*HEADER    CHAPERONE                               10-FEB-04   1SB6              
*TITLE     SOLUTION STRUCTURE OF A CYANOBACTERIAL COPPER                         
*TITLE    2 METALLOCHAPERONE, SCATX1                                             
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: COPPER CHAPERONE SCATX1;                                   
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: SYNECHOCYSTIS SP. PCC 6803;                     
*SOURCE   3 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   4 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   5 EXPRESSION_SYSTEM_STRAIN: BL21(DE3);                                 
*SOURCE   6 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   7 EXPRESSION_SYSTEM_PLASMID: PETATX1                                   
*KEYWDS    COPPER CHAPERONE, STRUCTURE, NEW METAL BINDING MOTIF, NMR             
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    L.BANCI, I.BERTINI, S.CIOFI-BAFFONI, X.C.SU, G.P.BORRELLY,            
*AUTHOR   2 N.J.ROBINSON                                                         
*REVDAT   1   27-APR-04 1SB6    0                                                
  2 THR  
         HA      3 ILE  HN      3.10                
         HA      3 ILE  HB      6.00                
         HA      3 ILE  QD1     7.00                
         HA     44 THR  HA      3.50                
         HA     44 THR  QG2     7.00                
         HA     45 SER  HN      3.80                
         HB      3 ILE  HN      5.70                
         HB     44 THR  HB      6.00                
         QG2     3 ILE  HN      5.10                
         QG2    44 THR  HA      7.00                
  3 ILE  
         HN      3 ILE  HB      3.90                
         HN      3 ILE  QG2     4.50                
         HN      3 ILE  QG1     5.60                
         HN      3 ILE  QD1     4.00                
         HN      4 GLN  HN      5.30                
         HN     43 ILE  HN      3.40                
         HN     43 ILE  QG2     7.00                
         HN     44 THR  HA      4.10                
         HA      4 GLN  HN      3.00                
         HB      4 GLN  HN      4.70                
         HB     43 ILE  QG2     7.00                
         HB     52 LEU  QQD     7.67                
         QG2     4 GLN  HN      5.50                
         QG2    43 ILE  HN      7.00                
         QG1     4 GLN  HN      6.10                
         QG1    43 ILE  HB      7.00                
         QG1    43 ILE  QG2     8.00                
         QG1    43 ILE  QD1     8.00                
         QD1     4 GLN  HN      5.50                
  4 GLN  
         HN      4 GLN  HB2     3.90                
         HN      4 GLN  HB3     3.90                
         HN      4 GLN  QB      3.46                
         HN      4 GLN  HG2     5.00                
         HN      4 GLN  HG3     5.00                
         HN      4 GLN  QG      4.49                
         HN      5 LEU  HN      5.60                
         HN     42 THR  HA      5.90                
         HA      5 LEU  HN      2.90                
         HA     41 VAL  HN      5.50                
         HA     42 THR  HN      5.30                
         HA     42 THR  HA      3.50                
         HA     42 THR  QG2     7.00                
         HA     43 ILE  HN      4.10                
         HB2     4 GLN  HE21    6.75                
         HB2     4 GLN  HE22    6.75                
         HB2     5 LEU  HN      4.80                
         HB3     4 GLN  HE21    6.75                
         HB3     4 GLN  HE22    6.75                
         HB3     5 LEU  HN      4.80                
         QB      5 LEU  HN      4.33                
         QB     42 THR  HA      6.88                
         QB     42 THR  QG2     7.88                
         QB     43 ILE  HN      6.88                
         HG2     5 LEU  HN      5.00                
         HG2    41 VAL  HN      6.00                
         HG2    42 THR  HA      6.00                
         HG2    42 THR  QG2     7.00                
         HG3     5 LEU  HN      5.00                
         HG3    41 VAL  HN      6.00                
         HG3    42 THR  HA      6.00                
         HG3    42 THR  QG2     7.00                
         HE21   40 LYS  QB      7.00                
         HE22   40 LYS  QB      7.00                
  5 LEU  
         HN      5 LEU  HB2     4.00                
         HN      5 LEU  HB3     4.00                
         HN      5 LEU  QB      3.70                
         HN      5 LEU  HG      4.50                
         HN      5 LEU  QD1     4.80                
         HN      5 LEU  QD2     4.80                
         HN      5 LEU  QQD     4.33                
         HN     41 VAL  HN      3.60                
         HN     41 VAL  HB      5.90                
