331  -7.246
  659   3HG2  ILE  88          3HG2      ILE  88   7.137  -2.388  -7.496
  660   1HD1  ILE  88          1HD1      ILE  88   7.392  -1.737  -9.651
  661   2HD1  ILE  88          2HD1      ILE  88   8.356  -0.554 -10.539
  662   3HD1  ILE  88          3HD1      ILE  88   9.089  -1.445  -9.183
  663    H    GLY  89           H        GLY  89   8.783   0.981  -4.229
  664   1HA   GLY  89          1HA       GLY  89  10.765   2.165  -3.830
  665   2HA   GLY  89          2HA       GLY  89  10.609   2.984  -5.397
  666    H    TYR  90           H        TYR  90  11.333   4.476  -3.257
  667    HA   TYR  90           HA       TYR  90   9.100   5.706  -1.888
  668   1HB   TYR  90          1HB       TYR  90  11.158   5.607  -0.714
  669   2HB   TYR  90          2HB       TYR  90  12.038   6.308  -2.066
  670    HD1  TYR  90           1HD      TYR  90   8.791   7.587  -0.599
  671    HD2  TYR  90           2HD      TYR  90  13.040   8.206  -1.108
  672    HE1  TYR  90           1HE      TYR  90   8.567   9.907   0.187
  673    HE2  TYR  90           2HE      TYR  90  12.810  10.510  -0.266
  674    HH   TYR  90           HH       TYR  90  11.313  12.151   0.509
  675    H    GLN  91           H        GLN  91   7.833   6.083  -3.859
  676    HA   GLN  91           HA       GLN  91   8.496   8.523  -5.334
  677   1HB   GLN  91          1HB       GLN  91   5.673   7.421  -5.027
  678   2HB   GLN  91          2HB       GLN  91   6.326   8.423  -6.286
  679   1HG   GLN  91          1HG       GLN  91   7.039   5.495  -5.865
  680   2HG   GLN  91          2HG       GLN  91   6.032   6.176  -7.131
  681   1HE2  GLN  91          1HE2      GLN  91   7.029   7.345  -8.930
  682   2HE2  GLN  91          2HE2      GLN  91   8.774   7.231  -9.139
  683    HA   PRO  92           HA       PRO  92   7.283  10.928  -1.686
  684   1HB   PRO  92          1HB       PRO  92   7.313  13.455  -2.718
  685   2HB   PRO  92          2HB       PRO  92   8.809  12.527  -2.416
  686   1HG   PRO  92          1HG       PRO  92   7.293  12.809  -5.032
  687   2HG   PRO  92          2HG       PRO  92   9.048  13.050  -4.743
  688   1HD   PRO  92          1HD       PRO  92   8.048  10.696  -5.694
  689   2HD   PRO  92          2HD       PRO  92   9.427  10.720  -4.551
  690    H    LYS  93           H        LYS  93   5.426  12.592  -1.189
  691    HA   LYS  93           HA       LYS  93   2.963  11.360  -1.798
  692   1HB   LYS  93          1HB       LYS  93   3.899  13.912  -0.478
  693   2HB   LYS  93          2HB       LYS  93   2.310  13.983  -1.194
  694   1HG   LYS  93          1HG       LYS  93   1.805  13.301   0.956
  695   2HG   LYS  93          2HG       LYS  93   1.770  11.794   0.055
  696   1HD   LYS  93          1HD       LYS  93   3.175  11.019   1.629
  697   2HD   LYS  93          2HD       LYS  93   4.452  11.906   0.818
  698   1HE   LYS  93          1HE       LYS  93   2.689  12.959   3.071
  699   2HE   LYS  93          2HE       LYS  93   4.296  12.291   3.297
  700   1HZ   LYS  93          1HZ       LYS  93   5.162  14.135   1.964
  701   2HZ   LYS  93          2HZ       LYS  93   3.643  14.788   1.865
  702   3HZ   LYS  93          3HZ       LYS  93   4.381  14.583   3.343
  703    H    GLU  94           H        GLU  94   4.588  14.180  -3.186
  704    HA   GLU  94           HA       GLU  94   2.387  14.998  -4.741
  705   1HB   GLU  94          1HB       GLU  94   5.348  15.705  -4.913
  706   2HB   GLU  94          2HB       GLU  94   4.016  16.601  -5.648
  707   1HG   GLU  94          1HG       GLU  94   4.448  17.753  -3.667
  708   2HG   GLU  94          2HG       GLU  94   2.981  16.867  -3.354
  709    H    GLN  95           H        GLN  95   4.290  12.258  -5.263
  710    HA   GLN  95           HA       GLN  95   3.785  12.253  -8.204
  711   1HB   GLN  95          1HB       GLN  95   6.170  12.032  -7.325
  712   2HB   GLN  95          2HB       GLN  95   5.700  10.578  -6.506
  713   1HG   GLN  95          1HG       GLN  95   6.834  10.073  -8.631
  714   2HG   GLN  95          2HG       GLN  95   5.190   9.442  -8.601
  715   1HE2  GLN  95          1HE2      GLN  95   6.401  12.815  -9.386
  716   2HE2  GLN  95          2HE2      GLN  95   5.691  12.769 -10.993
  717    H    LEU  96           H        LEU  96   3.883  10.389  -5.251
  718    HA   LEU  96           HA       LEU  96   2.270   8.098  -5.867
  719   1HB   LEU  96          1HB       LEU  96   3.838   8.698  -3.905
  720   2HB   LEU  96          2HB       LEU  96   2.455   9.508  -3.230
  721    HG   LEU  96           HG       LEU  96   1.947   6.713  -4.142
  722   1HD1  LEU  96          1HD1      LEU  96   3.770   7.230  -1.774
  723   2HD1  LEU  96          2HD1      LEU  96   3.041   5.669  -2.231
  724   3HD1  LEU  96          3HD1      LEU  96   4.210   6.445  -3.306
  725   1HD2  LEU  96          1HD2      LEU  96   0.742   6.578  -2.013
  726   2HD2  LEU  96          2HD2      LEU  96   1.422   8.132  -1.489
  727   3HD2  LEU  96          3HD2      LEU  96   0.295   8.078  -2.857
  728    H    GLU  97           H        GLU  97   1.137  11.051  -4.163
  729    HA   GLU  97           HA       GLU  97  -1.612  10.284  -4.412
  730   1HB   GLU  97          1HB       GLU  97  -0.474  11.815  -2.691
  731   2HB   GLU  97          2HB       GLU  97  -0.549  13.073  -3.919
  732   1HG   GLU  97          1HG       GLU  97  -2.796  13.388  -3.717
  733   2HG   GLU  97          2HG       GLU  97  -3.131  11.668  -3.505
  734    H    ALA  98           H        ALA  98   0.620  11.788  -6.647
  735    HA   ALA  98           HA       ALA  98  -1.477  13.058  -8.250
  736   1HB   ALA  98          1HB       ALA  98   1.396  12.386  -9.014
  737   2HB   ALA  98          2HB       ALA  98   0.266  13.402  -9.922
  738   3HB   ALA  98          3HB       ALA  98   0.826  13.921  -8.323
  739    H    GLN  99           H        GLN  99   0.475  10.033  -8.482
  740    HA   GLN  99           HA       GLN  99  -0.912   8.885 -10.712
  741   1HB   GLN  99          1HB       GLN  99   1.234   8.054  -9.912
  742   2HB   GLN  99          2HB       GLN  99   0.599   7.712  -8.332
  743   1HG   GLN  99          1HG       GLN  99   0.980   5.703  -9.766
  744   2HG   GLN  99          2HG       GLN  99  -0.598   5.829  -9.009
  745   1HE2  GLN  99          1HE2      GLN  99   0.846   7.080 -12.130
  746   2HE2  GLN  99          2HE2      GLN  99  -0.471   6.448 -13.104
  747    H    LEU 100           H        LEU 100  -1.374   8.519  -7.157
  748    HA   LEU 100           HA       LEU 100  -3.651   6.855  -7.370
  749   1HB   LEU 100          1HB       LEU 100  -1.954   8.177  -5.297
  750   2HB   LEU 100          2HB       LEU 100  -3.437   7.503  -4.810
  751    HG   LEU 100           HG       LEU 100  -1.747   5.758  -6.550
  752   1HD1  LEU 100          1HD1      LEU 100  -1.101   6.233  -3.620
  753   2HD1  LEU 100          2HD1      LEU 100  -0.422   4.961  -4.656
  754   3HD1  LEU 100          3HD1      LEU 100  -0.083   6.651  -5.020
  755   1HD2  LEU 100          1HD2      LEU 100  -3.235   5.141  -3.971
  756   2HD2  LEU 100          2HD2      LEU 100  -4.004   5.116  -5.563
  757   3HD2  LEU 100          3HD2      LEU 100  -2.667   3.992  -5.204
  758    H    ALA 101           H        ALA 101  -3.419  10.231  -7.826
  759    HA   ALA 101           HA       ALA 101  -5.739  11.270  -6.692
  760   1HB   ALA 101          1HB       ALA 101  -4.657  11.833  -9.483
  761   2HB   ALA 101          2HB       ALA 101  -5.767  12.858  -8.556
  762   3HB   ALA 101          3HB       ALA 101  -4.111  12.625  -7.985
  763    H    ASP 102           H        ASP 102  -5.478   8.976  -9.369
  764    HA   ASP 102           HA       ASP 102  -8.154   9.273 -10.363
  765   1HB   ASP 102          1HB       ASP 102  -6.773   8.264 -11.903
  766   2HB   ASP 102          2HB       ASP 102  -5.773   7.493 -10.693
  767    H    VAL 103           H        VAL 103  -7.195   8.052  -7.341
  768    HA   VAL 103           HA       VAL 103 -10.076   7.349  -7.045
  769    HB   VAL 103           HB       VAL 103  -8.688   5.285  -7.022
  770   1HG1  VAL 103          1HG1      VAL 103  -7.384   4.693  -5.119
  771   2HG1  VAL 103          2HG1      VAL 103  -6.674   6.113  -5.888
  772   3HG1  VAL 103          3HG1      VAL 103  -7.603   6.286  -4.375
  773   1HG2  VAL 103          1HG2      VAL 103 -10.898   5.344  -5.940
  774   2HG2  VAL 103          2HG2      VAL 103  -9.761   4.249  -5.117
  775   3HG2  VAL 103          3HG2      VAL 103 -10.134   5.811  -4.407
  776    H    LEU 104           H        LEU 104  -7.356   9.250  -5.871
  777    HA   LEU 104           HA       LEU 104  -8.847   9.991  -3.485
  778   1HB   LEU 104          1HB       LEU 104  -6.201  10.766  -4.735
  779   2HB   LEU 104          2HB       LEU 104  -6.923  11.740  -3.525
  780    HG   LEU 104           HG       LEU 104  -5.592  10.466  -2.200
  781   1HD1  LEU 104          1HD1      LEU 104  -7.806   8.404  -2.450
  782   2HD1  LEU 104          2HD1      LEU 104  -6.673   8.586  -1.097
  783   3HD1  LEU 104          3HD1      LEU 104  -7.879   9.855  -1.414
  784   1HD2  LEU 104          1HD2      LEU 104  -4.587   9.185  -3.996
  785   2HD2  LEU 104          2HD2      LEU 104  -4.865   8.166  -2.576
  786   3HD2  LEU 104          3HD2      LEU 104  -5.946   8.031  -3.978
  787    H    GLN 105           H        GLN 105  -9.077  10.721  -6.742
  788    HA   GLN 105           HA       GLN 105 -10.513  13.199  -6.658
  789   1HB   GLN 105          2HB       GLN 105  -9.648  12.189  -8.710
  790   2HB   GLN 105          3HB       GLN 105 -10.655  10.769  -8.450
  791   1HG   GLN 105          2HG       GLN 105 -12.695  12.200  -8.681
  792   2HG   GLN 105          3HG       GLN 105 -11.662  13.609  -8.950
  793   1HE2  GLN 105          1HE2      GLN 105  -9.708  11.903 -10.645
  794   2HE2  GLN 105          2HE2      GLN 105 -10.588  11.736 -12.163
  Start of MODEL   16
    1   1H    ALA   1           H        ALA   1  -9.648   5.523   6.008
    2   2H    ALA   1          2HN       ALA   1 -10.048   3.996   6.512
    3   3H    ALA   1          3HN       ALA   1 -11.036   5.293   6.868
    4    HA   ALA   1           HA       ALA   1  -9.273   6.283   8.152
    5   1HB   ALA   1          1HB       ALA   1  -9.597   4.851  10.112
    6   2HB   ALA   1          2HB       ALA   1 -11.109   5.058   9.216
    7   3HB   ALA   1          3HB       ALA   1 -10.206   3.535   9.066
    8    H    THR   2           H        THR   2  -7.976   3.547   9.591
    9    HA   THR   2           HA       THR   2  -6.093   2.804   7.579
   10    HB   THR   2           HB       THR   2  -5.182   4.312  10.063
   11    HG1  THR   2           1HG      THR   2  -5.725   5.087   7.659
   12   1HG2  THR   2          1HG2      THR   2  -3.641   2.441   9.860
   13   2HG2  THR   2          2HG2      THR   2  -3.493   2.682   8.108
   14   3HG2  THR   2          3HG2      THR   2  -2.846   3.888   9.236
   15    H    MET   3           H        MET   3  -5.051   0.824   8.203
   16    HA   MET   3           HA       MET   3  -6.000  -0.538  10.639
   17   1HB   MET   3          1HB       MET   3  -6.289  -1.547   7.772
   18   2HB   MET   3          2HB       MET   3  -6.511  -2.559   9.204
   19   1HG   MET   3          1HG       MET   3  -8.349  -1.134   9.972
   20   2HG   MET   3          2HG       MET   3  -8.158  -0.091   8.560
   21   1HE   MET   3          1HE       MET   3 -10.770  -0.346   8.179
   22   2HE   MET   3          2HE       MET   3 -11.584  -1.916   7.978
   23   3HE   MET   3          3HE       MET   3 -10.881  -1.476   9.551
   24    H    THR   4           H        THR   4  -4.791  -2.996  10.345
   25    HA   THR   4           HA       THR   4  -2.204  -2.868   9.132
   26    HB   THR   4           HB       THR   4  -2.508  -2.884  12.136
   27    HG1  THR   4           1HG      THR   4  -2.129  -0.970  10.507
   28   1HG2  THR   4          1HG2      THR   4   0.002  -3.531  10.526
   29   2HG2  THR   4          2HG2      THR   4  -0.051  -3.214  12.272
   30   3HG2  THR   4          3HG2      THR   4  -0.863  -4.641  11.619
   31    H    LEU   5           H        LEU   5  -1.301  -5.156   9.177
   32    HA   LEU   5           HA       LEU   5  -3.555  -7.109   9.202
   33   1HB   LEU   5          1HB       LEU   5  -1.720  -6.390   6.900
   34   2HB   LEU   5          2HB       LEU   5  -3.003  -7.588   6.830
   35    HG   LEU   5           HG       LEU   5  -3.427  -4.595   7.196
   36   1HD1  LEU   5          1HD1      LEU   5  -4.182  -4.657   4.806
   37   2HD1  LEU   5          2HD1      LEU   5  -2.448  -4.940   5.032
   38   3HD1  LEU   5          3HD1      LEU   5  -3.535  -6.300   4.694
   39   1HD2  LEU   5          1HD2      LEU   5  -5.414  -6.779   6.488
   40   2HD2  LEU   5          2HD2      LEU   5  -5.293  -5.969   8.060
   41   3HD2  LEU   5          3HD2      LEU   5  -5.759  -5.043   6.634
   42    H    THR   6           H        THR   6  -2.714  -9.323   8.553
   43    HA   THR   6           HA       THR   6   0.166  -9.716   9.169
   44    HB   THR   6           HB       THR   6  -0.455 -12.006   9.860
   45    HG1  THR   6           1HG      THR   6  -2.704 -12.310  10.369
   46   1HG2  THR   6          1HG2      THR   6  -1.373 -11.456  12.049
   47   2HG2  THR   6          2HG2      THR   6  -0.228 -10.198  11.565
   48   3HG2  THR   6          3HG2      THR   6  -1.974  -9.889  11.458
   49    H    ASP   7           H        ASP   7  -1.680 -12.248   7.855
   50    HA   ASP   7           HA       ASP   7  -0.751 -11.758   5.043
   51   1HB   ASP   7          1HB       ASP   7   0.745 -13.414   6.007
   52   2HB   ASP   7          2HB       ASP   7  -0.597 -14.316   6.690
   53    H    ALA   8           H        ALA   8  -2.763 -14.202   6.787
   54    HA   ALA   8           HA       ALA   8  -4.753 -14.448   4.870
   55   1HB   ALA   8          1HB       ALA   8  -4.522 -15.886   6.868
   56   2HB   ALA   8          2HB       ALA   8  -5.052 -14.542   7.909
   57   3HB   ALA   8          3HB       ALA   8  -6.177 -15.252   6.732
   58    H    ASN   9           H        ASN   9  -4.274 -11.822   7.122
   59    HA   ASN   9           HA       ASN   9  -6.977 -10.747   6.886
   60   1HB   ASN   9          1HB       ASN   9  -5.145 -10.456   8.829
   61   2HB   ASN   9          2HB       ASN   9  -4.773  -9.019   7.861
   62   1HD2  ASN   9          1HD2      ASN   9  -7.302 -10.681   9.790
   63   2HD2  ASN   9          2HD2      ASN   9  -8.375  -9.298   9.802
   64    H    PHE  10           H        PHE  10  -4.029 -10.582   5.009
   65    HA   PHE  10           HA       PHE  10  -4.489  -7.998   3.793
   66   1HB   PHE  10          1HB       PHE  10  -2.268  -9.097   3.780
   67   2HB   PHE  10          2HB       PHE  10  -2.918 -10.416   2.834
   68    HD1  PHE  10           1HD      PHE  10  -1.536 -10.378   0.979
   69    HD2  PHE  10           2HD      PHE  10  -3.557  -6.741   2.135
   70    HE1  PHE  10           1HE      PHE  10  -0.796  -9.316  -1.089
   71    HE2  PHE  10           2HE      PHE  10  -2.882  -5.710   0.012
   72    HZ   PHE  10           HZ       PHE  10  -1.452  -6.982  -1.605
   73    H    GLN  11           H        GLN  11  -4.998 -11.358   2.590
   74    HA   GLN  11           HA       GLN  11  -6.404 -10.597   0.264
   75   1HB   GLN  11          1HB       GLN  11  -5.387 -12.864   0.823
   76   2HB   GLN  11          2HB       GLN  11  -6.807 -13.179   1.835
   77   1HG   GLN  11          1HG       GLN  11  -8.239 -12.740  -0.227
   78   2HG   GLN  11          2HG       GLN  11  -6.751 -12.640  -1.171
   79   1HE2  GLN  11          1HE2      GLN  11  -5.245 -14.750  -1.053
   80   2HE2  GLN  11          2HE2      GLN  11  -6.184 -16.233  -0.892
   81    H    GLN  12           H        GLN  12  -7.608 -11.168   3.600
   82    HA   GLN  12           HA       GLN  12 -10.394 -10.833   2.996
   83   1HB   GLN  12          1HB       GLN  12  -9.546 -11.793   5.106
   84   2HB   GLN  12          2HB       GLN  12  -8.794 -10.250   5.535
   85   1HG   GLN  12          1HG       GLN  12 -10.992  -9.174   5.703
   86   2HG   GLN  12          2HG       GLN  12 -11.783 -10.650   5.129
   87   1HE2  GLN  12          1HE2      GLN  12 -12.859 -11.583   6.877
   88   2HE2  GLN  12          2HE2      GLN  12 -12.135 -11.736   8.474
   89    H    ALA  13           H        ALA  13  -7.897  -8.425   4.088
   90    HA   ALA  13           HA       ALA  13  -9.679  -6.250   4.194
   91   1HB   ALA  13          1HB       ALA  13  -7.504  -6.237   5.293
   92   2HB   ALA  13          2HB       ALA  13  -6.666  -6.266   3.722
   93   3HB   ALA  13          3HB       ALA  13  -7.634  -4.852   4.194
   94    H    ILE  14           H        ILE  14  -7.577  -7.342   1.472
   95    HA   ILE  14           HA       ILE  14  -8.164  -5.141  -0.217
   96    HB   ILE  14           HB       ILE  14  -7.409  -6.527  -2.081
   97   1HG1  ILE  14          1HG1      ILE  14  -7.182  -8.818  -0.207
   98   2HG1  ILE  14          2HG1      ILE  14  -8.495  -8.655  -1.364
   99   1HG2  ILE  14          1HG2      ILE  14  -5.126  -6.844  -1.281
  100   2HG2  ILE  14          2HG2      ILE  14  -5.810  -5.381  -0.567
  101   3HG2  ILE  14          3HG2      ILE  14  -5.671  -6.855   0.395
  102   1HD1  ILE  14          1HD1      ILE  14  -6.876  -8.619  -3.237
  103   2HD1  ILE  14          2HD1      ILE  14  -5.556  -8.927  -2.079
  104   3HD1  ILE  14          3HD1      ILE  14  -6.840 -10.127  -2.307
  105    H    GLN  15           H        GLN  15 -10.209  -7.794   0.605
  106    HA   GLN  15           HA       GLN  15 -11.918  -7.570  -1.718
  107   1HB   GLN  15          1HB       GLN  15 -13.004  -9.368  -0.943
  108   2HB   GLN  15          2HB       GLN  15 -11.544  -9.562  -0.019
  109   1HG   GLN  15          1HG       GLN  15 -12.828  -9.785   1.774
  110   2HG   GLN  15          2HG       GLN  15 -13.152  -8.066   1.732
  111   1HE2  GLN  15          1HE2      GLN  15 -15.034  -7.631  -0.214
  112   2HE2  GLN  15          2HE2      GLN  15 -16.417  -8.702   0.045
  113    H    GLY  16           H        GLY  16 -11.459  -5.473   0.958
  114   1HA   GLY  16          1HA       GLY  16 -14.105  -4.513   1.384
  115   2HA   GLY  16          2HA       GLY  16 -12.610  -3.605   1.637
  116    H    ASP  17           H        ASP  17 -15.328  -3.204   0.219
  117    HA   ASP  17           HA       ASP  17 -14.593  -2.958  -2.567
  118   1HB   ASP  17          1HB       ASP  17 -16.736  -3.972  -1.732
  119   2HB   ASP  17          2HB       ASP  17 -17.299  -2.332  -1.364
  120    H    GLY  18           H        GLY  18 -13.152  -1.120  -1.050
  121   1HA   GLY  18          1HA       GLY  18 -13.834   1.369  -2.463
  122   2HA   GLY  18          2HA       GLY  18 -13.642   1.486  -0.700
  123    HA   PRO  19           HA       PRO  19  -9.416   1.744  -2.858
  124   1HB   PRO  19          1HB       PRO  19  -8.677   4.219  -1.745
  125   2HB   PRO  19          2HB       PRO  19  -9.371   3.966  -3.358
  126   1HG   PRO  19          1HG       PRO  19 -10.799   4.677  -0.818
  127   2HG   PRO  19          2HG       PRO  19 -11.032   5.392  -2.441
  128   1HD   PRO  19          1HD       PRO  19 -12.722   3.554  -1.402
  129   2HD   PRO  19          2HD       PRO  19 -12.273   3.483  -3.133
  130    H    VAL  20           H        VAL  20  -8.806   0.038  -1.684
  131    HA   VAL  20           HA       VAL  20  -7.994   0.315   1.149
  132    HB   VAL  20           HB       VAL  20  -8.752  -1.968  -0.716
  133   1HG1  VAL  20          1HG1      VAL  20  -6.662  -2.792   0.302
  134   2HG1  VAL  20          2HG1      VAL  20  -7.126  -2.146   1.895
  135   3HG1  VAL  20          3HG1      VAL  20  -8.002  -3.511   1.201
  136   1HG2  VAL  20          1HG2      VAL  20  -9.554  -1.304   2.148
  137   2HG2  VAL  20          2HG2      VAL  20 -10.480  -0.871   0.694
  138   3HG2  VAL  20          3HG2      VAL  20 -10.233  -2.571   1.105
  139    H    LEU  21           H        LEU  21  -5.834   0.568   1.542
  140    HA   LEU  21           HA       LEU  21  -3.991   0.303  -0.811
  141   1HB   LEU  21          1HB       LEU  21  -4.886   2.628  -0.095
  142   2HB   LEU  21          2HB       LEU  21  -3.891   2.441   1.338
  143    HG   LEU  21           HG       LEU  21  -1.861   2.197  -0.137
  144   1HD1  LEU  21          1HD1      LEU  21  -2.322   3.074  -2.561
  145   2HD1  LEU  21          2HD1      LEU  21  -2.700   1.410  -2.201
  146   3HD1  LEU  21          3HD1      LEU  21  -4.000   2.623  -2.263
  147   1HD2  LEU  21          1HD2      LEU  21  -1.786   4.587  -0.764
  148   2HD2  LEU  21          2HD2      LEU  21  -3.551   4.692  -0.592
  149   3HD2  LEU  21          3HD2      LEU  21  -2.523   4.383   0.831
  150    H    VAL  22           H        VAL  22  -2.270  -1.046  -0.493
  151    HA   VAL  22           HA       VAL  22  -1.683  -1.767   2.342
  152    HB   VAL  22           HB       VAL  22  -2.353  -3.492   0.549
  153   1HG1  VAL  22          1HG1      VAL  22  -0.666  -4.480  -0.813
  154   2HG1  VAL  22          2HG1      VAL  22  -0.825  -2.766  -1.232
  155   3HG1  VAL  22          3HG1      VAL  22   0.556  -3.319  -0.263
  156   1HG2  VAL  22          1HG2      VAL  22  -1.497  -4.075   2.776
  157   2HG2  VAL  22          2HG2      VAL  22  -0.809  -5.167   1.563
  158   3HG2  VAL  22          3HG2      VAL  22   0.178  -3.852   2.216
  159    H    ASP  23           H        ASP  23   0.195  -1.080   3.315
  160    HA   ASP  23           HA       ASP  23   2.503  -0.272   1.585
  161   1HB   ASP  23          1HB       ASP  23   2.023   1.037   3.672
  162   2HB   ASP  23          2HB       ASP  23   2.290  -0.362   4.622
  163    H    PHE  24           H        PHE  24   3.528  -2.021   0.745
  164    HA   PHE  24           HA       PHE  24   4.181  -4.365   2.444
  165   1HB   PHE  24          1HB       PHE  24   4.795  -3.589  -0.408
  166   2HB   PHE  24          2HB       PHE  24   5.610  -4.908   0.367
  167    HD1  PHE  24           1HD      PHE  24   4.220  -6.676   1.558
  168    HD2  PHE  24           2HD      PHE  24   2.693  -4.096  -1.541
  169    HE1  PHE  24           1HE      PHE  24   2.632  -8.422   0.894
  170    HE2  PHE  24           2HE      PHE  24   1.073  -5.853  -2.188
  171    HZ   PHE  24           HZ       PHE  24   1.166  -8.107  -1.027
  172    H    TRP  25           H        TRP  25   5.656  -3.996   3.861
  173    HA   TRP  25           HA       TRP  25   8.176  -2.655   3.043
  174   1HB   TRP  25          1HB       TRP  25   8.525  -1.876   5.312
  175   2HB   TRP  25          2HB       TRP  25   7.008  -1.227   4.717
  176    HD1  TRP  25           HD       TRP  25   4.766  -2.619   5.645
  177    HE1  TRP  25           1HE      TRP  25   4.320  -3.713   7.925
  178    HE3  TRP  25           3HE      TRP  25   9.557  -2.727   7.447
  179    HZ2  TRP  25           2HZ      TRP  25   5.885  -4.669  10.191
  180    HZ3  TRP  25           3HZ      TRP  25  10.050  -3.742   9.642
  181    HH2  TRP  25           HH       TRP  25   8.228  -4.738  11.010
  182    H    ALA  26           H        ALA  26   9.857  -3.672   5.051
  183    HA   ALA  26           HA       ALA  26   9.017  -6.351   5.690
  184   1HB   ALA  26          1HB       ALA  26  10.849  -7.543   4.746
  185   2HB   ALA  26          2HB       ALA  26  10.160  -6.587   3.426
  186   3HB   ALA  26          3HB       ALA  26  11.655  -6.052   4.202
  187    H    ALA  27           H        ALA  27  10.368  -7.342   7.255
  188    HA   ALA  27           HA       ALA  27  11.507  -5.657   9.212
  189   1HB   ALA  27          1HB       ALA  27  10.453  -7.843   9.641
  190   2HB   ALA  27          2HB       ALA  27  11.801  -8.662   8.819
  191   3HB   ALA  27          3HB       ALA  27  12.084  -7.765  10.328
  192    H    TRP  28           H        TRP  28  12.952  -5.949   6.358
  193    HA   TRP  28           HA       TRP  28  15.520  -5.277   7.600
  194   1HB   TRP  28          1HB       TRP  28  16.920  -6.387   6.190
  195   2HB   TRP  28          2HB       TRP  28  15.698  -7.600   6.491
  196    HD1  TRP  28           HD       TRP  28  17.382  -5.617   3.816
  197    HE1  TRP  28           1HE      TRP  28  16.461  -6.109   1.491
  198    HE3  TRP  28           3HE      TRP  28  13.390  -8.572   5.123
  199    HZ2  TRP  28           2HZ      TRP  28  14.150  -7.408   0.338
  200    HZ3  TRP  28           3HZ      TRP  28  11.812  -9.362   3.365
  201    HH2  TRP  28           HH       TRP  28  12.162  -8.742   0.999
  202    H    CYS  29           H        CYS  29  14.112  -5.323   4.353
  203    HA   CYS  29           HA       CYS  29  13.881  -3.793   2.725
  204   1HB   CYS  29          1HB       CYS  29  11.774  -3.843   3.739
  205   2HB   CYS  29          2HB       CYS  29  12.286  -2.805   5.063
  206    H    GLY  30           H        GLY  30  13.822  -1.166   5.136
  207   1HA   GLY  30          1HA       GLY  30  15.645   0.428   5.393
  208   2HA   GLY  30          2HA       GLY  30  16.099   0.163   3.713
  209    HA   PRO  31           HA       PRO  31  13.944   3.769   2.671
  210   1HB   PRO  31          1HB       PRO  31  12.807   3.250   0.170
  211   2HB   PRO  31          2HB       PRO  31  14.529   3.623   0.499
  212   1HG   PRO  31          1HG       PRO  31  13.227   0.926   0.107
  213   2HG   PRO  31          2HG       PRO  31  14.789   1.512  -0.536
  214   1HD   PRO  31          1HD       PRO  31  14.640  -0.094   1.642
  215   2HD   PRO  31          2HD       PRO  31  15.852   1.219   1.554
  216    H    CYS  32           H        CYS  32  11.848   0.969   2.805
  217    HA   CYS  32           HA       CYS  32   9.294   2.227   2.778
  218   1HB   CYS  32          1HB       CYS  32   8.733   0.483   4.541
  219   2HB   CYS  32          2HB       CYS  32   9.282  -0.133   2.990
  220    H    ARG  33           H        ARG  33  11.892   2.308   5.282
  221    HA   ARG  33           HA       ARG  33  10.224   3.448   7.325
  222   1HB   ARG  33          1HB       ARG  33  12.566   2.272   7.447
  223   2HB   ARG  33          2HB       ARG  33  13.204   3.886   7.109
  224   1HG   ARG  33          1HG       ARG  33  11.920   4.719   9.142
  225   2HG   ARG  33          2HG       ARG  33  11.417   3.045   9.439
  226   1HD   ARG  33          1HD       ARG  33  13.865   2.413   9.539
  227   2HD   ARG  33          2HD       ARG  33  14.275   4.126   9.441
  228    HE   ARG  33           HE       ARG  33  13.347   2.625  11.713
  229   1HH1  ARG  33          2HH2      ARG  33  13.270   5.898  10.380
  230   2HH1  ARG  33          1HH2      ARG  33  13.072   6.692  11.904
  231   1HH2  ARG  33          2HH1      ARG  33  13.066   3.651  13.755
  232   2HH2  ARG  33          1HH1      ARG  33  12.947   5.367  13.865
  233    H    MET  34           H        MET  34  11.444   4.836   4.402
  234    HA   MET  34           HA       MET  34  11.205   7.597   5.402
  235   1HB   MET  34          1HB       MET  34  12.449   6.351   2.910
  236   2HB   MET  34          2HB       MET  34  12.379   8.083   3.211
  237   1HG   MET  34          1HG       MET  34  13.965   8.017   4.896
  238   2HG   MET  34          2HG       MET  34  13.641   6.342   5.313
  239   1HE   MET  34          1HE       MET  34  14.259   7.490   1.544
  240   2HE   MET  34          2HE       MET  34  15.194   8.660   2.509
  241   3HE   MET  34          3HE       MET  34  16.030   7.458   1.496
  242    H    MET  35           H        MET  35   9.515   5.177   3.695
  243    HA   MET  35           HA       MET  35   7.847   7.030   2.129
  244   1HB   MET  35          1HB       MET  35   8.858   4.883   1.152
  245   2HB   MET  35          2HB       MET  35   7.735   3.987   2.180
  246   1HG   MET  35          1HG       MET  35   5.842   5.066   1.092
  247   2HG   MET  35          2HG       MET  35   6.903   6.120   0.163
  248   1HE   MET  35          1HE       MET  35   5.486   5.479  -2.003
  249   2HE   MET  35          2HE       MET  35   5.211   3.797  -2.528
  250   3HE   MET  35          3HE       MET  35   4.470   4.389  -1.025
  251    H    ALA  36           H        ALA  36   7.786   4.694   4.849
  252    HA   ALA  36           HA       ALA  36   5.135   4.752   5.598
  253   1HB   ALA  36          1HB       ALA  36   5.952   4.348   7.896
  254   2HB   ALA  36          2HB       ALA  36   6.768   3.344   6.680
  255   3HB   ALA  36          3HB       ALA  36   7.602   4.747   7.375
  256    HA   PRO  37           HA       PRO  37   5.505   8.931   7.907
  257   1HB   PRO  37          1HB       PRO  37   7.471  10.726   7.127
  258   2HB   PRO  37          2HB       PRO  37   7.580   9.630   8.541
  259   1HG   PRO  37          1HG       PRO  37   8.690   9.223   5.765
  260   2HG   PRO  37          2HG       PRO  37   9.514   8.959   7.334
  261   1HD   PRO  37          1HD       PRO  37   8.448   6.888   5.992
  262   2HD   PRO  37          2HD       PRO  37   8.268   6.988   7.761
  263    H    VAL  38           H        VAL  38   6.567   8.692   4.445
  264    HA   VAL  38           HA       VAL  38   5.065  11.000   3.626
  265    HB   VAL  38           HB       VAL  38   6.774   9.031   2.442
  266   1HG1  VAL  38          1HG1      VAL  38   4.315   9.586   0.744
  267   2HG1  VAL  38          2HG1      VAL  38   5.848   8.902   0.162
  268   3HG1  VAL  38          3HG1      VAL  38   4.874   8.005   1.325
  269   1HG2  VAL  38          1HG2      VAL  38   7.239  10.796   0.857
  270   2HG2  VAL  38          2HG2      VAL  38   5.767  11.655   1.333
  271   3HG2  VAL  38          3HG2      VAL  38   7.106  11.473   2.489
  272    H    LEU  39           H        LEU  39   4.281   7.555   3.960
  273    HA   LEU  39           HA       LEU  39   1.588   7.644   3.077
  274   1HB   LEU  39          1HB       LEU  39   3.399   5.767   4.512
  275   2HB   LEU  39          2HB       LEU  39   1.696   5.557   4.837
  276    HG   LEU  39           HG       LEU  39   1.171   5.117   2.550
  277   1HD1  LEU  39          1HD1      LEU  39   2.575   6.652   1.299
  278   2HD1  LEU  39          2HD1      LEU  39   4.043   5.879   1.922
  279   3HD1  LEU  39          3HD1      LEU  39   2.997   5.009   0.801
  280   1HD2  LEU  39          1HD2      LEU  39   2.510   3.071   2.232
  281   2HD2  LEU  39          2HD2      LEU  39   3.774   3.693   3.301
  282   3HD2  LEU  39          3HD2      LEU  39   2.166   3.310   3.951
  283    H    GLU  40           H        GLU  40   3.094   8.304   6.247
  284    HA   GLU  40           HA       GLU  40   0.664   8.284   7.757
  285   1HB   GLU  40          1HB       GLU  40   2.980   8.023   8.634
  286   2HB   GLU  40          2HB       GLU  40   3.293   9.730   8.303
  287   1HG   GLU  40          1HG       GLU  40   1.681  10.425   9.954
  288   2HG   GLU  40          2HG       GLU  40   1.042   8.781  10.107
  289    H    GLU  41           H        GLU  41   2.599  10.939   6.302
  290    HA   GLU  41           HA       GLU  41   0.780  13.095   6.758
  291   1HB   GLU  41          1HB       GLU  41   2.563  12.495   4.376
  292   2HB   GLU  41          2HB       GLU  41   1.776  14.044   4.640
  293   1HG   GLU  41          1HG       GLU  41   3.198  14.512   6.544
  294   2HG   GLU  41          2HG       GLU  41   3.889  12.881   6.501
  295    H    PHE  42           H        PHE  42   1.031  10.804   4.002
  296    HA   PHE  42           HA       PHE  42  -1.107  11.745   2.428
  297   1HB   PHE  42          1HB       PHE  42   0.694  10.173   1.760
  298   2HB   PHE  42          2HB       PHE  42  -0.010   8.943   2.795
  299    HD1  PHE  42           1HD      PHE  42  -2.058   7.738   2.158
  300    HD2  PHE  42           2HD      PHE  42  -0.183  10.643  -0.433
  301    HE1  PHE  42           1HE      PHE  42  -3.270   6.803   0.222
  302    HE2  PHE  42           2HE      PHE  42  -1.365   9.663  -2.373
  303    HZ   PHE  42           HZ       PHE  42  -2.889   7.763  -2.067
  304    H    ALA  43           H        ALA  43  -1.124   9.269   5.072
  305    HA   ALA  43           HA       ALA  43  -3.856   8.641   4.921
  306   1HB   ALA  43          1HB       ALA  43  -2.217   7.279   6.166
  307   2HB   ALA  43          2HB       ALA  43  -2.034   8.579   7.361
  308   3HB   ALA  43          3HB       ALA  43  -3.588   7.746   7.185
  309    H    GLU  44           H        GLU  44  -2.173  11.032   7.033
  310    HA   GLU  44           HA       GLU  44  -4.464  12.095   8.296
  311   1HB   GLU  44          1HB       GLU  44  -1.886  13.480   7.459
  312   2HB   GLU  44          2HB       GLU  44  -3.137  14.248   8.437
  313   1HG   GLU  44          1HG       GLU  44  -2.894  12.504  10.169
  314   2HG   GLU  44          2HG       GLU  44  -1.606  11.738   9.237
  315    H    ALA  45           H        ALA  45  -2.983  13.044   5.204
  316    HA   ALA  45           HA       ALA  45  -4.832  15.126   4.576
  317   1HB   ALA  45          1HB       ALA  45  -3.083  13.445   2.723
  318   2HB   ALA  45          2HB       ALA  45  -3.797  15.025   2.339
  319   3HB   ALA  45          3HB       ALA  45  -2.556  14.896   3.603
  320    H    HIS  46           H        HIS  46  -5.421  11.750   4.516
  321    HA   HIS  46           HA       HIS  46  -7.644  12.028   2.513
  322   1HB   HIS  46          1HB       HIS  46  -5.640   9.877   2.680
  323   2HB   HIS  46          2HB       HIS  46  -6.993   9.902   1.559
  324    HD1  HIS  46           1HD      HIS  46  -6.103  13.251   1.076
  325    HD2  HIS  46           2HD      HIS  46  -4.212   9.559   0.344
  326    HE1  HIS  46           1HE      HIS  46  -4.656  13.539  -1.096
  327    HE2  HIS  46           2HE      HIS  46  -3.574  11.284  -1.531
  328    H    ALA  47           H        ALA  47  -7.040  11.298   5.595
  329    HA   ALA  47           HA       ALA  47  -7.257   9.125   6.551
  330   1HB   ALA  47          1HB       ALA  47  -9.285  11.178   7.477
  331   2HB   ALA  47          2HB       ALA  47  -8.640   9.827   8.441
  332   3HB   ALA  47          3HB       ALA  47  -7.555  11.119   7.889
  333    H    ASP  48           H        ASP  48 -10.491  10.192   5.353
  334    HA   ASP  48           HA       ASP  48 -11.199   7.301   5.265
  335   1HB   ASP  48          1HB       ASP  48 -12.615   9.431   6.787
  336   2HB   ASP  48          2HB       ASP  48 -13.592   8.188   6.002
  337    H    LYS  49           H        LYS  49 -10.542   9.563   3.110
  338    HA   LYS  49           HA       LYS  49 -12.733   8.766   1.291
  339   1HB   LYS  49          1HB       LYS  49 -11.480  10.845   0.822
  340   2HB   LYS  49          2HB       LYS  49  -9.976   9.929   0.665
  341   1HG   LYS  49          1HG       LYS  49 -10.764   8.714  -1.242
  342   2HG   LYS  49          2HG       LYS  49 -12.426   9.263  -1.034
  343   1HD   LYS  49          1HD       LYS  49 -10.141  11.119  -1.796
  344   2HD   LYS  49          2HD       LYS  49 -11.087  10.185  -2.965
  345   1HE   LYS  49          1HE       LYS  49 -13.182  11.265  -2.036
  346   2HE   LYS  49          2HE       LYS  49 -12.121  12.347  -1.108
  347   1HZ   LYS  49          1HZ       LYS  49 -11.090  12.810  -3.432
  348   2HZ   LYS  49          2HZ       LYS  49 -12.384  12.156  -4.069
  349   3HZ   LYS  49          3HZ       LYS  49 -12.590  13.476  -3.123
  350    H    VAL  50           H        VAL  50  -9.762   7.520   2.664
  351    HA   VAL  50           HA       VAL  50  -9.880   5.093   0.961
  352    HB   VAL  50           HB       VAL  50  -7.470   5.044   0.874
  353   1HG1  VAL  50          1HG1      VAL  50  -8.287   7.874   0.101
  354   2HG1  VAL  50          2HG1      VAL  50  -6.990   6.884  -0.592
  355   3HG1  VAL  50          3HG1      VAL  50  -8.683   6.429  -0.844
  356   1HG2  VAL  50          1HG2      VAL  50  -6.045   6.890   1.729
  357   2HG2  VAL  50          2HG2      VAL  50  -7.461   7.623   2.507
  358   3HG2  VAL  50          3HG2      VAL  50  -6.866   6.042   3.041
  359    H    THR  51           H        THR  51  -8.540   3.237   2.063
  360    HA   THR  51           HA       THR  51  -8.032   3.830   4.821
  361    HB   THR  51           HB       THR  51 -10.315   2.732   4.674
  362    HG1  THR  51           1HG      THR  51  -8.627   1.390   6.415
  363   1HG2  THR  51          1HG2      THR  51  -9.721   0.843   3.208
  364   2HG2  THR  51          2HG2      THR  51  -8.665   0.191   4.483
  365   3HG2  THR  51          3HG2      THR  51 -10.418   0.329   4.760
  366    H    VAL  52           H        VAL  52  -5.937   3.593   5.058
  367    HA   VAL  52           HA       VAL  52  -4.526   1.734   3.263
  368    HB   VAL  52           HB       VAL  52  -3.707   3.894   3.168
  369   1HG1  VAL  52          1HG1      VAL  52  -4.454   4.921   5.257
  370   2HG1  VAL  52          2HG1      VAL  52  -3.267   3.956   6.164
  371   3HG1  VAL  52          3HG1      VAL  52  -2.730   5.194   5.018
  372   1HG2  VAL  52          1HG2      VAL  52  -1.369   3.749   3.623
  373   2HG2  VAL  52          2HG2      VAL  52  -1.621   2.444   4.792
  374   3HG2  VAL  52          3HG2      VAL  52  -1.958   2.184   3.064
  375    H    ALA  53           H        ALA  53  -2.808   0.372   4.140
  376    HA   ALA  53           HA       ALA  53  -2.874  -0.104   6.981
  377   1HB   ALA  53          1HB       ALA  53  -3.498  -2.388   5.040