         HN     41 VAL  QQG     8.46                
         HN     42 THR  HA      3.40                
         HA      5 LEU  QD1     7.00                
         HA      5 LEU  QD2     7.00                
         HA      6 THR  HN      3.30                
         HB2     6 THR  HN      4.40                
         HB2    52 LEU  QD1     7.00                
         HB2    52 LEU  QD2     7.00                
         HB2    63 VAL  QG1     7.00                
         HB2    63 VAL  QG2     7.00                
         HB3     6 THR  HN      4.40                
         HB3    52 LEU  QD1     7.00                
         HB3    52 LEU  QD2     7.00                
         HB3    63 VAL  QG1     7.00                
         HB3    63 VAL  QG2     7.00                
         QB      6 THR  HN      3.83                
         QB     41 VAL  HN      6.68                
         QB     63 VAL  QQG     6.69                
         QD1     6 THR  HN      7.00                
         QD1    63 VAL  QG1    11.12                
         QD1    63 VAL  QG2    11.12                
         QD2     6 THR  HN      7.00                
         QD2    63 VAL  QG1    11.12                
         QD2    63 VAL  QG2    11.12                
         QQD    41 VAL  HB      8.57                
         QQD    52 LEU  HG      8.57                
         QQD    63 VAL  QQG     9.18                
  6 THR  
         HN      6 THR  HB      3.30                
         HN      6 THR  QG2     4.40                
         HN      7 VAL  HN      5.30                
         HN     64 GLU  HN      4.20                
         HN     64 GLU  HB2     5.90                
         HN     64 GLU  HB3     5.90                
         HN     64 GLU  QB      5.68                
         HN     64 GLU  QG      7.00                
         HA      7 VAL  HN      2.80                
         HA     40 LYS  HA      3.00                
         HB      7 VAL  HN      5.10                
         HB     64 GLU  HN      5.50                
         QG2     7 VAL  HN      4.30                
         QG2    41 VAL  HN      7.00                
         QG2    64 GLU  HN      7.00                
         QG2    64 GLU  HB2     7.00                
         QG2    64 GLU  HB3     7.00                
         QG2    64 GLU  QG      8.00                
  7 VAL  
         HN      7 VAL  HB      3.30                
         HN      7 VAL  QQG     4.34                
         HN      8 PRO  HD2     5.50                
         HN      8 PRO  HD3     5.50                
         HN      8 PRO  QD      5.23                
         HN     10 ILE  QD1     7.00                
         HN     40 LYS  HA      3.60                
         HN     40 LYS  QG      6.88                
         HN     41 VAL  QQG     8.56                
         HA      9 THR  HN      5.20                
         HA      9 THR  HB      5.70                
         HA     63 VAL  HA      3.70                
         HA     63 VAL  QG1     7.00                
         HA     63 VAL  QG2     7.00                
         HA     64 GLU  HN      4.20                
         HB     10 ILE  HN      4.90                
         HB     10 ILE  QD1     6.60                
         HB     63 VAL  QG1     7.00                
         HB     63 VAL  QG2     7.00                
         QG1    10 ILE  HN      7.00                
         QG1    41 VAL  QG1    11.12                
         QG1    41 VAL  QG2    11.12                
         QG1    63 VAL  QG1    11.12                
         QG1    63 VAL  QG2    11.12                
         QG2    10 ILE  HN      7.00                
         QG2    41 VAL  QG1    11.12                
         QG2    41 VAL  QG2    11.12                
         QG2    63 VAL  QG1    11.12                
         QG2    63 VAL  QG2    11.12                
         QQG     9 THR  HN      6.46                
         QQG    10 ILE  HN      5.97                
         QQG    10 ILE  HA      8.56                
         QQG    41 VAL  HB      7.66                
         QQG    41 VAL  QQG     9.04                
         QQG    61 HID  HN      8.56                
         QQG    63 VAL  HA      8.56                
         QQG    63 VAL  QQG     9.43                
         QQG    64 GLU  HN      8.16                
  8 PRO  
         QB      9 THR  HA      6.88                
         QB      9 THR  HB      6.88                
         QB      9 THR  QG2     7.88                
         QG      9 THR  HB      7.00                
         QG     10 ILE  HN      7.00                
         QG     61 HID  QB      7.88                
         HD2     9 THR  HB      6.00                
         HD2    39 LYS  QB      7.00                
         HD2    62 GLU  HG2     7.75                
         HD2    62 GLU  HG3     7.75                
         HD2    63 VAL  QG1     8.75                
         HD2    63 VAL  QG2     8.75                
         HD2    64 GLU  HN      5.80                
         HD3     9 THR  HB      6.00                
         HD3    39 LYS  QB      7.00                
         HD3    62 GLU  HG2     7.75                
         HD3    62 GLU  HG3     7.75                
         HD3    63 VAL  QG1     8.75                
         HD3    63 VAL  QG2     8.75                
         HD3    64 GLU  HN      5.80                
         QD      9 THR  HN      4.95                
         QD      9 THR  HA      6.88                
         QD      9 THR  HB      5.79                
         QD     62 GLU  QB      7.75                
         QD     62 GLU  QG      6.82                
         QD     63 VAL  QQG     7.08                
         QD     64 GLU  HN      5.30                
         QD     64 GLU  QB      7.75                
         QD     64 GLU  QG      7.88                
  9 THR  
         HN      9 THR  HB      3.90                
         HN      9 THR  QG2     4.10                
         HN     10 ILE  HN      3.70                
         HN     62 GLU  HN      4.30                
         HN     62 GLU  QB      6.48                
         HA      9 THR  HB      2.70                
         HA     63 VAL  QQG     8.56                
         HB     10 ILE  HN      5.20                
         QG2    10 ILE  HN      7.00                
         QG2    61 HID  HA      7.00                
         QG2    62 GLU  HN      5.30                
         QG2    62 GLU  HB2     6.50                
         QG2    62 GLU  HB3     6.50                
         QG2    62 GLU  QB      6.19                
         QG2    62 GLU  QG      7.88                
 10 ILE  
         HN     10 ILE  HB      4.00                
         HN     10 ILE  HG12    4.00                
         HN     10 ILE  HG13    4.00                
         HN     10 ILE  QG1     3.65                
         HN     10 ILE  QD1     5.80                
         HN     11 ALA  HN      5.00                
         HA     12 CYS  HB2     6.00                
         HA     12 CYS  HB3     6.00                
         HA     61 HID  HE1     6.00                
         QG2    12 CYS  HB2     7.00                
         QG2    12 CYS  HB3     7.00                
         QG2    61 HID  HE1     7.00                
         HG12   12 CYS  HN      5.70                
         HG12   36 LEU  HG      6.00                
         HG13   12 CYS  HN      5.70                
         HG13   36 LEU  HG      6.00                
         QG1    12 CYS  QB      7.75                
         QG1    15 CYS  HN      6.88                
         QG1    16 ALA  HN      6.08                
         QG1    36 LEU  HA      6.88                
         QG1    36 LEU  QB      7.75                
         QG1    36 LEU  QQD     9.45                
         QG1    39 LYS  HA      6.88                
         QD1    36 LEU  HA      7.00                
         QD1    36 LEU  QQD     9.27                
         QD1    39 LYS  HN      6.60                
         QD1    39 LYS  HA      7.00                
         QD1    39 LYS  QB      8.00                
         QD1    40 LYS  HN      7.00                
 11 ALA  
         HN     12 CYS  HN      4.70                
         HN     15 CYS  HN      5.10                
         HN     16 ALA  HN      3.10                
         HA     12 CYS  QB      6.28                
         QB     15 CYS  HN      6.00                
 12 CYS  
         HB2    61 HID  HE1     6.00                
         HB3    61 HID  HE1     6.00                
         QB     13 GLU  HN      5.68                
 13 GLU  
         HN     13 GLU  QG      5.10                
         HN     14 ALA  HN      5.00                
         HN     15 CYS  HN      3.30                
         HA     15 CYS  HN      5.10                
 14 ALA  
         HN     15 CYS  HN      3.20                
 15 CYS  
         HN     16 ALA  HN      4.10                
         HN     16 ALA  HA      6.00                
         HA     17 GLU  HN      6.00                
         HA     18 ALA  HN      4.80                
         HA     18 ALA  QB      5.80                
         QB     16 ALA  HN      4.98                
 16 ALA  
         HN     16 ALA  QB      3.40                
         HN     17 GLU  HN      3.90                
         HN     17 GLU  HA      5.90                
         HN     17 GLU  QB      6.58                
         HN     36 LEU  QD1     7.00                
         HN     36 LEU  QD2     7.00                
         HA     19 VAL  HN      4.50                
         HA     19 VAL  HB      5.80                
         HA     19 VAL  QG1     7.00                
         HA     19 VAL  QG2     7.00                
         HA     20 THR  HN      6.00                
         QB     17 GLU  HN      4.30                