  378   2HB   ALA  53          2HB       ALA  53  -3.370  -2.495   6.816
  379   3HB   ALA  53          3HB       ALA  53  -4.713  -1.612   6.077
  380    H    LYS  54           H        LYS  54  -1.161  -1.979   7.437
  381    HA   LYS  54           HA       LYS  54   1.091  -1.647   5.562
  382   1HB   LYS  54          1HB       LYS  54   1.033   0.219   7.186
  383   2HB   LYS  54          2HB       LYS  54   1.012  -0.916   8.543
  384   1HG   LYS  54          1HG       LYS  54   3.266  -1.606   8.118
  385   2HG   LYS  54          2HG       LYS  54   3.270  -0.848   6.528
  386   1HD   LYS  54          1HD       LYS  54   2.838   1.389   7.850
  387   2HD   LYS  54          2HD       LYS  54   3.393   0.479   9.254
  388   1HE   LYS  54          1HE       LYS  54   4.896   1.127   6.679
  389   2HE   LYS  54          2HE       LYS  54   5.226   1.760   8.299
  390   1HZ   LYS  54          1HZ       LYS  54   6.773   0.053   7.734
  391   2HZ   LYS  54          2HZ       LYS  54   5.800  -0.550   8.929
  392   3HZ   LYS  54          3HZ       LYS  54   5.592  -1.001   7.354
  393    H    LEU  55           H        LEU  55   2.279  -3.432   5.307
  394    HA   LEU  55           HA       LEU  55   2.328  -5.424   7.478
  395   1HB   LEU  55          1HB       LEU  55   1.631  -7.288   5.967
  396   2HB   LEU  55          2HB       LEU  55   0.407  -6.185   6.560
  397    HG   LEU  55           HG       LEU  55   0.213  -5.107   4.384
  398   1HD1  LEU  55          1HD1      LEU  55   2.298  -7.135   3.469
  399   2HD1  LEU  55          2HD1      LEU  55   1.259  -6.199   2.380
  400   3HD1  LEU  55          3HD1      LEU  55   2.409  -5.353   3.399
  401   1HD2  LEU  55          1HD2      LEU  55  -0.769  -7.039   3.167
  402   2HD2  LEU  55          2HD2      LEU  55   0.049  -8.146   4.281
  403   3HD2  LEU  55          3HD2      LEU  55  -1.204  -7.061   4.878
  404    H    ASN  56           H        ASN  56   3.749  -7.118   7.309
  405    HA   ASN  56           HA       ASN  56   6.314  -6.357   6.101
  406   1HB   ASN  56          1HB       ASN  56   6.367  -6.885   8.434
  407   2HB   ASN  56          2HB       ASN  56   5.368  -8.320   8.218
  408   1HD2  ASN  56          1HD2      ASN  56   6.663  -9.946   8.908
  409   2HD2  ASN  56          2HD2      ASN  56   8.211 -10.399   8.212
  410    H    VAL  57           H        VAL  57   6.755  -7.117   4.102
  411    HA   VAL  57           HA       VAL  57   5.121  -8.931   2.759
  412    HB   VAL  57           HB       VAL  57   6.599  -7.039   1.982
  413   1HG1  VAL  57          1HG1      VAL  57   8.655  -9.256   1.548
  414   2HG1  VAL  57          2HG1      VAL  57   8.817  -7.549   1.126
  415   3HG1  VAL  57          3HG1      VAL  57   8.759  -8.049   2.835
  416   1HG2  VAL  57          1HG2      VAL  57   6.585  -7.687  -0.248
  417   2HG2  VAL  57          2HG2      VAL  57   6.704  -9.415   0.149
  418   3HG2  VAL  57          3HG2      VAL  57   5.219  -8.519   0.508
  419    H    ASP  58           H        ASP  58   7.890  -9.585   4.723
  420    HA   ASP  58           HA       ASP  58   8.574 -12.235   3.772
  421   1HB   ASP  58          1HB       ASP  58  10.283 -11.435   4.996
  422   2HB   ASP  58          2HB       ASP  58   9.308 -10.346   5.923
  423    H    GLU  59           H        GLU  59   6.674 -10.986   6.436
  424    HA   GLU  59           HA       GLU  59   5.580 -13.467   7.390
  425   1HB   GLU  59          1HB       GLU  59   5.644 -11.566   8.801
  426   2HB   GLU  59          2HB       GLU  59   4.731 -10.591   7.644
  427   1HG   GLU  59          1HG       GLU  59   2.714 -11.980   8.086
  428   2HG   GLU  59          2HG       GLU  59   3.641 -12.895   9.289
  429    H    ASN  60           H        ASN  60   4.507 -11.229   4.870
  430    HA   ASN  60           HA       ASN  60   2.060 -12.866   4.438
  431   1HB   ASN  60          1HB       ASN  60   1.450 -10.662   4.958
  432   2HB   ASN  60          2HB       ASN  60   2.699  -9.966   3.940
  433   1HD2  ASN  60          1HD2      ASN  60   0.298 -12.605   2.950
  434   2HD2  ASN  60          2HD2      ASN  60  -0.110 -11.671   1.530
  435    HA   PRO  61           HA       PRO  61   4.223 -13.901   0.561
  436   1HB   PRO  61          1HB       PRO  61   3.720 -16.582   0.512
  437   2HB   PRO  61          2HB       PRO  61   5.074 -15.861   1.437
  438   1HG   PRO  61          1HG       PRO  61   2.324 -16.649   2.467
  439   2HG   PRO  61          2HG       PRO  61   3.928 -17.059   3.163
  440   1HD   PRO  61          1HD       PRO  61   2.457 -14.968   4.089
  441   2HD   PRO  61          2HD       PRO  61   4.230 -14.866   3.990
  442    H    GLU  62           H        GLU  62   0.837 -14.523   1.772
  443    HA   GLU  62           HA       GLU  62  -0.023 -15.422  -0.843
  444   1HB   GLU  62          1HB       GLU  62  -1.125 -15.768   1.559
  445   2HB   GLU  62          2HB       GLU  62  -1.986 -14.289   1.136
  446   1HG   GLU  62          1HG       GLU  62  -1.968 -16.971  -0.309
  447   2HG   GLU  62          2HG       GLU  62  -3.341 -16.182   0.467
  448    H    THR  63           H        THR  63  -1.054 -14.283  -2.419
  449    HA   THR  63           HA       THR  63  -1.412 -12.718  -3.898
  450    HB   THR  63           HB       THR  63  -2.234 -11.126  -1.497
  451    HG1  THR  63           1HG      THR  63  -3.471 -13.107  -2.098
  452   1HG2  THR  63          1HG2      THR  63  -3.489  -9.704  -3.080
  453   2HG2  THR  63          2HG2      THR  63  -1.749  -9.538  -3.354
  454   3HG2  THR  63          3HG2      THR  63  -2.727 -10.535  -4.452
  455    H    THR  64           H        THR  64   0.900 -11.954  -1.517
  456    HA   THR  64           HA       THR  64   2.525 -10.046  -2.831
  457    HB   THR  64           HB       THR  64   3.265 -12.325  -0.957
  458    HG1  THR  64           1HG      THR  64   2.825 -10.985   0.632
  459   1HG2  THR  64          1HG2      THR  64   5.128 -11.023  -0.224
  460   2HG2  THR  64          2HG2      THR  64   5.284 -11.273  -1.967
  461   3HG2  THR  64          3HG2      THR  64   4.709  -9.710  -1.349
  462    H    SER  65           H        SER  65   3.257 -13.598  -2.506
  463    HA   SER  65           HA       SER  65   5.179 -13.495  -4.637
  464   1HB   SER  65          1HB       SER  65   5.073 -15.184  -2.731
  465   2HB   SER  65          2HB       SER  65   3.744 -15.975  -3.604
  466    HG   SER  65           HG       SER  65   5.287 -16.038  -5.432
  467    H    GLN  66           H        GLN  66   1.743 -14.044  -4.498
  468    HA   GLN  66           HA       GLN  66   1.184 -15.206  -7.004
  469   1HB   GLN  66          1HB       GLN  66  -0.238 -14.587  -4.802
  470   2HB   GLN  66          2HB       GLN  66  -0.573 -13.134  -5.747
  471   1HG   GLN  66          1HG       GLN  66  -1.368 -14.749  -7.597
  472   2HG   GLN  66          2HG       GLN  66  -1.352 -15.994  -6.338
  473   1HE2  GLN  66          1HE2      GLN  66  -2.641 -15.167  -4.051
  474   2HE2  GLN  66          2HE2      GLN  66  -4.011 -14.187  -4.470
  475    H    PHE  67           H        PHE  67   2.147 -11.842  -6.172
  476    HA   PHE  67           HA       PHE  67   1.824 -11.090  -9.037
  477   1HB   PHE  67          1HB       PHE  67   1.272  -9.548  -6.494
  478   2HB   PHE  67          2HB       PHE  67   1.719  -8.710  -7.965
  479    HD1  PHE  67           1HD      PHE  67  -0.835 -11.099  -6.600
  480    HD2  PHE  67           2HD      PHE  67   0.136  -8.208  -9.644
  481    HE1  PHE  67           1HE      PHE  67  -3.163 -11.196  -7.423
  482    HE2  PHE  67           2HE      PHE  67  -2.209  -8.275 -10.443
  483    HZ   PHE  67           HZ       PHE  67  -3.861  -9.781  -9.346
  484    H    GLY  68           H        GLY  68   4.141 -12.315  -7.253
  485   1HA   GLY  68          1HA       GLY  68   6.429 -12.180  -7.305
  486   2HA   GLY  68          2HA       GLY  68   6.259 -11.063  -8.665
  487    H    ILE  69           H        ILE  69   4.856 -10.295  -5.523
  488    HA   ILE  69           HA       ILE  69   6.066  -7.714  -5.536
  489    HB   ILE  69           HB       ILE  69   4.457  -9.226  -3.487
  490   1HG1  ILE  69          1HG1      ILE  69   3.298  -8.767  -5.644
  491   2HG1  ILE  69          2HG1      ILE  69   2.525  -8.055  -4.241
  492   1HG2  ILE  69          1HG2      ILE  69   5.581  -7.519  -2.223
  493   2HG2  ILE  69          2HG2      ILE  69   5.179  -6.276  -3.416
  494   3HG2  ILE  69          3HG2      ILE  69   3.913  -7.058  -2.442
  495   1HD1  ILE  69          1HD1      ILE  69   3.326  -5.861  -4.797
  496   2HD1  ILE  69          2HD1      ILE  69   4.356  -6.481  -6.107
  497   3HD1  ILE  69          3HD1      ILE  69   2.588  -6.556  -6.244
  498    H    MET  70           H        MET  70   8.286  -8.083  -5.584
  499    HA   MET  70           HA       MET  70   9.471  -8.386  -2.847
  500   1HB   MET  70          1HB       MET  70  10.636  -8.984  -5.599
  501   2HB   MET  70          2HB       MET  70  11.563  -9.000  -4.099
  502   1HG   MET  70          1HG       MET  70   9.158 -10.776  -4.662
  503   2HG   MET  70          2HG       MET  70  10.841 -11.259  -4.845
  504   1HE   MET  70          1HE       MET  70  10.057 -13.397  -3.365
  505   2HE   MET  70          2HE       MET  70   9.410 -13.246  -1.713
  506   3HE   MET  70          3HE       MET  70   8.451 -12.672  -3.097
  507    H    SER  71           H        SER  71   8.812  -6.127  -5.339
  508    HA   SER  71           HA       SER  71  11.252  -4.558  -5.093
  509   1HB   SER  71          1HB       SER  71  10.116  -4.834  -7.252
  510   2HB   SER  71          2HB       SER  71   8.655  -4.064  -6.598
  511    HG   SER  71           HG       SER  71   9.958  -2.235  -6.157
  512    H    ILE  72           H        ILE  72  10.426  -4.697  -2.589
  513    HA   ILE  72           HA       ILE  72   8.519  -2.791  -1.824
  514    HB   ILE  72           HB       ILE  72   9.271  -3.222   0.477
  515   1HG1  ILE  72          1HG1      ILE  72  11.437  -4.922  -0.848
  516   2HG1  ILE  72          2HG1      ILE  72  11.665  -3.484   0.158
  517   1HG2  ILE  72          1HG2      ILE  72   7.637  -4.636  -0.878
  518   2HG2  ILE  72          2HG2      ILE  72   8.957  -5.804  -1.094
  519   3HG2  ILE  72          3HG2      ILE  72   8.357  -5.400   0.534
  520   1HD1  ILE  72          1HD1      ILE  72  10.485  -4.741   2.022
  521   2HD1  ILE  72          2HD1      ILE  72  10.626  -6.196   1.003
  522   3HD1  ILE  72          3HD1      ILE  72  12.088  -5.363   1.548
  523    HA   PRO  73           HA       PRO  73   8.184  -1.324   0.223
  524   1HB   PRO  73          1HB       PRO  73   7.273   1.261   0.032
  525   2HB   PRO  73          2HB       PRO  73   8.390   0.678   1.279
  526   1HG   PRO  73          1HG       PRO  73   9.070   2.086  -1.308
  527   2HG   PRO  73          2HG       PRO  73   9.724   2.421   0.326
  528   1HD   PRO  73          1HD       PRO  73  11.105   0.919  -1.469
  529   2HD   PRO  73          2HD       PRO  73  11.077   0.473   0.266
  530    H    THR  74           H        THR  74   6.339  -2.024  -0.766
  531    HA   THR  74           HA       THR  74   5.694  -0.995  -3.505
  532    HB   THR  74           HB       THR  74   5.039  -3.759  -2.417
  533    HG1  THR  74           1HG      THR  74   7.256  -2.813  -3.831
  534   1HG2  THR  74          1HG2      THR  74   4.594  -2.436  -5.087
  535   2HG2  THR  74          2HG2      THR  74   4.712  -4.182  -4.914
  536   3HG2  THR  74          3HG2      THR  74   3.434  -3.288  -4.057
  537    H    LEU  75           H        LEU  75   3.580  -0.370  -3.905
  538    HA   LEU  75           HA       LEU  75   1.768  -0.146  -1.570
  539   1HB   LEU  75          1HB       LEU  75   3.188   1.853  -1.765
  540   2HB   LEU  75          2HB       LEU  75   2.645   2.104  -3.363
  541    HG   LEU  75           HG       LEU  75   0.403   1.691  -1.417
  542   1HD1  LEU  75          1HD1      LEU  75   2.151   4.154  -1.266
  543   2HD1  LEU  75          2HD1      LEU  75   0.594   3.928  -0.435
  544   3HD1  LEU  75          3HD1      LEU  75   1.981   2.916  -0.003
  545   1HD2  LEU  75          1HD2      LEU  75   1.089   3.638  -3.651
  546   2HD2  LEU  75          2HD2      LEU  75  -0.127   2.337  -3.651
  547   3HD2  LEU  75          3HD2      LEU  75  -0.352   3.790  -2.647
  548    H    ILE  76           H        ILE  76   0.054  -1.373  -2.218
  549    HA   ILE  76           HA       ILE  76  -0.768  -1.166  -5.080
  550    HB   ILE  76           HB       ILE  76  -1.503  -3.418  -3.234
  551   1HG1  ILE  76          1HG1      ILE  76   0.777  -3.338  -5.266
  552   2HG1  ILE  76          2HG1      ILE  76   0.899  -3.617  -3.523
  553   1HG2  ILE  76          1HG2      ILE  76  -3.042  -2.959  -5.146
  554   2HG2  ILE  76          2HG2      ILE  76  -1.678  -3.073  -6.277
  555   3HG2  ILE  76          3HG2      ILE  76  -2.241  -4.490  -5.372
  556   1HD1  ILE  76          1HD1      ILE  76  -0.545  -5.716  -3.886
  557   2HD1  ILE  76          2HD1      ILE  76  -0.217  -5.502  -5.625
  558   3HD1  ILE  76          3HD1      ILE  76   1.111  -5.758  -4.492
  559    H    LEU  77           H        LEU  77  -2.636  -0.395  -5.442
  560    HA   LEU  77           HA       LEU  77  -4.525   0.395  -3.290
  561   1HB   LEU  77          1HB       LEU  77  -3.585   2.053  -4.957
  562   2HB   LEU  77          2HB       LEU  77  -4.383   1.140  -6.226
  563    HG   LEU  77           HG       LEU  77  -5.434   3.082  -4.216
  564   1HD1  LEU  77          1HD1      LEU  77  -6.921   3.582  -6.220
  565   2HD1  LEU  77          2HD1      LEU  77  -5.179   3.807  -6.458
  566   3HD1  LEU  77          3HD1      LEU  77  -6.002   2.396  -7.126
  567   1HD2  LEU  77          1HD2      LEU  77  -7.258   0.835  -5.126
  568   2HD2  LEU  77          2HD2      LEU  77  -6.790   1.241  -3.464
  569   3HD2  LEU  77          3HD2      LEU  77  -7.769   2.363  -4.404
  570    H    PHE  78           H        PHE  78  -5.895  -1.146  -3.002
  571    HA   PHE  78           HA       PHE  78  -6.835  -2.899  -5.223
  572   1HB   PHE  78          1HB       PHE  78  -6.834  -3.397  -2.233
  573   2HB   PHE  78          2HB       PHE  78  -7.765  -4.347  -3.365
  574    HD1  PHE  78           1HD      PHE  78  -6.785  -6.039  -4.778
  575    HD2  PHE  78           2HD      PHE  78  -4.317  -3.562  -2.241
  576    HE1  PHE  78           1HE      PHE  78  -4.924  -7.656  -5.011
  577    HE2  PHE  78           2HE      PHE  78  -2.478  -5.203  -2.460
  578    HZ   PHE  78           HZ       PHE  78  -2.767  -7.246  -3.854
  579    H    LYS  79           H        LYS  79  -9.107  -3.185  -5.384
  580    HA   LYS  79           HA       LYS  79 -10.774  -2.049  -3.293
  581   1HB   LYS  79          1HB       LYS  79 -11.727  -0.318  -4.359
  582   2HB   LYS  79          2HB       LYS  79 -10.254  -0.284  -5.237
  583   1HG   LYS  79          1HG       LYS  79 -11.864   0.042  -6.842
  584   2HG   LYS  79          2HG       LYS  79 -11.349  -1.613  -7.108
  585   1HD   LYS  79          1HD       LYS  79 -13.853  -1.054  -7.277
  586   2HD   LYS  79          2HD       LYS  79 -13.455  -2.472  -6.308
  587   1HE   LYS  79          1HE       LYS  79 -13.720  -1.286  -4.247
  588   2HE   LYS  79          2HE       LYS  79 -13.771   0.276  -5.048
  589   1HZ   LYS  79          1HZ       LYS  79 -15.932  -0.424  -6.041
  590   2HZ   LYS  79          2HZ       LYS  79 -15.841  -1.850  -5.179
  591   3HZ   LYS  79          3HZ       LYS  79 -15.960  -0.467  -4.375
  592    H    GLY  80           H        GLY  80 -12.304  -3.604  -2.854
  593   1HA   GLY  80          1HA       GLY  80 -13.682  -5.409  -3.125
  594   2HA   GLY  80          2HA       GLY  80 -13.885  -4.902  -4.802
  595    H    GLY  81           H        GLY  81 -10.739  -5.865  -3.437
  596   1HA   GLY  81          1HA       GLY  81  -9.500  -7.784  -3.699
  597   2HA   GLY  81          2HA       GLY  81 -10.749  -8.496  -4.722
  598    H    GLU  82           H        GLU  82 -10.443  -5.588  -6.229
  599    HA   GLU  82           HA       GLU  82  -8.618  -6.744  -8.212
  600   1HB   GLU  82          1HB       GLU  82 -10.811  -5.907  -8.903
  601   2HB   GLU  82          2HB       GLU  82 -10.404  -4.284  -8.324
  602   1HG   GLU  82          1HG       GLU  82  -8.556  -4.135  -9.954
  603   2HG   GLU  82          2HG       GLU  82  -8.846  -5.801 -10.467
  604    HA   PRO  83           HA       PRO  83  -5.462  -3.767  -6.663
  605   1HB   PRO  83          1HB       PRO  83  -3.322  -4.679  -8.072
  606   2HB   PRO  83          2HB       PRO  83  -3.956  -5.516  -6.632
  607   1HG   PRO  83          1HG       PRO  83  -4.486  -6.174  -9.536
  608   2HG   PRO  83          2HG       PRO  83  -4.069  -7.285  -8.192
  609   1HD   PRO  83          1HD       PRO  83  -6.643  -6.844  -9.061
  610   2HD   PRO  83          2HD       PRO  83  -6.250  -7.253  -7.364
  611    H    VAL  84           H        VAL  84  -6.700  -2.058  -7.701
  612    HA   VAL  84           HA       VAL  84  -6.786  -1.680 -10.516
  613    HB   VAL  84           HB       VAL  84  -7.378   0.741  -9.668
  614   1HG1  VAL  84          1HG1      VAL  84  -9.191  -1.647  -9.122
  615   2HG1  VAL  84          2HG1      VAL  84  -9.725   0.038  -9.326
  616   3HG1  VAL  84          3HG1      VAL  84  -8.989  -0.833 -10.681
  617   1HG2  VAL  84          1HG2      VAL  84  -8.014  -0.759  -7.112
  618   2HG2  VAL  84          2HG2      VAL  84  -6.632   0.332  -7.313
  619   3HG2  VAL  84          3HG2      VAL  84  -8.284   0.952  -7.483
  620    H    LYS  85           H        LYS  85  -4.493  -0.470  -8.037
  621    HA   LYS  85           HA       LYS  85  -2.676   0.151 -10.260
  622   1HB   LYS  85          1HB       LYS  85  -3.416   2.330  -8.245
  623   2HB   LYS  85          2HB       LYS  85  -1.951   2.348  -9.218
  624   1HG   LYS  85          1HG       LYS  85  -3.257   2.263 -11.294
  625   2HG   LYS  85          2HG       LYS  85  -4.765   2.287 -10.374
  626   1HD   LYS  85          1HD       LYS  85  -2.697   4.506 -10.160
  627   2HD   LYS  85          2HD       LYS  85  -3.943   4.497 -11.405
  628   1HE   LYS  85          1HE       LYS  85  -4.506   4.400  -8.415
  629   2HE   LYS  85          2HE       LYS  85  -4.524   5.859  -9.415
  630   1HZ   LYS  85          1HZ       LYS  85  -6.267   4.812 -10.794
  631   2HZ   LYS  85          2HZ       LYS  85  -6.338   3.536  -9.763
  632   3HZ   LYS  85          3HZ       LYS  85  -6.787   5.069  -9.302
  633    H    GLN  86           H        GLN  86  -0.427   0.311  -9.611
  634    HA   GLN  86           HA       GLN  86   0.267  -0.607  -6.906
  635   1HB   GLN  86          1HB       GLN  86   0.126  -2.677  -8.027
  636   2HB   GLN  86          2HB       GLN  86   0.799  -2.053  -9.523
  637   1HG   GLN  86          1HG       GLN  86   2.661  -1.938  -7.170
  638   2HG   GLN  86          2HG       GLN  86   2.160  -3.538  -7.666
  639   1HE2  GLN  86          1HE2      GLN  86   2.921  -0.605  -9.810
  640   2HE2  GLN  86          2HE2      GLN  86   4.176  -1.531 -10.629
  641    H    LEU  87           H        LEU  87   2.069   0.390  -6.202
  642    HA   LEU  87           HA       LEU  87   3.836   1.912  -8.066
  643   1HB   LEU  87          1HB       LEU  87   2.727   2.482  -5.307
  644   2HB   LEU  87          2HB       LEU  87   4.200   3.239  -5.854
  645    HG   LEU  87           HG       LEU  87   2.424   4.776  -5.982
  646   1HD1  LEU  87          1HD1      LEU  87   2.810   3.946  -8.863
  647   2HD1  LEU  87          2HD1      LEU  87   2.702   5.579  -8.141
  648   3HD1  LEU  87          3HD1      LEU  87   4.137   4.595  -7.892
  649   1HD2  LEU  87          1HD2      LEU  87   0.829   2.994  -7.851
  650   2HD2  LEU  87          2HD2      LEU  87   0.501   3.177  -6.113
  651   3HD2  LEU  87          3HD2      LEU  87   0.386   4.574  -7.203
  652    H    ILE  88           H        ILE  88   6.091   1.701  -7.499
  653    HA   ILE  88           HA       ILE  88   6.824  -0.367  -5.529
  654    HB   ILE  88           HB       ILE  88   8.299  -1.277  -7.509
  655   1HG1  ILE  88          1HG1      ILE  88   5.917  -0.225  -9.104
  656   2HG1  ILE  88          2HG1      ILE  88   7.583   0.348  -9.226
  657   1HG2  ILE  88          1HG2      ILE  88   6.678  -2.537  -6.169
  658   2HG2  ILE  88          2HG2      ILE  88   5.361  -1.991  -7.237
  659   3HG2  ILE  88          3HG2      ILE  88   6.644  -3.054  -7.846
  660   1HD1  ILE  88          1HD1      ILE  88   8.253  -1.978  -9.946
  661   2HD1  ILE  88          2HD1      ILE  88   6.521  -2.399  -9.992
  662   3HD1  ILE  88          3HD1      ILE  88   7.145  -1.139 -11.059
  663    H    GLY  89           H        GLY  89   8.384   0.395  -4.347
  664   1HA   GLY  89          1HA       GLY  89  10.513   1.281  -3.904
  665   2HA   GLY  89          2HA       GLY  89  10.492   2.170  -5.441
  666    H    TYR  90           H        TYR  90  11.119   3.596  -3.232
  667    HA   TYR  90           HA       TYR  90   8.976   4.863  -1.867
  668   1HB   TYR  90          1HB       TYR  90  11.249   4.759  -1.015
  669   2HB   TYR  90          2HB       TYR  90  11.823   5.709  -2.378
  670    HD1  TYR  90           1HD      TYR  90  12.903   7.135  -0.639
  671    HD2  TYR  90           2HD      TYR  90   8.598   6.848  -0.960
  672    HE1  TYR  90           1HE      TYR  90  12.636   9.120   0.839
  673    HE2  TYR  90           2HE      TYR  90   8.353   8.765   0.516
  674    HH   TYR  90           HH       TYR  90   9.929   9.584   2.517
  675    H    GLN  91           H        GLN  91   7.409   5.531  -3.365
  676    HA   GLN  91           HA       GLN  91   8.039   7.499  -5.427
  677   1HB   GLN  91          1HB       GLN  91   5.290   7.156  -4.194
  678   2HB   GLN  91          2HB       GLN  91   5.709   7.683  -5.807
  679   1HG   GLN  91          1HG       GLN  91   5.834   4.870  -4.704
  680   2HG   GLN  91          2HG       GLN  91   4.715   5.538  -5.877
  681   1HE2  GLN  91          1HE2      GLN  91   7.484   3.704  -5.535
  682   2HE2  GLN  91          2HE2      GLN  91   8.015   3.716  -7.201
  683    HA   PRO  92           HA       PRO  92   7.872  10.865  -2.280
  684   1HB   PRO  92          1HB       PRO  92   7.956  13.026  -3.959
  685   2HB   PRO  92          2HB       PRO  92   9.406  12.056  -3.561
  686   1HG   PRO  92          1HG       PRO  92   7.620  11.830  -5.998
  687   2HG   PRO  92          2HG       PRO  92   9.410  11.914  -5.945
  688   1HD   PRO  92          1HD       PRO  92   8.068   9.540  -6.146
  689   2HD   PRO  92          2HD       PRO  92   9.584   9.677  -5.210
  690    H    LYS  93           H        LYS  93   6.240  12.779  -2.055
  691    HA   LYS  93           HA       LYS  93   3.615  11.650  -2.136
  692   1HB   LYS  93          1HB       LYS  93   4.820  13.860  -0.892
  693   2HB   LYS  93          2HB       LYS  93   3.816  14.637  -2.089
  694   1HG   LYS  93          1HG       LYS  93   2.369  14.486  -0.248
  695   2HG   LYS  93          2HG       LYS  93   1.873  13.161  -1.292
  696   1HD   LYS  93          1HD       LYS  93   1.982  11.963   0.638
  697   2HD   LYS  93          2HD       LYS  93   3.682  11.813   0.236
  698   1HE   LYS  93          1HE       LYS  93   2.377  13.820   2.129
  699   2HE   LYS  93          2HE       LYS  93   3.361  12.427   2.584
  700   1HZ   LYS  93          1HZ       LYS  93   4.477  14.566   2.724
  701   2HZ   LYS  93          2HZ       LYS  93   5.280  13.489   1.845
  702   3HZ   LYS  93          3HZ       LYS  93   4.447  14.725   1.076
  703    H    GLU  94           H        GLU  94   5.204  14.123  -3.957
  704    HA   GLU  94           HA       GLU  94   3.256  14.905  -5.764
  705   1HB   GLU  94          1HB       GLU  94   6.223  14.786  -6.426
  706   2HB   GLU  94          2HB       GLU  94   5.008  15.901  -7.045
  707   1HG   GLU  94          1HG       GLU  94   5.932  17.257  -5.489
  708   2HG   GLU  94          2HG       GLU  94   4.716  16.532  -4.459
  709    H    GLN  95           H        GLN  95   4.801  11.830  -5.778
  710    HA   GLN  95           HA       GLN  95   4.123  11.279  -8.624
  711   1HB   GLN  95          1HB       GLN  95   6.442  10.776  -7.773
  712   2HB   GLN  95          2HB       GLN  95   5.776   9.751  -6.559
  713   1HG   GLN  95          1HG       GLN  95   6.582   8.331  -8.244
  714   2HG   GLN  95          2HG       GLN  95   4.833   8.240  -8.320
  715   1HE2  GLN  95          1HE2      GLN  95   7.264   7.929 -10.320
  716   2HE2  GLN  95          2HE2      GLN  95   6.666   8.809 -11.722
  717    H    LEU  96           H        LEU  96   3.990   9.931  -5.359
  718    HA   LEU  96           HA       LEU  96   2.194   7.813  -5.738
  719   1HB   LEU  96          1HB       LEU  96   3.749   8.736  -3.745
  720   2HB   LEU  96          2HB       LEU  96   2.218   9.349  -3.194
  721    HG   LEU  96           HG       LEU  96   2.905   6.435  -3.799
  722   1HD1  LEU  96          1HD1      LEU  96   2.903   6.174  -1.348
  723   2HD1  LEU  96          2HD1      LEU  96   4.075   7.404  -1.830
  724   3HD1  LEU  96          3HD1      LEU  96   2.514   7.886  -1.142
  725   1HD2  LEU  96          1HD2      LEU  96   0.372   7.612  -2.582
  726   2HD2  LEU  96          2HD2      LEU  96   0.500   6.732  -4.121
  727   3HD2  LEU  96          3HD2      LEU  96   0.785   5.893  -2.587
  728    H    GLU  97           H        GLU  97   1.425  11.143  -4.528
  729    HA   GLU  97           HA       GLU  97  -1.409  10.696  -4.554
  730   1HB   GLU  97          1HB       GLU  97   0.369  12.675  -3.623
  731   2HB   GLU  97          2HB       GLU  97  -0.540  13.495  -4.886
  732   1HG   GLU  97          1HG       GLU  97  -1.221  12.625  -2.148
  733   2HG   GLU  97          2HG       GLU  97  -1.601  14.119  -2.988
  734    H    ALA  98           H        ALA  98   0.916  11.563  -7.080
  735    HA   ALA  98           HA       ALA  98  -1.140  12.746  -8.814
  736   1HB   ALA  98          1HB       ALA  98   1.155  13.506  -9.069
  737   2HB   ALA  98          2HB       ALA  98   1.712  11.855  -9.429
  738   3HB   ALA  98          3HB       ALA  98   0.623  12.694 -10.550
  739    H    GLN  99           H        GLN  99   0.601   9.634  -8.569
  740    HA   GLN  99           HA       GLN  99  -0.790   8.253 -10.682
  741   1HB   GLN  99          1HB       GLN  99   0.949   7.522  -8.327
  742   2HB   GLN  99          2HB       GLN  99  -0.205   6.310  -8.821
  743   1HG   GLN  99          1HG       GLN  99   1.560   5.684 -10.078
  744   2HG   GLN  99          2HG       GLN  99   0.701   6.671 -11.240
  745   1HE2  GLN  99          1HE2      GLN  99   1.526   9.292 -10.758
  746   2HE2  GLN  99          2HE2      GLN  99   3.295   9.365 -10.795
  747    H    LEU 100           H        LEU 100  -1.382   8.493  -7.120
  748    HA   LEU 100           HA       LEU 100  -3.782   6.919  -7.425
  749   1HB   LEU 100          1HB       LEU 100  -1.881   7.479  -5.348
  750   2HB   LEU 100          2HB       LEU 100  -3.432   7.999  -4.797
  751    HG   LEU 100           HG       LEU 100  -4.286   5.682  -5.626
  752   1HD1  LEU 100          1HD1      LEU 100  -2.265   5.162  -7.025
  753   2HD1  LEU 100          2HD1      LEU 100  -1.267   5.165  -5.556
  754   3HD1  LEU 100          3HD1      LEU 100  -2.521   3.933  -5.778
  755   1HD2  LEU 100          1HD2      LEU 100  -4.018   6.246  -3.259
  756   2HD2  LEU 100          2HD2      LEU 100  -3.588   4.579  -3.590
  757   3HD2  LEU 100          3HD2      LEU 100  -2.293   5.774  -3.325
  758    H    ALA 101           H        ALA 101  -3.272  10.250  -7.870
  759    HA   ALA 101           HA       ALA 101  -5.595  11.471  -7.018
  760   1HB   ALA 101          1HB       ALA 101  -4.346  11.639  -9.796
  761   2HB   ALA 101          2HB       ALA 101  -5.502  12.793  -9.103
  762   3HB   ALA 101          3HB       ALA 101  -3.897  12.619  -8.380
  763    H    ASP 102           H        ASP 102  -5.250   8.999  -9.488
  764    HA   ASP 102           HA       ASP 102  -7.994   9.030 -10.440
  765   1HB   ASP 102          1HB       ASP 102  -6.047   8.485 -11.868
  766   2HB   ASP 102          2HB       ASP 102  -5.598   7.170 -10.795
  767    H    VAL 103           H        VAL 103  -7.448   8.688  -7.630
  768    HA   VAL 103           HA       VAL 103  -9.798   7.136  -7.264
  769    HB   VAL 103           HB       VAL 103  -7.745   5.470  -6.888
  770   1HG1  VAL 103          1HG1      VAL 103  -8.087   6.567  -4.075
  771   2HG1  VAL 103          2HG1      VAL 103  -7.238   5.089  -4.521
  772   3HG1  VAL 103          3HG1      VAL 103  -6.621   6.641  -5.088
  773   1HG2  VAL 103          1HG2      VAL 103 -10.226   5.486  -5.148
  774   2HG2  VAL 103          2HG2      VAL 103 -10.148   4.944  -6.838
  775   3HG2  VAL 103          3HG2      VAL 103  -9.247   4.066  -5.604
  776    H    LEU 104           H        LEU 104  -7.327   9.320  -5.995
  777    HA   LEU 104           HA       LEU 104  -8.902  10.146  -3.726
  778   1HB   LEU 104          1HB       LEU 104  -6.398  11.059  -5.169
  779   2HB   LEU 104          2HB       LEU 104  -7.154  12.117  -4.054
  780    HG   LEU 104           HG       LEU 104  -5.647  11.180  -2.690
  781   1HD1  LEU 104          1HD1      LEU 104  -7.763  10.579  -1.633
  782   2HD1  LEU 104          2HD1      LEU 104  -7.663   8.953  -2.408
  783   3HD1  LEU 104          3HD1      LEU 104  -6.441   9.454  -1.230
  784   1HD2  LEU 104          1HD2      LEU 104  -4.680   9.689  -4.342
  785   2HD2  LEU 104          2HD2      LEU 104  -4.744   8.925  -2.755
  786   3HD2  LEU 104          3HD2      LEU 104  -5.928   8.456  -3.998
  787    H    GLN 105           H        GLN 105  -9.095  10.690  -7.052
  788    HA   GLN 105           HA       GLN 105 -10.618  13.134  -7.070
  789   1HB   GLN 105          2HB       GLN 105  -9.406  12.180  -9.036
  790   2HB   GLN 105          3HB       GLN 105 -10.511  10.840  -9.035
  791   1HG   GLN 105          2HG       GLN 105 -12.053  13.318  -9.038
  792   2HG   GLN 105          3HG       GLN 105 -10.783  13.460 -10.233
  793   1HE2  GLN 105          1HE2      GLN 105 -12.924  10.774  -9.124
  794   2HE2  GLN 105          2HE2      GLN 105 -13.495  10.359 -10.765
  Start of MODEL   17
    1   1H    ALA   1           H        ALA   1  -9.148   5.941   9.138
    2   2H    ALA   1          2HN       ALA   1 -10.553   6.189   9.942
    3   3H    ALA   1          3HN       ALA   1  -9.106   6.091  10.770
    4    HA   ALA   1           HA       ALA   1 -10.274   4.081  11.118
    5   1HB   ALA   1          1HB       ALA   1 -11.735   4.226   9.140
    6   2HB   ALA   1          2HB       ALA   1 -10.343   3.951   8.067
    7   3HB   ALA   1          3HB       ALA   1 -10.909   2.668   9.164
    8    H    THR   2           H        THR   2  -9.329   1.764  10.231
    9    HA   THR   2           HA       THR   2  -7.642   0.364   9.952
   10    HB   THR   2           HB       THR   2  -8.389   1.138   7.769
   11    HG1  THR   2           1HG      THR   2  -6.114   0.512   6.797
   12   1HG2  THR   2          1HG2      THR   2  -6.906   2.503   6.335
   13   2HG2  THR   2          2HG2      THR   2  -7.637   3.437   7.603
   14   3HG2  THR   2          3HG2      THR   2  -5.933   2.937   7.753
   15    H    MET   3           H        MET   3  -5.167   0.578   8.863
   16    HA   MET   3           HA       MET   3  -3.038   1.710   9.159
   17   1HB   MET   3          1HB       MET   3  -3.566   2.660  11.457
   18   2HB   MET   3          2HB       MET   3  -3.154   1.059  12.102
   19   1HG   MET   3          1HG       MET   3  -0.914   1.327  10.870
   20   2HG   MET   3          2HG       MET   3  -1.454   2.930  10.382
   21   1HE   MET   3          1HE       MET   3   0.585   4.175  11.248
   22   2HE   MET   3          2HE       MET   3   1.327   3.912  12.839
   23   3HE   MET   3          3HE       MET   3   1.321   2.602  11.636
   24    H    THR   4           H        THR   4  -1.807  -0.350  11.259
   25    HA   THR   4           HA       THR   4  -0.757  -1.946   9.367
   26    HB   THR   4           HB       THR   4  -1.081  -2.791  12.241
   27    HG1  THR   4           1HG      THR   4   0.654  -1.385  12.631
   28   1HG2  THR   4          1HG2      THR   4   1.234  -3.068  10.264
   29   2HG2  THR   4          2HG2      THR   4   1.258  -3.588  11.963
   30   3HG2  THR   4          3HG2      THR   4   0.177  -4.385  10.815
   31    H    LEU   5           H        LEU   5  -1.052  -3.890   8.449
   32    HA   LEU   5           HA       LEU   5  -3.723  -5.148   8.587
   33   1HB   LEU   5          1HB       LEU   5  -1.932  -4.430   6.550
   34   2HB   LEU   5          2HB       LEU   5  -1.667  -6.155   6.710
   35    HG   LEU   5           HG       LEU   5  -3.656  -6.744   5.856
   36   1HD1  LEU   5          1HD1      LEU   5  -5.294  -5.843   7.171
   37   2HD1  LEU   5          2HD1      LEU   5  -4.911  -4.174   6.800
   38   3HD1  LEU   5          3HD1      LEU   5  -5.669  -5.212   5.578
   39   1HD2  LEU   5          1HD2      LEU   5  -4.150  -5.013   3.917
   40   2HD2  LEU   5          2HD2      LEU   5  -2.680  -4.239   4.514
   41   3HD2  LEU   5          3HD2      LEU   5  -2.638  -5.910   3.982
   42    H    THR   6           H        THR   6  -3.605  -7.622   8.027
   43    HA   THR   6           HA       THR   6  -1.476  -9.069   9.206
   44    HB   THR   6           HB       THR   6  -3.046 -10.739  10.141
   45    HG1  THR   6           1HG      THR   6  -5.202 -10.175  10.442
   46   1HG2  THR   6          1HG2      THR   6  -2.091  -9.021  11.671
   47   2HG2  THR   6          2HG2      THR   6  -3.544  -8.028  11.439
   48   3HG2  THR   6          3HG2      THR   6  -3.668  -9.627  12.204
   49    H    ASP   7           H        ASP   7  -2.267 -11.394   8.366
   50    HA   ASP   7           HA       ASP   7  -2.333 -11.366   5.456
   51   1HB   ASP   7          1HB       ASP   7  -2.333 -13.821   5.696
   52   2HB   ASP   7          2HB       ASP   7  -1.068 -13.116   6.695
   53    H    ALA   8           H        ALA   8  -4.517 -12.612   8.000
   54    HA   ALA   8           HA       ALA   8  -6.687 -13.158   6.313
   55   1HB   ALA   8          1HB       ALA   8  -6.773 -12.248   9.227
   56   2HB   ALA   8          2HB       ALA   8  -8.074 -13.094   8.361
   57   3HB   ALA   8          3HB       ALA   8  -6.529 -13.917   8.660
   58    H    ASN   9           H        ASN   9  -5.780 -10.084   7.817
   59    HA   ASN   9           HA       ASN   9  -8.289  -8.838   6.939
   60   1HB   ASN   9          1HB       ASN   9  -7.333  -8.402   9.176
   61   2HB   ASN   9          2HB       ASN   9  -6.004  -7.554   8.392
   62   1HD2  ASN   9          1HD2      ASN   9  -6.526  -5.366   9.122
   63   2HD2  ASN   9          2HD2      ASN   9  -8.066  -4.644   8.695
   64    H    PHE  10           H        PHE  10  -4.998  -9.148   5.692
   65    HA   PHE  10           HA       PHE  10  -5.104  -7.004   3.801
   66   1HB   PHE  10          1HB       PHE  10  -3.008  -8.271   4.070
   67   2HB   PHE  10          2HB       PHE  10  -3.818  -9.757   3.668
   68    HD1  PHE  10           1HD      PHE  10  -3.048 -10.673   1.699
   69    HD2  PHE  10           2HD      PHE  10  -3.554  -6.382   1.883
   70    HE1  PHE  10           1HE      PHE  10  -2.559 -10.504  -0.686
   71    HE2  PHE  10           2HE      PHE  10  -3.052  -6.239  -0.505
   72    HZ   PHE  10           HZ       PHE  10  -2.546  -8.287  -1.821
   73    H    GLN  11           H        GLN  11  -6.025 -10.414   3.559
   74    HA   GLN  11           HA       GLN  11  -7.334 -10.200   1.026
   75   1HB   GLN  11          1HB       GLN  11  -7.690 -12.168   3.358
   76   2HB   GLN  11          2HB       GLN  11  -8.264 -12.451   1.711
   77   1HG   GLN  11          1HG       GLN  11  -6.046 -12.648   0.850
   78   2HG   GLN  11          2HG       GLN  11  -5.310 -11.941   2.286
   79   1HE2  GLN  11          1HE2      GLN  11  -4.053 -13.497   3.274
   80   2HE2  GLN  11          2HE2      GLN  11  -4.682 -15.113   3.628
   81    H    GLN  12           H        GLN  12  -8.702 -10.119   4.422
   82    HA   GLN  12           HA       GLN  12 -11.347  -9.764   3.550
   83   1HB   GLN  12          1HB       GLN  12 -10.368 -10.271   5.942
   84   2HB   GLN  12          2HB       GLN  12 -10.356  -8.514   6.117
   85   1HG   GLN  12          1HG       GLN  12 -12.381  -9.284   7.068
   86   2HG   GLN  12          2HG       GLN  12 -12.858  -8.588   5.525
   87   1HE2  GLN  12          1HE2      GLN  12 -13.674 -10.089   3.820
   88   2HE2  GLN  12          2HE2      GLN  12 -13.979 -11.768   4.248
   89    H    ALA  13           H        ALA  13  -8.788  -7.243   3.944
   90    HA   ALA  13           HA       ALA  13 -10.564  -5.069   3.416
   91   1HB   ALA  13          1HB       ALA  13  -8.379  -4.710   4.458
   92   2HB   ALA  13          2HB       ALA  13  -7.550  -5.318   3.011
   93   3HB   ALA  13          3HB       ALA  13  -8.488  -3.813   2.932
   94    H    ILE  14           H        ILE  14  -8.186  -6.807   1.290
   95    HA   ILE  14           HA       ILE  14  -8.978  -5.276  -0.984
   96    HB   ILE  14           HB       ILE  14  -7.550  -6.691  -2.262