         QB     17 GLU  HA      4.90                
         QB     34 VAL  HB      7.00                
         QB     34 VAL  QG1     8.00                
         QB     34 VAL  QG2     8.00                
         QB     36 LEU  HG      6.80                
         QB     36 LEU  QD1     8.00                
         QB     36 LEU  QD2     8.00                
         QB     36 LEU  QQD     7.40                
 17 GLU  
         HN     17 GLU  QB      3.81                
         HN     17 GLU  HG2     3.90                
         HN     17 GLU  HG3     3.90                
         HN     17 GLU  QG      3.65                
         HN     18 ALA  HN      3.80                
         HN     19 VAL  HN      4.60                
         HN     36 LEU  QB      6.88                
         HA     20 THR  HN      4.40                
         HA     20 THR  HB      4.20                
         HA     20 THR  HG1     6.00                
         HA     21 LYS  HN      4.90                
         HA     36 LEU  QD1     7.00                
         HA     36 LEU  QD2     7.00                
         HB2    18 ALA  HN      5.10                
         HB3    18 ALA  HN      5.10                
         QB     18 ALA  HN      4.45                
         HG2    18 ALA  HN      6.00                
         HG3    18 ALA  HN      6.00                
         QG     18 ALA  HN      5.69                
         QG     21 LYS  HN      6.88                
         QG     36 LEU  QQD     9.45                
 18 ALA  
         HN     18 ALA  QB      3.40                
         HN     19 VAL  HN      3.30                
         HA     20 THR  HN      5.70                
         HA     21 LYS  HN      4.40                
         HA     21 LYS  QB      6.30                
         HA     21 LYS  QG      6.88                
         HA     21 LYS  QD      7.00                
         HA     22 ALA  HN      5.00                
         QB     19 VAL  HN      4.10                
         QB     59 ALA  HA      7.00                
         QB     59 ALA  QB      6.90                
 19 VAL  
         HN     19 VAL  HB      3.50                
         HN     19 VAL  QG1     4.70                
         HN     19 VAL  QG2     4.70                
         HN     20 THR  HN      3.70                
         HN     21 LYS  HN      5.10                
         HN     41 VAL  QQG     8.56                
         HA     21 LYS  HN      5.80                
         HA     22 ALA  HN      4.10                
         HA     22 ALA  QB      5.10                
         HA     56 ILE  QG2     7.00                
         HA     59 ALA  QB      6.30                
         HB     20 THR  HN      3.80                
         HB     41 VAL  QQG     8.56                
         QG1    20 THR  HN      6.30                
         QG1    56 ILE  HB      7.00                
         QG1    61 HID  HD2     7.00                
         QG2    20 THR  HN      6.30                
         QG2    56 ILE  HB      7.00                
         QG2    61 HID  HD2     7.00                
         QQG    20 THR  HN      5.61                
         QQG    20 THR  HA      8.56                
         QQG    21 LYS  HN      8.56                
         QQG    22 ALA  HN      7.96                
         QQG    27 ASP  QB      9.56                
         QQG    56 ILE  HN      8.56                
         QQG    56 ILE  QG2     9.56                
         QQG    56 ILE  QG1     9.56                
         QQG    56 ILE  QD1     8.36                
 20 THR  
         HN     20 THR  HB      3.40                
         HN     20 THR  HG1     3.00                
         HN     21 LYS  HN      3.70                
         HN     22 ALA  HN      4.20                
         HN     32 VAL  QQG     8.16                
         HA     22 ALA  HN      5.90                
         HA     23 VAL  HN      4.60                
         HA     23 VAL  HB      5.60                
         HA     23 VAL  QG1     7.00                
         HA     23 VAL  QG2     7.00                
         HA     24 GLN  HN      5.10                
         HA     32 VAL  HB      6.00                
         HA     32 VAL  QG1     6.50                
         HA     32 VAL  QG2     6.50                
         HA     32 VAL  QQG     6.01                
         HA     43 ILE  QG2     7.00                
         HB     21 LYS  HN      3.30                
         HB     22 ALA  HN      6.00                
         HB     32 VAL  QQG     8.56                
         QG2    21 LYS  HN      5.10                
         QG2    23 VAL  HN      7.00                
         QG2    24 GLN  HN      6.90                
         QG2    24 GLN  HE21    6.20                
         QG2    24 GLN  HE22    6.20                
         QG2    24 GLN  QE2     5.94                
         QG2    32 VAL  QQG     9.56                