   97   1HG1  ILE  14          1HG1      ILE  14  -6.410  -8.524  -0.365
   98   2HG1  ILE  14          2HG1      ILE  14  -8.144  -8.819  -0.532
   99   1HG2  ILE  14          1HG2      ILE  14  -6.237  -6.047   0.381
  100   2HG2  ILE  14          2HG2      ILE  14  -5.418  -6.406  -1.151
  101   3HG2  ILE  14          3HG2      ILE  14  -6.442  -4.980  -1.026
  102   1HD1  ILE  14          1HD1      ILE  14  -6.894 -10.100  -2.210
  103   2HD1  ILE  14          2HD1      ILE  14  -7.918  -8.880  -2.998
  104   3HD1  ILE  14          3HD1      ILE  14  -6.171  -8.599  -2.837
  105    H    GLN  15           H        GLN  15 -10.579  -7.985   0.350
  106    HA   GLN  15           HA       GLN  15 -11.430  -9.550  -1.647
  107   1HB   GLN  15          1HB       GLN  15 -13.396 -10.098  -0.418
  108   2HB   GLN  15          2HB       GLN  15 -12.124  -9.757   0.747
  109   1HG   GLN  15          1HG       GLN  15 -13.105  -7.450   1.062
  110   2HG   GLN  15          2HG       GLN  15 -14.412  -7.893  -0.036
  111   1HE2  GLN  15          1HE2      GLN  15 -13.564  -7.765   3.205
  112   2HE2  GLN  15          2HE2      GLN  15 -15.047  -8.598   3.744
  113    H    GLY  16           H        GLY  16 -12.667  -6.290  -1.145
  114   1HA   GLY  16          1HA       GLY  16 -12.788  -5.144  -3.293
  115   2HA   GLY  16          2HA       GLY  16 -13.921  -6.360  -3.864
  116    H    ASP  17           H        ASP  17 -13.584  -3.447  -2.682
  117    HA   ASP  17           HA       ASP  17 -16.387  -2.909  -2.853
  118   1HB   ASP  17          1HB       ASP  17 -16.442  -3.383  -0.498
  119   2HB   ASP  17          2HB       ASP  17 -14.944  -2.490  -0.210
  120    H    GLY  18           H        GLY  18 -14.466  -0.657  -1.152
  121   1HA   GLY  18          1HA       GLY  18 -14.069   0.946  -3.614
  122   2HA   GLY  18          2HA       GLY  18 -14.417   1.523  -1.988
  123    HA   PRO  19           HA       PRO  19 -10.046   2.380  -2.854
  124   1HB   PRO  19          1HB       PRO  19  -9.578   4.362  -1.031
  125   2HB   PRO  19          2HB       PRO  19 -10.608   4.629  -2.429
  126   1HG   PRO  19          1HG       PRO  19 -11.539   3.861   0.345
  127   2HG   PRO  19          2HG       PRO  19 -12.113   5.218  -0.685
  128   1HD   PRO  19          1HD       PRO  19 -13.415   2.856  -0.595
  129   2HD   PRO  19          2HD       PRO  19 -13.219   3.714  -2.156
  130    H    VAL  20           H        VAL  20  -9.323   0.174  -2.186
  131    HA   VAL  20           HA       VAL  20  -8.195   0.118   0.554
  132    HB   VAL  20           HB       VAL  20  -8.502  -1.910  -1.671
  133   1HG1  VAL  20          1HG1      VAL  20  -7.718  -3.555   0.168
  134   2HG1  VAL  20          2HG1      VAL  20  -6.445  -2.501  -0.465
  135   3HG1  VAL  20          3HG1      VAL  20  -7.203  -2.150   1.107
  136   1HG2  VAL  20          1HG2      VAL  20 -10.589  -1.381  -0.400
  137   2HG2  VAL  20          2HG2      VAL  20 -10.045  -3.042  -0.183
  138   3HG2  VAL  20          3HG2      VAL  20  -9.764  -1.854   1.103
  139    H    LEU  21           H        LEU  21  -5.983   0.259   0.823
  140    HA   LEU  21           HA       LEU  21  -4.323  -0.253  -1.540
  141   1HB   LEU  21          1HB       LEU  21  -2.716   1.624  -0.532
  142   2HB   LEU  21          2HB       LEU  21  -3.711   1.820  -1.948
  143    HG   LEU  21           HG       LEU  21  -4.879   2.645   0.722
  144   1HD1  LEU  21          1HD1      LEU  21  -2.577   3.582   0.687
  145   2HD1  LEU  21          2HD1      LEU  21  -2.935   4.306  -0.899
  146   3HD1  LEU  21          3HD1      LEU  21  -3.830   4.828   0.540
  147   1HD2  LEU  21          1HD2      LEU  21  -5.058   3.750  -2.129
  148   2HD2  LEU  21          2HD2      LEU  21  -6.302   2.800  -1.302
  149   3HD2  LEU  21          3HD2      LEU  21  -5.897   4.411  -0.717
  150    H    VAL  22           H        VAL  22  -2.728  -1.561  -1.118
  151    HA   VAL  22           HA       VAL  22  -2.277  -2.348   1.714
  152    HB   VAL  22           HB       VAL  22  -2.746  -4.075  -0.112
  153   1HG1  VAL  22          1HG1      VAL  22   0.064  -3.484  -1.062
  154   2HG1  VAL  22          2HG1      VAL  22  -1.073  -4.716  -1.659
  155   3HG1  VAL  22          3HG1      VAL  22  -1.419  -2.989  -1.878
  156   1HG2  VAL  22          1HG2      VAL  22  -1.601  -4.622   2.041
  157   2HG2  VAL  22          2HG2      VAL  22  -0.965  -5.609   0.708
  158   3HG2  VAL  22          3HG2      VAL  22  -0.044  -4.215   1.282
  159    H    ASP  23           H        ASP  23  -0.286  -1.696   2.688
  160    HA   ASP  23           HA       ASP  23   1.731  -0.457   0.918
  161   1HB   ASP  23          1HB       ASP  23   0.253   0.426   3.267
  162   2HB   ASP  23          2HB       ASP  23   1.951   0.341   3.638
  163    H    PHE  24           H        PHE  24   2.961  -2.186   0.440
  164    HA   PHE  24           HA       PHE  24   3.811  -4.158   2.443
  165   1HB   PHE  24          1HB       PHE  24   4.529  -3.725  -0.471
  166   2HB   PHE  24          2HB       PHE  24   5.131  -5.043   0.488
  167    HD1  PHE  24           1HD      PHE  24   3.333  -6.497   1.741
  168    HD2  PHE  24           2HD      PHE  24   2.583  -4.136  -1.781
  169    HE1  PHE  24           1HE      PHE  24   1.608  -8.118   1.026
  170    HE2  PHE  24           2HE      PHE  24   0.856  -5.748  -2.491
  171    HZ   PHE  24           HZ       PHE  24   0.407  -7.799  -1.091
  172    H    TRP  25           H        TRP  25   5.387  -3.715   3.818
  173    HA   TRP  25           HA       TRP  25   7.831  -2.425   2.845
  174   1HB   TRP  25          1HB       TRP  25   8.132  -1.172   4.866
  175   2HB   TRP  25          2HB       TRP  25   6.581  -0.706   4.192
  176    HD1  TRP  25           HD       TRP  25   4.407  -2.021   5.416
  177    HE1  TRP  25           1HE      TRP  25   4.027  -2.627   7.877
  178    HE3  TRP  25           3HE      TRP  25   9.211  -1.533   7.109
  179    HZ2  TRP  25           2HZ      TRP  25   5.663  -3.050  10.252
  180    HZ3  TRP  25           3HZ      TRP  25   9.771  -2.050   9.455
  181    HH2  TRP  25           HH       TRP  25   8.011  -2.831  11.031
  182    H    ALA  26           H        ALA  26   9.420  -3.073   5.111
  183    HA   ALA  26           HA       ALA  26   8.510  -5.521   6.242
  184   1HB   ALA  26          1HB       ALA  26   9.461  -6.466   4.156
  185   2HB   ALA  26          2HB       ALA  26  10.993  -5.613   4.467
  186   3HB   ALA  26          3HB       ALA  26  10.444  -6.906   5.554
  187    H    ALA  27           H        ALA  27   9.895  -6.227   7.948
  188    HA   ALA  27           HA       ALA  27  10.966  -4.180   9.523
  189   1HB   ALA  27          1HB       ALA  27  11.614  -7.155   9.617
  190   2HB   ALA  27          2HB       ALA  27  11.870  -5.984  10.932
  191   3HB   ALA  27          3HB       ALA  27  10.223  -6.355  10.385
  192    H    TRP  28           H        TRP  28  12.678  -6.046   7.007
  193    HA   TRP  28           HA       TRP  28  15.269  -5.113   8.008
  194   1HB   TRP  28          1HB       TRP  28  16.167  -6.840   6.999
  195   2HB   TRP  28          2HB       TRP  28  14.536  -7.454   6.900
  196    HD1  TRP  28           HD       TRP  28  17.368  -5.984   4.878
  197    HE1  TRP  28           1HE      TRP  28  16.948  -6.160   2.363
  198    HE3  TRP  28           3HE      TRP  28  12.595  -7.863   4.976
  199    HZ2  TRP  28           2HZ      TRP  28  14.713  -6.713   0.616
  200    HZ3  TRP  28           3HZ      TRP  28  11.316  -8.123   2.856
  201    HH2  TRP  28           HH       TRP  28  12.368  -7.487   0.692
  202    H    CYS  29           H        CYS  29  13.057  -4.065   5.437
  203    HA   CYS  29           HA       CYS  29  15.094  -3.547   3.556
  204   1HB   CYS  29          1HB       CYS  29  13.282  -2.376   2.260
  205   2HB   CYS  29          2HB       CYS  29  13.042  -4.053   2.712
  206    H    GLY  30           H        GLY  30  15.458  -1.479   2.410
  207   1HA   GLY  30          1HA       GLY  30  16.446   0.520   4.292
  208   2HA   GLY  30          2HA       GLY  30  16.855   0.358   2.588
  209    HA   PRO  31           HA       PRO  31  14.438   3.894   1.639
  210   1HB   PRO  31          1HB       PRO  31  13.009   3.256  -0.658
  211   2HB   PRO  31          2HB       PRO  31  14.759   3.625  -0.610
  212   1HG   PRO  31          1HG       PRO  31  13.414   0.910  -0.617
  213   2HG   PRO  31          2HG       PRO  31  14.815   1.457  -1.590
  214   1HD   PRO  31          1HD       PRO  31  15.154  -0.006   0.656
  215   2HD   PRO  31          2HD       PRO  31  16.266   1.347   0.287
  216    H    CYS  32           H        CYS  32  12.653   0.925   2.098
  217    HA   CYS  32           HA       CYS  32  10.030   2.017   2.271
  218   1HB   CYS  32          1HB       CYS  32   9.467   0.015   3.425
  219   2HB   CYS  32          2HB       CYS  32  10.614  -0.405   2.160
  220    H    ARG  33           H        ARG  33  12.822   2.277   4.599
  221    HA   ARG  33           HA       ARG  33  11.142   3.181   6.760
  222   1HB   ARG  33          1HB       ARG  33  14.109   3.100   6.139
  223   2HB   ARG  33          2HB       ARG  33  13.465   3.844   7.575
  224   1HG   ARG  33          1HG       ARG  33  12.473   1.788   8.348
  225   2HG   ARG  33          2HG       ARG  33  12.908   0.940   6.850
  226   1HD   ARG  33          1HD       ARG  33  15.218   0.947   7.352
  227   2HD   ARG  33          2HD       ARG  33  15.056   2.271   8.512
  228    HE   ARG  33           HE       ARG  33  14.558   0.846  10.171
  229   1HH1  ARG  33          2HH2      ARG  33  14.283  -1.124   7.119
  230   2HH1  ARG  33          1HH2      ARG  33  13.863  -2.530   8.072
  231   1HH2  ARG  33          2HH1      ARG  33  14.105  -1.180  11.237
  232   2HH2  ARG  33          1HH1      ARG  33  13.844  -2.586  10.226
  233    H    MET  34           H        MET  34  12.243   4.678   3.826
  234    HA   MET  34           HA       MET  34  11.931   7.389   4.948
  235   1HB   MET  34          1HB       MET  34  12.785   6.329   2.197
  236   2HB   MET  34          2HB       MET  34  12.611   8.036   2.592
  237   1HG   MET  34          1HG       MET  34  14.418   7.927   4.196
  238   2HG   MET  34          2HG       MET  34  14.494   6.170   4.074
  239   1HE   MET  34          1HE       MET  34  15.088   9.561   2.200
  240   2HE   MET  34          2HE       MET  34  15.879   9.037   0.696
  241   3HE   MET  34          3HE       MET  34  14.154   8.699   0.949
  242    H    MET  35           H        MET  35  10.428   4.983   2.843
  243    HA   MET  35           HA       MET  35   8.343   6.764   1.969
  244   1HB   MET  35          1HB       MET  35   9.330   4.611   0.804
  245   2HB   MET  35          2HB       MET  35   8.102   3.764   1.758
  246   1HG   MET  35          1HG       MET  35   6.358   5.206   0.793
  247   2HG   MET  35          2HG       MET  35   7.569   6.186  -0.030
  248   1HE   MET  35          1HE       MET  35   6.302   6.030  -2.273
  249   2HE   MET  35          2HE       MET  35   5.853   4.505  -3.076
  250   3HE   MET  35          3HE       MET  35   5.032   4.985  -1.576
  251    H    ALA  36           H        ALA  36   8.671   4.266   4.564
  252    HA   ALA  36           HA       ALA  36   6.040   4.125   5.394
  253   1HB   ALA  36          1HB       ALA  36   8.577   4.019   7.062
  254   2HB   ALA  36          2HB       ALA  36   6.956   3.595   7.652
  255   3HB   ALA  36          3HB       ALA  36   7.687   2.669   6.330
  256    HA   PRO  37           HA       PRO  37   6.320   8.131   7.985
  257   1HB   PRO  37          1HB       PRO  37   8.291   9.994   7.325
  258   2HB   PRO  37          2HB       PRO  37   8.352   8.848   8.703
  259   1HG   PRO  37          1HG       PRO  37   9.639   8.628   6.018
  260   2HG   PRO  37          2HG       PRO  37  10.307   8.186   7.610
  261   1HD   PRO  37          1HD       PRO  37   9.292   6.310   5.926
  262   2HD   PRO  37          2HD       PRO  37   9.105   6.177   7.692
  263    H    VAL  38           H        VAL  38   7.458   8.253   4.477
  264    HA   VAL  38           HA       VAL  38   5.770  10.514   3.917
  265    HB   VAL  38           HB       VAL  38   7.655   8.769   2.578
  266   1HG1  VAL  38          1HG1      VAL  38   5.869   8.186   1.063
  267   2HG1  VAL  38          2HG1      VAL  38   5.503   9.916   0.812
  268   3HG1  VAL  38          3HG1      VAL  38   7.057   9.226   0.285
  269   1HG2  VAL  38          1HG2      VAL  38   8.110  11.073   3.276
  270   2HG2  VAL  38          2HG2      VAL  38   8.333  10.870   1.534
  271   3HG2  VAL  38          3HG2      VAL  38   6.868  11.666   2.149
  272    H    LEU  39           H        LEU  39   5.065   7.168   4.409
  273    HA   LEU  39           HA       LEU  39   2.425   7.291   3.256
  274   1HB   LEU  39          1HB       LEU  39   4.243   5.192   4.371
  275   2HB   LEU  39          2HB       LEU  39   2.540   4.876   4.352
  276    HG   LEU  39           HG       LEU  39   2.389   4.590   2.122
  277   1HD1  LEU  39          1HD1      LEU  39   3.855   5.489   0.364
  278   2HD1  LEU  39          2HD1      LEU  39   2.996   6.743   1.251
  279   3HD1  LEU  39          3HD1      LEU  39   4.715   6.432   1.597
  280   1HD2  LEU  39          1HD2      LEU  39   5.369   4.079   2.592
  281   2HD2  LEU  39          2HD2      LEU  39   4.038   2.974   2.986
  282   3HD2  LEU  39          3HD2      LEU  39   4.383   3.365   1.301
  283    H    GLU  40           H        GLU  40   3.905   7.836   6.375
  284    HA   GLU  40           HA       GLU  40   1.367   7.522   7.808
  285   1HB   GLU  40          1HB       GLU  40   4.088   7.647   8.576
  286   2HB   GLU  40          2HB       GLU  40   3.433   9.192   9.103
  287   1HG   GLU  40          1HG       GLU  40   3.237   7.578  10.902
  288   2HG   GLU  40          2HG       GLU  40   1.614   7.960  10.320
  289    H    GLU  41           H        GLU  41   3.358  10.156   6.472
  290    HA   GLU  41           HA       GLU  41   1.552  12.331   6.772
  291   1HB   GLU  41          1HB       GLU  41   3.858  12.501   5.868
  292   2HB   GLU  41          2HB       GLU  41   3.412  11.503   4.495
  293   1HG   GLU  41          1HG       GLU  41   3.519  13.778   3.770
  294   2HG   GLU  41          2HG       GLU  41   1.847  13.242   3.689
  295    H    PHE  42           H        PHE  42   1.772   9.831   4.201
  296    HA   PHE  42           HA       PHE  42  -0.523  10.599   2.772
  297   1HB   PHE  42          1HB       PHE  42   1.292   8.853   2.176
  298   2HB   PHE  42          2HB       PHE  42   0.360   7.719   3.132
  299    HD1  PHE  42           1HD      PHE  42  -1.379  10.198   0.936
  300    HD2  PHE  42           2HD      PHE  42   0.145   6.162   1.318
  301    HE1  PHE  42           1HE      PHE  42  -2.572   9.549  -1.102
  302    HE2  PHE  42           2HE      PHE  42  -1.113   5.533  -0.710
  303    HZ   PHE  42           HZ       PHE  42  -2.484   7.250  -1.927
  304    H    ALA  43           H        ALA  43  -0.236   8.173   5.439
  305    HA   ALA  43           HA       ALA  43  -2.823   7.265   5.575
  306   1HB   ALA  43          1HB       ALA  43  -1.028   7.821   7.957
  307   2HB   ALA  43          2HB       ALA  43  -2.430   6.749   7.912
  308   3HB   ALA  43          3HB       ALA  43  -0.996   6.359   6.948
  309    H    GLU  44           H        GLU  44  -1.566  10.062   7.425
  310    HA   GLU  44           HA       GLU  44  -4.095  10.853   8.395
  311   1HB   GLU  44          1HB       GLU  44  -1.867  11.520   9.310
  312   2HB   GLU  44          2HB       GLU  44  -1.685  12.663   7.967
  313   1HG   GLU  44          1HG       GLU  44  -3.667  13.900   8.676
  314   2HG   GLU  44          2HG       GLU  44  -4.105  12.647   9.837
  315    H    ALA  45           H        ALA  45  -2.295  11.983   5.477
  316    HA   ALA  45           HA       ALA  45  -4.068  13.932   4.565
  317   1HB   ALA  45          1HB       ALA  45  -3.053  13.555   2.363
  318   2HB   ALA  45          2HB       ALA  45  -1.806  13.436   3.624
  319   3HB   ALA  45          3HB       ALA  45  -2.466  11.971   2.865
  320    H    HIS  46           H        HIS  46  -4.704  10.555   4.727
  321    HA   HIS  46           HA       HIS  46  -7.324  11.038   3.476
  322   1HB   HIS  46          1HB       HIS  46  -7.143   8.917   2.186
  323   2HB   HIS  46          2HB       HIS  46  -6.072  10.195   1.656
  324    HD1  HIS  46           1HD      HIS  46  -4.910   7.926   4.558
  325    HD2  HIS  46           2HD      HIS  46  -4.416   8.668   0.447
  326    HE1  HIS  46           1HE      HIS  46  -2.951   6.452   3.721
  327    HE2  HIS  46           2HE      HIS  46  -2.663   6.954   1.243
  328    H    ALA  47           H        ALA  47  -6.568  10.867   6.245
  329    HA   ALA  47           HA       ALA  47  -6.453   8.577   7.534
  330   1HB   ALA  47          1HB       ALA  47  -8.155  10.934   8.435
  331   2HB   ALA  47          2HB       ALA  47  -7.449   9.693   9.489
  332   3HB   ALA  47          3HB       ALA  47  -6.391  10.795   8.595
  333    H    ASP  48           H        ASP  48  -9.612   9.812   6.437
  334    HA   ASP  48           HA       ASP  48 -10.746   7.091   6.866
  335   1HB   ASP  48          1HB       ASP  48 -11.465   9.333   8.370
  336   2HB   ASP  48          2HB       ASP  48 -12.702   9.290   7.122
  337    H    LYS  49           H        LYS  49  -9.635   8.886   4.574
  338    HA   LYS  49           HA       LYS  49 -11.940   9.132   2.721
  339   1HB   LYS  49          1HB       LYS  49 -10.301  10.968   2.950
  340   2HB   LYS  49          2HB       LYS  49  -9.008   9.860   2.550
  341   1HG   LYS  49          1HG       LYS  49 -10.099   9.594   0.240
  342   2HG   LYS  49          2HG       LYS  49 -11.102  10.982   0.678
  343   1HD   LYS  49          1HD       LYS  49  -8.049  10.894   0.579
  344   2HD   LYS  49          2HD       LYS  49  -9.075  11.591  -0.668
  345   1HE   LYS  49          1HE       LYS  49  -9.766  13.385   0.745
  346   2HE   LYS  49          2HE       LYS  49  -9.129  12.612   2.204
  347   1HZ   LYS  49          1HZ       LYS  49  -6.933  13.060   1.560
  348   2HZ   LYS  49          2HZ       LYS  49  -7.359  13.443   0.002
  349   3HZ   LYS  49          3HZ       LYS  49  -7.747  14.434   1.254
  350    H    VAL  50           H        VAL  50  -9.219   6.976   3.450
  351    HA   VAL  50           HA       VAL  50 -10.189   5.126   1.411
  352    HB   VAL  50           HB       VAL  50  -8.006   4.569   0.570
  353   1HG1  VAL  50          1HG1      VAL  50  -8.128   7.604   0.425
  354   2HG1  VAL  50          2HG1      VAL  50  -7.410   6.474  -0.741
  355   3HG1  VAL  50          3HG1      VAL  50  -9.165   6.537  -0.528
  356   1HG2  VAL  50          1HG2      VAL  50  -6.541   4.849   2.415
  357   2HG2  VAL  50          2HG2      VAL  50  -5.982   5.958   1.168
  358   3HG2  VAL  50          3HG2      VAL  50  -6.923   6.567   2.556
  359    H    THR  51           H        THR  51  -9.098   2.834   1.893
  360    HA   THR  51           HA       THR  51  -8.311   2.707   4.686
  361    HB   THR  51           HB       THR  51 -10.440   1.658   4.424
  362    HG1  THR  51           1HG      THR  51  -9.705  -0.305   5.435
  363   1HG2  THR  51          1HG2      THR  51  -9.038  -0.499   2.831
  364   2HG2  THR  51          2HG2      THR  51 -10.736  -0.453   3.350
  365   3HG2  THR  51          3HG2      THR  51 -10.160   0.701   2.135
  366    H    VAL  52           H        VAL  52  -6.309   3.255   4.282
  367    HA   VAL  52           HA       VAL  52  -4.533   1.642   2.599
  368    HB   VAL  52           HB       VAL  52  -3.871   3.866   2.900
  369   1HG1  VAL  52          1HG1      VAL  52  -4.064   3.437   5.911
  370   2HG1  VAL  52          2HG1      VAL  52  -3.228   4.811   5.195
  371   3HG1  VAL  52          3HG1      VAL  52  -4.968   4.611   4.932
  372   1HG2  VAL  52          1HG2      VAL  52  -1.623   3.741   3.660
  373   2HG2  VAL  52          2HG2      VAL  52  -1.967   2.328   4.665
  374   3HG2  VAL  52          3HG2      VAL  52  -2.040   2.212   2.890
  375    H    ALA  53           H        ALA  53  -3.019   0.173   3.485
  376    HA   ALA  53           HA       ALA  53  -3.073  -0.308   6.357
  377   1HB   ALA  53          1HB       ALA  53  -3.552  -2.724   6.150
  378   2HB   ALA  53          2HB       ALA  53  -4.973  -1.715   5.824
  379   3HB   ALA  53          3HB       ALA  53  -4.097  -2.460   4.467
  380    H    LYS  54           H        LYS  54  -1.027  -0.644   6.955
  381    HA   LYS  54           HA       LYS  54   0.875  -1.475   4.859
  382   1HB   LYS  54          1HB       LYS  54   2.605  -0.513   6.015
  383   2HB   LYS  54          2HB       LYS  54   1.279   0.633   5.916
  384   1HG   LYS  54          1HG       LYS  54   0.687   0.007   8.338
  385   2HG   LYS  54          2HG       LYS  54   2.171  -0.972   8.350
  386   1HD   LYS  54          1HD       LYS  54   2.903   1.081   9.190
  387   2HD   LYS  54          2HD       LYS  54   3.360   1.156   7.469
  388   1HE   LYS  54          1HE       LYS  54   1.101   2.347   7.085
  389   2HE   LYS  54          2HE       LYS  54   0.961   2.456   8.845
  390   1HZ   LYS  54          1HZ       LYS  54   3.065   3.740   7.196
  391   2HZ   LYS  54          2HZ       LYS  54   1.837   4.454   8.078
  392   3HZ   LYS  54          3HZ       LYS  54   2.991   3.808   8.870
  393    H    LEU  55           H        LEU  55   2.330  -3.213   5.096
  394    HA   LEU  55           HA       LEU  55   2.224  -4.798   7.549
  395   1HB   LEU  55          1HB       LEU  55   1.408  -6.812   6.678
  396   2HB   LEU  55          2HB       LEU  55   0.266  -5.556   6.267
  397    HG   LEU  55           HG       LEU  55   2.201  -6.927   4.361
  398   1HD1  LEU  55          1HD1      LEU  55   0.157  -8.217   5.089
  399   2HD1  LEU  55          2HD1      LEU  55  -0.845  -6.922   4.482
  400   3HD1  LEU  55          3HD1      LEU  55   0.165  -7.853   3.358
  401   1HD2  LEU  55          1HD2      LEU  55   0.916  -5.717   2.586
  402   2HD2  LEU  55          2HD2      LEU  55   0.181  -4.693   3.838
  403   3HD2  LEU  55          3HD2      LEU  55   1.935  -4.655   3.542
  404    H    ASN  56           H        ASN  56   3.688  -6.521   7.616
  405    HA   ASN  56           HA       ASN  56   6.258  -5.751   6.454
  406   1HB   ASN  56          1HB       ASN  56   6.107  -6.035   8.890
  407   2HB   ASN  56          2HB       ASN  56   5.294  -7.593   8.716
  408   1HD2  ASN  56          1HD2      ASN  56   6.709  -8.983   9.834
  409   2HD2  ASN  56          2HD2      ASN  56   8.382  -9.160   9.307
  410    H    VAL  57           H        VAL  57   6.326  -6.566   4.375
  411    HA   VAL  57           HA       VAL  57   4.871  -8.819   3.600
  412    HB   VAL  57           HB       VAL  57   5.663  -6.794   2.313
  413   1HG1  VAL  57          1HG1      VAL  57   7.572  -7.262   0.752
  414   2HG1  VAL  57          2HG1      VAL  57   8.093  -7.063   2.444
  415   3HG1  VAL  57          3HG1      VAL  57   8.002  -8.675   1.691
  416   1HG2  VAL  57          1HG2      VAL  57   5.632  -9.506   1.043
  417   2HG2  VAL  57          2HG2      VAL  57   4.209  -8.565   1.466
  418   3HG2  VAL  57          3HG2      VAL  57   5.309  -7.963   0.215
  419    H    ASP  58           H        ASP  58   8.012  -8.687   4.970
  420    HA   ASP  58           HA       ASP  58   9.255 -11.124   4.182
  421   1HB   ASP  58          1HB       ASP  58  10.201  -9.189   5.458
  422   2HB   ASP  58          2HB       ASP  58   9.240  -9.687   6.841
  423    H    GLU  59           H        GLU  59   6.634 -10.349   6.317
  424    HA   GLU  59           HA       GLU  59   6.404 -13.074   7.475
  425   1HB   GLU  59          1HB       GLU  59   6.814 -11.234   8.934
  426   2HB   GLU  59          2HB       GLU  59   5.493 -10.308   8.230
  427   1HG   GLU  59          1HG       GLU  59   3.843 -11.785   9.214
  428   2HG   GLU  59          2HG       GLU  59   5.132 -12.810   9.873
  429    H    ASN  60           H        ASN  60   4.824 -10.827   5.271
  430    HA   ASN  60           HA       ASN  60   2.381 -12.470   5.172
  431   1HB   ASN  60          1HB       ASN  60   3.074  -9.559   4.689
  432   2HB   ASN  60          2HB       ASN  60   1.708 -10.285   3.894
  433   1HD2  ASN  60          1HD2      ASN  60   0.032 -11.380   5.247
  434   2HD2  ASN  60          2HD2      ASN  60  -0.220 -10.773   6.881
  435    HA   PRO  61           HA       PRO  61   4.423 -13.591   1.188
  436   1HB   PRO  61          1HB       PRO  61   3.943 -16.301   1.270
  437   2HB   PRO  61          2HB       PRO  61   5.392 -15.504   1.919
  438   1HG   PRO  61          1HG       PRO  61   2.906 -16.412   3.407
  439   2HG   PRO  61          2HG       PRO  61   4.615 -16.555   3.916
  440   1HD   PRO  61          1HD       PRO  61   2.902 -14.581   4.823
  441   2HD   PRO  61          2HD       PRO  61   4.661 -14.344   4.679
  442    H    GLU  62           H        GLU  62   1.815 -15.912   1.809
  443    HA   GLU  62           HA       GLU  62  -0.124 -16.399   0.864
  444   1HB   GLU  62          1HB       GLU  62  -1.767 -15.110   1.880
  445   2HB   GLU  62          2HB       GLU  62  -0.332 -14.954   2.886
  446   1HG   GLU  62          1HG       GLU  62   0.119 -12.722   1.640
  447   2HG   GLU  62          2HG       GLU  62  -1.501 -12.888   0.969
  448    H    THR  63           H        THR  63   1.207 -13.863  -0.971
  449    HA   THR  63           HA       THR  63  -0.128 -14.204  -3.350
  450    HB   THR  63           HB       THR  63  -1.239 -12.013  -1.568
  451    HG1  THR  63           1HG      THR  63  -2.163 -14.211  -1.833
  452   1HG2  THR  63          1HG2      THR  63  -2.555 -11.144  -3.493
  453   2HG2  THR  63          2HG2      THR  63  -0.826 -10.837  -3.677
  454   3HG2  THR  63          3HG2      THR  63  -1.594 -12.159  -4.591
  455    H    THR  64           H        THR  64   1.813 -12.296  -1.193
  456    HA   THR  64           HA       THR  64   3.034 -10.387  -2.665
  457    HB   THR  64           HB       THR  64   4.110 -12.418  -0.690
  458    HG1  THR  64           1HG      THR  64   3.411 -10.982   0.770
  459   1HG2  THR  64          1HG2      THR  64   6.049 -11.209  -0.227
  460   2HG2  THR  64          2HG2      THR  64   6.065 -11.433  -1.963
  461   3HG2  THR  64          3HG2      THR  64   5.590  -9.865  -1.288
  462    H    SER  65           H        SER  65   4.204 -13.768  -2.448
  463    HA   SER  65           HA       SER  65   6.209 -13.572  -4.416
  464   1HB   SER  65          1HB       SER  65   5.988 -15.324  -2.657
  465   2HB   SER  65          2HB       SER  65   4.607 -16.015  -3.519
  466    HG   SER  65           HG       SER  65   6.603 -17.054  -4.021
  467    H    GLN  66           H        GLN  66   2.779 -14.553  -4.684
  468    HA   GLN  66           HA       GLN  66   2.784 -15.354  -7.374
  469   1HB   GLN  66          1HB       GLN  66   1.032 -15.647  -5.429
  470   2HB   GLN  66          2HB       GLN  66   0.403 -14.098  -5.972
  471   1HG   GLN  66          1HG       GLN  66  -0.905 -15.776  -7.009
  472   2HG   GLN  66          2HG       GLN  66   0.104 -15.089  -8.279
  473   1HE2  GLN  66          1HE2      GLN  66  -0.872 -17.380  -9.091
  474   2HE2  GLN  66          2HE2      GLN  66   0.255 -18.709  -8.848
  475    H    PHE  67           H        PHE  67   2.575 -12.061  -5.983
  476    HA   PHE  67           HA       PHE  67   2.135 -11.009  -8.739
  477   1HB   PHE  67          1HB       PHE  67   0.580 -10.602  -6.562
  478   2HB   PHE  67          2HB       PHE  67   1.676  -9.269  -6.367
  479    HD1  PHE  67           1HD      PHE  67  -1.079 -10.679  -8.303
  480    HD2  PHE  67           2HD      PHE  67   1.793  -7.460  -8.164
  481    HE1  PHE  67           1HE      PHE  67  -2.465  -9.358  -9.879
  482    HE2  PHE  67           2HE      PHE  67   0.402  -6.144  -9.703
  483    HZ   PHE  67           HZ       PHE  67  -1.738  -7.081 -10.578
  484    H    GLY  68           H        GLY  68   4.758 -11.800  -7.103
  485   1HA   GLY  68          1HA       GLY  68   6.931 -11.198  -7.439
  486   2HA   GLY  68          2HA       GLY  68   6.371  -9.941  -8.545
  487    H    ILE  69           H        ILE  69   5.302  -9.986  -5.202
  488    HA   ILE  69           HA       ILE  69   6.136  -7.230  -4.898
  489    HB   ILE  69           HB       ILE  69   4.624  -9.132  -3.103
  490   1HG1  ILE  69          1HG1      ILE  69   3.468  -9.016  -5.203
  491   2HG1  ILE  69          2HG1      ILE  69   2.525  -8.181  -3.998
  492   1HG2  ILE  69          1HG2      ILE  69   5.167  -7.102  -1.788
  493   2HG2  ILE  69          2HG2      ILE  69   4.302  -6.126  -2.977
  494   3HG2  ILE  69          3HG2      ILE  69   3.471  -7.392  -2.040
  495   1HD1  ILE  69          1HD1      ILE  69   2.565  -6.978  -6.151
  496   2HD1  ILE  69          2HD1      ILE  69   3.259  -5.996  -4.872
  497   3HD1  ILE  69          3HD1      ILE  69   4.322  -6.799  -6.052
  498    H    MET  70           H        MET  70   8.317  -8.531  -5.128
  499    HA   MET  70           HA       MET  70   9.703  -8.510  -2.473
  500   1HB   MET  70          1HB       MET  70  10.330 -10.182  -4.274
  501   2HB   MET  70          2HB       MET  70  10.916  -8.828  -5.253
  502   1HG   MET  70          1HG       MET  70  12.572  -8.280  -3.516
  503   2HG   MET  70          2HG       MET  70  11.892  -9.518  -2.450
  504   1HE   MET  70          1HE       MET  70  15.402 -10.981  -3.266
  505   2HE   MET  70          2HE       MET  70  14.951  -9.284  -2.982
  506   3HE   MET  70          3HE       MET  70  14.229 -10.577  -1.992
  507    H    SER  71           H        SER  71   8.447  -6.343  -4.748
  508    HA   SER  71           HA       SER  71  10.654  -4.657  -5.276
  509   1HB   SER  71          1HB       SER  71   8.755  -3.359  -6.417
  510   2HB   SER  71          2HB       SER  71   8.927  -5.052  -6.895
  511    HG   SER  71           HG       SER  71   7.046  -4.001  -5.000
  512    H    ILE  72           H        ILE  72   9.777  -4.850  -2.393
  513    HA   ILE  72           HA       ILE  72   8.261  -2.662  -1.723
  514    HB   ILE  72           HB       ILE  72   8.886  -3.020   0.618
  515   1HG1  ILE  72          1HG1      ILE  72  10.828  -5.096  -0.494
  516   2HG1  ILE  72          2HG1      ILE  72  11.226  -3.625   0.406
  517   1HG2  ILE  72          1HG2      ILE  72   8.249  -5.614  -0.826
  518   2HG2  ILE  72          2HG2      ILE  72   7.689  -5.040   0.770
  519   3HG2  ILE  72          3HG2      ILE  72   7.109  -4.261  -0.694
  520   1HD1  ILE  72          1HD1      ILE  72   9.742  -4.589   2.296
  521   2HD1  ILE  72          2HD1      ILE  72   9.894  -6.131   1.416
  522   3HD1  ILE  72          3HD1      ILE  72  11.335  -5.305   2.019
  523    HA   PRO  73           HA       PRO  73   7.969  -1.055   0.132
  524   1HB   PRO  73          1HB       PRO  73   7.334   1.552  -0.187
  525   2HB   PRO  73          2HB       PRO  73   8.481   0.971   1.046
  526   1HG   PRO  73          1HG       PRO  73   9.147   2.088  -1.706
  527   2HG   PRO  73          2HG       PRO  73   9.872   2.552  -0.134
  528   1HD   PRO  73          1HD       PRO  73  11.059   0.767  -1.801
  529   2HD   PRO  73          2HD       PRO  73  11.116   0.546  -0.027
  530    H    THR  74           H        THR  74   6.035  -1.562  -0.777
  531    HA   THR  74           HA       THR  74   5.435  -0.672  -3.564
  532    HB   THR  74           HB       THR  74   5.335  -3.493  -2.433
  533    HG1  THR  74           1HG      THR  74   7.190  -2.172  -3.660
  534   1HG2  THR  74          1HG2      THR  74   3.340  -3.275  -3.825
  535   2HG2  THR  74          2HG2      THR  74   4.274  -2.478  -5.097
  536   3HG2  THR  74          3HG2      THR  74   4.581  -4.177  -4.712
  537    H    LEU  75           H        LEU  75   3.314  -0.278  -4.033
  538    HA   LEU  75           HA       LEU  75   1.332  -0.230  -1.802
  539   1HB   LEU  75          1HB       LEU  75   2.778   1.852  -2.072
  540   2HB   LEU  75          2HB       LEU  75   1.836   2.167  -3.519
  541    HG   LEU  75           HG       LEU  75   0.520   1.523  -0.834
  542   1HD1  LEU  75          1HD1      LEU  75   0.358   3.856  -0.419
  543   2HD1  LEU  75          2HD1      LEU  75   2.051   3.431  -0.631
  544   3HD1  LEU  75          3HD1      LEU  75   1.195   4.227  -1.976
  545   1HD2  LEU  75          1HD2      LEU  75  -1.337   2.892  -1.885
  546   2HD2  LEU  75          2HD2      LEU  75  -0.457   2.819  -3.421
  547   3HD2  LEU  75          3HD2      LEU  75  -1.061   1.329  -2.654
  548    H    ILE  76           H        ILE  76  -0.122  -1.695  -2.709
  549    HA   ILE  76           HA       ILE  76  -0.796  -1.367  -5.599
  550    HB   ILE  76           HB       ILE  76  -1.726  -3.628  -3.844
  551   1HG1  ILE  76          1HG1      ILE  76   0.674  -3.627  -5.737
  552   2HG1  ILE  76          2HG1      ILE  76   0.720  -3.838  -3.987
  553   1HG2  ILE  76          1HG2      ILE  76  -2.359  -4.667  -5.953
  554   2HG2  ILE  76          2HG2      ILE  76  -3.097  -3.088  -5.850
  555   3HG2  ILE  76          3HG2      ILE  76  -1.661  -3.319  -6.872
  556   1HD1  ILE  76          1HD1      ILE  76   0.915  -6.023  -4.857
  557   2HD1  ILE  76          2HD1      ILE  76  -0.763  -5.919  -4.323
  558   3HD1  ILE  76          3HD1      ILE  76  -0.357  -5.782  -6.055
  559    H    LEU  77           H        LEU  77  -2.698  -0.556  -6.069
  560    HA   LEU  77           HA       LEU  77  -4.538   0.352  -3.896
  561   1HB   LEU  77          1HB       LEU  77  -3.556   1.920  -5.646
  562   2HB   LEU  77          2HB       LEU  77  -4.495   1.055  -6.848
  563    HG   LEU  77           HG       LEU  77  -5.406   2.875  -4.597
  564   1HD1  LEU  77          1HD1      LEU  77  -4.654   3.636  -6.921
  565   2HD1  LEU  77          2HD1      LEU  77  -6.104   2.861  -7.557
  566   3HD1  LEU  77          3HD1      LEU  77  -6.234   4.211  -6.407
  567   1HD2  LEU  77          1HD2      LEU  77  -7.105   1.223  -4.408
  568   2HD2  LEU  77          2HD2      LEU  77  -7.787   2.463  -5.431
  569   3HD2  LEU  77          3HD2      LEU  77  -7.188   0.965  -6.154
  570    H    PHE  78           H        PHE  78  -6.348  -0.854  -3.680
  571    HA   PHE  78           HA       PHE  78  -7.163  -2.648  -5.903
  572   1HB   PHE  78          1HB       PHE  78  -7.411  -3.236  -2.948
  573   2HB   PHE  78          2HB       PHE  78  -8.228  -4.126  -4.201
  574    HD1  PHE  78           1HD      PHE  78  -7.190  -5.953  -5.306
  575    HD2  PHE  78           2HD      PHE  78  -4.853  -3.330  -2.796
  576    HE1  PHE  78           1HE      PHE  78  -5.333  -7.605  -5.293
  577    HE2  PHE  78           2HE      PHE  78  -3.035  -5.020  -2.753
  578    HZ   PHE  78           HZ       PHE  78  -3.263  -7.139  -4.019
  579    H    LYS  79           H        LYS  79  -9.352  -2.714  -6.299
  580    HA   LYS  79           HA       LYS  79 -11.254  -1.691  -4.417
  581   1HB   LYS  79          1HB       LYS  79 -12.399  -0.086  -5.870
  582   2HB   LYS  79          2HB       LYS  79 -10.767   0.437  -5.484
  583   1HG   LYS  79          1HG       LYS  79 -10.097  -0.591  -7.798
  584   2HG   LYS  79          2HG       LYS  79 -11.829  -0.649  -8.118
  585   1HD   LYS  79          1HD       LYS  79 -10.968   1.350  -9.101
  586   2HD   LYS  79          2HD       LYS  79 -11.907   1.864  -7.689
  587   1HE   LYS  79          1HE       LYS  79  -9.911   2.245  -6.393
  588   2HE   LYS  79          2HE       LYS  79  -8.926   1.336  -7.505
  589   1HZ   LYS  79          1HZ       LYS  79 -10.076   4.050  -8.051
  590   2HZ   LYS  79          2HZ       LYS  79  -8.502   3.660  -7.924
  591   3HZ   LYS  79          3HZ       LYS  79  -9.316   3.185  -9.205
  592    H    GLY  80           H        GLY  80 -13.464  -2.442  -5.105
  593   1HA   GLY  80          1HA       GLY  80 -14.775  -4.182  -5.699
  594   2HA   GLY  80          2HA       GLY  80 -14.200  -3.783  -7.311
  595    H    GLY  81           H        GLY  81 -11.731  -5.149  -5.243
  596   1HA   GLY  81          1HA       GLY  81 -11.148  -7.420  -4.863
  597   2HA   GLY  81          2HA       GLY  81 -12.265  -7.934  -6.121
  598    H    GLU  82           H        GLU  82 -10.228  -5.199  -6.912
  599    HA   GLU  82           HA       GLU  82  -8.594  -6.906  -8.698
  600   1HB   GLU  82          1HB       GLU  82 -10.596  -6.066  -9.853
  601   2HB   GLU  82          2HB       GLU  82 -10.167  -4.405  -9.416
  602   1HG   GLU  82          1HG       GLU  82  -8.027  -4.646 -10.707
  603   2HG   GLU  82          2HG       GLU  82  -8.509  -6.284 -11.159
  604    HA   PRO  83           HA       PRO  83  -5.484  -3.887  -7.211
  605   1HB   PRO  83          1HB       PRO  83  -3.274  -4.970  -8.372
  606   2HB   PRO  83          2HB       PRO  83  -4.083  -5.733  -6.976
  607   1HG   PRO  83          1HG       PRO  83  -4.372  -6.457  -9.897
  608   2HG   PRO  83          2HG       PRO  83  -4.121  -7.544  -8.494
  609   1HD   PRO  83          1HD       PRO  83  -6.592  -7.001  -9.593
  610   2HD   PRO  83          2HD       PRO  83  -6.365  -7.399  -7.864
  611    H    VAL  84           H        VAL  84  -6.500  -2.132  -8.471
  612    HA   VAL  84           HA       VAL  84  -6.451  -2.049 -11.296
  613    HB   VAL  84           HB       VAL  84  -6.842   0.428 -10.859
  614   1HG1  VAL  84          1HG1      VAL  84  -8.667  -1.160 -11.336
  615   2HG1  VAL  84          2HG1      VAL  84  -8.775  -1.578  -9.622
  616   3HG1  VAL  84          3HG1      VAL  84  -9.189   0.066 -10.177
  617   1HG2  VAL  84          1HG2      VAL  84  -7.424   1.262  -8.772
  618   2HG2  VAL  84          2HG2      VAL  84  -7.324  -0.341  -7.992
  619   3HG2  VAL  84          3HG2      VAL  84  -5.859   0.495  -8.548
  620    H    LYS  85           H        LYS  85  -4.130  -0.842  -8.905
  621    HA   LYS  85           HA       LYS  85  -2.120  -0.885 -10.952
  622   1HB   LYS  85          1HB       LYS  85  -1.364   1.342 -11.036
  623   2HB   LYS  85          2HB       LYS  85  -3.098   1.434 -11.280
  624   1HG   LYS  85          1HG       LYS  85  -3.239   1.972  -8.724
  625   2HG   LYS  85          2HG       LYS  85  -1.486   2.163  -8.805
  626   1HD   LYS  85          1HD       LYS  85  -1.901   4.303  -9.342
  627   2HD   LYS  85          2HD       LYS  85  -2.257   3.721 -10.959
  628   1HE   LYS  85          1HE       LYS  85  -4.214   4.267  -8.693
  629   2HE   LYS  85          2HE       LYS  85  -4.055   5.207 -10.155
  630   1HZ   LYS  85          1HZ       LYS  85  -5.932   3.695 -10.041
  631   2HZ   LYS  85          2HZ       LYS  85  -5.005   3.449 -11.397
  632   3HZ   LYS  85          3HZ       LYS  85  -4.924   2.388 -10.127
  633    H    GLN  86           H        GLN  86   0.060  -0.305 -10.081
  634    HA   GLN  86           HA       GLN  86   0.395  -0.766  -7.191
  635   1HB   GLN  86          1HB       GLN  86   0.598  -2.935  -8.073
  636   2HB   GLN  86          2HB       GLN  86   1.455  -2.391  -9.520
  637   1HG   GLN  86          1HG       GLN  86   3.461  -1.958  -8.324
  638   2HG   GLN  86          2HG       GLN  86   2.702  -2.190  -6.754
  639   1HE2  GLN  86          1HE2      GLN  86   5.075  -3.642  -7.515
  640   2HE2  GLN  86          2HE2      GLN  86   4.586  -5.315  -7.715
  641    H    LEU  87           H        LEU  87   1.897   0.522  -6.354
  642    HA   LEU  87           HA       LEU  87   3.806   1.995  -8.108
  643   1HB   LEU  87          1HB       LEU  87   2.503   2.600  -5.432
  644   2HB   LEU  87          2HB       LEU  87   4.071   3.276  -5.796
  645    HG   LEU  87           HG       LEU  87   2.358   4.883  -6.217
  646   1HD1  LEU  87          1HD1      LEU  87   3.198   5.675  -8.242
  647   2HD1  LEU  87          2HD1      LEU  87   4.447   4.529  -7.745
  648   3HD1  LEU  87          3HD1      LEU  87   3.282   4.051  -8.978
  649   1HD2  LEU  87          1HD2      LEU  87   0.558   4.652  -7.766
  650   2HD2  LEU  87          2HD2      LEU  87   1.183   3.117  -8.399
  651   3HD2  LEU  87          3HD2      LEU  87   0.531   3.197  -6.755
  652    H    ILE  88           H        ILE  88   5.993   1.971  -7.409
  653    HA   ILE  88           HA       ILE  88   6.799   0.112  -5.311
  654    HB   ILE  88           HB       ILE  88   8.413  -0.969  -6.876
  655   1HG1  ILE  88          1HG1      ILE  88   6.804   0.443  -9.061
  656   2HG1  ILE  88          2HG1      ILE  88   8.533   0.578  -8.731
  657   1HG2  ILE  88          1HG2      ILE  88   5.545  -1.439  -7.721
  658   2HG2  ILE  88          2HG2      ILE  88   6.877  -2.623  -7.647
  659   3HG2  ILE  88          3HG2      ILE  88   6.214  -1.946  -6.159
  660   1HD1  ILE  88          1HD1      ILE  88   8.232  -0.814 -10.663
  661   2HD1  ILE  88          2HD1      ILE  88   8.747  -1.877  -9.329
  662   3HD1  ILE  88          3HD1      ILE  88   7.042  -1.830  -9.846
  663    H    GLY  89           H        GLY  89   8.678   0.711  -4.420
  664   1HA   GLY  89          1HA       GLY  89  10.649   1.881  -4.038
  665   2HA   GLY  89          2HA       GLY  89  10.548   2.595  -5.657
  666    H    TYR  90           H        TYR  90  11.393   4.191  -3.719
  667    HA   TYR  90           HA       TYR  90   9.382   5.592  -2.214
  668   1HB   TYR  90          1HB       TYR  90  11.635   5.278  -1.394
  669   2HB   TYR  90          2HB       TYR  90  12.295   6.120  -2.786
  670    HD1  TYR  90           1HD      TYR  90  12.839   8.405  -2.566
  671    HD2  TYR  90           2HD      TYR  90   9.919   6.681   0.075
  672    HE1  TYR  90           1HE      TYR  90  12.750  10.525  -1.308
  673    HE2  TYR  90           2HE      TYR  90   9.802   8.816   1.347
  674    HH   TYR  90           HH       TYR  90  11.773  11.668   0.490
  675    H    GLN  91           H        GLN  91   7.978   5.963  -4.213
  676    HA   GLN  91           HA       GLN  91   8.678   8.359  -5.738
  677   1HB   GLN  91          1HB       GLN  91   5.813   7.478  -5.286
  678   2HB   GLN  91          2HB       GLN  91   6.514   8.371  -6.597
  679   1HG   GLN  91          1HG       GLN  91   7.142   5.435  -6.172
  680   2HG   GLN  91          2HG       GLN  91   5.838   6.066  -7.166
  681   1HE2  GLN  91          1HE2      GLN  91   6.275   7.192  -9.160
  682   2HE2  GLN  91          2HE2      GLN  91   7.900   7.053  -9.857
  683    HA   PRO  92           HA       PRO  92   7.657  10.992  -2.213
  684   1HB   PRO  92          1HB       PRO  92   7.540  13.460  -3.399
  685   2HB   PRO  92          2HB       PRO  92   9.075  12.571  -3.157
  686   1HG   PRO  92          1HG       PRO  92   7.363  12.685  -5.658
  687   2HG   PRO  92          2HG       PRO  92   9.133  12.936  -5.518
  688   1HD   PRO  92          1HD       PRO  92   8.064  10.530  -6.251
  689   2HD   PRO  92          2HD       PRO  92   9.535  10.626  -5.234
  690    H    LYS  93           H        LYS  93   5.856  12.531  -1.513
  691    HA   LYS  93           HA       LYS  93   3.380  11.415  -1.869
  692   1HB   LYS  93          1HB       LYS  93   4.453  14.065  -0.879
  693   2HB   LYS  93          2HB       LYS  93   2.735  13.912  -1.081
  694   1HG   LYS  93          1HG       LYS  93   4.310  11.927   0.600
  695   2HG   LYS  93          2HG       LYS  93   3.742  13.462   1.230
  696   1HD   LYS  93          1HD       LYS  93   2.145  11.827   1.885
  697   2HD   LYS  93          2HD       LYS  93   1.391  12.869   0.683
  698   1HE   LYS  93          1HE       LYS  93   0.739  10.573   0.393
  699   2HE   LYS  93          2HE       LYS  93   1.631  11.121  -1.016
  700   1HZ   LYS  93          1HZ       LYS  93   3.541   9.927  -0.269
  701   2HZ   LYS  93          2HZ       LYS  93   2.900   9.635   1.209
  702   3HZ   LYS  93          3HZ       LYS  93   2.263   8.889  -0.122
  703    H    GLU  94           H        GLU  94   4.572  14.367  -3.467
  704    HA   GLU  94           HA       GLU  94   2.357  15.061  -4.963
  705   1HB   GLU  94          1HB       GLU  94   4.463  16.332  -4.664
  706   2HB   GLU  94          2HB       GLU  94   5.325  15.166  -5.670
  707   1HG   GLU  94          1HG       GLU  94   3.925  15.836  -7.625
  708   2HG   GLU  94          2HG       GLU  94   3.073  17.002  -6.598
  709    H    GLN  95           H        GLN  95   4.533  12.289  -5.618
  710    HA   GLN  95           HA       GLN  95   3.566  11.999  -8.376
  711   1HB   GLN  95          1HB       GLN  95   6.010  11.592  -7.316
  712   2HB   GLN  95          2HB       GLN  95   5.321  10.087  -6.793
  713   1HG   GLN  95          1HG       GLN  95   5.801  11.060  -9.619
  714   2HG   GLN  95          2HG       GLN  95   6.577   9.723  -8.783
  715   1HE2  GLN  95          1HE2      GLN  95   3.623  10.748 -10.509
  716   2HE2  GLN  95          2HE2      GLN  95   3.048   9.110 -10.767
  717    H    LEU  96           H        LEU  96   3.610  10.429  -5.193
  718    HA   LEU  96           HA       LEU  96   2.158   8.118  -5.832
  719   1HB   LEU  96          1HB       LEU  96   3.649   8.767  -3.882
  720   2HB   LEU  96          2HB       LEU  96   2.207   9.440  -3.148
  721    HG   LEU  96           HG       LEU  96   2.319   6.565  -4.168
  722   1HD1  LEU  96          1HD1      LEU  96   2.924   5.812  -1.965
  723   2HD1  LEU  96          2HD1      LEU  96   4.136   6.991  -2.497
  724   3HD1  LEU  96          3HD1      LEU  96   2.900   7.458  -1.318
  725   1HD2  LEU  96          1HD2      LEU  96   0.529   6.264  -2.426
  726   2HD2  LEU  96          2HD2      LEU  96   0.559   8.014  -2.133
  727   3HD2  LEU  96          3HD2      LEU  96   0.049   7.367  -3.704
  728    H    GLU  97           H        GLU  97   0.941  11.188  -4.233
  729    HA   GLU  97           HA       GLU  97  -1.772  10.516  -4.109
  730   1HB   GLU  97          1HB       GLU  97  -0.256  13.107  -4.466
  731   2HB   GLU  97          2HB       GLU  97  -1.926  13.018  -4.030
  732   1HG   GLU  97          1HG       GLU  97   0.227  11.752  -2.305
  733   2HG   GLU  97          2HG       GLU  97  -0.167  13.461  -2.196
  734    H    ALA  98           H        ALA  98   0.317  11.670  -6.797
  735    HA   ALA  98           HA       ALA  98  -2.014  12.430  -8.427
  736   1HB   ALA  98          1HB       ALA  98   0.929  12.116  -9.187
  737   2HB   ALA  98          2HB       ALA  98  -0.353  12.760 -10.232
  738   3HB   ALA  98          3HB       ALA  98   0.102  13.628  -8.755
  739    H    GLN  99           H        GLN  99   0.399   9.778  -8.422
  740    HA   GLN  99           HA       GLN  99  -0.703   8.334 -10.595
  741   1HB   GLN  99          1HB       GLN  99   1.559   8.072  -9.225
  742   2HB   GLN  99          2HB       GLN  99   0.616   6.985  -8.216
  743   1HG   GLN  99          1HG       GLN  99   1.575   5.544  -9.799
  744   2HG   GLN  99          2HG       GLN  99  -0.012   5.816 -10.493
  745   1HE2  GLN  99          1HE2      GLN  99   3.455   7.076 -10.590
  746   2HE2  GLN  99          2HE2      GLN  99   3.336   7.365 -12.326
  747    H    LEU 100           H        LEU 100  -1.446   8.190  -7.099
  748    HA   LEU 100           HA       LEU 100  -3.454   6.084  -7.435
  749   1HB   LEU 100          1HB       LEU 100  -1.750   7.041  -5.341
  750   2HB   LEU 100          2HB       LEU 100  -3.386   7.333  -4.834
  751    HG   LEU 100           HG       LEU 100  -3.865   4.899  -5.392
  752   1HD1  LEU 100          1HD1      LEU 100  -0.809   4.849  -5.555
  753   2HD1  LEU 100          2HD1      LEU 100  -1.838   3.409  -5.517
  754   3HD1  LEU 100          3HD1      LEU 100  -1.913   4.506  -6.901
  755   1HD2  LEU 100          1HD2      LEU 100  -2.842   4.020  -3.369
  756   2HD2  LEU 100          2HD2      LEU 100  -1.758   5.428  -3.277
  757   3HD2  LEU 100          3HD2      LEU 100  -3.527   5.623  -3.097
  758    H    ALA 101           H        ALA 101  -3.641   9.362  -8.120
  759    HA   ALA 101           HA       ALA 101  -5.779  10.362  -6.756
  760   1HB   ALA 101          1HB       ALA 101  -5.151  10.743  -9.707
  761   2HB   ALA 101          2HB       ALA 101  -6.171  11.800  -8.707
  762   3HB   ALA 101          3HB       ALA 101  -4.444  11.647  -8.344
  763    H    ASP 102           H        ASP 102  -6.028   7.822  -9.250
  764    HA   ASP 102           HA       ASP 102  -8.846   8.202  -9.719
  765   1HB   ASP 102          1HB       ASP 102  -8.669   6.568 -11.241
  766   2HB   ASP 102          2HB       ASP 102  -6.932   6.703 -11.001
  767    H    VAL 103           H        VAL 103  -7.376   7.245  -6.841
  768    HA   VAL 103           HA       VAL 103 -10.181   6.684  -6.076
  769    HB   VAL 103           HB       VAL 103  -8.382   4.648  -6.050
  770   1HG1  VAL 103          1HG1      VAL 103  -7.018   5.550  -4.214
  771   2HG1  VAL 103          2HG1      VAL 103  -8.438   5.536  -3.145
  772   3HG1  VAL 103          3HG1      VAL 103  -7.803   4.022  -3.778
  773   1HG2  VAL 103          1HG2      VAL 103 -10.884   5.097  -4.446
  774   2HG2  VAL 103          2HG2      VAL 103 -10.735   4.437  -6.058
  775   3HG2  VAL 103          3HG2      VAL 103 -10.106   3.502  -4.691
  776    H    LEU 104           H        LEU 104  -7.919   8.994  -5.834
  777    HA   LEU 104           HA       LEU 104  -8.856   9.842  -3.154
  778   1HB   LEU 104          1HB       LEU 104  -6.495  10.548  -4.922
  779   2HB   LEU 104          2HB       LEU 104  -7.006  11.586  -3.708
  780    HG   LEU 104           HG       LEU 104  -5.314  10.526  -2.612
  781   1HD1  LEU 104          1HD1      LEU 104  -6.057   8.838  -1.045
  782   2HD1  LEU 104          2HD1      LEU 104  -7.327  10.056  -1.277
  783   3HD1  LEU 104          3HD1      LEU 104  -7.470   8.463  -2.053
  784   1HD2  LEU 104          1HD2      LEU 104  -5.993   7.900  -3.978
  785   2HD2  LEU 104          2HD2      LEU 104  -4.727   9.064  -4.452
  786   3HD2  LEU 104          3HD2      LEU 104  -4.609   8.214  -2.904
  787    H    GLN 105           H        GLN 105  -9.339  10.253  -6.531
  788    HA   GLN 105           HA       GLN 105 -10.394  12.912  -6.603
  789   1HB   GLN 105          2HB       GLN 105  -9.601  11.474  -8.572
  790   2HB   GLN 105          3HB       GLN 105 -11.031  10.505  -8.291
  791   1HG   GLN 105          2HG       GLN 105 -11.576  11.938 -10.081
  792   2HG   GLN 105          3HG       GLN 105 -12.437  12.599  -8.701
  793   1HE2  GLN 105          1HE2      GLN 105  -9.222  13.507  -8.184
  794   2HE2  GLN 105          2HE2      GLN 105  -9.275  15.047  -9.046
  Start of MODEL   18
    1   1H    ALA   1           H        ALA   1  -9.824   5.491   8.128
    2   2H    ALA   1          2HN       ALA   1 -11.203   5.842   8.922
    3   3H    ALA   1          3HN       ALA   1 -10.073   4.885   9.654
    4    HA   ALA   1           HA       ALA   1 -11.908   3.563   8.883
    5   1HB   ALA   1          1HB       ALA   1 -12.468   3.519   6.497
    6   2HB   ALA   1          2HB       ALA   1 -12.595   5.171   7.116
    7   3HB   ALA   1          3HB       ALA   1 -11.179   4.688   6.147
    8    H    THR   2           H        THR   2  -8.944   3.033   9.554
    9    HA   THR   2           HA       THR   2  -8.645   0.686   7.957
   10    HB   THR   2           HB       THR   2  -7.795   2.723   6.572
   11    HG1  THR   2           1HG      THR   2  -7.493   0.722   5.918
   12   1HG2  THR   2          1HG2      THR   2  -5.587   3.492   6.879
   13   2HG2  THR   2          2HG2      THR   2  -6.434   3.758   8.407
   14   3HG2  THR   2          3HG2      THR   2  -5.293   2.399   8.241
   15    H    MET   3           H        MET   3  -6.283  -0.229   8.490
   16    HA   MET   3           HA       MET   3  -5.488   0.169  11.261
   17   1HB   MET   3          1HB       MET   3  -6.759  -2.434  10.261
   18   2HB   MET   3          2HB       MET   3  -5.815  -2.295  11.744
   19   1HG   MET   3          1HG       MET   3  -7.450  -0.733  12.694
   20   2HG   MET   3          2HG       MET   3  -8.392  -0.788  11.204
   21   1HE   MET   3          1HE       MET   3  -8.064  -4.350  14.159
   22   2HE   MET   3          2HE       MET   3  -6.699  -3.914  13.114
   23   3HE   MET   3          3HE       MET   3  -7.244  -2.789  14.386
   24    H    THR   4           H        THR   4  -3.585  -1.393  11.702
   25    HA   THR   4           HA       THR   4  -1.810  -1.915   9.484
   26    HB   THR   4           HB       THR   4  -1.938  -3.080  12.271
   27    HG1  THR   4           1HG      THR   4  -0.517  -1.436  12.802
   28   1HG2  THR   4          1HG2      THR   4   0.513  -3.418  12.024
   29   2HG2  THR   4          2HG2      THR   4  -0.394  -4.369  10.845
   30   3HG2  THR   4          3HG2      THR   4   0.412  -2.869  10.338
   31    H    LEU   5           H        LEU   5  -1.434  -3.989   8.521
   32    HA   LEU   5           HA       LEU   5  -3.794  -5.820   8.642
   33   1HB   LEU   5          1HB       LEU   5  -3.053  -4.165   6.589
   34   2HB   LEU   5          2HB       LEU   5  -2.028  -5.525   6.256
   35    HG   LEU   5           HG       LEU   5  -4.088  -6.999   6.184
   36   1HD1  LEU   5          1HD1      LEU   5  -5.534  -5.364   7.515
   37   2HD1  LEU   5          2HD1      LEU   5  -5.538  -4.322   6.085
   38   3HD1  LEU   5          3HD1      LEU   5  -6.248  -5.926   6.001
   39   1HD2  LEU   5          1HD2      LEU   5  -3.645  -4.677   4.264
   40   2HD2  LEU   5          2HD2      LEU   5  -3.236  -6.390   4.049
   41   3HD2  LEU   5          3HD2      LEU   5  -4.919  -5.860   3.970
   42    H    THR   6           H        THR   6  -3.313  -8.122   7.973
   43    HA   THR   6           HA       THR   6  -0.471  -8.848   8.152
   44    HB   THR   6           HB       THR   6  -0.980 -10.827   9.486
   45    HG1  THR   6           1HG      THR   6  -2.876 -10.999  10.558
   46   1HG2  THR   6          1HG2      THR   6  -1.796  -8.278  10.942
   47   2HG2  THR   6          2HG2      THR   6  -1.134  -9.761  11.663
   48   3HG2  THR   6          3HG2      THR   6  -0.125  -8.774  10.594
   49    H    ASP   7           H        ASP   7  -2.856 -11.194   8.027
   50    HA   ASP   7           HA       ASP   7  -2.084 -11.893   5.204
   51   1HB   ASP   7          1HB       ASP   7  -2.242 -13.571   7.742
   52   2HB   ASP   7          2HB       ASP   7  -2.031 -14.246   6.115
   53    H    ALA   8           H        ALA   8  -4.258 -13.410   7.576
   54    HA   ALA   8           HA       ALA   8  -6.503 -13.909   5.958
   55   1HB   ALA   8          1HB       ALA   8  -6.320 -12.954   8.865
   56   2HB   ALA   8          2HB       ALA   8  -7.740 -13.719   8.127
   57   3HB   ALA   8          3HB       ALA   8  -6.228 -14.647   8.325
   58    H    ASN   9           H        ASN   9  -5.377 -10.969   7.531
   59    HA   ASN   9           HA       ASN   9  -7.757  -9.385   7.086
   60   1HB   ASN   9          1HB       ASN   9  -4.933  -8.735   7.900
   61   2HB   ASN   9          2HB       ASN   9  -6.242  -7.558   7.816
   62   1HD2  ASN   9          1HD2      ASN   9  -4.605  -9.610  10.019
   63   2HD2  ASN   9          2HD2      ASN   9  -5.924  -9.610  11.190
   64    H    PHE  10           H        PHE  10  -4.884 -10.248   5.223
   65    HA   PHE  10           HA       PHE  10  -4.850  -7.940   3.494
   66   1HB   PHE  10          1HB       PHE  10  -2.974  -9.607   3.872
   67   2HB   PHE  10          2HB       PHE  10  -3.826 -10.710   2.814
   68    HD1  PHE  10           1HD      PHE  10  -4.440  -9.749   0.367
   69    HD2  PHE  10           2HD      PHE  10  -1.346  -8.191   2.954
   70    HE1  PHE  10           1HE      PHE  10  -3.406  -8.601  -1.539
   71    HE2  PHE  10           2HE      PHE  10  -0.320  -7.094   1.048
   72    HZ   PHE  10           HZ       PHE  10  -1.317  -7.275  -1.222
   73    H    GLN  11           H        GLN  11  -5.907 -11.311   2.814
   74    HA   GLN  11           HA       GLN  11  -7.244 -10.528   0.450
   75   1HB   GLN  11          1HB       GLN  11  -6.436 -12.877   1.292
   76   2HB   GLN  11          2HB       GLN  11  -8.068 -13.013   1.964
   77   1HG   GLN  11          1HG       GLN  11  -9.010 -12.564  -0.307
   78   2HG   GLN  11          2HG       GLN  11  -7.374 -12.371  -0.951
   79   1HE2  GLN  11          1HE2      GLN  11  -5.850 -14.331  -0.806
   80   2HE2  GLN  11          2HE2      GLN  11  -6.640 -15.896  -0.934
   81    H    GLN  12           H        GLN  12  -8.454 -10.820   3.830
   82    HA   GLN  12           HA       GLN  12 -11.190 -10.312   3.066
   83   1HB   GLN  12          1HB       GLN  12 -10.313 -11.612   5.075
   84   2HB   GLN  12          2HB       GLN  12  -9.961 -10.066   5.841
   85   1HG   GLN  12          1HG       GLN  12 -12.743 -10.251   4.801
   86   2HG   GLN  12          2HG       GLN  12 -12.345 -11.555   5.907
   87   1HE2  GLN  12          1HE2      GLN  12 -12.172  -7.964   5.645
   88   2HE2  GLN  12          2HE2      GLN  12 -12.457  -7.700   7.380
   89    H    ALA  13           H        ALA  13  -8.506  -8.090   3.303
   90    HA   ALA  13           HA       ALA  13 -10.319  -5.839   3.714
   91   1HB   ALA  13          1HB       ALA  13  -8.269  -4.463   3.499
   92   2HB   ALA  13          2HB       ALA  13  -8.184  -5.651   4.809
   93   3HB   ALA  13          3HB       ALA  13  -7.316  -5.946   3.279
   94    H    ILE  14           H        ILE  14  -8.119  -7.181   1.178
   95    HA   ILE  14           HA       ILE  14  -8.648  -5.167  -0.730
   96    HB   ILE  14           HB       ILE  14  -7.688  -6.684  -2.390
   97   1HG1  ILE  14          1HG1      ILE  14  -7.816  -8.784  -0.278
   98   2HG1  ILE  14          2HG1      ILE  14  -8.785  -8.754  -1.738
   99   1HG2  ILE  14          1HG2      ILE  14  -5.490  -6.838  -1.390
  100   2HG2  ILE  14          2HG2      ILE  14  -6.276  -5.386  -0.772
  101   3HG2  ILE  14          3HG2      ILE  14  -6.162  -6.830   0.243
  102   1HD1  ILE  14          1HD1      ILE  14  -5.775  -9.141  -1.593
  103   2HD1  ILE  14          2HD1      ILE  14  -7.000 -10.301  -2.124
  104   3HD1  ILE  14          3HD1      ILE  14  -6.672  -8.863  -3.106
  105    H    GLN  15           H        GLN  15 -10.706  -7.737   0.180
  106    HA   GLN  15           HA       GLN  15 -12.438  -7.836  -2.087
  107   1HB   GLN  15          1HB       GLN  15 -13.962  -8.976  -0.654
  108   2HB   GLN  15          2HB       GLN  15 -12.332  -9.503  -0.277
  109   1HG   GLN  15          1HG       GLN  15 -13.279  -9.283   1.830
  110   2HG   GLN  15          2HG       GLN  15 -12.377  -7.781   1.644
  111   1HE2  GLN  15          1HE2      GLN  15 -15.734  -8.973   0.769
  112   2HE2  GLN  15          2HE2      GLN  15 -16.499  -7.536   1.435
  113    H    GLY  16           H        GLY  16 -11.963  -5.231   0.225
  114   1HA   GLY  16          1HA       GLY  16 -14.588  -4.238   0.382
  115   2HA   GLY  16          2HA       GLY  16 -13.084  -3.336   0.665
  116    H    ASP  17           H        ASP  17 -15.635  -2.634  -0.724
  117    HA   ASP  17           HA       ASP  17 -15.246  -2.578  -3.550
  118   1HB   ASP  17          1HB       ASP  17 -17.419  -2.610  -2.319
  119   2HB   ASP  17          2HB       ASP  17 -17.130  -0.947  -1.801
  120    H    GLY  18           H        GLY  18 -14.196  -0.358  -1.090
  121   1HA   GLY  18          1HA       GLY  18 -13.953   1.941  -2.947
  122   2HA   GLY  18          2HA       GLY  18 -13.716   1.955  -1.192
  123    HA   PRO  19           HA       PRO  19  -9.456   1.953  -3.230
  124   1HB   PRO  19          1HB       PRO  19  -8.562   4.213  -1.799
  125   2HB   PRO  19          2HB       PRO  19  -9.161   4.190  -3.452
  126   1HG   PRO  19          1HG       PRO  19 -10.667   4.839  -0.936
  127   2HG   PRO  19          2HG       PRO  19 -10.761   5.660  -2.520
  128   1HD   PRO  19          1HD       PRO  19 -12.635   3.900  -1.651
  129   2HD   PRO  19          2HD       PRO  19 -12.167   3.972  -3.376
  130    H    VAL  20           H        VAL  20  -9.302  -0.012  -2.103
  131    HA   VAL  20           HA       VAL  20  -8.164   0.046   0.634
  132    HB   VAL  20           HB       VAL  20  -8.570  -2.168  -1.445
  133   1HG1  VAL  20          1HG1      VAL  20  -6.588  -2.767  -0.119
  134   2HG1  VAL  20          2HG1      VAL  20  -7.355  -2.206   1.384
  135   3HG1  VAL  20          3HG1      VAL  20  -7.934  -3.667   0.588
  136   1HG2  VAL  20          1HG2      VAL  20 -10.255  -3.029   0.007
  137   2HG2  VAL  20          2HG2      VAL  20  -9.899  -1.835   1.272
  138   3HG2  VAL  20          3HG2      VAL  20 -10.639  -1.332  -0.267
  139    H    LEU  21           H        LEU  21  -5.939   0.051   0.910
  140    HA   LEU  21           HA       LEU  21  -4.322  -0.841  -1.317
  141   1HB   LEU  21          1HB       LEU  21  -2.824   1.085  -1.481
  142   2HB   LEU  21          2HB       LEU  21  -4.430   1.463  -2.061
  143    HG   LEU  21           HG       LEU  21  -3.790   2.104   0.777
  144   1HD1  LEU  21          1HD1      LEU  21  -1.810   2.892  -0.385
  145   2HD1  LEU  21          2HD1      LEU  21  -2.824   3.822  -1.526
  146   3HD1  LEU  21          3HD1      LEU  21  -2.775   4.246   0.201
  147   1HD2  LEU  21          1HD2      LEU  21  -5.207   4.103   0.299
  148   2HD2  LEU  21          2HD2      LEU  21  -5.391   3.562  -1.380
  149   3HD2  LEU  21          3HD2      LEU  21  -6.069   2.606  -0.047
  150    H    VAL  22           H        VAL  22  -2.053  -1.041  -0.773
  151    HA   VAL  22           HA       VAL  22  -1.711  -1.628   2.144
  152    HB   VAL  22           HB       VAL  22  -1.028  -3.238  -0.343
  153   1HG1  VAL  22          1HG1      VAL  22   0.964  -3.339   1.042
  154   2HG1  VAL  22          2HG1      VAL  22   0.001  -3.626   2.495
  155   3HG1  VAL  22          3HG1      VAL  22   0.097  -4.851   1.195
  156   1HG2  VAL  22          1HG2      VAL  22  -3.303  -3.554   0.591
  157   2HG2  VAL  22          2HG2      VAL  22  -2.317  -5.000   0.840
  158   3HG2  VAL  22          3HG2      VAL  22  -2.606  -3.882   2.190
  159    H    ASP  23           H        ASP  23  -0.040  -0.700   3.060
  160    HA   ASP  23           HA       ASP  23   2.289   0.306   1.462
  161   1HB   ASP  23          1HB       ASP  23   1.569   1.549   3.566
  162   2HB   ASP  23          2HB       ASP  23   1.926   0.130   4.473
  163    H    PHE  24           H        PHE  24   3.671  -1.250   0.801
  164    HA   PHE  24           HA       PHE  24   4.118  -3.662   2.497
  165   1HB   PHE  24          1HB       PHE  24   4.526  -3.053  -0.406
  166   2HB   PHE  24          2HB       PHE  24   5.435  -4.332   0.349
  167    HD1  PHE  24           1HD      PHE  24   2.458  -3.660  -1.425
  168    HD2  PHE  24           2HD      PHE  24   4.098  -6.029   1.788
  169    HE1  PHE  24           1HE      PHE  24   0.873  -5.501  -1.948
  170    HE2  PHE  24           2HE      PHE  24   2.631  -7.904   1.161
  171    HZ   PHE  24           HZ       PHE  24   1.130  -7.697  -0.774
  172    H    TRP  25           H        TRP  25   5.602  -3.231   3.849
  173    HA   TRP  25           HA       TRP  25   8.157  -2.021   2.972
  174   1HB   TRP  25          1HB       TRP  25   8.384  -0.775   4.971
  175   2HB   TRP  25          2HB       TRP  25   6.782  -0.395   4.370
  176    HD1  TRP  25           HD       TRP  25   4.665  -1.579   5.793
  177    HE1  TRP  25           1HE      TRP  25   4.531  -2.451   8.178
  178    HE3  TRP  25           3HE      TRP  25   9.634  -1.376   7.017
  179    HZ2  TRP  25           2HZ      TRP  25   6.397  -3.206  10.323
  180    HZ3  TRP  25           3HZ      TRP  25  10.415  -2.128   9.243
  181    HH2  TRP  25           HH       TRP  25   8.804  -3.077  10.886
  182    H    ALA  26           H        ALA  26   9.827  -2.765   4.998
  183    HA   ALA  26           HA       ALA  26   9.197  -5.401   6.013
  184   1HB   ALA  26          1HB       ALA  26  10.871  -6.608   4.880
  185   2HB   ALA  26          2HB       ALA  26  10.184  -5.625   3.569
  186   3HB   ALA  26          3HB       ALA  26  11.708  -5.162   4.318
  187    H    ALA  27           H        ALA  27  10.963  -6.141   7.453
  188    HA   ALA  27           HA       ALA  27  11.806  -4.002   9.116
  189   1HB   ALA  27          1HB       ALA  27  11.160  -6.208   9.941
  190   2HB   ALA  27          2HB       ALA  27  12.582  -6.941   9.159
  191   3HB   ALA  27          3HB       ALA  27  12.788  -5.778  10.492
  192    H    TRP  28           H        TRP  28  13.422  -5.114   6.295
  193    HA   TRP  28           HA       TRP  28  16.016  -4.044   7.337
  194   1HB   TRP  28          1HB       TRP  28  17.159  -5.782   6.520
  195   2HB   TRP  28          2HB       TRP  28  15.647  -6.624   6.793
  196    HD1  TRP  28           HD       TRP  28  18.051  -5.487   4.157
  197    HE1  TRP  28           1HE      TRP  28  17.345  -6.203   1.806
  198    HE3  TRP  28           3HE      TRP  28  13.437  -7.489   5.244
  199    HZ2  TRP  28           2HZ      TRP  28  14.948  -7.143   0.506
  200    HZ3  TRP  28           3HZ      TRP  28  11.952  -8.215   3.396
  201    HH2  TRP  28           HH       TRP  28  12.675  -7.950   1.036
  202    H    CYS  29           H        CYS  29  13.661  -3.525   4.886
  203    HA   CYS  29           HA       CYS  29  15.308  -3.271   2.622
  204   1HB   CYS  29          1HB       CYS  29  13.196  -2.451   1.570
  205   2HB   CYS  29          2HB       CYS  29  13.182  -4.027   2.341
  206    H    GLY  30           H        GLY  30  16.377  -1.396   4.454
  207   1HA   GLY  30          1HA       GLY  30  16.958   0.820   4.831
  208   2HA   GLY  30          2HA       GLY  30  17.355   0.673   3.131
  209    HA   PRO  31           HA       PRO  31  14.912   4.342   2.610
  210   1HB   PRO  31          1HB       PRO  31  14.063   4.063  -0.040
  211   2HB   PRO  31          2HB       PRO  31  15.673   4.645   0.496
  212   1HG   PRO  31          1HG       PRO  31  14.864   1.868  -0.380
  213   2HG   PRO  31          2HG       PRO  31  16.337   2.794  -0.821
  214   1HD   PRO  31          1HD       PRO  31  16.408   0.892   1.090
  215   2HD   PRO  31          2HD       PRO  31  17.310   2.423   1.311
  216    H    CYS  32           H        CYS  32  13.320   1.242   2.146
  217    HA   CYS  32           HA       CYS  32  10.645   2.209   1.937
  218   1HB   CYS  32          1HB       CYS  32   9.943   0.144   2.995
  219   2HB   CYS  32          2HB       CYS  32  11.233  -0.204   1.850
  220    H    ARG  33           H        ARG  33  12.858   2.128   4.721
  221    HA   ARG  33           HA       ARG  33  10.896   2.816   6.694
  222   1HB   ARG  33          1HB       ARG  33  13.329   1.792   6.849
  223   2HB   ARG  33          2HB       ARG  33  13.829   3.487   6.917
  224   1HG   ARG  33          1HG       ARG  33  12.283   3.772   8.909
  225   2HG   ARG  33          2HG       ARG  33  11.899   2.043   8.794
  226   1HD   ARG  33          1HD       ARG  33  14.373   1.557   9.024
  227   2HD   ARG  33          2HD       ARG  33  14.644   3.273   9.339
  228    HE   ARG  33           HE       ARG  33  13.615   1.246  11.113
  229   1HH1  ARG  33          2HH2      ARG  33  13.444   4.724  10.524
  230   2HH1  ARG  33          1HH2      ARG  33  13.095   5.155  12.163
  231   1HH2  ARG  33          2HH1      ARG  33  13.136   1.779  13.299
  232   2HH2  ARG  33          1HH1      ARG  33  12.905   3.422  13.772
  233    H    MET  34           H        MET  34  12.133   4.721   4.125
  234    HA   MET  34           HA       MET  34  11.580   7.237   5.547
  235   1HB   MET  34          1HB       MET  34  13.038   6.700   2.931
  236   2HB   MET  34          2HB       MET  34  12.790   8.287   3.674
  237   1HG   MET  34          1HG       MET  34  14.082   7.462   5.673
  238   2HG   MET  34          2HG       MET  34  14.506   6.026   4.732
  239   1HE   MET  34          1HE       MET  34  14.848   7.328   1.754
  240   2HE   MET  34          2HE       MET  34  16.574   7.724   1.739
  241   3HE   MET  34          3HE       MET  34  16.034   6.174   2.412
  242    H    MET  35           H        MET  35  10.211   5.012   3.331
  243    HA   MET  35           HA       MET  35   8.470   7.054   2.069
  244   1HB   MET  35          1HB       MET  35   9.650   5.213   0.681
  245   2HB   MET  35          2HB       MET  35   8.535   4.081   1.454
  246   1HG   MET  35          1HG       MET  35   6.633   5.600   0.647
  247   2HG   MET  35          2HG       MET  35   7.825   6.502  -0.257
  248   1HE   MET  35          1HE       MET  35   5.947   4.641  -3.113
  249   2HE   MET  35          2HE       MET  35   5.232   5.299  -1.622
  250   3HE   MET  35          3HE       MET  35   6.504   6.205  -2.473
  251    H    ALA  36           H        ALA  36   8.513   4.157   4.199
  252    HA   ALA  36           HA       ALA  36   5.788   3.812   4.650
  253   1HB   ALA  36          1HB       ALA  36   8.098   3.479   6.600
  254   2HB   ALA  36          2HB       ALA  36   6.450   2.838   6.806
  255   3HB   ALA  36          3HB       ALA  36   7.454   2.268   5.467
  256    HA   PRO  37           HA       PRO  37   5.670   7.286   7.927
  257   1HB   PRO  37          1HB       PRO  37   7.524   9.336   7.819
  258   2HB   PRO  37          2HB       PRO  37   7.634   7.912   8.896
  259   1HG   PRO  37          1HG       PRO  37   8.954   8.314   6.199
  260   2HG   PRO  37          2HG       PRO  37   9.697   7.718   7.718
  261   1HD   PRO  37          1HD       PRO  37   8.900   5.992   5.824
  262   2HD   PRO  37          2HD       PRO  37   8.598   5.625   7.540
  263    H    VAL  38           H        VAL  38   6.869   7.929   4.588
  264    HA   VAL  38           HA       VAL  38   5.211  10.301   4.303
  265    HB   VAL  38           HB       VAL  38   7.262   9.019   2.807
  266   1HG1  VAL  38          1HG1      VAL  38   4.817   9.523   1.063
  267   2HG1  VAL  38          2HG1      VAL  38   6.472   9.274   0.486
  268   3HG1  VAL  38          3HG1      VAL  38   5.644   7.964   1.322
  269   1HG2  VAL  38          1HG2      VAL  38   7.129  11.388   3.420
  270   2HG2  VAL  38          2HG2      VAL  38   7.382  11.176   1.683
  271   3HG2  VAL  38          3HG2      VAL  38   5.769  11.613   2.297
  272    H    LEU  39           H        LEU  39   4.768   6.808   3.777
  273    HA   LEU  39           HA       LEU  39   2.129   7.005   2.720
  274   1HB   LEU  39          1HB       LEU  39   3.955   4.851   3.743
  275   2HB   LEU  39          2HB       LEU  39   2.266   4.496   3.679
  276    HG   LEU  39           HG       LEU  39   2.256   4.081   1.515
  277   1HD1  LEU  39          1HD1      LEU  39   3.980   6.509   0.909
  278   2HD1  LEU  39          2HD1      LEU  39   3.307   5.397  -0.294
  279   3HD1  LEU  39          3HD1      LEU  39   2.215   6.361   0.689
  280   1HD2  LEU  39          1HD2      LEU  39   5.271   4.388   1.732
  281   2HD2  LEU  39          2HD2      LEU  39   4.345   2.962   2.163
  282   3HD2  LEU  39          3HD2      LEU  39   4.410   3.467   0.474
  283    H    GLU  40           H        GLU  40   3.440   6.739   6.042
  284    HA   GLU  40           HA       GLU  40   0.841   6.448   7.233
  285   1HB   GLU  40          1HB       GLU  40   3.133   6.007   8.331
  286   2HB   GLU  40          2HB       GLU  40   3.276   7.752   8.517
  287   1HG   GLU  40          1HG       GLU  40   2.470   6.997  10.572
  288   2HG   GLU  40          2HG       GLU  40   1.027   7.655   9.799
  289    H    GLU  41           H        GLU  41   2.866   9.312   6.456
  290    HA   GLU  41           HA       GLU  41   0.936  11.259   7.286
  291   1HB   GLU  41          1HB       GLU  41   3.289  11.730   6.898
  292   2HB   GLU  41          2HB       GLU  41   3.139  11.372   5.184
  293   1HG   GLU  41          1HG       GLU  41   1.468  13.582   6.446
  294   2HG   GLU  41          2HG       GLU  41   3.180  13.849   6.052
  295    H    PHE  42           H        PHE  42   1.388   9.577   4.127
  296    HA   PHE  42           HA       PHE  42  -0.842  10.688   2.752
  297   1HB   PHE  42          1HB       PHE  42   1.006   9.204   1.828
  298   2HB   PHE  42          2HB       PHE  42   0.211   7.837   2.559
  299    HD1  PHE  42           1HD      PHE  42   0.246  10.118  -0.266
  300    HD2  PHE  42           2HD      PHE  42  -1.960   6.981   1.721
  301    HE1  PHE  42           1HE      PHE  42  -0.953   9.638  -2.356
  302    HE2  PHE  42           2HE      PHE  42  -3.158   6.501  -0.407
  303    HZ   PHE  42           HZ       PHE  42  -2.627   7.830  -2.451
  304    H    ALA  43           H        ALA  43  -0.740   7.861   4.991
  305    HA   ALA  43           HA       ALA  43  -3.482   7.270   4.863
  306   1HB   ALA  43          1HB       ALA  43  -3.131   6.037   6.938
  307   2HB   ALA  43          2HB       ALA  43  -1.726   5.785   5.878
  308   3HB   ALA  43          3HB       ALA  43  -1.621   6.891   7.258
  309    H    GLU  44           H        GLU  44  -1.731   9.308   7.232
  310    HA   GLU  44           HA       GLU  44  -3.947  10.139   8.733
  311   1HB   GLU  44          1HB       GLU  44  -1.510  10.419   9.260
  312   2HB   GLU  44          2HB       GLU  44  -1.435  11.749   8.093
  313   1HG   GLU  44          1HG       GLU  44  -3.096  13.012   9.423
  314   2HG   GLU  44          2HG       GLU  44  -3.256  11.648  10.539
  315    H    ALA  45           H        ALA  45  -2.493  11.682   5.846
  316    HA   ALA  45           HA       ALA  45  -4.356  13.821   5.643
  317   1HB   ALA  45          1HB       ALA  45  -2.673  12.491   3.475
  318   2HB   ALA  45          2HB       ALA  45  -3.397  14.115   3.386
  319   3HB   ALA  45          3HB       ALA  45  -2.117  13.780   4.568
  320    H    HIS  46           H        HIS  46  -4.935  10.492   4.949
  321    HA   HIS  46           HA       HIS  46  -7.327  11.181   3.296
  322   1HB   HIS  46          1HB       HIS  46  -5.467   8.964   2.729
  323   2HB   HIS  46          2HB       HIS  46  -6.929   9.339   1.848
  324    HD1  HIS  46           1HD      HIS  46  -5.960  12.631   1.971
  325    HD2  HIS  46           2HD      HIS  46  -4.022   9.209   0.449
  326    HE1  HIS  46           1HE      HIS  46  -4.490  13.404  -0.051
  327    HE2  HIS  46           2HE      HIS  46  -3.381  11.349  -0.970
  328    H    ALA  47           H        ALA  47  -6.739  10.293   6.188
  329    HA   ALA  47           HA       ALA  47  -6.937   7.802   6.790