         HG1    21 LYS  HN      5.90                
 21 LYS  
         HN     21 LYS  QB      3.90                
         HN     21 LYS  HG2     3.60                
         HN     21 LYS  HG3     3.60                
         HN     21 LYS  QG      3.39                
         HN     21 LYS  QD      4.70                
         HN     22 ALA  HN      3.60                
         HN     23 VAL  HN      4.60                
         HA     21 LYS  QD      5.90                
         HA     23 VAL  HN      5.50                
         HA     24 GLN  HN      3.90                
         HA     24 GLN  HB2     5.90                
         HA     24 GLN  HB3     5.90                
         HA     24 GLN  QB      5.35                
         HA     24 GLN  QG      6.88                
         QB     22 ALA  HN      5.10                
         QB     23 VAL  HN      6.90                
         QB     24 GLN  HN      6.10                
         QB     25 ASN  HD21    7.00                
         QB     25 ASN  HD22    7.00                
         HG2    22 ALA  HN      5.10                
         HG3    22 ALA  HN      5.10                
         QG     22 ALA  HN      4.37                
         QD     22 ALA  HN      6.60                
 22 ALA  
         HN     22 ALA  QB      3.40                
         HN     23 VAL  HN      3.00                
         HN     23 VAL  HB      4.80                
         HN     23 VAL  QQG     8.56                
         HN     24 GLN  HN      4.80                
         HA     23 VAL  HA      6.00                
         HA     25 ASN  HN      4.60                
         HA     25 ASN  HB2     5.80                
         HA     25 ASN  HB3     5.80                
         HA     25 ASN  QB      5.63                
         HA     25 ASN  HD21    6.00                
         HA     25 ASN  HD22    6.00                
         HA     25 ASN  QD2     5.64                
         QB     23 VAL  HN      3.40                
         QB     24 GLN  HN      5.30                
         QB     25 ASN  HN      5.30                
         QB     25 ASN  HD21    7.00                
         QB     25 ASN  HD22    7.00                
         QB     58 SER  QB      7.88                
 23 VAL  
         HN     23 VAL  HB      3.00                
         HN     23 VAL  QG1     4.90                
         HN     23 VAL  QG2     4.90                
         HN     23 VAL  QQG     4.29                
         HN     24 GLN  HN      3.20                
         HN     24 GLN  HA      6.00                
         HN     24 GLN  HG2     6.00                
         HN     24 GLN  HG3     6.00                
         HN     25 ASN  HN      4.80                
         HN     32 VAL  QQG     7.66                
         HA     25 ASN  HN      5.50                
         HA     26 GLU  HN      4.50                
         HA     26 GLU  HB2     6.00                
         HA     26 GLU  HB3     6.00                
         HA     26 GLU  HG2     6.00                
         HA     26 GLU  HG3     6.00                
         HA     27 ASP  HN      5.60                
         HA     47 LEU  QQD     8.57                
         HA     52 LEU  QQD     8.57                
         HA     55 ALA  QB      7.00                
         HB     24 GLN  HN      3.20                
         HB     32 VAL  QQG     8.56                
         QG1    24 GLN  HN      4.80                
         QG1    32 VAL  QG1    10.62                
         QG1    32 VAL  QG2    10.62                
         QG1    56 ILE  HN      7.00                
         QG2    24 GLN  HN      4.80                
         QG2    32 VAL  QG1    10.62                
         QG2    32 VAL  QG2    10.62                
         QG2    56 ILE  HN      7.00                
         QQG    25 ASN  HN      8.56                
         QQG    26 GLU  HN      8.56                
         QQG    27 ASP  HN      8.46                
         QQG    27 ASP  QB      9.56                
         QQG    30 ALA  HN      8.56                
         QQG    31 THR  HN      8.56                
         QQG    32 VAL  QQG     9.03                
         QQG    43 ILE  QG1     9.56                
         QQG    49 GLU  HA      8.56                
         QQG    52 LEU  HA      8.56                
         QQG    52 LEU  QB      9.44                
         QQG    56 ILE  HN      6.28                
 24 GLN  
         HN     24 GLN  HB2     3.80                
         HN     24 GLN  HB3     3.80                
         HN     24 GLN  QB      3.31                
         HN     24 GLN  HG2     3.20                
         HN     24 GLN  HG3     3.20                
         HN     24 GLN  QG      2.83                
         HN     25 ASN  HN      3.30                
         HN     25 ASN  QB      6.18                
         HN     26 GLU  HN      5.20                