  330   1HB   ALA  47          1HB       ALA  47  -7.823   8.437   8.996
  331   2HB   ALA  47          2HB       ALA  47  -6.656   9.639   8.406
  332   3HB   ALA  47          3HB       ALA  47  -8.403   9.978   8.336
  333    H    ASP  48           H        ASP  48  -9.886   9.549   5.924
  334    HA   ASP  48           HA       ASP  48 -11.408   6.995   6.166
  335   1HB   ASP  48          1HB       ASP  48 -12.334   9.814   6.767
  336   2HB   ASP  48          2HB       ASP  48 -13.385   8.392   6.722
  337    H    LYS  49           H        LYS  49 -10.201   9.064   3.778
  338    HA   LYS  49           HA       LYS  49 -12.482   8.575   1.960
  339   1HB   LYS  49          1HB       LYS  49 -11.142  10.626   1.659
  340   2HB   LYS  49          2HB       LYS  49  -9.686   9.662   1.369
  341   1HG   LYS  49          1HG       LYS  49 -10.585   8.663  -0.618
  342   2HG   LYS  49          2HG       LYS  49 -12.205   9.272  -0.308
  343   1HD   LYS  49          1HD       LYS  49  -9.861  11.118  -0.953
  344   2HD   LYS  49          2HD       LYS  49 -10.844  10.324  -2.179
  345   1HE   LYS  49          1HE       LYS  49 -12.915  11.309  -1.005
  346   2HE   LYS  49          2HE       LYS  49 -11.785  12.367  -0.133
  347   1HZ   LYS  49          1HZ       LYS  49 -12.481  13.507  -2.126
  348   2HZ   LYS  49          2HZ       LYS  49 -10.958  12.937  -2.483
  349   3HZ   LYS  49          3HZ       LYS  49 -12.249  12.191  -3.065
  350    H    VAL  50           H        VAL  50  -9.274   7.221   2.829
  351    HA   VAL  50           HA       VAL  50  -9.850   4.940   1.004
  352    HB   VAL  50           HB       VAL  50  -7.597   4.811   0.318
  353   1HG1  VAL  50          1HG1      VAL  50  -8.977   6.575  -0.857
  354   2HG1  VAL  50          2HG1      VAL  50  -8.173   7.793   0.149
  355   3HG1  VAL  50          3HG1      VAL  50  -7.226   6.785  -0.967
  356   1HG2  VAL  50          1HG2      VAL  50  -6.339   5.327   2.281
  357   2HG2  VAL  50          2HG2      VAL  50  -5.836   6.473   1.036
  358   3HG2  VAL  50          3HG2      VAL  50  -6.944   6.989   2.329
  359    H    THR  51           H        THR  51  -8.605   2.916   1.656
  360    HA   THR  51           HA       THR  51  -8.069   2.937   4.511
  361    HB   THR  51           HB       THR  51 -10.228   1.952   4.112
  362    HG1  THR  51           1HG      THR  51  -9.648   1.175   5.859
  363   1HG2  THR  51          1HG2      THR  51  -9.807   0.815   1.965
  364   2HG2  THR  51          2HG2      THR  51  -8.783  -0.369   2.833
  365   3HG2  THR  51          3HG2      THR  51 -10.512  -0.233   3.215
  366    H    VAL  52           H        VAL  52  -6.010   3.287   4.381
  367    HA   VAL  52           HA       VAL  52  -4.325   1.560   2.714
  368    HB   VAL  52           HB       VAL  52  -3.911   3.635   2.271
  369   1HG1  VAL  52          1HG1      VAL  52  -4.890   4.980   4.034
  370   2HG1  VAL  52          2HG1      VAL  52  -3.602   4.472   5.143
  371   3HG1  VAL  52          3HG1      VAL  52  -3.229   5.496   3.730
  372   1HG2  VAL  52          1HG2      VAL  52  -1.861   2.311   2.521
  373   2HG2  VAL  52          2HG2      VAL  52  -1.556   4.045   2.708
  374   3HG2  VAL  52          3HG2      VAL  52  -1.628   3.008   4.142
  375    H    ALA  53           H        ALA  53  -3.387   0.000   3.449
  376    HA   ALA  53           HA       ALA  53  -3.422  -0.272   6.395
  377   1HB   ALA  53          1HB       ALA  53  -5.377  -1.295   5.287
  378   2HB   ALA  53          2HB       ALA  53  -4.289  -2.381   4.391
  379   3HB   ALA  53          3HB       ALA  53  -4.388  -2.454   6.177
  380    H    LYS  54           H        LYS  54  -1.380  -0.236   6.966
  381    HA   LYS  54           HA       LYS  54   0.696  -1.209   5.237
  382   1HB   LYS  54          1HB       LYS  54   2.299  -0.490   6.852
  383   2HB   LYS  54          2HB       LYS  54   1.148   0.783   6.497
  384   1HG   LYS  54          1HG       LYS  54   0.987  -0.989   8.955
  385   2HG   LYS  54          2HG       LYS  54   1.879   0.538   8.849
  386   1HD   LYS  54          1HD       LYS  54  -0.419   1.530   8.022
  387   2HD   LYS  54          2HD       LYS  54  -1.105   0.075   8.761
  388   1HE   LYS  54          1HE       LYS  54  -1.246   1.886  10.337
  389   2HE   LYS  54          2HE       LYS  54  -0.052   0.719  10.939
  390   1HZ   LYS  54          1HZ       LYS  54   0.682   3.160  11.012
  391   2HZ   LYS  54          2HZ       LYS  54   1.684   2.208  10.092
  392   3HZ   LYS  54          3HZ       LYS  54   0.565   3.243   9.464
  393    H    LEU  55           H        LEU  55   1.992  -2.881   5.262
  394    HA   LEU  55           HA       LEU  55   2.012  -4.655   7.591
  395   1HB   LEU  55          1HB       LEU  55   1.319  -6.681   6.466
  396   2HB   LEU  55          2HB       LEU  55   0.074  -5.484   6.455
  397    HG   LEU  55           HG       LEU  55   1.465  -5.065   3.984
  398   1HD1  LEU  55          1HD1      LEU  55   0.945  -8.012   4.551
  399   2HD1  LEU  55          2HD1      LEU  55   1.296  -7.327   2.959
  400   3HD1  LEU  55          3HD1      LEU  55   2.531  -7.269   4.228
  401   1HD2  LEU  55          1HD2      LEU  55  -1.093  -6.588   4.585
  402   2HD2  LEU  55          2HD2      LEU  55  -0.960  -4.814   4.372
  403   3HD2  LEU  55          3HD2      LEU  55  -0.656  -5.900   3.019
  404    H    ASN  56           H        ASN  56   3.399  -6.578   7.219
  405    HA   ASN  56           HA       ASN  56   5.990  -5.594   6.225
  406   1HB   ASN  56          1HB       ASN  56   5.816  -6.179   8.586
  407   2HB   ASN  56          2HB       ASN  56   5.101  -7.749   8.195
  408   1HD2  ASN  56          1HD2      ASN  56   6.716  -8.867   9.378
  409   2HD2  ASN  56          2HD2      ASN  56   8.367  -8.985   8.739
  410    H    VAL  57           H        VAL  57   6.543  -6.253   4.241
  411    HA   VAL  57           HA       VAL  57   5.253  -8.357   2.836
  412    HB   VAL  57           HB       VAL  57   6.503  -6.256   2.072
  413   1HG1  VAL  57          1HG1      VAL  57   8.793  -6.581   1.254
  414   2HG1  VAL  57          2HG1      VAL  57   8.748  -7.039   2.962
  415   3HG1  VAL  57          3HG1      VAL  57   8.768  -8.280   1.700
  416   1HG2  VAL  57          1HG2      VAL  57   6.618  -8.813   0.460
  417   2HG2  VAL  57          2HG2      VAL  57   5.240  -7.728   0.621
  418   3HG2  VAL  57          3HG2      VAL  57   6.708  -7.145  -0.168
  419    H    ASP  58           H        ASP  58   7.955  -8.349   5.041
  420    HA   ASP  58           HA       ASP  58   9.354 -10.646   4.041
  421   1HB   ASP  58          1HB       ASP  58   9.901  -8.504   5.649
  422   2HB   ASP  58          2HB       ASP  58   9.613  -9.710   6.881
  423    H    GLU  59           H        GLU  59   6.519 -10.353   5.501
  424    HA   GLU  59           HA       GLU  59   6.534 -12.913   7.051
  425   1HB   GLU  59          1HB       GLU  59   6.745 -11.102   8.507
  426   2HB   GLU  59          2HB       GLU  59   5.561 -10.130   7.614
  427   1HG   GLU  59          1HG       GLU  59   3.727 -11.483   8.418
  428   2HG   GLU  59          2HG       GLU  59   4.846 -12.585   9.226
  429    H    ASN  60           H        ASN  60   4.548 -10.630   5.078
  430    HA   ASN  60           HA       ASN  60   2.355 -12.605   5.110
  431   1HB   ASN  60          1HB       ASN  60   1.466 -10.461   5.333
  432   2HB   ASN  60          2HB       ASN  60   2.492  -9.761   4.092
  433   1HD2  ASN  60          1HD2      ASN  60  -0.703 -10.372   4.543
  434   2HD2  ASN  60          2HD2      ASN  60  -1.079 -10.804   2.860
  435    HA   PRO  61           HA       PRO  61   3.691 -13.926   0.948
  436   1HB   PRO  61          1HB       PRO  61   2.741 -16.451   0.959
  437   2HB   PRO  61          2HB       PRO  61   4.189 -16.008   1.915
  438   1HG   PRO  61          1HG       PRO  61   1.317 -16.231   2.895
  439   2HG   PRO  61          2HG       PRO  61   2.786 -16.973   3.609
  440   1HD   PRO  61          1HD       PRO  61   1.764 -14.584   4.512
  441   2HD   PRO  61          2HD       PRO  61   3.505 -14.930   4.503
  442    H    GLU  62           H        GLU  62   0.525 -13.716   2.461
  443    HA   GLU  62           HA       GLU  62  -1.093 -14.854   0.446
  444   1HB   GLU  62          1HB       GLU  62  -1.951 -14.664   2.634
  445   2HB   GLU  62          2HB       GLU  62  -1.656 -12.931   2.716
  446   1HG   GLU  62          1HG       GLU  62  -4.089 -13.710   2.386
  447   2HG   GLU  62          2HG       GLU  62  -3.490 -12.383   1.392
  448    H    THR  63           H        THR  63  -1.254 -14.207  -1.551
  449    HA   THR  63           HA       THR  63  -1.587 -13.101  -3.449
  450    HB   THR  63           HB       THR  63  -2.682 -10.990  -1.582
  451    HG1  THR  63           1HG      THR  63  -4.011 -12.818  -1.749
  452   1HG2  THR  63          1HG2      THR  63  -1.955  -9.777  -3.616
  453   2HG2  THR  63          2HG2      THR  63  -2.823 -10.970  -4.617
  454   3HG2  THR  63          3HG2      THR  63  -3.719  -9.910  -3.522
  455    H    THR  64           H        THR  64   0.290 -11.483  -1.084
  456    HA   THR  64           HA       THR  64   2.036  -9.832  -2.497
  457    HB   THR  64           HB       THR  64   2.574 -11.736  -0.177
  458    HG1  THR  64           1HG      THR  64   1.404 -10.436   0.922
  459   1HG2  THR  64          1HG2      THR  64   4.208 -10.083   0.603
  460   2HG2  THR  64          2HG2      THR  64   4.692 -10.689  -0.988
  461   3HG2  THR  64          3HG2      THR  64   3.921  -9.089  -0.816
  462    H    SER  65           H        SER  65   2.375 -13.371  -1.870
  463    HA   SER  65           HA       SER  65   4.727 -13.787  -3.378
  464   1HB   SER  65          1HB       SER  65   3.687 -15.341  -1.724
  465   2HB   SER  65          2HB       SER  65   2.402 -15.702  -2.891
  466    HG   SER  65           HG       SER  65   4.190 -17.199  -2.869
  467    H    GLN  66           H        GLN  66   1.277 -14.008  -4.380
  468    HA   GLN  66           HA       GLN  66   1.706 -14.940  -7.007
  469   1HB   GLN  66          1HB       GLN  66  -0.485 -14.985  -5.940
  470   2HB   GLN  66          2HB       GLN  66  -0.541 -13.243  -5.839
  471   1HG   GLN  66          1HG       GLN  66  -1.985 -14.008  -7.607
  472   2HG   GLN  66          2HG       GLN  66  -0.700 -13.019  -8.272
  473   1HE2  GLN  66          1HE2      GLN  66   1.184 -14.225  -9.354
  474   2HE2  GLN  66          2HE2      GLN  66   0.761 -15.761 -10.131
  475    H    PHE  67           H        PHE  67   1.547 -11.550  -5.773
  476    HA   PHE  67           HA       PHE  67   1.883 -10.612  -8.561
  477   1HB   PHE  67          1HB       PHE  67   1.155  -9.245  -5.979
  478   2HB   PHE  67          2HB       PHE  67   1.614  -8.336  -7.416
  479    HD1  PHE  67           1HD      PHE  67  -0.950 -10.624  -6.017
  480    HD2  PHE  67           2HD      PHE  67   0.218  -8.261  -9.420
  481    HE1  PHE  67           1HE      PHE  67  -3.212 -10.905  -6.979
  482    HE2  PHE  67           2HE      PHE  67  -2.054  -8.536 -10.378
  483    HZ   PHE  67           HZ       PHE  67  -3.775  -9.856  -9.157
  484    H    GLY  68           H        GLY  68   4.106 -11.937  -6.697
  485   1HA   GLY  68          1HA       GLY  68   6.369 -11.938  -6.854
  486   2HA   GLY  68          2HA       GLY  68   6.237 -10.730  -8.143
  487    H    ILE  69           H        ILE  69   5.000 -10.269  -4.850
  488    HA   ILE  69           HA       ILE  69   6.138  -7.634  -4.912
  489    HB   ILE  69           HB       ILE  69   4.382  -9.094  -2.939
  490   1HG1  ILE  69          1HG1      ILE  69   3.342  -8.909  -5.152
  491   2HG1  ILE  69          2HG1      ILE  69   2.502  -7.961  -3.957
  492   1HG2  ILE  69          1HG2      ILE  69   3.587  -6.830  -2.271
  493   2HG2  ILE  69          2HG2      ILE  69   5.181  -7.264  -1.711
  494   3HG2  ILE  69          3HG2      ILE  69   5.011  -6.138  -3.075
  495   1HD1  ILE  69          1HD1      ILE  69   3.578  -5.889  -4.810
  496   2HD1  ILE  69          2HD1      ILE  69   4.475  -6.843  -6.011
  497   3HD1  ILE  69          3HD1      ILE  69   2.706  -6.744  -6.073
  498    H    MET  70           H        MET  70   8.321  -8.314  -4.938
  499    HA   MET  70           HA       MET  70   9.475  -8.400  -2.166
  500   1HB   MET  70          1HB       MET  70   9.907 -10.333  -3.772
  501   2HB   MET  70          2HB       MET  70  10.836  -9.206  -4.765
  502   1HG   MET  70          1HG       MET  70  12.330  -8.792  -2.785
  503   2HG   MET  70          2HG       MET  70  11.416  -9.995  -1.877
  504   1HE   MET  70          1HE       MET  70  10.961 -12.387  -4.006
  505   2HE   MET  70          2HE       MET  70  12.416 -13.339  -3.649
  506   3HE   MET  70          3HE       MET  70  11.511 -12.577  -2.322
  507    H    SER  71           H        SER  71   8.810  -6.289  -4.672
  508    HA   SER  71           HA       SER  71  11.397  -5.007  -4.943
  509   1HB   SER  71          1HB       SER  71   9.843  -5.360  -6.840
  510   2HB   SER  71          2HB       SER  71   8.654  -4.294  -6.059
  511    HG   SER  71           HG       SER  71  10.368  -2.710  -6.051
  512    H    ILE  72           H        ILE  72  10.233  -4.811  -2.227
  513    HA   ILE  72           HA       ILE  72   8.788  -2.481  -1.970
  514    HB   ILE  72           HB       ILE  72   8.905  -2.744   0.416
  515   1HG1  ILE  72          1HG1      ILE  72  11.187  -3.245   0.798
  516   2HG1  ILE  72          2HG1      ILE  72  10.114  -4.386   1.589
  517   1HG2  ILE  72          1HG2      ILE  72   7.406  -4.091  -1.000
  518   2HG2  ILE  72          2HG2      ILE  72   8.546  -5.445  -0.887
  519   3HG2  ILE  72          3HG2      ILE  72   7.769  -4.772   0.574
  520   1HD1  ILE  72          1HD1      ILE  72  12.056  -5.537   0.785
  521   2HD1  ILE  72          2HD1      ILE  72  10.683  -6.075  -0.195
  522   3HD1  ILE  72          3HD1      ILE  72  11.864  -4.901  -0.845
  523    HA   PRO  73           HA       PRO  73   8.496  -0.758   0.148
  524   1HB   PRO  73          1HB       PRO  73   7.956   1.824  -0.393
  525   2HB   PRO  73          2HB       PRO  73   9.033   1.289   0.912
  526   1HG   PRO  73          1HG       PRO  73   9.794   2.243  -1.869
  527   2HG   PRO  73          2HG       PRO  73  10.529   2.731  -0.313
  528   1HD   PRO  73          1HD       PRO  73  11.635   0.813  -1.923
  529   2HD   PRO  73          2HD       PRO  73  11.721   0.686  -0.146
  530    H    THR  74           H        THR  74   6.632  -1.367  -0.740
  531    HA   THR  74           HA       THR  74   6.030  -0.660  -3.578
  532    HB   THR  74           HB       THR  74   5.505  -3.299  -2.147
  533    HG1  THR  74           1HG      THR  74   6.901  -4.109  -3.669
  534   1HG2  THR  74          1HG2      THR  74   3.666  -2.985  -3.664
  535   2HG2  THR  74          2HG2      THR  74   4.750  -2.423  -4.951
  536   3HG2  THR  74          3HG2      THR  74   4.810  -4.103  -4.418
  537    H    LEU  75           H        LEU  75   3.809  -0.300  -4.034
  538    HA   LEU  75           HA       LEU  75   1.946  -0.174  -1.742
  539   1HB   LEU  75          1HB       LEU  75   2.930   2.074  -2.382
  540   2HB   LEU  75          2HB       LEU  75   2.114   1.919  -3.921
  541    HG   LEU  75           HG       LEU  75   0.412   1.421  -1.486
  542   1HD1  LEU  75          1HD1      LEU  75   0.135   3.852  -1.077
  543   2HD1  LEU  75          2HD1      LEU  75   1.764   3.269  -0.709
  544   3HD1  LEU  75          3HD1      LEU  75   1.464   4.168  -2.213
  545   1HD2  LEU  75          1HD2      LEU  75  -0.071   3.126  -3.961
  546   2HD2  LEU  75          2HD2      LEU  75  -0.504   1.404  -3.827
  547   3HD2  LEU  75          3HD2      LEU  75  -1.273   2.589  -2.776
  548    H    ILE  76           H        ILE  76   0.068  -1.360  -2.360
  549    HA   ILE  76           HA       ILE  76  -0.479  -1.487  -5.277
  550    HB   ILE  76           HB       ILE  76  -1.161  -3.663  -3.328
  551   1HG1  ILE  76          1HG1      ILE  76   1.013  -3.700  -5.463
  552   2HG1  ILE  76          2HG1      ILE  76   1.241  -3.768  -3.713
  553   1HG2  ILE  76          1HG2      ILE  76  -1.444  -3.514  -6.376
  554   2HG2  ILE  76          2HG2      ILE  76  -1.903  -4.909  -5.389
  555   3HG2  ILE  76          3HG2      ILE  76  -2.774  -3.417  -5.197
  556   1HD1  ILE  76          1HD1      ILE  76   1.391  -6.000  -4.215
  557   2HD1  ILE  76          2HD1      ILE  76  -0.321  -5.905  -3.858
  558   3HD1  ILE  76          3HD1      ILE  76   0.224  -5.923  -5.552
  559    H    LEU  77           H        LEU  77  -2.388  -0.854  -5.765
  560    HA   LEU  77           HA       LEU  77  -4.342   0.129  -3.735
  561   1HB   LEU  77          1HB       LEU  77  -3.279   1.428  -5.871
  562   2HB   LEU  77          2HB       LEU  77  -4.546   0.593  -6.716
  563    HG   LEU  77           HG       LEU  77  -4.635   2.824  -4.694
  564   1HD1  LEU  77          1HD1      LEU  77  -6.008   3.892  -6.417
  565   2HD1  LEU  77          2HD1      LEU  77  -4.522   3.253  -7.122
  566   3HD1  LEU  77          3HD1      LEU  77  -6.060   2.390  -7.349
  567   1HD2  LEU  77          1HD2      LEU  77  -6.314   1.578  -3.656
  568   2HD2  LEU  77          2HD2      LEU  77  -7.159   2.723  -4.669
  569   3HD2  LEU  77          3HD2      LEU  77  -7.039   1.036  -5.184
  570    H    PHE  78           H        PHE  78  -6.390  -0.882  -3.754
  571    HA   PHE  78           HA       PHE  78  -6.955  -3.129  -5.609
  572   1HB   PHE  78          1HB       PHE  78  -6.932  -3.186  -2.559
  573   2HB   PHE  78          2HB       PHE  78  -7.673  -4.421  -3.539
  574    HD1  PHE  78           1HD      PHE  78  -6.330  -6.073  -4.774
  575    HD2  PHE  78           2HD      PHE  78  -4.546  -3.170  -2.131
  576    HE1  PHE  78           1HE      PHE  78  -4.310  -7.478  -4.611
  577    HE2  PHE  78           2HE      PHE  78  -2.575  -4.645  -1.872
  578    HZ   PHE  78           HZ       PHE  78  -2.431  -6.780  -3.155
  579    H    LYS  79           H        LYS  79  -9.160  -3.881  -5.438
  580    HA   LYS  79           HA       LYS  79 -10.912  -3.009  -3.529
  581   1HB   LYS  79          1HB       LYS  79 -12.454  -1.665  -4.339
  582   2HB   LYS  79          2HB       LYS  79 -11.109  -0.917  -5.128
  583   1HG   LYS  79          1HG       LYS  79 -12.815  -2.956  -6.655
  584   2HG   LYS  79          2HG       LYS  79 -13.457  -1.382  -6.298
  585   1HD   LYS  79          1HD       LYS  79 -12.425  -1.575  -8.561
  586   2HD   LYS  79          2HD       LYS  79 -11.839  -0.244  -7.558
  587   1HE   LYS  79          1HE       LYS  79  -9.929  -1.190  -8.610
  588   2HE   LYS  79          2HE       LYS  79  -9.878  -1.619  -6.902
  589   1HZ   LYS  79          1HZ       LYS  79 -10.535  -3.827  -7.424
  590   2HZ   LYS  79          2HZ       LYS  79 -10.889  -3.539  -8.978
  591   3HZ   LYS  79          3HZ       LYS  79  -9.322  -3.449  -8.480
  592    H    GLY  80           H        GLY  80 -12.835  -4.323  -3.572
  593   1HA   GLY  80          1HA       GLY  80 -14.236  -6.043  -4.163
  594   2HA   GLY  80          2HA       GLY  80 -13.842  -5.650  -5.837
  595    H    GLY  81           H        GLY  81 -11.153  -6.662  -3.860
  596   1HA   GLY  81          1HA       GLY  81 -10.137  -8.753  -3.616
  597   2HA   GLY  81          2HA       GLY  81 -11.275  -9.477  -4.757
  598    H    GLU  82           H        GLU  82 -10.433  -6.730  -6.419
  599    HA   GLU  82           HA       GLU  82  -8.256  -8.081  -7.875
  600   1HB   GLU  82          1HB       GLU  82  -9.701  -5.529  -8.455
  601   2HB   GLU  82          2HB       GLU  82  -8.815  -6.481  -9.600
  602   1HG   GLU  82          1HG       GLU  82 -10.634  -8.038  -9.810
  603   2HG   GLU  82          2HG       GLU  82 -11.503  -7.324  -8.438
  604    HA   PRO  83           HA       PRO  83  -5.676  -4.430  -6.612
  605   1HB   PRO  83          1HB       PRO  83  -3.893  -4.312  -8.656
  606   2HB   PRO  83          2HB       PRO  83  -3.843  -5.597  -7.416
  607   1HG   PRO  83          1HG       PRO  83  -5.125  -5.725 -10.168
  608   2HG   PRO  83          2HG       PRO  83  -3.963  -6.880  -9.440
  609   1HD   PRO  83          1HD       PRO  83  -6.663  -7.281  -9.367
  610   2HD   PRO  83          2HD       PRO  83  -5.610  -7.774  -8.007
  611    H    VAL  84           H        VAL  84  -5.015  -2.379  -7.871
  612    HA   VAL  84           HA       VAL  84  -6.526  -1.823 -10.363
  613    HB   VAL  84           HB       VAL  84  -6.020   0.663  -8.968
  614   1HG1  VAL  84          1HG1      VAL  84  -8.295   1.191  -9.692
  615   2HG1  VAL  84          2HG1      VAL  84  -7.345   0.468 -11.001
  616   3HG1  VAL  84          3HG1      VAL  84  -8.550  -0.512 -10.144
  617   1HG2  VAL  84          1HG2      VAL  84  -8.026   0.566  -7.436
  618   2HG2  VAL  84          2HG2      VAL  84  -7.927  -1.210  -7.566
  619   3HG2  VAL  84          3HG2      VAL  84  -6.588  -0.302  -6.901
  620    H    LYS  85           H        LYS  85  -3.753  -0.952  -8.201
  621    HA   LYS  85           HA       LYS  85  -2.021  -0.629 -10.562
  622   1HB   LYS  85          1HB       LYS  85  -2.390   1.448  -8.349
  623   2HB   LYS  85          2HB       LYS  85  -1.127   1.499  -9.578
  624   1HG   LYS  85          1HG       LYS  85  -2.786   1.821 -11.357
  625   2HG   LYS  85          2HG       LYS  85  -4.109   1.614 -10.193
  626   1HD   LYS  85          1HD       LYS  85  -3.202   3.585  -8.910
  627   2HD   LYS  85          2HD       LYS  85  -2.140   3.925 -10.290
  628   1HE   LYS  85          1HE       LYS  85  -4.003   4.303 -11.743
  629   2HE   LYS  85          2HE       LYS  85  -5.129   3.499 -10.634
  630   1HZ   LYS  85          1HZ       LYS  85  -4.866   5.326  -9.104
  631   2HZ   LYS  85          2HZ       LYS  85  -3.832   6.116 -10.116
  632   3HZ   LYS  85          3HZ       LYS  85  -5.402   5.886 -10.524
  633    H    GLN  86           H        GLN  86   0.180  -1.055  -9.989
  634    HA   GLN  86           HA       GLN  86   0.840  -1.545  -7.154
  635   1HB   GLN  86          1HB       GLN  86   0.973  -3.721  -8.151
  636   2HB   GLN  86          2HB       GLN  86   1.779  -3.093  -9.603
  637   1HG   GLN  86          1HG       GLN  86   3.774  -2.510  -8.308
  638   2HG   GLN  86          2HG       GLN  86   3.011  -3.010  -6.808
  639   1HE2  GLN  86          1HE2      GLN  86   1.943  -5.498  -8.726
  640   2HE2  GLN  86          2HE2      GLN  86   3.364  -6.527  -8.547
  641    H    LEU  87           H        LEU  87   2.461  -0.228  -6.517
  642    HA   LEU  87           HA       LEU  87   4.014   1.330  -8.518
  643   1HB   LEU  87          1HB       LEU  87   3.078   2.364  -5.815
  644   2HB   LEU  87          2HB       LEU  87   3.939   3.236  -7.050
  645    HG   LEU  87           HG       LEU  87   1.764   4.085  -6.977
  646   1HD1  LEU  87          1HD1      LEU  87   0.898   3.752  -9.223
  647   2HD1  LEU  87          2HD1      LEU  87   2.680   3.830  -9.237
  648   3HD1  LEU  87          3HD1      LEU  87   1.850   2.273  -9.413
  649   1HD2  LEU  87          1HD2      LEU  87   0.422   1.429  -7.535
  650   2HD2  LEU  87          2HD2      LEU  87   0.656   2.070  -5.906
  651   3HD2  LEU  87          3HD2      LEU  87  -0.300   2.977  -7.093
  652    H    ILE  88           H        ILE  88   6.256   1.499  -7.877
  653    HA   ILE  88           HA       ILE  88   7.088   0.034  -5.463
  654    HB   ILE  88           HB       ILE  88   8.720  -1.198  -6.898
  655   1HG1  ILE  88          1HG1      ILE  88   8.507   0.007  -9.047
  656   2HG1  ILE  88          2HG1      ILE  88   8.400  -1.743  -9.140
  657   1HG2  ILE  88          1HG2      ILE  88   6.936  -2.349  -5.854
  658   2HG2  ILE  88          2HG2      ILE  88   5.799  -1.954  -7.150
  659   3HG2  ILE  88          3HG2      ILE  88   7.167  -3.039  -7.462
  660   1HD1  ILE  88          1HD1      ILE  88   5.912  -1.558  -9.439
  661   2HD1  ILE  88          2HD1      ILE  88   6.110   0.210  -9.540
  662   3HD1  ILE  88          3HD1      ILE  88   6.884  -0.835 -10.723
  663    H    GLY  89           H        GLY  89   8.925   0.795  -4.607
  664   1HA   GLY  89          1HA       GLY  89  11.047   1.852  -4.602
  665   2HA   GLY  89          2HA       GLY  89  10.663   2.673  -6.128
  666    H    TYR  90           H        TYR  90  11.671   4.141  -4.001
  667    HA   TYR  90           HA       TYR  90   9.527   5.354  -2.485
  668   1HB   TYR  90          1HB       TYR  90  11.801   5.106  -1.578
  669   2HB   TYR  90          2HB       TYR  90  12.381   6.273  -2.755
  670    HD1  TYR  90           1HD      TYR  90   9.150   7.507  -1.797
  671    HD2  TYR  90           2HD      TYR  90  13.173   7.002  -0.286
  672    HE1  TYR  90           1HE      TYR  90   8.707   9.189  -0.124
  673    HE2  TYR  90           2HE      TYR  90  12.714   8.743   1.416
  674    HH   TYR  90           HH       TYR  90  10.207   9.342   2.638
  675    H    GLN  91           H        GLN  91   8.196   5.775  -4.371
  676    HA   GLN  91           HA       GLN  91   8.796   8.094  -6.002
  677   1HB   GLN  91          1HB       GLN  91   5.952   7.365  -5.276
  678   2HB   GLN  91          2HB       GLN  91   6.605   8.037  -6.747
  679   1HG   GLN  91          1HG       GLN  91   7.008   5.149  -5.901
  680   2HG   GLN  91          2HG       GLN  91   5.806   5.735  -7.037
  681   1HE2  GLN  91          1HE2      GLN  91   6.495   6.728  -9.054
  682   2HE2  GLN  91          2HE2      GLN  91   8.081   6.269  -9.719
  683    HA   PRO  92           HA       PRO  92   8.127  10.918  -2.528
  684   1HB   PRO  92          1HB       PRO  92   8.005  13.324  -3.818
  685   2HB   PRO  92          2HB       PRO  92   9.517  12.417  -3.576
  686   1HG   PRO  92          1HG       PRO  92   7.740  12.477  -6.031
  687   2HG   PRO  92          2HG       PRO  92   9.516  12.672  -5.951
  688   1HD   PRO  92          1HD       PRO  92   8.354  10.259  -6.538
  689   2HD   PRO  92          2HD       PRO  92   9.847  10.354  -5.564
  690    H    LYS  93           H        LYS  93   6.485  12.687  -1.911
  691    HA   LYS  93           HA       LYS  93   3.989  11.406  -1.750
  692   1HB   LYS  93          1HB       LYS  93   5.302  13.525  -0.508
  693   2HB   LYS  93          2HB       LYS  93   4.047  14.384  -1.359
  694   1HG   LYS  93          1HG       LYS  93   3.700  12.168   0.680
  695   2HG   LYS  93          2HG       LYS  93   3.301  13.886   0.853
  696   1HD   LYS  93          1HD       LYS  93   1.633  13.548  -1.080
  697   2HD   LYS  93          2HD       LYS  93   1.879  11.801  -0.845
  698   1HE   LYS  93          1HE       LYS  93   0.673  13.849   1.030
  699   2HE   LYS  93          2HE       LYS  93  -0.092  12.397   0.370
  700   1HZ   LYS  93          1HZ       LYS  93   0.687  12.358   2.736
  701   2HZ   LYS  93          2HZ       LYS  93   1.373  11.088   1.845
  702   3HZ   LYS  93          3HZ       LYS  93   2.157  12.498   2.296
  703    H    GLU  94           H        GLU  94   5.061  14.165  -3.523
  704    HA   GLU  94           HA       GLU  94   2.883  15.071  -4.980
  705   1HB   GLU  94          1HB       GLU  94   5.664  14.805  -6.175
  706   2HB   GLU  94          2HB       GLU  94   4.409  15.986  -6.549
  707   1HG   GLU  94          1HG       GLU  94   5.726  17.243  -5.216
  708   2HG   GLU  94          2HG       GLU  94   4.639  16.611  -3.994
  709    H    GLN  95           H        GLN  95   4.907  12.207  -5.705
  710    HA   GLN  95           HA       GLN  95   3.872  11.798  -8.396
  711   1HB   GLN  95          1HB       GLN  95   6.254  11.326  -7.227
  712   2HB   GLN  95          2HB       GLN  95   5.494   9.838  -6.754
  713   1HG   GLN  95          1HG       GLN  95   5.890  10.864  -9.594
  714   2HG   GLN  95          2HG       GLN  95   6.870   9.643  -8.790
  715   1HE2  GLN  95          1HE2      GLN  95   3.986  10.172 -10.689
  716   2HE2  GLN  95          2HE2      GLN  95   3.534   8.482 -10.783
  717    H    LEU  96           H        LEU  96   3.707  10.481  -5.096
  718    HA   LEU  96           HA       LEU  96   2.125   8.197  -5.501
  719   1HB   LEU  96          1HB       LEU  96   3.370   9.361  -3.394
  720   2HB   LEU  96          2HB       LEU  96   1.758   9.877  -3.082
  721    HG   LEU  96           HG       LEU  96   1.824   7.957  -1.835
  722   1HD1  LEU  96          1HD1      LEU  96   0.472   6.235  -2.769
  723   2HD1  LEU  96          2HD1      LEU  96  -0.070   7.727  -3.537
  724   3HD1  LEU  96          3HD1      LEU  96   0.969   6.608  -4.430
  725   1HD2  LEU  96          1HD2      LEU  96   3.482   6.664  -4.026
  726   2HD2  LEU  96          2HD2      LEU  96   4.054   7.292  -2.461
  727   3HD2  LEU  96          3HD2      LEU  96   2.987   5.879  -2.509
  728    H    GLU  97           H        GLU  97   1.037  11.534  -4.399
  729    HA   GLU  97           HA       GLU  97  -1.707  11.018  -4.685
  730   1HB   GLU  97          1HB       GLU  97   0.016  13.488  -4.767
  731   2HB   GLU  97          2HB       GLU  97  -1.708  13.552  -4.742
  732   1HG   GLU  97          1HG       GLU  97  -0.083  12.214  -2.549
  733   2HG   GLU  97          2HG       GLU  97  -0.453  13.944  -2.560
  734    H    ALA  98           H        ALA  98   0.814  12.214  -7.033
  735    HA   ALA  98           HA       ALA  98  -1.229  12.932  -8.963
  736   1HB   ALA  98          1HB       ALA  98   0.614  13.005 -10.619
  737   2HB   ALA  98          2HB       ALA  98   1.050  13.864  -9.132
  738   3HB   ALA  98          3HB       ALA  98   1.710  12.239  -9.448
  739    H    GLN  99           H        GLN  99   0.567   9.904  -8.400
  740    HA   GLN  99           HA       GLN  99  -0.636   8.615 -10.706
  741   1HB   GLN  99          1HB       GLN  99   1.570   8.108  -9.217
  742   2HB   GLN  99          2HB       GLN  99   0.462   7.083  -8.323
  743   1HG   GLN  99          1HG       GLN  99   1.654   5.803  -9.978
  744   2HG   GLN  99          2HG       GLN  99  -0.045   5.870 -10.473
  745   1HE2  GLN  99          1HE2      GLN  99  -0.449   6.679 -12.591
  746   2HE2  GLN  99          2HE2      GLN  99   0.807   7.444 -13.554
  747    H    LEU 100           H        LEU 100  -1.665   9.023  -7.413
  748    HA   LEU 100           HA       LEU 100  -3.840   7.055  -7.799
  749   1HB   LEU 100          1HB       LEU 100  -1.955   7.614  -5.694
  750   2HB   LEU 100          2HB       LEU 100  -3.544   7.940  -5.114
  751    HG   LEU 100           HG       LEU 100  -4.188   5.592  -5.961
  752   1HD1  LEU 100          1HD1      LEU 100  -2.305   4.024  -6.323
  753   2HD1  LEU 100          2HD1      LEU 100  -2.259   5.321  -7.531
  754   3HD1  LEU 100          3HD1      LEU 100  -1.143   5.358  -6.158
  755   1HD2  LEU 100          1HD2      LEU 100  -3.779   6.029  -3.581
  756   2HD2  LEU 100          2HD2      LEU 100  -3.100   4.457  -4.026
  757   3HD2  LEU 100          3HD2      LEU 100  -2.022   5.851  -3.823
  758    H    ALA 101           H        ALA 101  -3.501  10.427  -8.001
  759    HA   ALA 101           HA       ALA 101  -5.466  11.603  -6.615
  760   1HB   ALA 101          1HB       ALA 101  -5.711  13.190  -8.548
  761   2HB   ALA 101          2HB       ALA 101  -4.034  12.876  -8.107
  762   3HB   ALA 101          3HB       ALA 101  -4.733  12.081  -9.535
  763    H    ASP 102           H        ASP 102  -6.028   9.560  -9.480
  764    HA   ASP 102           HA       ASP 102  -8.810  10.236  -9.854
  765   1HB   ASP 102          1HB       ASP 102  -8.745   8.167 -11.286
  766   2HB   ASP 102          2HB       ASP 102  -7.478   9.331 -11.665
  767    H    VAL 103           H        VAL 103  -7.308   8.373  -7.350
  768    HA   VAL 103           HA       VAL 103 -10.029   7.400  -6.637
  769    HB   VAL 103           HB       VAL 103  -7.841   5.778  -6.941
  770   1HG1  VAL 103          1HG1      VAL 103  -6.585   6.725  -5.062
  771   2HG1  VAL 103          2HG1      VAL 103  -7.916   6.328  -3.951
  772   3HG1  VAL 103          3HG1      VAL 103  -7.034   5.044  -4.771
  773   1HG2  VAL 103          1HG2      VAL 103  -9.156   4.119  -5.743
  774   2HG2  VAL 103          2HG2      VAL 103 -10.185   5.418  -5.069
  775   3HG2  VAL 103          3HG2      VAL 103 -10.153   5.109  -6.814
  776    H    LEU 104           H        LEU 104  -7.781   9.846  -5.947
  777    HA   LEU 104           HA       LEU 104  -8.713  10.202  -3.171
  778   1HB   LEU 104          1HB       LEU 104  -6.469  11.261  -4.898
  779   2HB   LEU 104          2HB       LEU 104  -7.002  12.201  -3.591
  780    HG   LEU 104           HG       LEU 104  -5.309  11.194  -2.551
  781   1HD1  LEU 104          1HD1      LEU 104  -5.865   9.211  -1.238
  782   2HD1  LEU 104          2HD1      LEU 104  -7.203  10.389  -1.247
  783   3HD1  LEU 104          3HD1      LEU 104  -7.266   8.898  -2.255
  784   1HD2  LEU 104          1HD2      LEU 104  -4.372   9.023  -2.973
  785   2HD2  LEU 104          2HD2      LEU 104  -5.690   8.622  -4.095
  786   3HD2  LEU 104          3HD2      LEU 104  -4.526   9.931  -4.474
  787    H    GLN 105           H        GLN 105  -9.462  11.194  -6.340
  788    HA   GLN 105           HA       GLN 105 -10.459  13.771  -6.081
  789   1HB   GLN 105          2HB       GLN 105 -10.256  12.488  -8.149
  790   2HB   GLN 105          3HB       GLN 105 -11.581  11.451  -7.643
  791   1HG   GLN 105          2HG       GLN 105 -13.086  13.494  -7.584
  792   2HG   GLN 105          3HG       GLN 105 -11.728  14.460  -8.166
  793   1HE2  GLN 105          1HE2      GLN 105 -10.703  12.523 -10.152
  794   2HE2  GLN 105          2HE2      GLN 105 -11.941  12.478 -11.404
  Start of MODEL   19
    1   1H    ALA   1           H        ALA   1 -11.898  -0.504   7.294
    2   2H    ALA   1          2HN       ALA   1 -12.685  -0.168   5.850
    3   3H    ALA   1          3HN       ALA   1 -11.221  -0.833   5.826
    4    HA   ALA   1           HA       ALA   1 -11.050   1.437   5.281
    5   1HB   ALA   1          1HB       ALA   1 -12.021   2.008   8.096
    6   2HB   ALA   1          2HB       ALA   1 -11.497   3.189   6.875
    7   3HB   ALA   1          3HB       ALA   1 -12.970   2.253   6.601
    8    H    THR   2           H        THR   2  -9.338   2.990   6.474
    9    HA   THR   2           HA       THR   2  -7.038   1.596   6.399
   10    HB   THR   2           HB       THR   2  -7.670   4.238   7.762
   11    HG1  THR   2           1HG      THR   2  -7.838   4.955   5.814
   12   1HG2  THR   2          1HG2      THR   2  -4.981   3.188   6.775
   13   2HG2  THR   2          2HG2      THR   2  -5.305   4.851   7.271
   14   3HG2  THR   2          3HG2      THR   2  -5.412   3.527   8.445
   15    H    MET   3           H        MET   3  -5.776   0.366   7.716
   16    HA   MET   3           HA       MET   3  -5.558   0.733  10.520
   17   1HB   MET   3          1HB       MET   3  -6.427  -1.433  11.274
   18   2HB   MET   3          2HB       MET   3  -7.711  -0.427  10.625
   19   1HG   MET   3          1HG       MET   3  -7.602  -1.685   8.475
   20   2HG   MET   3          2HG       MET   3  -6.369  -2.730   9.164
   21   1HE   MET   3          1HE       MET   3  -8.407  -4.680  11.939
   22   2HE   MET   3          2HE       MET   3  -6.791  -4.267  11.320
   23   3HE   MET   3          3HE       MET   3  -7.705  -3.087  12.290
   24    H    THR   4           H        THR   4  -4.166  -1.407  11.387
   25    HA   THR   4           HA       THR   4  -1.920  -1.738   9.633
   26    HB   THR   4           HB       THR   4  -2.641  -3.412  12.042
   27    HG1  THR   4           1HG      THR   4  -1.426  -0.856  12.078
   28   1HG2  THR   4          1HG2      THR   4  -0.181  -3.328  12.468
   29   2HG2  THR   4          2HG2      THR   4  -0.567  -4.109  10.933
   30   3HG2  THR   4          3HG2      THR   4   0.040  -2.438  10.944
   31    H    LEU   5           H        LEU   5  -1.166  -3.852   8.670
   32    HA   LEU   5           HA       LEU   5  -3.438  -5.681   8.090
   33   1HB   LEU   5          1HB       LEU   5  -2.156  -3.917   6.297
   34   2HB   LEU   5          2HB       LEU   5  -1.384  -5.416   6.021
   35    HG   LEU   5           HG       LEU   5  -3.650  -6.498   5.713
   36   1HD1  LEU   5          1HD1      LEU   5  -5.618  -5.207   5.417
   37   2HD1  LEU   5          2HD1      LEU   5  -4.936  -4.594   6.925
   38   3HD1  LEU   5          3HD1      LEU   5  -4.753  -3.679   5.427
   39   1HD2  LEU   5          1HD2      LEU   5  -4.020  -5.376   3.438
   40   2HD2  LEU   5          2HD2      LEU   5  -2.770  -4.214   3.895
   41   3HD2  LEU   5          3HD2      LEU   5  -2.373  -5.935   3.751
   42    H    THR   6           H        THR   6  -2.783  -7.911   7.403
   43    HA   THR   6           HA       THR   6  -0.287  -8.968   7.539
   44    HB   THR   6           HB       THR   6  -2.152  -9.827   9.811
   45    HG1  THR   6           1HG      THR   6  -0.513  -7.710   9.797
   46   1HG2  THR   6          1HG2      THR   6  -0.094 -10.976  10.662
   47   2HG2  THR   6          2HG2      THR   6  -0.607 -11.611   9.101
   48   3HG2  THR   6          3HG2      THR   6   0.770 -10.485   9.194
   49    H    ASP   7           H        ASP   7  -0.914 -11.427   7.180
   50    HA   ASP   7           HA       ASP   7  -2.032 -11.691   4.806
   51   1HB   ASP   7          1HB       ASP   7  -2.002 -13.789   7.018
   52   2HB   ASP   7          2HB       ASP   7  -2.176 -14.144   5.299
   53    H    ALA   8           H        ALA   8  -3.849 -12.723   7.680
   54    HA   ALA   8           HA       ALA   8  -6.290 -13.246   6.307
   55   1HB   ALA   8          1HB       ALA   8  -5.828 -14.065   8.592
   56   2HB   ALA   8          2HB       ALA   8  -5.904 -12.399   9.216
   57   3HB   ALA   8          3HB       ALA   8  -7.356 -13.159   8.539
   58    H    ASN   9           H        ASN   9  -5.084 -10.276   7.783
   59    HA   ASN   9           HA       ASN   9  -7.604  -8.886   7.438
   60   1HB   ASN   9          1HB       ASN   9  -5.907  -8.420   9.307
   61   2HB   ASN   9          2HB       ASN   9  -5.035  -7.486   8.075
   62   1HD2  ASN   9          1HD2      ASN   9  -5.523  -5.232   9.029
   63   2HD2  ASN   9          2HD2      ASN   9  -7.215  -4.801   9.062
   64    H    PHE  10           H        PHE  10  -4.744  -9.423   5.542
   65    HA   PHE  10           HA       PHE  10  -4.929  -7.360   3.623
   66   1HB   PHE  10          1HB       PHE  10  -3.184  -9.293   3.925
   67   2HB   PHE  10          2HB       PHE  10  -4.244 -10.226   2.883
   68    HD1  PHE  10           1HD      PHE  10  -1.220  -9.014   2.645
   69    HD2  PHE  10           2HD      PHE  10  -5.031  -8.307   0.736
   70    HE1  PHE  10           1HE      PHE  10  -0.106  -8.129   0.719
   71    HE2  PHE  10           2HE      PHE  10  -3.881  -7.354  -1.205
   72    HZ   PHE  10           HZ       PHE  10  -1.414  -7.228  -1.245
   73    H    GLN  11           H        GLN  11  -6.388 -10.664   3.547
   74    HA   GLN  11           HA       GLN  11  -8.136 -10.079   1.344
   75   1HB   GLN  11          1HB       GLN  11  -8.419 -12.134   3.601
   76   2HB   GLN  11          2HB       GLN  11  -9.431 -12.056   2.155
   77   1HG   GLN  11          1HG       GLN  11  -7.327 -12.340   0.760
   78   2HG   GLN  11          2HG       GLN  11  -6.445 -12.656   2.262
   79   1HE2  GLN  11          1HE2      GLN  11  -6.334 -14.851   2.876
   80   2HE2  GLN  11          2HE2      GLN  11  -7.517 -16.044   2.343
   81    H    GLN  12           H        GLN  12  -8.741  -9.899   4.927
   82    HA   GLN  12           HA       GLN  12 -11.481  -9.199   4.639
   83   1HB   GLN  12          1HB       GLN  12  -9.520  -8.444   6.837
   84   2HB   GLN  12          2HB       GLN  12 -11.256  -8.236   6.958
   85   1HG   GLN  12          1HG       GLN  12 -11.680 -10.581   6.968
   86   2HG   GLN  12          2HG       GLN  12 -10.050 -10.978   6.446
   87   1HE2  GLN  12          1HE2      GLN  12 -11.516  -9.000   9.153
   88   2HE2  GLN  12          2HE2      GLN  12 -10.467  -9.729  10.361
   89    H    ALA  13           H        ALA  13  -8.604  -7.058   4.380
   90    HA   ALA  13           HA       ALA  13 -10.229  -4.695   4.080
   91   1HB   ALA  13          1HB       ALA  13  -7.883  -4.570   4.785
   92   2HB   ALA  13          2HB       ALA  13  -7.353  -5.255   3.234
   93   3HB   ALA  13          3HB       ALA  13  -8.157  -3.668   3.291
   94    H    ILE  14           H        ILE  14  -8.332  -6.724   1.721
   95    HA   ILE  14           HA       ILE  14  -9.323  -5.174  -0.418
   96    HB   ILE  14           HB       ILE  14  -8.193  -6.556  -1.903
   97   1HG1  ILE  14          1HG1      ILE  14  -7.278  -8.647   0.008
   98   2HG1  ILE  14          2HG1      ILE  14  -8.864  -8.825  -0.744
   99   1HG2  ILE  14          1HG2      ILE  14  -6.323  -6.581   0.464
  100   2HG2  ILE  14          2HG2      ILE  14  -5.996  -6.168  -1.226
  101   3HG2  ILE  14          3HG2      ILE  14  -6.915  -5.085  -0.164
  102   1HD1  ILE  14          1HD1      ILE  14  -7.861  -8.616  -2.986
  103   2HD1  ILE  14          2HD1      ILE  14  -6.251  -8.412  -2.259
  104   3HD1  ILE  14          3HD1      ILE  14  -7.126  -9.947  -2.072
  105    H    GLN  15           H        GLN  15 -10.958  -7.779   1.077
  106    HA   GLN  15           HA       GLN  15 -12.475  -8.809  -1.040
  107   1HB   GLN  15          1HB       GLN  15 -14.156  -9.433   0.678
  108   2HB   GLN  15          2HB       GLN  15 -12.506  -9.858   1.093
  109   1HG   GLN  15          1HG       GLN  15 -13.612  -9.117   3.068
  110   2HG   GLN  15          2HG       GLN  15 -12.365  -7.967   2.622
  111   1HE2  GLN  15          1HE2      GLN  15 -13.124  -6.177   3.683
  112   2HE2  GLN  15          2HE2      GLN  15 -14.667  -5.405   3.289
  113    H    GLY  16           H        GLY  16 -12.717  -5.577   0.252
  114   1HA   GLY  16          1HA       GLY  16 -14.721  -4.798  -1.709
  115   2HA   GLY  16          2HA       GLY  16 -15.373  -4.920  -0.081
  116    H    ASP  17           H        ASP  17 -15.259  -3.243   0.948
  117    HA   ASP  17           HA       ASP  17 -14.682  -1.521   2.255
  118   1HB   ASP  17          1HB       ASP  17 -13.035  -3.407   2.651
  119   2HB   ASP  17          2HB       ASP  17 -11.858  -2.448   1.759
  120    H    GLY  18           H        GLY  18 -13.350  -1.271  -0.886
  121   1HA   GLY  18          1HA       GLY  18 -13.658   0.896  -2.045
  122   2HA   GLY  18          2HA       GLY  18 -13.193   1.711  -0.545
  123    HA   PRO  19           HA       PRO  19  -9.512   1.450  -3.450
  124   1HB   PRO  19          1HB       PRO  19  -8.546   4.006  -2.505
  125   2HB   PRO  19          2HB       PRO  19  -9.249   3.585  -4.069
  126   1HG   PRO  19          1HG       PRO  19 -10.492   4.926  -1.778
  127   2HG   PRO  19          2HG       PRO  19 -11.043   4.902  -3.463
  128   1HD   PRO  19          1HD       PRO  19 -12.219   3.518  -1.335
  129   2HD   PRO  19          2HD       PRO  19 -12.450   3.126  -3.063
  130    H    VAL  20           H        VAL  20  -8.382  -0.139  -2.464
  131    HA   VAL  20           HA       VAL  20  -7.382   0.250   0.253
  132    HB   VAL  20           HB       VAL  20  -8.678  -1.846  -0.939
  133   1HG1  VAL  20          1HG1      VAL  20  -7.362  -3.586  -1.550
  134   2HG1  VAL  20          2HG1      VAL  20  -6.677  -2.207  -2.391
  135   3HG1  VAL  20          3HG1      VAL  20  -5.844  -2.842  -0.958
  136   1HG2  VAL  20          1HG2      VAL  20  -8.281  -1.671   1.521
  137   2HG2  VAL  20          2HG2      VAL  20  -7.938  -3.280   0.910
  138   3HG2  VAL  20          3HG2      VAL  20  -6.599  -2.167   1.281
  139    H    LEU  21           H        LEU  21  -5.244   0.203   0.814
  140    HA   LEU  21           HA       LEU  21  -3.245   0.027  -1.372
  141   1HB   LEU  21          1HB       LEU  21  -3.354   2.190   0.759
  142   2HB   LEU  21          2HB       LEU  21  -1.905   1.769  -0.109
  143    HG   LEU  21           HG       LEU  21  -2.666   3.724  -1.047
  144   1HD1  LEU  21          1HD1      LEU  21  -2.002   1.761  -2.607
  145   2HD1  LEU  21          2HD1      LEU  21  -3.711   1.740  -3.047
  146   3HD1  LEU  21          3HD1      LEU  21  -2.728   3.188  -3.332
  147   1HD2  LEU  21          1HD2      LEU  21  -5.030   3.611  -0.198
  148   2HD2  LEU  21          2HD2      LEU  21  -4.847   4.279  -1.822
  149   3HD2  LEU  21          3HD2      LEU  21  -5.436   2.627  -1.615
  150    H    VAL  22           H        VAL  22  -1.427  -1.062  -0.748
  151    HA   VAL  22           HA       VAL  22  -1.267  -1.996   2.084
  152    HB   VAL  22           HB       VAL  22  -0.749  -3.623  -0.451
  153   1HG1  VAL  22          1HG1      VAL  22   0.728  -4.274   1.422
  154   2HG1  VAL  22          2HG1      VAL  22  -0.677  -4.390   2.507
  155   3HG1  VAL  22          3HG1      VAL  22  -0.495  -5.510   1.142
  156   1HG2  VAL  22          1HG2      VAL  22  -3.147  -3.369  -0.200
  157   2HG2  VAL  22          2HG2      VAL  22  -2.714  -4.981   0.369
  158   3HG2  VAL  22          3HG2      VAL  22  -3.058  -3.694   1.541
  159    H    ASP  23           H        ASP  23   0.464  -0.911   2.918
  160    HA   ASP  23           HA       ASP  23   2.805  -0.237   1.238
  161   1HB   ASP  23          1HB       ASP  23   2.057   1.179   3.206
  162   2HB   ASP  23          2HB       ASP  23   2.498  -0.131   4.246
  163    H    PHE  24           H        PHE  24   3.727  -2.007   0.477
  164    HA   PHE  24           HA       PHE  24   4.466  -4.271   2.234
  165   1HB   PHE  24          1HB       PHE  24   4.907  -3.635  -0.685
  166   2HB   PHE  24          2HB       PHE  24   5.537  -5.072   0.067
  167    HD1  PHE  24           1HD      PHE  24   2.718  -3.796  -1.733
  168    HD2  PHE  24           2HD      PHE  24   3.889  -6.564   1.350
  169    HE1  PHE  24           1HE      PHE  24   0.909  -5.359  -2.429
  170    HE2  PHE  24           2HE      PHE  24   2.177  -8.158   0.599
  171    HZ   PHE  24           HZ       PHE  24   0.802  -7.644  -1.367
  172    H    TRP  25           H        TRP  25   6.007  -3.728   3.544
  173    HA   TRP  25           HA       TRP  25   8.557  -2.721   2.461
  174   1HB   TRP  25          1HB       TRP  25   9.035  -1.426   4.404
  175   2HB   TRP  25          2HB       TRP  25   7.475  -0.878   3.813
  176    HD1  TRP  25           HD       TRP  25   5.302  -1.918   5.234
  177    HE1  TRP  25           1HE      TRP  25   5.058  -2.502   7.707
  178    HE3  TRP  25           3HE      TRP  25  10.254  -1.930   6.551
  179    HZ2  TRP  25           2HZ      TRP  25   6.823  -3.113   9.956
  180    HZ3  TRP  25           3HZ      TRP  25  10.938  -2.516   8.846
  181    HH2  TRP  25           HH       TRP  25   9.235  -3.136  10.551
  182    H    ALA  26           H        ALA  26  10.240  -3.464   4.535
  183    HA   ALA  26           HA       ALA  26   9.256  -5.773   5.890
  184   1HB   ALA  26          1HB       ALA  26   9.879  -6.899   3.783
  185   2HB   ALA  26          2HB       ALA  26  11.476  -6.113   3.821
  186   3HB   ALA  26          3HB       ALA  26  11.036  -7.325   5.041
  187    H    ALA  27           H        ALA  27  10.832  -6.608   7.386
  188    HA   ALA  27           HA       ALA  27  12.107  -4.583   8.846
  189   1HB   ALA  27          1HB       ALA  27  11.177  -6.654   9.792
  190   2HB   ALA  27          2HB       ALA  27  12.475  -7.599   9.019
  191   3HB   ALA  27          3HB       ALA  27  12.861  -6.417  10.289
  192    H    TRP  28           H        TRP  28  13.407  -5.900   6.010
  193    HA   TRP  28           HA       TRP  28  16.181  -5.312   6.923
  194   1HB   TRP  28          1HB       TRP  28  16.970  -7.088   5.953
  195   2HB   TRP  28          2HB       TRP  28  15.329  -7.674   5.887
  196    HD1  TRP  28           HD       TRP  28  18.163  -6.330   3.807
  197    HE1  TRP  28           1HE      TRP  28  17.656  -6.375   1.306
  198    HE3  TRP  28           3HE      TRP  28  13.296  -7.928   3.996
  199    HZ2  TRP  28           2HZ      TRP  28  15.316  -6.645  -0.373
  200    HZ3  TRP  28           3HZ      TRP  28  11.926  -7.991   1.917
  201    HH2  TRP  28           HH       TRP  28  12.923  -7.234  -0.237
  202    H    CYS  29           H        CYS  29  13.664  -4.110   4.774
  203    HA   CYS  29           HA       CYS  29  15.555  -3.268   2.719
  204   1HB   CYS  29          1HB       CYS  29  13.662  -2.102   1.690
  205   2HB   CYS  29          2HB       CYS  29  13.433  -3.818   1.963
  206    H    GLY  30           H        GLY  30  15.814  -0.915   2.146
  207   1HA   GLY  30          1HA       GLY  30  16.472   0.599   4.590
  208   2HA   GLY  30          2HA       GLY  30  17.101   0.875   2.973
  209    HA   PRO  31           HA       PRO  31  14.604   4.394   2.636
  210   1HB   PRO  31          1HB       PRO  31  13.769   4.515   0.019
  211   2HB   PRO  31          2HB       PRO  31  15.469   4.745   0.540
  212   1HG   PRO  31          1HG       PRO  31  14.163   2.219  -0.508
  213   2HG   PRO  31          2HG       PRO  31  15.715   2.957  -1.027
  214   1HD   PRO  31          1HD       PRO  31  15.663   0.925   0.762
  215   2HD   PRO  31          2HD       PRO  31  16.804   2.288   0.976
  216    H    CYS  32           H        CYS  32  13.018   1.428   1.939
  217    HA   CYS  32           HA       CYS  32  10.295   2.172   1.850
  218   1HB   CYS  32          1HB       CYS  32   9.863  -0.024   2.776
  219   2HB   CYS  32          2HB       CYS  32  11.155  -0.141   1.590
  220    H    ARG  33           H        ARG  33  12.541   2.016   4.659
  221    HA   ARG  33           HA       ARG  33  10.467   2.528   6.584
  222   1HB   ARG  33          1HB       ARG  33  12.632   1.347   6.971
  223   2HB   ARG  33          2HB       ARG  33  13.469   2.893   6.867
  224   1HG   ARG  33          1HG       ARG  33  11.153   2.655   8.786
  225   2HG   ARG  33          2HG       ARG  33  12.616   1.762   9.186
  226   1HD   ARG  33          1HD       ARG  33  13.921   3.679   9.482
  227   2HD   ARG  33          2HD       ARG  33  12.899   4.671   8.457
  228    HE   ARG  33           HE       ARG  33  11.468   5.115  10.136
  229   1HH1  ARG  33          2HH2      ARG  33  13.648   2.578  11.266
  230   2HH1  ARG  33          1HH2      ARG  33  13.146   2.639  12.921
  231   1HH2  ARG  33          2HH1      ARG  33  10.775   5.231  12.342
  232   2HH2  ARG  33          1HH1      ARG  33  11.462   4.195  13.537
  233    H    MET  34           H        MET  34  11.932   4.628   4.285
  234    HA   MET  34           HA       MET  34  11.246   7.027   5.844
  235   1HB   MET  34          1HB       MET  34  12.798   6.696   3.248
  236   2HB   MET  34          2HB       MET  34  12.490   8.224   4.081
  237   1HG   MET  34          1HG       MET  34  13.705   7.310   6.080
  238   2HG   MET  34          2HG       MET  34  14.175   5.914   5.102
  239   1HE   MET  34          1HE       MET  34  15.988   6.022   3.098
  240   2HE   MET  34          2HE       MET  34  14.817   7.068   2.254
  241   3HE   MET  34          3HE       MET  34  16.517   7.557   2.383
  242    H    MET  35           H        MET  35  10.017   4.919   3.444
  243    HA   MET  35           HA       MET  35   8.244   6.889   2.188
  244   1HB   MET  35          1HB       MET  35   9.310   5.013   0.854
  245   2HB   MET  35          2HB       MET  35   8.315   3.869   1.763
  246   1HG   MET  35          1HG       MET  35   6.310   5.032   0.892
  247   2HG   MET  35          2HG       MET  35   7.327   6.214   0.073
  248   1HE   MET  35          1HE       MET  35   5.984   4.362  -3.044
  249   2HE   MET  35          2HE       MET  35   5.082   4.848  -1.594
  250   3HE   MET  35          3HE       MET  35   6.315   5.934  -2.280
  251    H    ALA  36           H        ALA  36   8.181   4.015   4.392
  252    HA   ALA  36           HA       ALA  36   5.500   3.845   4.930
  253   1HB   ALA  36          1HB       ALA  36   6.165   2.994   7.174
  254   2HB   ALA  36          2HB       ALA  36   7.111   2.305   5.847
  255   3HB   ALA  36          3HB       ALA  36   7.822   3.563   6.882
  256    HA   PRO  37           HA       PRO  37   5.382   7.463   8.065
  257   1HB   PRO  37          1HB       PRO  37   7.304   9.439   7.961
  258   2HB   PRO  37          2HB       PRO  37   7.342   8.040   9.076
  259   1HG   PRO  37          1HG       PRO  37   8.751   8.345   6.417
  260   2HG   PRO  37          2HG       PRO  37   9.427   7.743   7.963
  261   1HD   PRO  37          1HD       PRO  37   8.611   6.025   6.056
  262   2HD   PRO  37          2HD       PRO  37   8.284   5.681   7.772
  263    H    VAL  38           H        VAL  38   6.830   8.046   4.777
  264    HA   VAL  38           HA       VAL  38   5.272  10.431   4.299
  265    HB   VAL  38           HB       VAL  38   7.220   8.847   2.920
  266   1HG1  VAL  38          1HG1      VAL  38   5.484   7.962   1.443
  267   2HG1  VAL  38          2HG1      VAL  38   4.894   9.607   1.116
  268   3HG1  VAL  38          3HG1      VAL  38   6.509   9.110   0.580
  269   1HG2  VAL  38          1HG2      VAL  38   7.634  10.942   1.734
  270   2HG2  VAL  38          2HG2      VAL  38   6.100  11.604   2.343
  271   3HG2  VAL  38          3HG2      VAL  38   7.418  11.212   3.468
  272    H    LEU  39           H        LEU  39   4.657   6.933   3.923
  273    HA   LEU  39           HA       LEU  39   2.120   7.211   2.705
  274   1HB   LEU  39          1HB       LEU  39   3.590   4.935   4.057
  275   2HB   LEU  39          2HB       LEU  39   2.049   4.749   3.269
  276    HG   LEU  39           HG       LEU  39   4.585   5.707   1.894
  277   1HD1  LEU  39          1HD1      LEU  39   3.215   3.003   1.909
  278   2HD1  LEU  39          2HD1      LEU  39   4.540   3.446   0.813
  279   3HD1  LEU  39          3HD1      LEU  39   4.817   3.399   2.553
  280   1HD2  LEU  39          1HD2      LEU  39   2.792   6.620   0.661
  281   2HD2  LEU  39          2HD2      LEU  39   3.421   5.233  -0.214
  282   3HD2  LEU  39          3HD2      LEU  39   1.899   5.069   0.692
  283    H    GLU  40           H        GLU  40   3.186   7.525   6.002
  284    HA   GLU  40           HA       GLU  40   0.529   7.076   7.176
  285   1HB   GLU  40          1HB       GLU  40   3.177   7.234   8.197
  286   2HB   GLU  40          2HB       GLU  40   2.401   8.704   8.759
  287   1HG   GLU  40          1HG       GLU  40   2.030   7.077  10.455
  288   2HG   GLU  40          2HG       GLU  40   0.485   7.205   9.605
  289    H    GLU  41           H        GLU  41   2.702   9.867   6.362
  290    HA   GLU  41           HA       GLU  41   0.777  11.920   6.788
  291   1HB   GLU  41          1HB       GLU  41   3.369  12.015   6.335
  292   2HB   GLU  41          2HB       GLU  41   2.905  12.010   4.633
  293   1HG   GLU  41          1HG       GLU  41   1.263  13.994   5.515
  294   2HG   GLU  41          2HG       GLU  41   2.511  14.115   6.753
  295    H    PHE  42           H        PHE  42   1.269   9.716   4.081
  296    HA   PHE  42           HA       PHE  42  -0.602  10.863   2.208
  297   1HB   PHE  42          1HB       PHE  42   1.097   9.108   1.654
  298   2HB   PHE  42          2HB       PHE  42   0.212   7.970   2.653
  299    HD1  PHE  42           1HD      PHE  42  -0.230  10.173  -0.309
  300    HD2  PHE  42           2HD      PHE  42  -1.336   6.515   1.684
  301    HE1  PHE  42           1HE      PHE  42  -1.748   9.603  -2.186
  302    HE2  PHE  42           2HE      PHE  42  -2.827   5.936  -0.228
  303    HZ   PHE  42           HZ       PHE  42  -3.067   7.571  -2.128
  304    H    ALA  43           H        ALA  43  -1.045   8.086   4.502
  305    HA   ALA  43           HA       ALA  43  -3.791   7.901   4.094
  306   1HB   ALA  43          1HB       ALA  43  -3.794   6.644   6.243
  307   2HB   ALA  43          2HB       ALA  43  -2.300   6.247   5.353
  308   3HB   ALA  43          3HB       ALA  43  -2.252   7.382   6.708
  309    H    GLU  44           H        GLU  44  -2.087   9.881   6.528
  310    HA   GLU  44           HA       GLU  44  -4.244  10.829   8.009
  311   1HB   GLU  44          1HB       GLU  44  -1.837  11.108   8.505
  312   2HB   GLU  44          2HB       GLU  44  -1.694  12.277   7.184
  313   1HG   GLU  44          1HG       GLU  44  -3.230  13.815   8.364
  314   2HG   GLU  44          2HG       GLU  44  -3.485  12.608   9.633
  315    H    ALA  45           H        ALA  45  -3.189  11.872   4.789
  316    HA   ALA  45           HA       ALA  45  -4.769  14.314   4.804
  317   1HB   ALA  45          1HB       ALA  45  -3.464  12.828   2.480
  318   2HB   ALA  45          2HB       ALA  45  -4.084  14.491   2.452
  319   3HB   ALA  45          3HB       ALA  45  -2.694  14.080   3.480
  320    H    HIS  46           H        HIS  46  -5.644  11.012   4.294
  321    HA   HIS  46           HA       HIS  46  -8.371  11.700   3.558
  322   1HB   HIS  46          1HB       HIS  46  -8.189  10.174   1.495
  323   2HB   HIS  46          2HB       HIS  46  -7.546  11.812   1.348
  324    HD1  HIS  46           1HD      HIS  46  -6.128   8.381   2.270
  325    HD2  HIS  46           2HD      HIS  46  -5.076  12.010   0.467
  326    HE1  HIS  46           1HE      HIS  46  -3.656   8.164   1.415
  327    HE2  HIS  46           2HE      HIS  46  -3.111  10.522   0.328
  328    H    ALA  47           H        ALA  47  -7.927  10.656   5.849
  329    HA   ALA  47           HA       ALA  47  -6.918   8.129   6.159
  330   1HB   ALA  47          1HB       ALA  47  -8.028   8.123   8.353
  331   2HB   ALA  47          2HB       ALA  47  -7.325   9.713   7.988
  332   3HB   ALA  47          3HB       ALA  47  -9.083   9.453   7.841
  333    H    ASP  48           H        ASP  48 -10.268   8.905   5.395
  334    HA   ASP  48           HA       ASP  48 -10.939   6.002   5.233
  335   1HB   ASP  48          1HB       ASP  48 -12.534   8.350   6.306
  336   2HB   ASP  48          2HB       ASP  48 -13.199   6.735   6.051
  337    H    LYS  49           H        LYS  49 -10.627   8.670   3.165
  338    HA   LYS  49           HA       LYS  49 -12.785   7.882   1.338
  339   1HB   LYS  49          1HB       LYS  49 -11.659  10.067   1.030
  340   2HB   LYS  49          2HB       LYS  49 -10.117   9.246   0.735
  341   1HG   LYS  49          1HG       LYS  49 -10.967   8.152  -1.258
  342   2HG   LYS  49          2HG       LYS  49 -12.598   8.746  -0.968
  343   1HD   LYS  49          1HD       LYS  49 -10.222  10.565  -1.582
  344   2HD   LYS  49          2HD       LYS  49 -11.260   9.836  -2.812
  345   1HE   LYS  49          1HE       LYS  49 -13.252  10.891  -1.534
  346   2HE   LYS  49          2HE       LYS  49 -12.028  11.878  -0.708
  347   1HZ   LYS  49          1HZ       LYS  49 -12.834  13.038  -2.678
  348   2HZ   LYS  49          2HZ       LYS  49 -11.287  12.528  -3.019
  349   3HZ   LYS  49          3HZ       LYS  49 -12.532  11.746  -3.645
  350    H    VAL  50           H        VAL  50  -9.493   6.879   2.144
  351    HA   VAL  50           HA       VAL  50  -9.728   4.570   0.294
  352    HB   VAL  50           HB       VAL  50  -7.356   4.554   0.019
  353   1HG1  VAL  50          1HG1      VAL  50  -8.141   7.480  -0.251
  354   2HG1  VAL  50          2HG1      VAL  50  -6.900   6.587  -1.158
  355   3HG1  VAL  50          3HG1      VAL  50  -8.607   6.208  -1.398
  356   1HG2  VAL  50          1HG2      VAL  50  -5.837   6.237   1.021
  357   2HG2  VAL  50          2HG2      VAL  50  -7.194   6.783   2.046
  358   3HG2  VAL  50          3HG2      VAL  50  -6.556   5.147   2.211
  359    H    THR  51           H        THR  51  -8.443   2.652   1.198
  360    HA   THR  51           HA       THR  51  -8.520   2.524   4.098
  361    HB   THR  51           HB       THR  51 -10.486   1.549   3.521
  362    HG1  THR  51           1HG      THR  51 -10.147  -0.717   3.963
  363   1HG2  THR  51          1HG2      THR  51 -10.709  -0.283   1.804
  364   2HG2  THR  51          2HG2      THR  51 -10.533   1.382   1.227
  365   3HG2  THR  51          3HG2      THR  51  -9.160   0.276   1.181
  366    H    VAL  52           H        VAL  52  -6.455   3.137   3.972
  367    HA   VAL  52           HA       VAL  52  -4.491   1.493   2.473
  368    HB   VAL  52           HB       VAL  52  -4.142   3.729   2.199
  369   1HG1  VAL  52          1HG1      VAL  52  -3.931   4.342   5.139
  370   2HG1  VAL  52          2HG1      VAL  52  -3.814   5.473   3.771
  371   3HG1  VAL  52          3HG1      VAL  52  -5.351   4.716   4.141
  372   1HG2  VAL  52          1HG2      VAL  52  -1.997   3.102   4.234
  373   2HG2  VAL  52          2HG2      VAL  52  -2.017   2.468   2.575
  374   3HG2  VAL  52          3HG2      VAL  52  -1.899   4.210   2.858
  375    H    ALA  53           H        ALA  53  -2.544   0.614   3.564
  376    HA   ALA  53           HA       ALA  53  -2.730   0.356   6.425
  377   1HB   ALA  53          1HB       ALA  53  -3.022  -2.053   6.438
  378   2HB   ALA  53          2HB       ALA  53  -4.358  -1.379   5.523
  379   3HB   ALA  53          3HB       ALA  53  -2.998  -2.114   4.648
  380    H    LYS  54           H        LYS  54  -0.917  -1.328   7.108
  381    HA   LYS  54           HA       LYS  54   1.319  -1.305   5.201
  382   1HB   LYS  54          1HB       LYS  54   1.561  -0.589   8.167
  383   2HB   LYS  54          2HB       LYS  54   2.893  -0.724   7.016
  384   1HG   LYS  54          1HG       LYS  54   2.062   1.259   5.802
  385   2HG   LYS  54          2HG       LYS  54   0.716   1.419   6.927
  386   1HD   LYS  54          1HD       LYS  54   2.056   2.190   8.649
  387   2HD   LYS  54          2HD       LYS  54   3.454   1.236   8.147
  388   1HE   LYS  54          1HE       LYS  54   3.865   3.623   7.855
  389   2HE   LYS  54          2HE       LYS  54   3.952   2.743   6.311
  390   1HZ   LYS  54          1HZ       LYS  54   1.803   3.629   5.764
  391   2HZ   LYS  54          2HZ       LYS  54   1.633   4.280   7.285
  392   3HZ   LYS  54          3HZ       LYS  54   2.804   4.870   6.286
  393    H    LEU  55           H        LEU  55   2.645  -3.061   5.213
  394    HA   LEU  55           HA       LEU  55   2.666  -4.738   7.580
  395   1HB   LEU  55          1HB       LEU  55   2.020  -6.815   6.406
  396   2HB   LEU  55          2HB       LEU  55   0.741  -5.649   6.717
  397    HG   LEU  55           HG       LEU  55   0.528  -5.071   4.425
  398   1HD1  LEU  55          1HD1      LEU  55   2.916  -6.897   3.899
  399   2HD1  LEU  55          2HD1      LEU  55   1.775  -6.327   2.666
  400   3HD1  LEU  55          3HD1      LEU  55   2.766  -5.154   3.527
  401   1HD2  LEU  55          1HD2      LEU  55  -0.586  -7.187   5.266
  402   2HD2  LEU  55          2HD2      LEU  55  -0.201  -7.229   3.541
  403   3HD2  LEU  55          3HD2      LEU  55   0.812  -8.086   4.719
  404    H    ASN  56           H        ASN  56   4.073  -6.615   7.409
  405    HA   ASN  56           HA       ASN  56   6.605  -5.889   6.091
  406   1HB   ASN  56          1HB       ASN  56   6.682  -6.272   8.491
  407   2HB   ASN  56          2HB       ASN  56   5.787  -7.790   8.337
  408   1HD2  ASN  56          1HD2      ASN  56   7.446  -8.947   9.490
  409   2HD2  ASN  56          2HD2      ASN  56   8.981  -9.292   8.683
  410    H    VAL  57           H        VAL  57   6.719  -6.691   4.045
  411    HA   VAL  57           HA       VAL  57   5.089  -8.809   3.115
  412    HB   VAL  57           HB       VAL  57   6.047  -6.832   1.900
  413   1HG1  VAL  57          1HG1      VAL  57   8.441  -8.688   1.521
  414   2HG1  VAL  57          2HG1      VAL  57   8.068  -7.330   0.475
  415   3HG1  VAL  57          3HG1      VAL  57   8.424  -7.035   2.185
  416   1HG2  VAL  57          1HG2      VAL  57   6.190  -9.464   0.428
  417   2HG2  VAL  57          2HG2      VAL  57   4.684  -8.636   0.869
  418   3HG2  VAL  57          3HG2      VAL  57   5.826  -7.861  -0.230
  419    H    ASP  58           H        ASP  58   8.216  -8.909   4.651
  420    HA   ASP  58           HA       ASP  58   9.188 -11.435   3.664
  421   1HB   ASP  58          1HB       ASP  58  10.416  -9.554   4.860
  422   2HB   ASP  58          2HB       ASP  58   9.668 -10.129   6.343
  423    H    GLU  59           H        GLU  59   6.814 -10.452   5.904
  424    HA   GLU  59           HA       GLU  59   6.601 -13.077   7.295
  425   1HB   GLU  59          1HB       GLU  59   7.261 -11.223   8.612
  426   2HB   GLU  59          2HB       GLU  59   5.944 -10.226   7.979
  427   1HG   GLU  59          1HG       GLU  59   4.299 -11.528   9.199
  428   2HG   GLU  59          2HG       GLU  59   5.563 -12.632   9.771
  429    H    ASN  60           H        ASN  60   4.860 -10.841   5.246
  430    HA   ASN  60           HA       ASN  60   2.379 -12.470   5.434
  431   1HB   ASN  60          1HB       ASN  60   1.713 -10.267   5.584
  432   2HB   ASN  60          2HB       ASN  60   2.970  -9.673   4.505
  433   1HD2  ASN  60          1HD2      ASN  60   0.380 -12.233   4.000
  434   2HD2  ASN  60          2HD2      ASN  60  -0.233 -11.448   2.551
  435    HA   PRO  61           HA       PRO  61   4.010 -14.182   1.499
  436   1HB   PRO  61          1HB       PRO  61   3.105 -16.741   1.820
  437   2HB   PRO  61          2HB       PRO  61   4.635 -16.149   2.535
  438   1HG   PRO  61          1HG       PRO  61   1.918 -16.358   3.880
  439   2HG   PRO  61          2HG       PRO  61   3.500 -16.953   4.483
  440   1HD   PRO  61          1HD       PRO  61   2.502 -14.569   5.294
  441   2HD   PRO  61          2HD       PRO  61   4.238 -14.757   4.974
  442    H    GLU  62           H        GLU  62   0.752 -14.215   3.078
  443    HA   GLU  62           HA       GLU  62  -0.578 -15.270   0.769
  444   1HB   GLU  62          1HB       GLU  62  -1.327 -15.492   3.145
  445   2HB   GLU  62          2HB       GLU  62  -1.803 -13.779   3.107
  446   1HG   GLU  62          1HG       GLU  62  -3.396 -14.209   1.312
  447   2HG   GLU  62          2HG       GLU  62  -2.824 -15.871   1.143
  448    H    THR  63           H        THR  63  -0.462 -14.172  -1.014
  449    HA   THR  63           HA       THR  63  -1.483 -12.824  -2.571
  450    HB   THR  63           HB       THR  63  -1.318 -10.377  -0.803
  451    HG1  THR  63           1HG      THR  63  -2.613 -11.718   0.234
  452   1HG2  THR  63          1HG2      THR  63  -2.905 -11.075  -3.313
  453   2HG2  THR  63          2HG2      THR  63  -3.164  -9.614  -2.344
  454   3HG2  THR  63          3HG2      THR  63  -1.610  -9.857  -3.152
  455    H    THR  64           H        THR  64   1.150 -11.960  -0.503
  456    HA   THR  64           HA       THR  64   2.901 -10.650  -2.275
  457    HB   THR  64           HB       THR  64   3.378 -12.680  -0.073
  458    HG1  THR  64           1HG      THR  64   3.394 -11.033   1.212
  459   1HG2  THR  64          1HG2      THR  64   5.437 -12.611  -1.386
  460   2HG2  THR  64          2HG2      THR  64   5.453 -10.839  -1.298
  461   3HG2  THR  64          3HG2      THR  64   5.645 -11.805   0.174
  462    H    SER  65           H        SER  65   2.479 -14.159  -1.633
  463    HA   SER  65           HA       SER  65   4.138 -15.001  -3.812
  464   1HB   SER  65          1HB       SER  65   3.638 -16.335  -1.754
  465   2HB   SER  65          2HB       SER  65   1.970 -16.543  -2.332
  466    HG   SER  65           HG       SER  65   3.093 -17.316  -4.343
  467    H    GLN  66           H        GLN  66   1.005 -13.565  -4.021
  468    HA   GLN  66           HA       GLN  66   0.174 -15.206  -6.311
  469   1HB   GLN  66          1HB       GLN  66  -1.446 -14.426  -4.609
  470   2HB   GLN  66          2HB       GLN  66  -1.095 -12.759  -5.015
  471   1HG   GLN  66          1HG       GLN  66  -3.191 -13.514  -6.038
  472   2HG   GLN  66          2HG       GLN  66  -2.022 -12.956  -7.222
  473   1HE2  GLN  66          1HE2      GLN  66  -0.828 -14.613  -8.502
  474   2HE2  GLN  66          2HE2      GLN  66  -1.667 -16.147  -8.805
  475    H    PHE  67           H        PHE  67   1.550 -11.982  -5.554
  476    HA   PHE  67           HA       PHE  67   1.645 -11.414  -8.487
  477   1HB   PHE  67          1HB       PHE  67   1.344  -9.604  -6.090
  478   2HB   PHE  67          2HB       PHE  67   1.577  -9.035  -7.737
  479    HD1  PHE  67           1HD      PHE  67  -0.187  -9.679  -9.513
  480    HD2  PHE  67           2HD      PHE  67  -0.813 -10.130  -5.275
  481    HE1  PHE  67           1HE      PHE  67  -2.641  -9.733  -9.879
  482    HE2  PHE  67           2HE      PHE  67  -3.271 -10.177  -5.643
  483    HZ   PHE  67           HZ       PHE  67  -4.187  -9.980  -7.946
  484    H    GLY  68           H        GLY  68   3.777 -12.420  -6.111
  485   1HA   GLY  68          1HA       GLY  68   6.057 -12.659  -6.291
  486   2HA   GLY  68          2HA       GLY  68   6.007 -11.755  -7.812
  487    H    ILE  69           H        ILE  69   4.863 -10.756  -4.616
  488    HA   ILE  69           HA       ILE  69   5.855  -8.091  -5.032
  489    HB   ILE  69           HB       ILE  69   4.509  -9.414  -2.680
  490   1HG1  ILE  69          1HG1      ILE  69   3.031  -9.640  -4.552
  491   2HG1  ILE  69          2HG1      ILE  69   2.409  -8.339  -3.552
  492   1HG2  ILE  69          1HG2      ILE  69   4.111  -6.475  -3.102
  493   2HG2  ILE  69          2HG2      ILE  69   3.962  -7.519  -1.705
  494   3HG2  ILE  69          3HG2      ILE  69   5.561  -7.051  -2.261
  495   1HD1  ILE  69          1HD1      ILE  69   3.698  -6.720  -5.151
  496   2HD1  ILE  69          2HD1      ILE  69   3.868  -8.120  -6.211
  497   3HD1  ILE  69          3HD1      ILE  69   2.251  -7.522  -5.773
  498    H    MET  70           H        MET  70   8.133  -8.616  -5.213
  499    HA   MET  70           HA       MET  70   9.493  -8.451  -2.556
  500   1HB   MET  70          1HB       MET  70  11.459  -9.301  -3.691
  501   2HB   MET  70          2HB       MET  70  10.099 -10.406  -3.884
  502   1HG   MET  70          1HG       MET  70   9.722  -9.532  -6.174
  503   2HG   MET  70          2HG       MET  70  11.080  -8.418  -5.978
  504   1HE   MET  70          1HE       MET  70  10.530 -10.588  -8.348
  505   2HE   MET  70          2HE       MET  70  11.850  -9.393  -8.357
  506   3HE   MET  70          3HE       MET  70  12.204 -11.112  -8.645
  507    H    SER  71           H        SER  71   8.491  -6.479  -5.082
  508    HA   SER  71           HA       SER  71  10.832  -4.977  -5.669
  509   1HB   SER  71          1HB       SER  71   7.895  -4.341  -6.168
  510   2HB   SER  71          2HB       SER  71   9.287  -3.750  -7.095
  511    HG   SER  71           HG       SER  71   9.636  -5.852  -7.819
  512    H    ILE  72           H        ILE  72  10.406  -4.869  -2.809
  513    HA   ILE  72           HA       ILE  72   8.735  -2.718  -2.187
  514    HB   ILE  72           HB       ILE  72   9.364  -3.081   0.148
  515   1HG1  ILE  72          1HG1      ILE  72  11.320  -5.153  -0.935
  516   2HG1  ILE  72          2HG1      ILE  72  11.725  -3.649  -0.093
  517   1HG2  ILE  72          1HG2      ILE  72   8.804  -5.707  -1.266
  518   2HG2  ILE  72          2HG2      ILE  72   8.197  -5.111   0.302
  519   3HG2  ILE  72          3HG2      ILE  72   7.624  -4.383  -1.188
  520   1HD1  ILE  72          1HD1      ILE  72  11.838  -5.301   1.574
  521   2HD1  ILE  72          2HD1      ILE  72  10.275  -4.525   1.848
  522   3HD1  ILE  72          3HD1      ILE  72  10.355  -6.103   1.032
  523    HA   PRO  73           HA       PRO  73   8.513  -1.145  -0.179
  524   1HB   PRO  73          1HB       PRO  73   7.804   1.455  -0.452
  525   2HB   PRO  73          2HB       PRO  73   8.968   0.872   0.752
  526   1HG   PRO  73          1HG       PRO  73   9.537   2.097  -1.964
  527   2HG   PRO  73          2HG       PRO  73  10.330   2.494  -0.412
  528   1HD   PRO  73          1HD       PRO  73  11.443   0.786  -2.242
  529   2HD   PRO  73          2HD       PRO  73  11.641   0.520  -0.490
  530    H    THR  74           H        THR  74   6.623  -1.764  -1.065
  531    HA   THR  74           HA       THR  74   5.909  -0.752  -3.781
  532    HB   THR  74           HB       THR  74   5.205  -3.495  -2.684
  533    HG1  THR  74           1HG      THR  74   7.425  -2.640  -4.119
  534   1HG2  THR  74          1HG2      THR  74   4.841  -2.256  -5.427
  535   2HG2  THR  74          2HG2      THR  74   4.639  -3.982  -5.054
  536   3HG2  THR  74          3HG2      THR  74   3.584  -2.782  -4.297
  537    H    LEU  75           H        LEU  75   3.830  -0.129  -4.084
  538    HA   LEU  75           HA       LEU  75   1.839  -0.265  -1.880
  539   1HB   LEU  75          1HB       LEU  75   3.081   2.015  -2.175
  540   2HB   LEU  75          2HB       LEU  75   2.089   2.127  -3.624
  541    HG   LEU  75           HG       LEU  75   0.128   1.294  -1.977
  542   1HD1  LEU  75          1HD1      LEU  75   2.079   2.645  -0.061
  543   2HD1  LEU  75          2HD1      LEU  75   0.395   2.220   0.312
  544   3HD1  LEU  75          3HD1      LEU  75   1.577   0.950  -0.009
  545   1HD2  LEU  75          1HD2      LEU  75   1.291   4.067  -1.992
  546   2HD2  LEU  75          2HD2      LEU  75   0.152   3.364  -3.185
  547   3HD2  LEU  75          3HD2      LEU  75  -0.372   3.638  -1.502
  548    H    ILE  76           H        ILE  76   0.245  -1.599  -2.875
  549    HA   ILE  76           HA       ILE  76  -0.278  -1.085  -5.774
  550    HB   ILE  76           HB       ILE  76  -0.630  -3.665  -4.268
  551   1HG1  ILE  76          1HG1      ILE  76   0.834  -3.589  -6.878
  552   2HG1  ILE  76          2HG1      ILE  76   1.657  -2.716  -5.602
  553   1HG2  ILE  76          1HG2      ILE  76  -2.527  -3.400  -5.829
  554   2HG2  ILE  76          2HG2      ILE  76  -1.420  -2.955  -7.140
  555   3HG2  ILE  76          3HG2      ILE  76  -1.403  -4.598  -6.471
  556   1HD1  ILE  76          1HD1      ILE  76   1.837  -4.680  -4.263
  557   2HD1  ILE  76          2HD1      ILE  76   0.718  -5.590  -5.323
  558   3HD1  ILE  76          3HD1      ILE  76   2.320  -5.084  -5.913
  559    H    LEU  77           H        LEU  77  -2.294  -0.774  -6.363
  560    HA   LEU  77           HA       LEU  77  -4.172   0.112  -4.255
  561   1HB   LEU  77          1HB       LEU  77  -3.071   1.724  -5.919
  562   2HB   LEU  77          2HB       LEU  77  -4.051   0.972  -7.158
  563    HG   LEU  77           HG       LEU  77  -4.801   2.807  -4.896
  564   1HD1  LEU  77          1HD1      LEU  77  -5.862   4.076  -6.649
  565   2HD1  LEU  77          2HD1      LEU  77  -4.278   3.579  -7.244
  566   3HD1  LEU  77          3HD1      LEU  77  -5.726   2.740  -7.795
  567   1HD2  LEU  77          1HD2      LEU  77  -6.839   0.958  -6.178
  568   2HD2  LEU  77          2HD2      LEU  77  -6.453   1.143  -4.456
  569   3HD2  LEU  77          3HD2      LEU  77  -7.237   2.453  -5.321
  570    H    PHE  78           H        PHE  78  -5.853  -1.115  -4.033
  571    HA   PHE  78           HA       PHE  78  -7.010  -2.502  -6.361
  572   1HB   PHE  78          1HB       PHE  78  -7.150  -3.879  -3.682
  573   2HB   PHE  78          2HB       PHE  78  -7.381  -4.530  -5.227
  574    HD1  PHE  78           1HD      PHE  78  -4.620  -3.138  -3.041
  575    HD2  PHE  78           2HD      PHE  78  -5.759  -6.020  -6.050
  576    HE1  PHE  78           1HE      PHE  78  -2.505  -4.342  -2.689
  577    HE2  PHE  78           2HE      PHE  78  -3.604  -7.191  -5.726
  578    HZ   PHE  78           HZ       PHE  78  -1.981  -6.379  -4.026
  579    H    LYS  79           H        LYS  79  -9.353  -3.316  -5.717
  580    HA   LYS  79           HA       LYS  79 -10.396  -2.476  -3.198
  581   1HB   LYS  79          1HB       LYS  79 -12.217  -1.115  -3.811
  582   2HB   LYS  79          2HB       LYS  79 -10.798  -0.354  -4.490
  583   1HG   LYS  79          1HG       LYS  79 -11.701  -1.911  -6.629
  584   2HG   LYS  79          2HG       LYS  79 -13.202  -1.526  -5.787
  585   1HD   LYS  79          1HD       LYS  79 -12.835   0.134  -7.470
  586   2HD   LYS  79          2HD       LYS  79 -12.537   0.920  -5.910
  587   1HE   LYS  79          1HE       LYS  79 -10.422   1.441  -6.544
  588   2HE   LYS  79          2HE       LYS  79 -10.063  -0.283  -6.764
  589   1HZ   LYS  79          1HZ       LYS  79  -9.693   0.939  -8.800
  590   2HZ   LYS  79          2HZ       LYS  79 -10.861  -0.196  -8.974
  591   3HZ   LYS  79          3HZ       LYS  79 -11.299   1.386  -8.878
  592    H    GLY  80           H        GLY  80 -12.209  -3.883  -2.708
  593   1HA   GLY  80          1HA       GLY  80 -13.191  -5.942  -2.865
  594   2HA   GLY  80          2HA       GLY  80 -13.993  -5.153  -4.210
  595    H    GLY  81           H        GLY  81 -10.675  -6.445  -3.864
  596   1HA   GLY  81          1HA       GLY  81  -9.688  -8.347  -4.719
  597   2HA   GLY  81          2HA       GLY  81 -11.161  -8.729  -5.604
  598    H    GLU  82           H        GLU  82 -10.701  -5.618  -6.753
  599    HA   GLU  82           HA       GLU  82  -9.159  -6.667  -9.014
  600   1HB   GLU  82          1HB       GLU  82  -9.955  -4.813 -10.213
  601   2HB   GLU  82          2HB       GLU  82 -11.268  -5.814  -9.639
  602   1HG   GLU  82          1HG       GLU  82 -12.178  -4.113  -8.376
  603   2HG   GLU  82          2HG       GLU  82 -10.636  -3.326  -8.077
  604    HA   PRO  83           HA       PRO  83  -5.827  -3.768  -7.734
  605   1HB   PRO  83          1HB       PRO  83  -3.939  -4.570  -9.520
  606   2HB   PRO  83          2HB       PRO  83  -4.276  -5.491  -8.027
  607   1HG   PRO  83          1HG       PRO  83  -5.288  -6.041 -10.827
  608   2HG   PRO  83          2HG       PRO  83  -4.620  -7.203  -9.642
  609   1HD   PRO  83          1HD       PRO  83  -7.315  -6.788 -10.041
  610   2HD   PRO  83          2HD       PRO  83  -6.643  -7.296  -8.463
  611    H    VAL  84           H        VAL  84  -5.388  -1.731  -8.764
  612    HA   VAL  84           HA       VAL  84  -6.218  -1.470 -11.612
  613    HB   VAL  84           HB       VAL  84  -6.406   1.024 -10.764
  614   1HG1  VAL  84          1HG1      VAL  84  -8.150  -0.309 -11.931
  615   2HG1  VAL  84          2HG1      VAL  84  -8.646  -0.999 -10.379
  616   3HG1  VAL  84          3HG1      VAL  84  -8.829   0.751 -10.700
  617   1HG2  VAL  84          1HG2      VAL  84  -7.478   1.323  -8.645
  618   2HG2  VAL  84          2HG2      VAL  84  -7.383  -0.417  -8.286
  619   3HG2  VAL  84          3HG2      VAL  84  -5.903   0.553  -8.400
  620    H    LYS  85           H        LYS  85  -3.753  -0.360  -9.159
  621    HA   LYS  85           HA       LYS  85  -1.769  -0.553 -11.161
  622   1HB   LYS  85          1HB       LYS  85  -0.938   1.826 -11.070
  623   2HB   LYS  85          2HB       LYS  85  -2.318   1.494 -12.079
  624   1HG   LYS  85          1HG       LYS  85  -3.839   2.501 -10.405
  625   2HG   LYS  85          2HG       LYS  85  -2.443   2.865  -9.360
  626   1HD   LYS  85          1HD       LYS  85  -1.477   4.318 -11.060
  627   2HD   LYS  85          2HD       LYS  85  -2.659   3.783 -12.266
  628   1HE   LYS  85          1HE       LYS  85  -4.486   4.802 -10.855
  629   2HE   LYS  85          2HE       LYS  85  -3.226   5.469  -9.800
  630   1HZ   LYS  85          1HZ       LYS  85  -3.596   6.117 -12.663
  631   2HZ   LYS  85          2HZ       LYS  85  -3.875   7.093 -11.366
  632   3HZ   LYS  85          3HZ       LYS  85  -2.333   6.642 -11.707
  633    H    GLN  86           H        GLN  86   0.361   0.323 -10.272
  634    HA   GLN  86           HA       GLN  86   0.596  -0.141  -7.396
  635   1HB   GLN  86          1HB       GLN  86   2.121  -1.886  -7.666
  636   2HB   GLN  86          2HB       GLN  86   0.761  -2.317  -8.724
  637   1HG   GLN  86          1HG       GLN  86   3.480  -1.219  -9.555
  638   2HG   GLN  86          2HG       GLN  86   2.970  -2.887  -9.640
  639   1HE2  GLN  86          1HE2      GLN  86   2.410   0.370 -11.056
  640   2HE2  GLN  86          2HE2      GLN  86   1.737  -0.289 -12.566
  641    H    LEU  87           H        LEU  87   2.619   0.502  -6.542
  642    HA   LEU  87           HA       LEU  87   4.319   2.269  -8.206
  643   1HB   LEU  87          1HB       LEU  87   3.201   2.863  -5.433
  644   2HB   LEU  87          2HB       LEU  87   4.257   3.920  -6.374
  645    HG   LEU  87           HG       LEU  87   1.435   3.101  -7.182
  646   1HD1  LEU  87          1HD1      LEU  87   1.342   4.458  -5.196
  647   2HD1  LEU  87          2HD1      LEU  87   2.373   5.696  -5.964
  648   3HD1  LEU  87          3HD1      LEU  87   0.752   5.352  -6.610
  649   1HD2  LEU  87          1HD2      LEU  87   3.122   5.375  -8.296
  650   2HD2  LEU  87          2HD2      LEU  87   3.025   3.784  -9.074
  651   3HD2  LEU  87          3HD2      LEU  87   1.563   4.731  -8.887
  652    H    ILE  88           H        ILE  88   6.480   2.182  -7.593
  653    HA   ILE  88           HA       ILE  88   7.283   0.312  -5.494
  654    HB   ILE  88           HB       ILE  88   8.854  -0.702  -7.191
  655   1HG1  ILE  88          1HG1      ILE  88   8.417   0.870  -9.118
  656   2HG1  ILE  88          2HG1      ILE  88   8.446  -0.850  -9.459
  657   1HG2  ILE  88          1HG2      ILE  88   7.244  -2.437  -7.866
  658   2HG2  ILE  88          2HG2      ILE  88   7.093  -1.955  -6.170
  659   3HG2  ILE  88          3HG2      ILE  88   5.907  -1.383  -7.359
  660   1HD1  ILE  88          1HD1      ILE  88   6.755   0.226 -10.788
  661   2HD1  ILE  88          2HD1      ILE  88   5.990  -0.900  -9.665
  662   3HD1  ILE  88          3HD1      ILE  88   5.930   0.854  -9.363
  663    H    GLY  89           H        GLY  89   9.036   1.013  -4.505
  664   1HA   GLY  89          1HA       GLY  89  11.117   2.126  -4.240
  665   2HA   GLY  89          2HA       GLY  89  10.865   2.999  -5.762
  666    H    TYR  90           H        TYR  90  11.680   4.334  -3.484
  667    HA   TYR  90           HA       TYR  90   9.494   5.402  -1.955
  668   1HB   TYR  90          1HB       TYR  90  11.687   5.035  -0.996
  669   2HB   TYR  90          2HB       TYR  90  12.398   6.181  -2.124
  670    HD1  TYR  90           1HD      TYR  90   9.125   7.247  -0.767
  671    HD2  TYR  90           2HD      TYR  90  13.396   7.198  -0.062
  672    HE1  TYR  90           1HE      TYR  90   8.853   8.923   0.983
  673    HE2  TYR  90           2HE      TYR  90  13.104   8.930   1.695
  674    HH   TYR  90           HH       TYR  90  10.237   9.348   3.194
  675    H    GLN  91           H        GLN  91   8.251   6.046  -3.909
  676    HA   GLN  91           HA       GLN  91   8.979   8.609  -5.100
  677   1HB   GLN  91          1HB       GLN  91   6.112   7.648  -4.955
  678   2HB   GLN  91          2HB       GLN  91   6.910   8.618  -6.170
  679   1HG   GLN  91          1HG       GLN  91   7.308   5.627  -5.762
  680   2HG   GLN  91          2HG       GLN  91   6.396   6.402  -7.039
  681   1HE2  GLN  91          1HE2      GLN  91   7.528   7.349  -8.859
  682   2HE2  GLN  91          2HE2      GLN  91   9.262   7.099  -9.021
  683    HA   PRO  92           HA       PRO  92   7.797  10.901  -1.449
  684   1HB   PRO  92          1HB       PRO  92   7.526  13.460  -2.417
  685   2HB   PRO  92          2HB       PRO  92   9.106  12.631  -2.292
  686   1HG   PRO  92          1HG       PRO  92   7.287  12.819  -4.715
  687   2HG   PRO  92          2HG       PRO  92   9.036  13.210  -4.623
  688   1HD   PRO  92          1HD       PRO  92   8.200  10.785  -5.511
  689   2HD   PRO  92          2HD       PRO  92   9.632  10.912  -4.447
  690    H    LYS  93           H        LYS  93   6.061  12.374  -0.615
  691    HA   LYS  93           HA       LYS  93   3.531  11.324  -0.862
  692   1HB   LYS  93          1HB       LYS  93   4.814  13.637   0.423
  693   2HB   LYS  93          2HB       LYS  93   3.221  14.093  -0.140
  694   1HG   LYS  93          1HG       LYS  93   3.791  11.628   1.540
  695   2HG   LYS  93          2HG       LYS  93   3.321  13.174   2.214
  696   1HD   LYS  93          1HD       LYS  93   1.639  11.617   0.199
  697   2HD   LYS  93          2HD       LYS  93   1.504  11.466   1.930
  698   1HE   LYS  93          1HE       LYS  93   1.085  14.092   0.449
  699   2HE   LYS  93          2HE       LYS  93  -0.215  12.946   0.796
  700   1HZ   LYS  93          1HZ       LYS  93   1.413  14.321   2.859
  701   2HZ   LYS  93          2HZ       LYS  93  -0.125  14.678   2.433
  702   3HZ   LYS  93          3HZ       LYS  93   0.188  13.244   3.156
  703    H    GLU  94           H        GLU  94   4.789  14.202  -2.543
  704    HA   GLU  94           HA       GLU  94   2.483  15.032  -3.879
  705   1HB   GLU  94          1HB       GLU  94   5.402  15.095  -4.751
  706   2HB   GLU  94          2HB       GLU  94   4.112  16.057  -5.488
  707   1HG   GLU  94          1HG       GLU  94   3.765  17.322  -3.463
  708   2HG   GLU  94          2HG       GLU  94   4.807  16.253  -2.522
  709    H    GLN  95           H        GLN  95   4.776  12.426  -4.764
  710    HA   GLN  95           HA       GLN  95   3.725  12.148  -7.485
  711   1HB   GLN  95          1HB       GLN  95   5.904  10.892  -5.819
  712   2HB   GLN  95          2HB       GLN  95   5.117   9.851  -6.988
  713   1HG   GLN  95          1HG       GLN  95   7.057  10.731  -8.009
  714   2HG   GLN  95          2HG       GLN  95   5.641  11.400  -8.816
  715   1HE2  GLN  95          1HE2      GLN  95   8.706  12.232  -7.543
  716   2HE2  GLN  95          2HE2      GLN  95   8.368  13.949  -7.365
  717    H    LEU  96           H        LEU  96   3.336  10.673  -4.249
  718    HA   LEU  96           HA       LEU  96   1.853   8.431  -5.092
  719   1HB   LEU  96          1HB       LEU  96   3.046   9.301  -2.769
  720   2HB   LEU  96          2HB       LEU  96   1.395   9.679  -2.429
  721    HG   LEU  96           HG       LEU  96   1.618   7.583  -1.497
  722   1HD1  LEU  96          1HD1      LEU  96   0.221   6.061  -2.672
  723   2HD1  LEU  96          2HD1      LEU  96  -0.322   7.660  -3.171
  724   3HD1  LEU  96          3HD1      LEU  96   0.682   6.709  -4.258
  725   1HD2  LEU  96          1HD2      LEU  96   3.219   6.738  -3.940
  726   2HD2  LEU  96          2HD2      LEU  96   3.845   7.105  -2.321
  727   3HD2  LEU  96          3HD2      LEU  96   2.810   5.690  -2.563
  728    H    GLU  97           H        GLU  97   0.815  11.637  -3.602
  729    HA   GLU  97           HA       GLU  97  -1.954  11.079  -3.841
  730   1HB   GLU  97          1HB       GLU  97  -0.338  13.620  -3.660
  731   2HB   GLU  97          2HB       GLU  97  -2.066  13.522  -3.486
  732   1HG   GLU  97          1HG       GLU  97  -0.090  12.183  -1.616
  733   2HG   GLU  97          2HG       GLU  97  -0.811  13.763  -1.347
  734    H    ALA  98           H        ALA  98   0.462  12.490  -6.082
  735    HA   ALA  98           HA       ALA  98  -1.590  13.390  -7.954
  736   1HB   ALA  98          1HB       ALA  98   0.304  13.701  -9.531
  737   2HB   ALA  98          2HB       ALA  98   0.645  14.442  -7.955
  738   3HB   ALA  98          3HB       ALA  98   1.396  12.889  -8.391
  739    H    GLN  99           H        GLN  99   0.676  10.525  -7.958
  740    HA   GLN  99           HA       GLN  99  -0.404   9.543 -10.397
  741   1HB   GLN  99          1HB       GLN  99   1.782   8.864  -9.297
  742   2HB   GLN  99          2HB       GLN  99   0.879   7.945  -8.128
  743   1HG   GLN  99          1HG       GLN  99   1.849   6.663 -10.125
  744   2HG   GLN  99          2HG       GLN  99   0.172   6.340  -9.663
  745   1HE2  GLN  99          1HE2      GLN  99   1.941   8.628 -11.902
  746   2HE2  GLN  99          2HE2      GLN  99   0.815   8.332 -13.221
  747    H    LEU 100           H        LEU 100  -1.311   9.031  -7.023
  748    HA   LEU 100           HA       LEU 100  -3.323   7.034  -7.765
  749   1HB   LEU 100          1HB       LEU 100  -1.770   7.443  -5.521
  750   2HB   LEU 100          2HB       LEU 100  -3.310   8.094  -5.024
  751    HG   LEU 100           HG       LEU 100  -4.213   5.797  -6.082
  752   1HD1  LEU 100          1HD1      LEU 100  -2.506   3.989  -5.790
  753   2HD1  LEU 100          2HD1      LEU 100  -1.968   5.167  -7.001
  754   3HD1  LEU 100          3HD1      LEU 100  -1.291   5.191  -5.357
  755   1HD2  LEU 100          1HD2      LEU 100  -4.109   4.764  -3.939
  756   2HD2  LEU 100          2HD2      LEU 100  -2.726   5.763  -3.430
  757   3HD2  LEU 100          3HD2      LEU 100  -4.350   6.475  -3.681
  758    H    ALA 101           H        ALA 101  -3.398  10.380  -8.019
  759    HA   ALA 101           HA       ALA 101  -5.544  11.350  -6.697
  760   1HB   ALA 101          1HB       ALA 101  -4.056  12.704  -8.093
  761   2HB   ALA 101          2HB       ALA 101  -4.743  11.978  -9.565
  762   3HB   ALA 101          3HB       ALA 101  -5.752  12.997  -8.516
  763    H    ASP 102           H        ASP 102  -5.795   9.214  -9.604
  764    HA   ASP 102           HA       ASP 102  -8.459   9.792 -10.308
  765   1HB   ASP 102          1HB       ASP 102  -7.464   6.938 -10.414
  766   2HB   ASP 102          2HB       ASP 102  -8.365   7.840 -11.618
  767    H    VAL 103           H        VAL 103  -7.256   8.081  -7.516
  768    HA   VAL 103           HA       VAL 103 -10.028   7.139  -6.941
  769    HB   VAL 103           HB       VAL 103  -7.721   5.602  -7.155
  770   1HG1  VAL 103          1HG1      VAL 103  -7.208   4.715  -4.944
  771   2HG1  VAL 103          2HG1      VAL 103  -6.760   6.417  -5.069
  772   3HG1  VAL 103          3HG1      VAL 103  -8.221   5.934  -4.175
  773   1HG2  VAL 103          1HG2      VAL 103 -10.278   4.992  -5.676
  774   2HG2  VAL 103          2HG2      VAL 103 -10.003   4.879  -7.423
  775   3HG2  VAL 103          3HG2      VAL 103  -9.113   3.807  -6.336
  776    H    LEU 104           H        LEU 104  -7.804   9.548  -6.123
  777    HA   LEU 104           HA       LEU 104  -8.962   9.969  -3.444
  778   1HB   LEU 104          1HB       LEU 104  -6.605  11.018  -5.014
  779   2HB   LEU 104          2HB       LEU 104  -7.239  11.960  -3.753
  780    HG   LEU 104           HG       LEU 104  -5.595  10.922  -2.602
  781   1HD1  LEU 104          1HD1      LEU 104  -6.277   9.021  -1.266
  782   2HD1  LEU 104          2HD1      LEU 104  -7.648  10.141  -1.431
  783   3HD1  LEU 104          3HD1      LEU 104  -7.590   8.637  -2.397
  784   1HD2  LEU 104          1HD2      LEU 104  -4.692   8.719  -3.051
  785   2HD2  LEU 104          2HD2      LEU 104  -5.964   8.407  -4.259
  786   3HD2  LEU 104          3HD2      LEU 104  -4.763   9.697  -4.519
  787    H    GLN 105           H        GLN 105  -9.421  10.842  -6.714
  788    HA   GLN 105           HA       GLN 105 -10.477  13.379  -6.651
  789   1HB   GLN 105          2HB       GLN 105 -10.146  12.174  -8.683
  790   2HB   GLN 105          3HB       GLN 105 -11.276  10.930  -8.190
  791   1HG   GLN 105          2HG       GLN 105 -12.284  12.364  -9.872
  792   2HG   GLN 105          3HG       GLN 105 -13.170  12.533  -8.365
  793   1HE2  GLN 105          1HE2      GLN 105 -12.571  14.493  -6.967
  794   2HE2  GLN 105          2HE2      GLN 105 -12.172  15.981  -7.860
  Start of MODEL   20
    1   1H    ALA   1           H        ALA   1 -10.265   3.691  10.122
    2   2H    ALA   1          2HN       ALA   1  -9.653   2.377  10.930
    3   3H    ALA   1          3HN       ALA   1  -8.662   3.296  10.008
    4    HA   ALA   1           HA       ALA   1 -10.916   1.719   9.031
    5   1HB   ALA   1          1HB       ALA   1  -8.705   3.088   7.445
    6   2HB   ALA   1          2HB       ALA   1 -10.102   2.171   6.813
    7   3HB   ALA   1          3HB       ALA   1 -10.366   3.701   7.646
    8    H    THR   2           H        THR   2  -8.714   0.534   7.082
    9    HA   THR   2           HA       THR   2  -8.572  -1.817   8.572
   10    HB   THR   2           HB       THR   2  -6.785  -1.283   6.208
   11    HG1  THR   2           1HG      THR   2  -8.632  -0.521   5.441
   12   1HG2  THR   2          1HG2      THR   2  -7.302  -3.604   5.658
   13   2HG2  THR   2          2HG2      THR   2  -6.680  -3.519   7.316
   14   3HG2  THR   2          3HG2      THR   2  -8.422  -3.725   7.029
   15    H    MET   3           H        MET   3  -5.970   0.071   7.542
   16    HA   MET   3           HA       MET   3  -3.726   0.166   8.034
   17   1HB   MET   3          1HB       MET   3  -4.753   1.297  10.098
   18   2HB   MET   3          2HB       MET   3  -4.350  -0.187  10.972
   19   1HG   MET   3          1HG       MET   3  -1.949   0.124  10.238
   20   2HG   MET   3          2HG       MET   3  -2.433   1.571   9.363
   21   1HE   MET   3          1HE       MET   3  -2.217   1.202  13.982
   22   2HE   MET   3          2HE       MET   3  -3.557   0.451  13.089
   23   3HE   MET   3          3HE       MET   3  -1.888  -0.118  12.839
   24    H    THR   4           H        THR   4  -2.788  -1.523  10.520
   25    HA   THR   4           HA       THR   4  -1.308  -3.067   8.962
   26    HB   THR   4           HB       THR   4  -1.783  -3.764  11.844
   27    HG1  THR   4           1HG      THR   4  -0.245  -2.110  12.209
   28   1HG2  THR   4          1HG2      THR   4  -0.183  -5.234  10.636
   29   2HG2  THR   4          2HG2      THR   4   0.702  -3.811  10.056
   30   3HG2  THR   4          3HG2      THR   4   0.674  -4.205  11.788
   31    H    LEU   5           H        LEU   5  -1.347  -4.923   7.956
   32    HA   LEU   5           HA       LEU   5  -3.602  -6.833   8.255
   33   1HB   LEU   5          1HB       LEU   5  -1.784  -5.833   6.121
   34   2HB   LEU   5          2HB       LEU   5  -2.034  -7.561   6.048
   35    HG   LEU   5           HG       LEU   5  -4.241  -7.393   5.517
   36   1HD1  LEU   5          1HD1      LEU   5  -5.244  -6.025   7.210
   37   2HD1  LEU   5          2HD1      LEU   5  -4.384  -4.596   6.632
   38   3HD1  LEU   5          3HD1      LEU   5  -5.665  -5.345   5.644
   39   1HD2  LEU   5          1HD2      LEU   5  -2.958  -4.875   4.353
   40   2HD2  LEU   5          2HD2      LEU   5  -2.820  -6.520   3.712
   41   3HD2  LEU   5          3HD2      LEU   5  -4.383  -5.683   3.679
   42    H    THR   6           H        THR   6  -2.973  -9.145   7.759
   43    HA   THR   6           HA       THR   6  -0.563  -9.942   9.282
   44    HB   THR   6           HB       THR   6  -2.395  -9.870  10.842
   45    HG1  THR   6           1HG      THR   6  -2.075 -11.889  11.653
   46   1HG2  THR   6          1HG2      THR   6  -3.792 -12.065   9.253
   47   2HG2  THR   6          2HG2      THR   6  -4.315 -11.322  10.768
   48   3HG2  THR   6          3HG2      THR   6  -4.305 -10.354   9.293
   49    H    ASP   7           H        ASP   7  -3.202 -11.206   7.278
   50    HA   ASP   7           HA       ASP   7  -1.792 -11.936   5.058
   51   1HB   ASP   7          1HB       ASP   7  -1.780 -14.115   7.171
   52   2HB   ASP   7          2HB       ASP   7  -2.250 -14.595   5.549
   53    H    ALA   8           H        ALA   8  -4.148 -13.799   7.041
   54    HA   ALA   8           HA       ALA   8  -6.124 -13.967   5.056
   55   1HB   ALA   8          1HB       ALA   8  -7.677 -14.426   6.930
   56   2HB   ALA   8          2HB       ALA   8  -6.125 -15.258   7.182
   57   3HB   ALA   8          3HB       ALA   8  -6.496 -13.771   8.085
   58    H    ASN   9           H        ASN   9  -5.356 -11.239   7.133
   59    HA   ASN   9           HA       ASN   9  -7.892  -9.885   6.653
   60   1HB   ASN   9          1HB       ASN   9  -6.349  -9.639   8.705
   61   2HB   ASN   9          2HB       ASN   9  -5.478  -8.470   7.702
   62   1HD2  ASN   9          1HD2      ASN   9  -7.713  -7.180   6.377
   63   2HD2  ASN   9          2HD2      ASN   9  -8.621  -6.372   7.665
   64    H    PHE  10           H        PHE  10  -4.974 -10.328   4.854
   65    HA   PHE  10           HA       PHE  10  -4.975  -7.806   3.410
   66   1HB   PHE  10          1HB       PHE  10  -2.967  -9.264   3.562
   67   2HB   PHE  10          2HB       PHE  10  -3.795 -10.496   2.656
   68    HD1  PHE  10           1HD      PHE  10  -1.457  -7.856   2.351
   69    HD2  PHE  10           2HD      PHE  10  -4.647  -9.829   0.191
   70    HE1  PHE  10           1HE      PHE  10  -0.595  -7.006   0.251
   71    HE2  PHE  10           2HE      PHE  10  -3.811  -8.896  -1.898
   72    HZ   PHE  10           HZ       PHE  10  -1.762  -7.482  -1.903
   73    H    GLN  11           H        GLN  11  -5.970 -11.129   2.415
   74    HA   GLN  11           HA       GLN  11  -7.544 -10.166   0.236
   75   1HB   GLN  11          1HB       GLN  11  -7.270 -12.809   1.622
   76   2HB   GLN  11          2HB       GLN  11  -8.743 -12.518   0.703
   77   1HG   GLN  11          1HG       GLN  11  -7.395 -11.891  -1.291
   78   2HG   GLN  11          2HG       GLN  11  -5.919 -12.187  -0.377
   79   1HE2  GLN  11          1HE2      GLN  11  -5.089 -14.248  -0.688
   80   2HE2  GLN  11          2HE2      GLN  11  -6.088 -15.711  -0.956
   81    H    GLN  12           H        GLN  12  -8.538 -10.928   3.657
   82    HA   GLN  12           HA       GLN  12 -11.258 -10.550   3.226
   83   1HB   GLN  12          1HB       GLN  12 -10.088 -11.438   5.288
   84   2HB   GLN  12          2HB       GLN  12  -9.714  -9.757   5.714
   85   1HG   GLN  12          1HG       GLN  12 -12.181  -9.303   5.846
   86   2HG   GLN  12          2HG       GLN  12 -12.468 -11.023   5.539
   87   1HE2  GLN  12          1HE2      GLN  12 -11.654  -8.624   7.957
   88   2HE2  GLN  12          2HE2      GLN  12 -11.336  -9.773   9.248
   89    H    ALA  13           H        ALA  13  -8.771  -7.997   3.536
   90    HA   ALA  13           HA       ALA  13 -10.756  -5.884   3.658
   91   1HB   ALA  13          1HB       ALA  13  -8.794  -4.398   3.536
   92   2HB   ALA  13          2HB       ALA  13  -8.620  -5.610   4.820
   93   3HB   ALA  13          3HB       ALA  13  -7.731  -5.808   3.291
   94    H    ILE  14           H        ILE  14  -8.233  -6.979   1.257
   95    HA   ILE  14           HA       ILE  14  -9.054  -5.042  -0.643
   96    HB   ILE  14           HB       ILE  14  -7.732  -6.193  -2.278
   97   1HG1  ILE  14          1HG1      ILE  14  -6.672  -8.368  -0.598
   98   2HG1  ILE  14          2HG1      ILE  14  -8.342  -8.614  -1.119
   99   1HG2  ILE  14          1HG2      ILE  14  -6.317  -6.136   0.411
  100   2HG2  ILE  14          2HG2      ILE  14  -5.542  -6.124  -1.183
  101   3HG2  ILE  14          3HG2      ILE  14  -6.573  -4.769  -0.696
  102   1HD1  ILE  14          1HD1      ILE  14  -7.659  -8.230  -3.478
  103   2HD1  ILE  14          2HD1      ILE  14  -5.968  -8.072  -2.931
  104   3HD1  ILE  14          3HD1      ILE  14  -6.832  -9.611  -2.726
  105    H    GLN  15           H        GLN  15 -10.450  -8.145   0.014
  106    HA   GLN  15           HA       GLN  15 -11.713  -8.725  -2.426
  107   1HB   GLN  15          1HB       GLN  15 -13.189 -10.151  -1.227
  108   2HB   GLN  15          2HB       GLN  15 -11.674 -10.214  -0.354
  109   1HG   GLN  15          1HG       GLN  15 -12.654  -8.469   1.234
  110   2HG   GLN  15          2HG       GLN  15 -14.195  -8.670   0.401
  111   1HE2  GLN  15          1HE2      GLN  15 -13.407  -9.208   3.236
  112   2HE2  GLN  15          2HE2      GLN  15 -14.127 -10.824   3.465
  113    H    GLY  16           H        GLY  16 -12.570  -6.250  -0.024
  114   1HA   GLY  16          1HA       GLY  16 -14.585  -4.959  -1.559
  115   2HA   GLY  16          2HA       GLY  16 -15.345  -6.143  -0.519
  116    H    ASP  17           H        ASP  17 -13.991  -3.266  -0.780
  117    HA   ASP  17           HA       ASP  17 -14.533  -2.279   1.915
  118   1HB   ASP  17          1HB       ASP  17 -12.263  -3.073   2.288
  119   2HB   ASP  17          2HB       ASP  17 -11.699  -2.357   0.793
  120    H    GLY  18           H        GLY  18 -12.358  -1.247  -0.699
  121   1HA   GLY  18          1HA       GLY  18 -13.654  -0.004  -2.638
  122   2HA   GLY  18          2HA       GLY  18 -13.968   1.114  -1.301
  123    HA   PRO  19           HA       PRO  19  -9.914   2.536  -2.662
  124   1HB   PRO  19          1HB       PRO  19  -9.598   4.747  -1.076
  125   2HB   PRO  19          2HB       PRO  19 -10.870   4.658  -2.311
  126   1HG   PRO  19          1HG       PRO  19 -11.178   4.051   0.643
  127   2HG   PRO  19          2HG       PRO  19 -12.200   5.107  -0.394
  128   1HD   PRO  19          1HD       PRO  19 -12.857   2.537   0.167
  129   2HD   PRO  19          2HD       PRO  19 -13.222   3.299  -1.417
  130    H    VAL  20           H        VAL  20  -8.978   0.413  -1.850
  131    HA   VAL  20           HA       VAL  20  -7.539   0.692   0.716
  132    HB   VAL  20           HB       VAL  20  -7.773  -1.587  -1.284
  133   1HG1  VAL  20          1HG1      VAL  20  -6.814  -2.953   0.631
  134   2HG1  VAL  20          2HG1      VAL  20  -5.670  -1.767  -0.003
  135   3HG1  VAL  20          3HG1      VAL  20  -6.524  -1.453   1.521
  136   1HG2  VAL  20          1HG2      VAL  20  -9.066  -1.187   1.450
  137   2HG2  VAL  20          2HG2      VAL  20  -9.897  -1.118  -0.112
  138   3HG2  VAL  20          3HG2      VAL  20  -9.193  -2.645   0.447
  139    H    LEU  21           H        LEU  21  -5.495   1.269   0.752
  140    HA   LEU  21           HA       LEU  21  -3.804   0.600  -1.615
  141   1HB   LEU  21          1HB       LEU  21  -2.124   2.195  -0.995
  142   2HB   LEU  21          2HB       LEU  21  -3.562   2.881  -1.724
  143    HG   LEU  21           HG       LEU  21  -3.252   2.906   1.270
  144   1HD1  LEU  21          1HD1      LEU  21  -2.064   5.047   1.189
  145   2HD1  LEU  21          2HD1      LEU  21  -1.113   3.734   0.502
  146   3HD1  LEU  21          3HD1      LEU  21  -1.915   4.907  -0.568
  147   1HD2  LEU  21          1HD2      LEU  21  -5.403   3.693   0.298
  148   2HD2  LEU  21          2HD2      LEU  21  -4.541   4.996   1.113
  149   3HD2  LEU  21          3HD2      LEU  21  -4.524   4.895  -0.658
  150    H    VAL  22           H        VAL  22  -2.562  -1.008  -1.299
  151    HA   VAL  22           HA       VAL  22  -2.298  -2.234   1.370
  152    HB   VAL  22           HB       VAL  22  -2.222  -3.111  -1.520
  153   1HG1  VAL  22          1HG1      VAL  22  -1.102  -5.196  -1.036
  154   2HG1  VAL  22          2HG1      VAL  22   0.005  -3.871  -0.766
  155   3HG1  VAL  22          3HG1      VAL  22  -0.759  -4.661   0.630
  156   1HG2  VAL  22          1HG2      VAL  22  -3.467  -5.048  -0.537
  157   2HG2  VAL  22          2HG2      VAL  22  -3.282  -4.334   1.071
  158   3HG2  VAL  22          3HG2      VAL  22  -4.230  -3.496  -0.171
  159    H    ASP  23           H        ASP  23  -0.448  -1.861   2.434
  160    HA   ASP  23           HA       ASP  23   1.794  -0.612   0.917
  161   1HB   ASP  23          1HB       ASP  23   0.393   0.452   2.976
  162   2HB   ASP  23          2HB       ASP  23   1.678  -0.335   3.879
  163    H    PHE  24           H        PHE  24   3.059  -2.286   0.289
  164    HA   PHE  24           HA       PHE  24   3.838  -4.399   2.211
  165   1HB   PHE  24          1HB       PHE  24   4.628  -3.818  -0.650
  166   2HB   PHE  24          2HB       PHE  24   5.209  -5.173   0.279
  167    HD1  PHE  24           1HD      PHE  24   2.762  -4.214  -2.103
  168    HD2  PHE  24           2HD      PHE  24   3.343  -6.717   1.358
  169    HE1  PHE  24           1HE      PHE  24   1.227  -5.894  -3.052
  170    HE2  PHE  24           2HE      PHE  24   1.867  -8.427   0.365
  171    HZ   PHE  24           HZ       PHE  24   0.884  -8.088  -1.818
  172    H    TRP  25           H        TRP  25   5.319  -3.768   3.672
  173    HA   TRP  25           HA       TRP  25   7.752  -2.421   2.697
  174   1HB   TRP  25          1HB       TRP  25   7.928  -1.063   4.650
  175   2HB   TRP  25          2HB       TRP  25   6.340  -0.746   3.969
  176    HD1  TRP  25           HD       TRP  25   4.254  -2.065   5.251
  177    HE1  TRP  25           1HE      TRP  25   3.938  -2.736   7.701
  178    HE3  TRP  25           3HE      TRP  25   9.087  -1.541   6.849
  179    HZ2  TRP  25           2HZ      TRP  25   5.608  -3.091  10.059
  180    HZ3  TRP  25           3HZ      TRP  25   9.697  -2.062   9.185
  181    HH2  TRP  25           HH       TRP  25   7.975  -2.855  10.795
  182    H    ALA  26           H        ALA  26   9.505  -2.966   4.632
  183    HA   ALA  26           HA       ALA  26   8.886  -5.592   5.790
  184   1HB   ALA  26          1HB       ALA  26  11.267  -5.043   3.973
  185   2HB   ALA  26          2HB       ALA  26  11.095  -6.444   5.026
  186   3HB   ALA  26          3HB       ALA  26   9.949  -6.208   3.701
  187    H    ALA  27           H        ALA  27  10.009  -6.018   7.632
  188    HA   ALA  27           HA       ALA  27  11.036  -3.987   9.240
  189   1HB   ALA  27          1HB       ALA  27  11.671  -6.968   9.303
  190   2HB   ALA  27          2HB       ALA  27  11.922  -5.826  10.642
  191   3HB   ALA  27          3HB       ALA  27  10.277  -6.167  10.067
  192    H    TRP  28           H        TRP  28  12.802  -5.786   6.748
  193    HA   TRP  28           HA       TRP  28  15.373  -4.776   7.749
  194   1HB   TRP  28          1HB       TRP  28  16.327  -6.469   6.727
  195   2HB   TRP  28          2HB       TRP  28  14.720  -7.142   6.609
  196    HD1  TRP  28           HD       TRP  28  17.451  -5.410   4.617
  197    HE1  TRP  28           1HE      TRP  28  17.022  -5.523   2.100
  198    HE3  TRP  28           3HE      TRP  28  12.922  -7.810   4.671
  199    HZ2  TRP  28           2HZ      TRP  28  14.830  -6.224   0.350
  200    HZ3  TRP  28           3HZ      TRP  28  11.639  -8.084   2.569
  201    HH2  TRP  28           HH       TRP  28  12.577  -7.230   0.418
  202    H    CYS  29           H        CYS  29  13.029  -3.719   5.308
  203    HA   CYS  29           HA       CYS  29  15.029  -3.147   3.343
  204   1HB   CYS  29          1HB       CYS  29  13.257  -2.018   2.060
  205   2HB   CYS  29          2HB       CYS  29  12.947  -3.677   2.524
  206    H    GLY  30           H        GLY  30  15.562  -1.040   2.404
  207   1HA   GLY  30          1HA       GLY  30  16.397   0.769   4.527
  208   2HA   GLY  30          2HA       GLY  30  16.921   0.792   2.849
  209    HA   PRO  31           HA       PRO  31  14.629   4.452   2.240
  210   1HB   PRO  31          1HB       PRO  31  13.556   4.232  -0.311
  211   2HB   PRO  31          2HB       PRO  31  15.276   4.570   0.059
  212   1HG   PRO  31          1HG       PRO  31  13.983   1.918  -0.623
  213   2HG   PRO  31          2HG       PRO  31  15.516   2.603  -1.253
  214   1HD   PRO  31          1HD       PRO  31  15.511   0.770   0.739
  215   2HD   PRO  31          2HD       PRO  31  16.656   2.143   0.775
  216    H    CYS  32           H        CYS  32  12.790   1.513   2.008
  217    HA   CYS  32           HA       CYS  32  10.140   2.554   2.022
  218   1HB   CYS  32          1HB       CYS  32   9.500   0.495   3.065
  219   2HB   CYS  32          2HB       CYS  32  10.735   0.138   1.863
  220    H    ARG  33           H        ARG  33  12.633   2.423   4.614
  221    HA   ARG  33           HA       ARG  33  10.846   3.161   6.736
  222   1HB   ARG  33          1HB       ARG  33  13.083   1.975   6.855
  223   2HB   ARG  33          2HB       ARG  33  13.848   3.547   6.565
  224   1HG   ARG  33          1HG       ARG  33  12.935   4.427   8.660
  225   2HG   ARG  33          2HG       ARG  33  11.954   2.958   8.887
  226   1HD   ARG  33          1HD       ARG  33  14.012   1.599   8.996
  227   2HD   ARG  33          2HD       ARG  33  14.999   3.064   8.797
  228    HE   ARG  33           HE       ARG  33  13.443   3.669  10.940
  229   1HH1  ARG  33          2HH2      ARG  33  15.538   0.916  10.235
  230   2HH1  ARG  33          1HH2      ARG  33  15.970   0.595  11.876
  231   1HH2  ARG  33          2HH1      ARG  33  13.996   3.276  13.160
  232   2HH2  ARG  33          1HH1      ARG  33  15.064   1.987  13.577
  233    H    MET  34           H        MET  34  12.205   5.023   4.136
  234    HA   MET  34           HA       MET  34  11.751   7.580   5.528
  235   1HB   MET  34          1HB       MET  34  13.047   6.918   2.850
  236   2HB   MET  34          2HB       MET  34  12.888   8.533   3.554
  237   1HG   MET  34          1HG       MET  34  14.217   7.712   5.535
  238   2HG   MET  34          2HG       MET  34  14.547   6.233   4.626
  239   1HE   MET  34          1HE       MET  34  16.687   7.636   1.591
  240   2HE   MET  34          2HE       MET  34  16.004   6.180   2.346
  241   3HE   MET  34          3HE       MET  34  14.931   7.389   1.594
  242    H    MET  35           H        MET  35  10.170   5.347   3.525
  243    HA   MET  35           HA       MET  35   8.423   7.296   2.174
  244   1HB   MET  35          1HB       MET  35   9.476   5.285   0.974
  245   2HB   MET  35          2HB       MET  35   8.442   4.254   1.975
  246   1HG   MET  35          1HG       MET  35   6.446   5.438   1.055
  247   2HG   MET  35          2HG       MET  35   7.505   6.418   0.045
  248   1HE   MET  35          1HE       MET  35   5.934   4.179  -2.703
  249   2HE   MET  35          2HE       MET  35   5.085   4.826  -1.284
  250   3HE   MET  35          3HE       MET  35   6.283   5.830  -2.139
  251    H    ALA  36           H        ALA  36   8.491   4.660   4.631
  252    HA   ALA  36           HA       ALA  36   5.898   4.505   5.459
  253   1HB   ALA  36          1HB       ALA  36   8.411   4.541   7.177
  254   2HB   ALA  36          2HB       ALA  36   6.809   3.965   7.692
  255   3HB   ALA  36          3HB       ALA  36   7.666   3.141   6.377
  256    HA   PRO  37           HA       PRO  37   5.988   8.525   8.079
  257   1HB   PRO  37          1HB       PRO  37   7.856  10.485   7.413
  258   2HB   PRO  37          2HB       PRO  37   8.061   9.295   8.738
  259   1HG   PRO  37          1HG       PRO  37   9.151   9.171   5.927
  260   2HG   PRO  37          2HG       PRO  37  10.014   8.849   7.469
  261   1HD   PRO  37          1HD       PRO  37   9.062   6.811   5.993
  262   2HD   PRO  37          2HD       PRO  37   8.904   6.778   7.767
  263    H    VAL  38           H        VAL  38   7.028   8.614   4.585
  264    HA   VAL  38           HA       VAL  38   5.271  10.884   4.084
  265    HB   VAL  38           HB       VAL  38   7.361   9.627   2.686
  266   1HG1  VAL  38          1HG1      VAL  38   6.462   9.442   0.358
  267   2HG1  VAL  38          2HG1      VAL  38   5.962   8.139   1.428
  268   3HG1  VAL  38          3HG1      VAL  38   4.826   9.445   1.011
  269   1HG2  VAL  38          1HG2      VAL  38   6.948  12.031   2.884
  270   2HG2  VAL  38          2HG2      VAL  38   7.158  11.555   1.194
  271   3HG2  VAL  38          3HG2      VAL  38   5.532  11.892   1.831
  272    H    LEU  39           H        LEU  39   4.829   7.419   4.286
  273    HA   LEU  39           HA       LEU  39   2.195   7.352   3.161
  274   1HB   LEU  39          1HB       LEU  39   4.086   5.483   4.543
  275   2HB   LEU  39          2HB       LEU  39   2.406   5.050   4.524
  276    HG   LEU  39           HG       LEU  39   2.340   4.555   2.329
  277   1HD1  LEU  39          1HD1      LEU  39   3.877   5.362   0.560
  278   2HD1  LEU  39          2HD1      LEU  39   2.853   6.630   1.239
  279   3HD1  LEU  39          3HD1      LEU  39   4.560   6.509   1.720
  280   1HD2  LEU  39          1HD2      LEU  39   4.368   3.333   1.713
  281   2HD2  LEU  39          2HD2      LEU  39   5.358   4.336   2.801
  282   3HD2  LEU  39          3HD2      LEU  39   4.148   3.217   3.459
  283    H    GLU  40           H        GLU  40   3.533   7.557   6.504
  284    HA   GLU  40           HA       GLU  40   0.918   7.522   7.709
  285   1HB   GLU  40          1HB       GLU  40   3.602   7.727   8.661
  286   2HB   GLU  40          2HB       GLU  40   2.830   9.202   9.140
  287   1HG   GLU  40          1HG       GLU  40   2.314   7.836  10.942
  288   2HG   GLU  40          2HG       GLU  40   0.854   7.710  10.000
  289    H    GLU  41           H        GLU  41   3.009  10.165   6.443
  290    HA   GLU  41           HA       GLU  41   1.111  12.302   6.688
  291   1HB   GLU  41          1HB       GLU  41   3.680  12.311   6.209
  292   2HB   GLU  41          2HB       GLU  41   3.225  11.978   4.536
  293   1HG   GLU  41          1HG       GLU  41   1.707  14.164   4.885
  294   2HG   GLU  41          2HG       GLU  41   2.844  14.480   6.184
  295    H    PHE  42           H        PHE  42   1.129   9.557   4.577
  296    HA   PHE  42           HA       PHE  42  -0.628  10.804   2.560
  297   1HB   PHE  42          1HB       PHE  42   1.049   8.900   2.086
  298   2HB   PHE  42          2HB       PHE  42  -0.104   7.831   2.888
  299    HD1  PHE  42           1HD      PHE  42   0.767   9.610  -0.110
  300    HD2  PHE  42           2HD      PHE  42  -2.461   7.606   1.934
  301    HE1  PHE  42           1HE      PHE  42  -0.560   9.651  -2.172
  302    HE2  PHE  42           2HE      PHE  42  -3.787   7.613  -0.165
  303    HZ   PHE  42           HZ       PHE  42  -2.867   8.746  -2.201
  304    H    ALA  43           H        ALA  43  -0.810   8.386   5.226
  305    HA   ALA  43           HA       ALA  43  -3.543   7.842   5.064
  306   1HB   ALA  43          1HB       ALA  43  -1.876   6.534   6.390
  307   2HB   ALA  43          2HB       ALA  43  -1.756   7.871   7.546
  308   3HB   ALA  43          3HB       ALA  43  -3.284   6.994   7.366
  309    H    GLU  44           H        GLU  44  -1.840  10.323   7.005
  310    HA   GLU  44           HA       GLU  44  -4.083  11.382   8.352
  311   1HB   GLU  44          1HB       GLU  44  -1.787  11.760   8.948
  312   2HB   GLU  44          2HB       GLU  44  -1.513  12.771   7.538
  313   1HG   GLU  44          1HG       GLU  44  -3.785  13.347   9.506
  314   2HG   GLU  44          2HG       GLU  44  -2.144  13.754   9.922
  315    H    ALA  45           H        ALA  45  -2.578  12.515   5.326
  316    HA   ALA  45           HA       ALA  45  -4.029  14.831   5.099
  317   1HB   ALA  45          1HB       ALA  45  -1.928  14.386   3.946
  318   2HB   ALA  45          2HB       ALA  45  -2.729  13.208   2.872
  319   3HB   ALA  45          3HB       ALA  45  -3.151  14.938   2.786
  320    H    HIS  46           H        HIS  46  -5.296  11.738   4.322
  321    HA   HIS  46           HA       HIS  46  -7.872  12.887   3.681
  322   1HB   HIS  46          1HB       HIS  46  -7.911  11.083   1.660
  323   2HB   HIS  46          2HB       HIS  46  -7.559  12.794   1.475
  324    HD1  HIS  46           1HD      HIS  46  -5.577  13.120  -0.202
  325    HD2  HIS  46           2HD      HIS  46  -5.249   9.764   2.378
  326    HE1  HIS  46           1HE      HIS  46  -3.304  12.145  -0.576
  327    HE2  HIS  46           2HE      HIS  46  -3.094  10.056   0.949
  328    H    ALA  47           H        ALA  47  -7.085  11.788   5.987
  329    HA   ALA  47           HA       ALA  47  -7.274   9.030   6.328
  330   1HB   ALA  47          1HB       ALA  47  -7.845   9.583   8.669
  331   2HB   ALA  47          2HB       ALA  47  -6.554  10.637   8.061
  332   3HB   ALA  47          3HB       ALA  47  -8.218  11.253   8.192
  333    H    ASP  48           H        ASP  48  -9.837  11.075   5.268
  334    HA   ASP  48           HA       ASP  48 -12.011   9.346   6.158
  335   1HB   ASP  48          1HB       ASP  48 -13.387  11.122   5.139
  336   2HB   ASP  48          2HB       ASP  48 -12.244  11.826   6.282
  337    H    LYS  49           H        LYS  49 -10.547  10.556   3.120
  338    HA   LYS  49           HA       LYS  49 -12.410   9.072   1.549
  339   1HB   LYS  49          1HB       LYS  49 -11.312  11.186   0.832
  340   2HB   LYS  49          2HB       LYS  49  -9.786  10.314   0.621
  341   1HG   LYS  49          1HG       LYS  49 -10.742   8.939  -1.127
  342   2HG   LYS  49          2HG       LYS  49 -12.356   9.596  -0.868
  343   1HD   LYS  49          1HD       LYS  49 -10.000  11.286  -1.792
  344   2HD   LYS  49          2HD       LYS  49 -10.981  10.308  -2.891
  345   1HE   LYS  49          1HE       LYS  49 -13.018  11.571  -2.025
  346   2HE   LYS  49          2HE       LYS  49 -11.870  12.714  -1.294
  347   1HZ   LYS  49          1HZ       LYS  49 -12.076  12.000  -4.186
  348   2HZ   LYS  49          2HZ       LYS  49 -12.479  13.440  -3.552
  349   3HZ   LYS  49          3HZ       LYS  49 -10.901  12.928  -3.608
  350    H    VAL  50           H        VAL  50  -9.568   7.795   3.102
  351    HA   VAL  50           HA       VAL  50  -9.665   5.474   1.224
  352    HB   VAL  50           HB       VAL  50  -7.316   5.407   0.874
  353   1HG1  VAL  50          1HG1      VAL  50  -8.198   8.246   0.288
  354   2HG1  VAL  50          2HG1      VAL  50  -6.978   7.282  -0.580
  355   3HG1  VAL  50          3HG1      VAL  50  -8.689   6.832  -0.655
  356   1HG2  VAL  50          1HG2      VAL  50  -7.050   7.938   2.539
  357   2HG2  VAL  50          2HG2      VAL  50  -6.420   6.336   2.957
  358   3HG2  VAL  50          3HG2      VAL  50  -5.760   7.205   1.567
  359    H    THR  51           H        THR  51  -8.427   3.502   1.951
  360    HA   THR  51           HA       THR  51  -7.660   3.677   4.748
  361    HB   THR  51           HB       THR  51  -9.599   2.255   4.664
  362    HG1  THR  51           1HG      THR  51  -7.049   1.139   5.241
  363   1HG2  THR  51          1HG2      THR  51  -9.360   1.354   2.357
  364   2HG2  THR  51          2HG2      THR  51  -8.010   0.347   2.936
  365   3HG2  THR  51          3HG2      THR  51  -9.645   0.127   3.596
  366    H    VAL  52           H        VAL  52  -5.542   3.563   4.977
  367    HA   VAL  52           HA       VAL  52  -3.925   2.147   2.966
  368    HB   VAL  52           HB       VAL  52  -2.948   3.078   5.621
  369   1HG1  VAL  52          1HG1      VAL  52  -0.784   3.307   4.395
  370   2HG1  VAL  52          2HG1      VAL  52  -1.406   1.659   4.340
  371   3HG1  VAL  52          3HG1      VAL  52  -1.566   2.715   2.922
  372   1HG2  VAL  52          1HG2      VAL  52  -3.289   4.797   3.132
  373   2HG2  VAL  52          2HG2      VAL  52  -3.895   5.127   4.766
  374   3HG2  VAL  52          3HG2      VAL  52  -2.163   5.210   4.438
  375    H    ALA  53           H        ALA  53  -2.997   0.106   3.427
  376    HA   ALA  53           HA       ALA  53  -3.702  -1.139   5.973
  377   1HB   ALA  53          1HB       ALA  53  -4.493  -3.176   4.939
  378   2HB   ALA  53          2HB       ALA  53  -5.517  -1.820   4.467
  379   3HB   ALA  53          3HB       ALA  53  -4.316  -2.472   3.319
  380    H    LYS  54           H        LYS  54  -1.673  -1.392   6.724
  381    HA   LYS  54           HA       LYS  54   0.474  -1.859   4.748
  382   1HB   LYS  54          1HB       LYS  54   2.027  -0.985   6.422
  383   2HB   LYS  54          2HB       LYS  54   0.763   0.144   5.963
  384   1HG   LYS  54          1HG       LYS  54  -0.439  -0.402   8.120
  385   2HG   LYS  54          2HG       LYS  54   0.986  -1.344   8.600
  386   1HD   LYS  54          1HD       LYS  54   2.408   0.685   8.374
  387   2HD   LYS  54          2HD       LYS  54   1.022   1.613   7.785
  388   1HE   LYS  54          1HE       LYS  54  -0.093   1.243  10.024
  389   2HE   LYS  54          2HE       LYS  54   1.400   0.502  10.587
  390   1HZ   LYS  54          1HZ       LYS  54   1.190   3.393   9.693
  391   2HZ   LYS  54          2HZ       LYS  54   1.285   2.837  11.218
  392   3HZ   LYS  54          3HZ       LYS  54   2.528   2.646  10.194
  393    H    LEU  55           H        LEU  55   1.975  -3.510   4.861
  394    HA   LEU  55           HA       LEU  55   1.747  -5.384   7.136
  395   1HB   LEU  55          1HB       LEU  55   1.675  -7.349   5.793
  396   2HB   LEU  55          2HB       LEU  55   0.228  -6.410   5.585
  397    HG   LEU  55           HG       LEU  55   2.482  -6.333   3.534
  398   1HD1  LEU  55          1HD1      LEU  55   0.251  -8.363   3.921
  399   2HD1  LEU  55          2HD1      LEU  55   0.974  -8.064   2.334
  400   3HD1  LEU  55          3HD1      LEU  55   1.983  -8.632   3.645
  401   1HD2  LEU  55          1HD2      LEU  55   0.624  -5.789   1.984
  402   2HD2  LEU  55          2HD2      LEU  55  -0.520  -5.771   3.348
  403   3HD2  LEU  55          3HD2      LEU  55   0.778  -4.571   3.234
  404    H    ASN  56           H        ASN  56   3.511  -6.681   7.486
  405    HA   ASN  56           HA       ASN  56   6.072  -5.612   6.477
  406   1HB   ASN  56          1HB       ASN  56   5.837  -5.857   8.931
  407   2HB   ASN  56          2HB       ASN  56   5.305  -7.535   8.747
  408   1HD2  ASN  56          1HD2      ASN  56   7.038  -8.412  10.075
  409   2HD2  ASN  56          2HD2      ASN  56   8.685  -8.375   9.445
  410    H    VAL  57           H        VAL  57   6.029  -6.435   4.417
  411    HA   VAL  57           HA       VAL  57   4.917  -8.909   3.614
  412    HB   VAL  57           HB       VAL  57   5.296  -6.779   2.396
  413   1HG1  VAL  57          1HG1      VAL  57   7.266  -6.076   1.557
  414   2HG1  VAL  57          2HG1      VAL  57   7.907  -6.896   2.968
  415   3HG1  VAL  57          3HG1      VAL  57   7.960  -7.722   1.408
  416   1HG2  VAL  57          1HG2      VAL  57   5.434  -7.767   0.200
  417   2HG2  VAL  57          2HG2      VAL  57   6.147  -9.243   0.880
  418   3HG2  VAL  57          3HG2      VAL  57   4.475  -8.796   1.270
  419    H    ASP  58           H        ASP  58   7.885  -8.267   5.143
  420    HA   ASP  58           HA       ASP  58   9.543 -10.490   4.422
  421   1HB   ASP  58          1HB       ASP  58   9.983  -8.226   5.665
  422   2HB   ASP  58          2HB       ASP  58   9.382  -9.071   7.079
  423    H    GLU  59           H        GLU  59   6.734 -10.116   6.352
  424    HA   GLU  59           HA       GLU  59   7.041 -12.698   7.811
  425   1HB   GLU  59          1HB       GLU  59   7.471 -10.740   9.150
  426   2HB   GLU  59          2HB       GLU  59   5.986  -9.979   8.565
  427   1HG   GLU  59          1HG       GLU  59   4.617 -11.574   9.788
  428   2HG   GLU  59          2HG       GLU  59   6.067 -12.452  10.305
  429    H    ASN  60           H        ASN  60   4.886 -10.585   5.919
  430    HA   ASN  60           HA       ASN  60   2.525 -12.256   6.430
  431   1HB   ASN  60          1HB       ASN  60   3.022  -9.407   5.460
  432   2HB   ASN  60          2HB       ASN  60   1.456 -10.144   5.705
  433   1HD2  ASN  60          1HD2      ASN  60   1.551 -11.284   8.220
  434   2HD2  ASN  60          2HD2      ASN  60   2.155 -10.143   9.429
  435    HA   PRO  61           HA       PRO  61   4.046 -13.187   2.137
  436   1HB   PRO  61          1HB       PRO  61   3.497 -15.898   2.050
  437   2HB   PRO  61          2HB       PRO  61   4.946 -15.188   2.820
  438   1HG   PRO  61          1HG       PRO  61   2.304 -15.940   4.141
  439   2HG   PRO  61          2HG       PRO  61   3.962 -16.421   4.638
  440   1HD   PRO  61          1HD       PRO  61   2.768 -14.326   5.828
  441   2HD   PRO  61          2HD       PRO  61   4.479 -14.210   5.340
  442    H    GLU  62           H        GLU  62   0.760 -13.216   3.307
  443    HA   GLU  62           HA       GLU  62  -0.460 -14.573   1.143
  444   1HB   GLU  62          1HB       GLU  62  -1.811 -14.075   3.031
  445   2HB   GLU  62          2HB       GLU  62  -1.420 -12.341   2.954
  446   1HG   GLU  62          1HG       GLU  62  -3.765 -13.068   2.169
  447   2HG   GLU  62          2HG       GLU  62  -2.852 -11.875   1.277
  448    H    THR  63           H        THR  63  -1.115 -14.000  -0.823
  449    HA   THR  63           HA       THR  63  -0.902 -13.300  -2.902
  450    HB   THR  63           HB       THR  63  -1.589 -10.777  -1.424
  451    HG1  THR  63           1HG      THR  63  -3.283 -12.414  -1.718
  452   1HG2  THR  63          1HG2      THR  63  -2.182  -9.671  -3.557
  453   2HG2  THR  63          2HG2      THR  63  -0.437  -9.896  -3.406
  454   3HG2  THR  63          3HG2      THR  63  -1.395 -10.972  -4.466
  455    H    THR  64           H        THR  64   1.499 -12.300  -0.783
  456    HA   THR  64           HA       THR  64   3.170 -10.753  -2.361
  457    HB   THR  64           HB       THR  64   3.756 -12.680  -0.088
  458    HG1  THR  64           1HG      THR  64   2.342 -11.107   0.595
  459   1HG2  THR  64          1HG2      THR  64   5.503 -10.396  -0.997
  460   2HG2  THR  64          2HG2      THR  64   5.732 -11.443   0.420
  461   3HG2  THR  64          3HG2      THR  64   5.866 -12.122  -1.203
  462    H    SER  65           H        SER  65   3.287 -14.244  -1.688
  463    HA   SER  65           HA       SER  65   5.193 -14.880  -3.775
  464   1HB   SER  65          1HB       SER  65   4.958 -16.187  -1.668
  465   2HB   SER  65          2HB       SER  65   3.319 -16.665  -2.166
  466    HG   SER  65           HG       SER  65   4.435 -17.386  -4.164
  467    H    GLN  66           H        GLN  66   2.041 -13.803  -4.166
  468    HA   GLN  66           HA       GLN  66   1.365 -15.743  -6.307
  469   1HB   GLN  66          1HB       GLN  66  -0.184 -15.223  -4.268
  470   2HB   GLN  66          2HB       GLN  66  -0.449 -13.665  -5.050
  471   1HG   GLN  66          1HG       GLN  66  -2.259 -15.037  -5.653
  472   2HG   GLN  66          2HG       GLN  66  -1.261 -14.863  -7.099
  473   1HE2  GLN  66          1HE2      GLN  66  -2.932 -16.874  -7.392
  474   2HE2  GLN  66          2HE2      GLN  66  -2.172 -18.417  -7.017
  475    H    PHE  67           H        PHE  67   1.710 -12.221  -5.546
  476    HA   PHE  67           HA       PHE  67   1.377 -11.575  -8.416
  477   1HB   PHE  67          1HB       PHE  67   0.059 -10.567  -6.354
  478   2HB   PHE  67          2HB       PHE  67   1.477  -9.621  -6.135
  479    HD1  PHE  67           1HD      PHE  67  -1.559 -10.181  -8.045
  480    HD2  PHE  67           2HD      PHE  67   2.117  -7.921  -7.989
  481    HE1  PHE  67           1HE      PHE  67  -2.525  -8.559  -9.649
  482    HE2  PHE  67           2HE      PHE  67   1.144  -6.308  -9.601
  483    HZ   PHE  67           HZ       PHE  67  -1.180  -6.617 -10.425
  484    H    GLY  68           H        GLY  68   3.913 -12.494  -6.554
  485   1HA   GLY  68          1HA       GLY  68   6.164 -12.442  -6.998
  486   2HA   GLY  68          2HA       GLY  68   5.821 -11.406  -8.393
  487    H    ILE  69           H        ILE  69   5.107 -10.831  -4.945
  488    HA   ILE  69           HA       ILE  69   5.871  -8.051  -5.245
  489    HB   ILE  69           HB       ILE  69   4.806  -9.658  -2.935
  490   1HG1  ILE  69          1HG1      ILE  69   3.219  -9.741  -4.752
  491   2HG1  ILE  69          2HG1      ILE  69   2.589  -8.695  -3.506
  492   1HG2  ILE  69          1HG2      ILE  69   3.984  -7.682  -1.917
  493   2HG2  ILE  69          2HG2      ILE  69   5.720  -7.545  -2.070
  494   3HG2  ILE  69          3HG2      ILE  69   4.665  -6.634  -3.168
  495   1HD1  ILE  69          1HD1      ILE  69   3.375  -6.681  -4.852
  496   2HD1  ILE  69          2HD1      ILE  69   3.835  -7.810  -6.147
  497   3HD1  ILE  69          3HD1      ILE  69   2.149  -7.660  -5.623
  498    H    MET  70           H        MET  70   8.097  -8.642  -5.763
  499    HA   MET  70           HA       MET  70   9.853  -8.799  -3.343
  500   1HB   MET  70          1HB       MET  70  10.537  -8.885  -6.313
  501   2HB   MET  70          2HB       MET  70  11.652  -9.162  -4.964
  502   1HG   MET  70          1HG       MET  70  10.179 -11.078  -4.247
  503   2HG   MET  70          2HG       MET  70   9.263 -10.877  -5.742
  504   1HE   MET  70          1HE       MET  70  10.115 -11.447  -8.130
  505   2HE   MET  70          2HE       MET  70  11.461 -10.286  -7.976
  506   3HE   MET  70          3HE       MET  70  11.779 -11.948  -8.514
  507    H    SER  71           H        SER  71   8.469  -6.535  -5.481
  508    HA   SER  71           HA       SER  71  10.703  -4.904  -6.035
  509   1HB   SER  71          1HB       SER  71   7.738  -4.359  -6.405
  510   2HB   SER  71          2HB       SER  71   9.083  -3.730  -7.394
  511    HG   SER  71           HG       SER  71   8.008  -5.504  -8.377
  512    H    ILE  72           H        ILE  72  10.032  -4.988  -3.149
  513    HA   ILE  72           HA       ILE  72   8.341  -2.889  -2.527
  514    HB   ILE  72           HB       ILE  72   8.620  -3.503  -0.229
  515   1HG1  ILE  72          1HG1      ILE  72  11.011  -5.226  -1.001
  516   2HG1  ILE  72          2HG1      ILE  72  11.134  -3.643  -0.225
  517   1HG2  ILE  72          1HG2      ILE  72   8.006  -5.850  -0.403
  518   2HG2  ILE  72          2HG2      ILE  72   7.324  -4.969  -1.760
  519   3HG2  ILE  72          3HG2      ILE  72   8.758  -6.006  -1.972
  520   1HD1  ILE  72          1HD1      ILE  72   9.914  -6.143   0.955
  521   2HD1  ILE  72          2HD1      ILE  72  11.290  -5.188   1.530
  522   3HD1  ILE  72          3HD1      ILE  72   9.659  -4.520   1.647
  523    HA   PRO  73           HA       PRO  73   8.056  -1.467  -0.204
  524   1HB   PRO  73          1HB       PRO  73   7.337   1.165  -0.327
  525   2HB   PRO  73          2HB       PRO  73   8.512   0.507   0.844
  526   1HG   PRO  73          1HG       PRO  73   9.083   1.862  -1.806
  527   2HG   PRO  73          2HG       PRO  73   9.845   2.198  -0.222
  528   1HD   PRO  73          1HD       PRO  73  11.043   0.597  -2.055
  529   2HD   PRO  73          2HD       PRO  73  11.118   0.192  -0.321
  530    H    THR  74           H        THR  74   6.190  -2.106  -1.146
  531    HA   THR  74           HA       THR  74   5.551  -1.109  -3.892
  532    HB   THR  74           HB       THR  74   4.849  -3.828  -2.729
  533    HG1  THR  74           1HG      THR  74   6.353  -4.602  -4.156
  534   1HG2  THR  74          1HG2      THR  74   4.198  -4.345  -5.076
  535   2HG2  THR  74          2HG2      THR  74   3.211  -3.041  -4.403
  536   3HG2  THR  74          3HG2      THR  74   4.530  -2.659  -5.517
  537    H    LEU  75           H        LEU  75   3.558  -0.317  -4.232
  538    HA   LEU  75           HA       LEU  75   1.627  -0.191  -1.957
  539   1HB   LEU  75          1HB       LEU  75   3.226   1.772  -2.205
  540   2HB   LEU  75          2HB       LEU  75   2.331   2.195  -3.645
  541    HG   LEU  75           HG       LEU  75   0.781   1.625  -1.090
  542   1HD1  LEU  75          1HD1      LEU  75   2.581   3.029  -0.359
  543   2HD1  LEU  75          2HD1      LEU  75   2.362   4.121  -1.740
  544   3HD1  LEU  75          3HD1      LEU  75   1.115   4.006  -0.452
  545   1HD2  LEU  75          1HD2      LEU  75  -0.629   3.494  -2.052
  546   2HD2  LEU  75          2HD2      LEU  75   0.409   3.496  -3.474
  547   3HD2  LEU  75          3HD2      LEU  75  -0.558   2.047  -3.069
  548    H    ILE  76           H        ILE  76   0.083  -1.526  -2.848
  549    HA   ILE  76           HA       ILE  76  -0.630  -1.151  -5.732
  550    HB   ILE  76           HB       ILE  76  -1.398  -3.497  -3.975
  551   1HG1  ILE  76          1HG1      ILE  76   0.865  -3.225  -5.980
  552   2HG1  ILE  76          2HG1      ILE  76   0.967  -3.671  -4.277
  553   1HG2  ILE  76          1HG2      ILE  76  -2.153  -4.483  -6.132
  554   2HG2  ILE  76          2HG2      ILE  76  -2.970  -2.971  -5.856
  555   3HG2  ILE  76          3HG2      ILE  76  -1.609  -3.033  -6.999
  556   1HD1  ILE  76          1HD1      ILE  76  -0.115  -5.393  -6.543
  557   2HD1  ILE  76          2HD1      ILE  76   1.305  -5.647  -5.533
  558   3HD1  ILE  76          3HD1      ILE  76  -0.311  -5.797  -4.821
  559    H    LEU  77           H        LEU  77  -2.834  -0.633  -6.116
  560    HA   LEU  77           HA       LEU  77  -4.369   0.110  -3.670
  561   1HB   LEU  77          1HB       LEU  77  -3.562   1.979  -5.036
  562   2HB   LEU  77          2HB       LEU  77  -4.551   1.383  -6.399
  563    HG   LEU  77           HG       LEU  77  -5.447   2.536  -3.729
  564   1HD1  LEU  77          1HD1      LEU  77  -5.963   4.447  -4.991
  565   2HD1  LEU  77          2HD1      LEU  77  -4.461   3.921  -5.718
  566   3HD1  LEU  77          3HD1      LEU  77  -5.973   3.575  -6.542
  567   1HD2  LEU  77          1HD2      LEU  77  -7.211   0.973  -4.299
  568   2HD2  LEU  77          2HD2      LEU  77  -7.749   2.562  -4.801
  569   3HD2  LEU  77          3HD2      LEU  77  -7.130   1.416  -6.010
  570    H    PHE  78           H        PHE  78  -6.200  -1.071  -3.454
  571    HA   PHE  78           HA       PHE  78  -7.026  -2.759  -5.755
  572   1HB   PHE  78          1HB       PHE  78  -7.103  -3.497  -2.823
  573   2HB   PHE  78          2HB       PHE  78  -7.893  -4.386  -4.098
  574    HD1  PHE  78           1HD      PHE  78  -4.523  -3.478  -2.744
  575    HD2  PHE  78           2HD      PHE  78  -6.757  -6.029  -5.417
  576    HE1  PHE  78           1HE      PHE  78  -2.574  -5.031  -2.925
  577    HE2  PHE  78           2HE      PHE  78  -4.779  -7.528  -5.617
  578    HZ   PHE  78           HZ       PHE  78  -2.707  -7.028  -4.375
  579    H    LYS  79           H        LYS  79  -9.248  -2.798  -6.035
  580    HA   LYS  79           HA       LYS  79 -10.937  -1.574  -3.963
  581   1HB   LYS  79          1HB       LYS  79 -12.198  -0.188  -5.580
  582   2HB   LYS  79          2HB       LYS  79 -10.560   0.332  -5.227
  583   1HG   LYS  79          1HG       LYS  79  -9.865  -0.824  -7.451
  584   2HG   LYS  79          2HG       LYS  79 -11.596  -0.947  -7.783
  585   1HD   LYS  79          1HD       LYS  79 -10.808   1.030  -8.860
  586   2HD   LYS  79          2HD       LYS  79 -11.742   1.581  -7.461
  587   1HE   LYS  79          1HE       LYS  79  -9.698   2.010  -6.186
  588   2HE   LYS  79          2HE       LYS  79  -8.725   1.187  -7.384
  589   1HZ   LYS  79          1HZ       LYS  79  -9.301   3.030  -9.000
  590   2HZ   LYS  79          2HZ       LYS  79 -10.094   3.803  -7.799
  591   3HZ   LYS  79          3HZ       LYS  79  -8.475   3.549  -7.778
  592    H    GLY  80           H        GLY  80 -12.205  -3.072  -3.415
  593   1HA   GLY  80          1HA       GLY  80 -13.263  -5.075  -3.332
  594   2HA   GLY  80          2HA       GLY  80 -14.225  -4.389  -4.633
  595    H    GLY  81           H        GLY  81 -11.028  -5.917  -4.109
  596   1HA   GLY  81          1HA       GLY  81 -10.227  -7.903  -4.936
  597   2HA   GLY  81          2HA       GLY  81 -11.518  -7.965  -6.137
  598    H    GLU  82           H        GLU  82 -10.674  -5.003  -6.915
  599    HA   GLU  82           HA       GLU  82  -8.947  -6.083  -9.021
  600   1HB   GLU  82          1HB       GLU  82 -11.143  -5.036  -9.508
  601   2HB   GLU  82          2HB       GLU  82 -10.525  -3.495  -8.914
  602   1HG   GLU  82          1HG       GLU  82 -10.357  -3.450 -11.296
  603   2HG   GLU  82          2HG       GLU  82  -8.715  -3.601 -10.684
  604    HA   PRO  83           HA       PRO  83  -5.546  -3.440  -7.377
  605   1HB   PRO  83          1HB       PRO  83  -3.475  -4.641  -8.678
  606   2HB   PRO  83          2HB       PRO  83  -4.206  -5.304  -7.198
  607   1HG   PRO  83          1HG       PRO  83  -4.774  -6.100 -10.065
  608   2HG   PRO  83          2HG       PRO  83  -4.466  -7.165  -8.659
  609   1HD   PRO  83          1HD       PRO  83  -6.974  -6.572  -9.555
  610   2HD   PRO  83          2HD       PRO  83  -6.626  -6.844  -7.826
  611    H    VAL  84           H        VAL  84  -6.336  -1.553  -8.519
  612    HA   VAL  84           HA       VAL  84  -6.404  -1.376 -11.356
  613    HB   VAL  84           HB       VAL  84  -6.493   1.125 -10.797
  614   1HG1  VAL  84          1HG1      VAL  84  -8.831   0.982 -10.132
  615   2HG1  VAL  84          2HG1      VAL  84  -8.467  -0.296 -11.292
  616   3HG1  VAL  84          3HG1      VAL  84  -8.603  -0.700  -9.572
  617   1HG2  VAL  84          1HG2      VAL  84  -5.448   0.979  -8.512
  618   2HG2  VAL  84          2HG2      VAL  84  -6.963   1.859  -8.594
  619   3HG2  VAL  84          3HG2      VAL  84  -6.939   0.199  -7.949
  620    H    LYS  85           H        LYS  85  -3.899  -0.458  -9.012
  621    HA   LYS  85           HA       LYS  85  -1.886  -0.421 -11.075
  622   1HB   LYS  85          1HB       LYS  85  -1.173   1.919 -10.888
  623   2HB   LYS  85          2HB       LYS  85  -2.802   1.803 -11.489
  624   1HG   LYS  85          1HG       LYS  85  -2.962   3.571 -10.025
  625   2HG   LYS  85          2HG       LYS  85  -3.605   2.270  -9.071
  626   1HD   LYS  85          1HD       LYS  85  -0.674   2.509  -8.720
  627   2HD   LYS  85          2HD       LYS  85  -1.490   4.038  -8.394
  628   1HE   LYS  85          1HE       LYS  85  -2.796   3.195  -6.697
  629   2HE   LYS  85          2HE       LYS  85  -2.705   1.539  -7.244
  630   1HZ   LYS  85          1HZ       LYS  85  -0.431   3.008  -6.059
  631   2HZ   LYS  85          2HZ       LYS  85  -1.391   1.964  -5.236
  632   3HZ   LYS  85          3HZ       LYS  85  -0.438   1.406  -6.421
  633    H    GLN  86           H        GLN  86   0.266   0.206 -10.153
  634    HA   GLN  86           HA       GLN  86   0.613  -0.429  -7.292
  635   1HB   GLN  86          1HB       GLN  86   0.832  -2.537  -8.380
  636   2HB   GLN  86          2HB       GLN  86   1.747  -1.840  -9.729
  637   1HG   GLN  86          1HG       GLN  86   3.649  -1.410  -8.322
  638   2HG   GLN  86          2HG       GLN  86   2.810  -1.971  -6.885
  639   1HE2  GLN  86          1HE2      GLN  86   1.784  -4.443  -7.394
  640   2HE2  GLN  86          2HE2      GLN  86   3.046  -5.476  -8.053
  641    H    LEU  87           H        LEU  87   2.169   0.841  -6.401
  642    HA   LEU  87           HA       LEU  87   4.104   2.238  -8.192
  643   1HB   LEU  87          1HB       LEU  87   3.402   2.943  -5.301
  644   2HB   LEU  87          2HB       LEU  87   4.758   3.567  -6.189
  645    HG   LEU  87           HG       LEU  87   3.220   5.281  -6.145
  646   1HD1  LEU  87          1HD1      LEU  87   2.857   5.804  -8.424
  647   2HD1  LEU  87          2HD1      LEU  87   4.305   4.791  -8.394
  648   3HD1  LEU  87          3HD1      LEU  87   2.754   4.092  -8.902
  649   1HD2  LEU  87          1HD2      LEU  87   1.228   3.927  -5.555
  650   2HD2  LEU  87          2HD2      LEU  87   0.908   5.203  -6.744
  651   3HD2  LEU  87          3HD2      LEU  87   1.052   3.523  -7.300
  652    H    ILE  88           H        ILE  88   6.285   2.010  -7.485
  653    HA   ILE  88           HA       ILE  88   6.940   0.048  -5.440
  654    HB   ILE  88           HB       ILE  88   8.622  -0.949  -7.116
  655   1HG1  ILE  88          1HG1      ILE  88   6.636   0.164  -9.166
  656   2HG1  ILE  88          2HG1      ILE  88   8.328   0.638  -8.979
  657   1HG2  ILE  88          1HG2      ILE  88   6.742  -2.135  -6.111
  658   2HG2  ILE  88          2HG2      ILE  88   5.663  -1.563  -7.400
  659   3HG2  ILE  88          3HG2      ILE  88   6.974  -2.674  -7.775
  660   1HD1  ILE  88          1HD1      ILE  88   7.245  -2.052  -9.899
  661   2HD1  ILE  88          2HD1      ILE  88   8.160  -0.867 -10.835
  662   3HD1  ILE  88          3HD1      ILE  88   8.962  -1.756  -9.516
  663    H    GLY  89           H        GLY  89   8.829   0.572  -4.479
  664   1HA   GLY  89          1HA       GLY  89  10.785   1.739  -4.003
  665   2HA   GLY  89          2HA       GLY  89  10.727   2.511  -5.595
  666    H    TYR  90           H        TYR  90  11.447   4.119  -3.629
  667    HA   TYR  90           HA       TYR  90   9.280   5.345  -2.176
  668   1HB   TYR  90          1HB       TYR  90  11.548   5.118  -1.307
  669   2HB   TYR  90          2HB       TYR  90  12.139   6.196  -2.560
  670    HD1  TYR  90           1HD      TYR  90  13.135   7.156  -0.360
  671    HD2  TYR  90           2HD      TYR  90   8.937   7.450  -1.361
  672    HE1  TYR  90           1HE      TYR  90  12.862   9.021   1.252
  673    HE2  TYR  90           2HE      TYR  90   8.686   9.284   0.236
  674    HH   TYR  90           HH       TYR  90  10.376   9.727   2.656
  675    H    GLN  91           H        GLN  91   7.908   5.743  -4.050
  676    HA   GLN  91           HA       GLN  91   8.446   8.171  -5.595
  677   1HB   GLN  91          1HB       GLN  91   5.666   7.137  -4.926
  678   2HB   GLN  91          2HB       GLN  91   6.180   8.109  -6.276
  679   1HG   GLN  91          1HG       GLN  91   6.814   5.161  -5.883
  680   2HG   GLN  91          2HG       GLN  91   5.743   5.894  -7.073
  681   1HE2  GLN  91          1HE2      GLN  91   8.459   4.212  -7.301
  682   2HE2  GLN  91          2HE2      GLN  91   9.341   5.265  -8.401
  683    HA   PRO  92           HA       PRO  92   7.650  10.642  -1.850
  684   1HB   PRO  92          1HB       PRO  92   7.657  13.164  -2.920
  685   2HB   PRO  92          2HB       PRO  92   9.156  12.208  -2.703
  686   1HG   PRO  92          1HG       PRO  92   7.480  12.496  -5.219
  687   2HG   PRO  92          2HG       PRO  92   9.255  12.691  -5.046
  688   1HD   PRO  92          1HD       PRO  92   8.131  10.355  -5.905
  689   2HD   PRO  92          2HD       PRO  92   9.582  10.353  -4.858
  690    H    LYS  93           H        LYS  93   5.853  12.090  -1.096
  691    HA   LYS  93           HA       LYS  93   3.318  11.229  -1.671
  692   1HB   LYS  93          1HB       LYS  93   4.586  13.492  -0.245
  693   2HB   LYS  93          2HB       LYS  93   3.019  13.924  -0.874
  694   1HG   LYS  93          1HG       LYS  93   3.372  11.332   0.655
  695   2HG   LYS  93          2HG       LYS  93   3.272  12.844   1.531
  696   1HD   LYS  93          1HD       LYS  93   1.159  11.946  -0.454
  697   2HD   LYS  93          2HD       LYS  93   1.112  11.547   1.263
  698   1HE   LYS  93          1HE       LYS  93   1.131  14.386   0.164
  699   2HE   LYS  93          2HE       LYS  93  -0.338  13.490   0.587
  700   1HZ   LYS  93          1HZ       LYS  93   0.527  13.375   2.895
  701   2HZ   LYS  93          2HZ       LYS  93   1.829  14.278   2.458
  702   3HZ   LYS  93          3HZ       LYS  93   0.328  14.923   2.384
  703    H    GLU  94           H        GLU  94   4.961  14.032  -3.185
  704    HA   GLU  94           HA       GLU  94   2.839  15.019  -4.700
  705   1HB   GLU  94          1HB       GLU  94   5.827  14.891  -5.309
  706   2HB   GLU  94          2HB       GLU  94   4.708  16.009  -6.087
  707   1HG   GLU  94          1HG       GLU  94   4.426  17.310  -4.137
  708   2HG   GLU  94          2HG       GLU  94   5.006  16.042  -3.060
  709    H    GLN  95           H        GLN  95   4.668  12.047  -5.330
  710    HA   GLN  95           HA       GLN  95   3.825  11.999  -8.183
  711   1HB   GLN  95          1HB       GLN  95   6.250  11.663  -7.487
  712   2HB   GLN  95          2HB       GLN  95   5.777  10.280  -6.560
  713   1HG   GLN  95          1HG       GLN  95   6.704   9.584  -8.726
  714   2HG   GLN  95          2HG       GLN  95   5.026   9.079  -8.560
  715   1HE2  GLN  95          1HE2      GLN  95   6.925  11.926  -9.851
  716   2HE2  GLN  95          2HE2      GLN  95   5.872  12.100 -11.251
  717    H    LEU  96           H        LEU  96   3.995  10.276  -5.181
  718    HA   LEU  96           HA       LEU  96   2.492   7.933  -5.666
  719   1HB   LEU  96          1HB       LEU  96   3.938   8.813  -3.663
  720   2HB   LEU  96          2HB       LEU  96   2.393   9.346  -3.049
  721    HG   LEU  96           HG       LEU  96   3.225   6.502  -3.763
  722   1HD1  LEU  96          1HD1      LEU  96   4.228   7.419  -1.710
  723   2HD1  LEU  96          2HD1      LEU  96   2.616   7.862  -1.102
  724   3HD1  LEU  96          3HD1      LEU  96   3.046   6.161  -1.330
  725   1HD2  LEU  96          1HD2      LEU  96   0.831   6.671  -4.214
  726   2HD2  LEU  96          2HD2      LEU  96   1.082   5.775  -2.714
  727   3HD2  LEU  96          3HD2      LEU  96   0.556   7.460  -2.642
  728    H    GLU  97           H        GLU  97   1.316  11.006  -4.136
  729    HA   GLU  97           HA       GLU  97  -1.423  10.239  -4.137
  730   1HB   GLU  97          1HB       GLU  97   0.056  12.146  -2.946
  731   2HB   GLU  97          2HB       GLU  97  -0.594  13.142  -4.226
  732   1HG   GLU  97          1HG       GLU  97  -2.315  11.383  -2.414
  733   2HG   GLU  97          2HG       GLU  97  -1.673  12.912  -1.845
  734    H    ALA  98           H        ALA  98   0.640  11.722  -6.580
  735    HA   ALA  98           HA       ALA  98  -1.648  12.612  -8.200
  736   1HB   ALA  98          1HB       ALA  98   0.044  13.074  -9.944
  737   2HB   ALA  98          2HB       ALA  98   0.541  13.759  -8.386
  738   3HB   ALA  98          3HB       ALA  98   1.291  12.261  -8.981
  739    H    GLN  99           H        GLN  99   0.558   9.771  -8.266
  740    HA   GLN  99           HA       GLN  99  -0.824   8.555 -10.490
  741   1HB   GLN  99          1HB       GLN  99   1.499   8.023  -9.206
  742   2HB   GLN  99          2HB       GLN  99   0.505   6.800  -8.430
  743   1HG   GLN  99          1HG       GLN  99   0.700   7.145 -11.465
  744   2HG   GLN  99          2HG       GLN  99   1.868   6.217 -10.548
  745   1HE2  GLN  99          1HE2      GLN  99  -1.839   6.289 -10.760
  746   2HE2  GLN  99          2HE2      GLN  99  -1.851   4.569 -11.077
  747    H    LEU 100           H        LEU 100  -1.204   8.389  -6.956
  748    HA   LEU 100           HA       LEU 100  -3.291   6.420  -6.944
  749   1HB   LEU 100          1HB       LEU 100  -1.564   7.489  -5.032
  750   2HB   LEU 100          2HB       LEU 100  -3.099   8.199  -4.605
  751    HG   LEU 100           HG       LEU 100  -3.999   5.773  -4.789
  752   1HD1  LEU 100          1HD1      LEU 100  -2.300   4.004  -4.565
  753   2HD1  LEU 100          2HD1      LEU 100  -1.930   4.958  -6.035
  754   3HD1  LEU 100          3HD1      LEU 100  -0.996   5.206  -4.558
  755   1HD2  LEU 100          1HD2      LEU 100  -3.144   5.044  -2.597
  756   2HD2  LEU 100          2HD2      LEU 100  -1.977   6.380  -2.618
  757   3HD2  LEU 100          3HD2      LEU 100  -3.739   6.694  -2.596
  758    H    ALA 101           H        ALA 101  -3.454   9.639  -7.918
  759    HA   ALA 101           HA       ALA 101  -5.746  10.675  -6.911
  760   1HB   ALA 101          1HB       ALA 101  -4.258  11.833  -8.455
  761   2HB   ALA 101          2HB       ALA 101  -4.801  10.802  -9.796
  762   3HB   ALA 101          3HB       ALA 101  -5.935  11.925  -9.013
  763    H    ASP 102           H        ASP 102  -5.707   7.835  -9.080
  764    HA   ASP 102           HA       ASP 102  -8.470   8.104  -9.847
  765   1HB   ASP 102          1HB       ASP 102  -7.895   6.390 -11.197
  766   2HB   ASP 102          2HB       ASP 102  -6.311   6.315 -10.444
  767    H    VAL 103           H        VAL 103  -7.225   7.449  -6.754
  768    HA   VAL 103           HA       VAL 103 -10.043   6.882  -5.998
  769    HB   VAL 103           HB       VAL 103  -7.939   5.086  -5.675
  770   1HG1  VAL 103          1HG1      VAL 103  -7.787   4.551  -3.313
  771   2HG1  VAL 103          2HG1      VAL 103  -7.029   6.094  -3.698
  772   3HG1  VAL 103          3HG1      VAL 103  -8.623   6.053  -2.897
  773   1HG2  VAL 103          1HG2      VAL 103 -10.278   4.589  -6.028
  774   2HG2  VAL 103          2HG2      VAL 103  -9.667   3.697  -4.624
  775   3HG2  VAL 103          3HG2      VAL 103 -10.675   5.153  -4.413
  776    H    LEU 104           H        LEU 104  -7.663   9.206  -5.883
  777    HA   LEU 104           HA       LEU 104  -8.820  10.357  -3.446
  778   1HB   LEU 104          1HB       LEU 104  -6.158  10.611  -4.855
  779   2HB   LEU 104          2HB       LEU 104  -6.765  11.927  -3.935
  780    HG   LEU 104           HG       LEU 104  -5.391  10.808  -2.411
  781   1HD1  LEU 104          1HD1      LEU 104  -8.004   9.378  -1.798
  782   2HD1  LEU 104          2HD1      LEU 104  -6.702   9.790  -0.683
  783   3HD1  LEU 104          3HD1      LEU 104  -7.686  11.087  -1.400
  784   1HD2  LEU 104          1HD2      LEU 104  -4.994   8.822  -3.782
  785   2HD2  LEU 104          2HD2      LEU 104  -5.272   8.406  -2.076
  786   3HD2  LEU 104          3HD2      LEU 104  -6.550   8.153  -3.274
  787    H    GLN 105           H        GLN 105  -9.009  10.525  -6.814
  788    HA   GLN 105           HA       GLN 105  -9.995  13.082  -7.342
  789   1HB   GLN 105          2HB       GLN 105  -9.549  11.343  -8.993
  790   2HB   GLN 105          3HB       GLN 105 -10.844  10.358  -8.333
  791   1HG   GLN 105          2HG       GLN 105 -12.518  12.024  -9.041
  792   2HG   GLN 105          3HG       GLN 105 -11.238  13.134  -9.544
  793   1HE2  GLN 105          1HE2      GLN 105  -9.524  11.882 -11.127
  794   2HE2  GLN 105          2HE2      GLN 105 -10.346  11.049 -12.442