         HN     30 ALA  QB      7.00                
         HN     32 VAL  QQG     7.76                
         HA     27 ASP  HN      4.90                
         HA     27 ASP  QB      7.00                
         HA     30 ALA  QB      7.00                
         HB2    24 GLN  HE21    6.00                
         HB2    24 GLN  HE22    6.00                
         HB2    25 ASN  HN      4.70                
         HB3    24 GLN  HE21    6.00                
         HB3    24 GLN  HE22    6.00                
         HB3    25 ASN  HN      4.70                
         QB     25 ASN  HN      4.37                
         QB     27 ASP  HN      6.58                
         QB     28 ALA  HA      6.48                
         QB     30 ALA  HN      6.88                
         HG2    24 GLN  HE21    3.90                
         HG2    24 GLN  HE22    3.90                
         HG2    25 ASN  HN      6.00                
         HG2    30 ALA  QB      7.00                
         HG3    24 GLN  HE21    3.90                
         HG3    24 GLN  HE22    3.90                
         HG3    25 ASN  HN      6.00                
         HG3    30 ALA  QB      7.00                
         QG     24 GLN  QE2     3.24                
         QG     25 ASN  HN      5.84                
         HE21   30 ALA  QB      7.00                
         HE21   32 VAL  HA      6.00                
         HE22   30 ALA  QB      7.00                
         HE22   32 VAL  HA      6.00                
         QE2    32 VAL  HA      5.64                
         QE2    32 VAL  QQG     9.43                
 25 ASN  
         HN     25 ASN  HB2     3.70                
         HN     25 ASN  HB3     3.70                
         HN     25 ASN  QB      3.30                
         HN     26 GLU  HN      3.30                
         HN     26 GLU  QG      6.18                
         HN     27 ASP  HN      4.20                
         HB2    26 GLU  HN      4.10                
         HB2    27 ASP  HN      6.00                
         HB3    26 GLU  HN      4.10                
         HB3    27 ASP  HN      6.00                
         QB     26 GLU  HN      3.62                
         QB     27 ASP  HN      5.59                
         QD2    26 GLU  QG      7.74                
 26 GLU  
         HN     26 GLU  QB      3.63                
         HN     26 GLU  HG2     3.70                
         HN     26 GLU  HG3     3.70                
         HN     26 GLU  QG      3.21                
         HN     27 ASP  HN      2.90                
         HN     27 ASP  HA      6.00                
         HN     27 ASP  QB      6.30                
         HN     47 LEU  QQD     7.77                
         HN     55 ALA  QB      6.90                
         HB2    27 ASP  HN      4.70                
         HB3    27 ASP  HN      4.70                
         QB     27 ASP  HN      4.23                
         QB     47 LEU  QQD     9.45                
         HG2    27 ASP  HN      5.20                
         HG3    27 ASP  HN      5.20                
         QG     27 ASP  HN      4.78                
         QG     47 LEU  QQD     9.45                
 27 ASP  
         HN     28 ALA  HN      4.60                
         HN     28 ALA  QB      5.70                
         HN     30 ALA  QB      5.80                
         HN     47 LEU  QQD     6.67                
         HA     28 ALA  HN      2.80                
         HA     29 GLN  HN      4.50                
         QB     30 ALA  QB      7.90                
         QB     45 SER  HG      7.00                
         QB     46 ALA  HN      6.80                
         QB     47 LEU  HN      6.60                
         QB     47 LEU  HG      7.00                
         QB     47 LEU  QD1     8.00                
         QB     47 LEU  QD2     8.00                
         QB     47 LEU  QQD     7.64                
 28 ALA  
         HN     28 ALA  QB      3.40                
         HN     29 GLN  HN      3.40                
         HN     29 GLN  HB2     6.00                
         HN     29 GLN  HB3     6.00                
         HN     29 GLN  QG      6.68                
         HN     30 ALA  HN      5.10                
         HN     30 ALA  QB      7.00                
         QB     29 GLN  HN      3.80                
         QB     30 ALA  HN      5.60                
 29 GLN  
         HN     29 GLN  HB2     4.20                
         HN     29 GLN  HB3     4.20                
         HN     29 GLN  QB      3.63                
         HN     29 GLN  HG2     3.10                
         HN     29 GLN  HG3     3.10                
         HN     29 GLN  QG      2.87                
         HN     30 ALA  HN      3.00                
         HN     30 ALA  QB      5.10                
         HA     30 ALA  HN      3.60                
         HB2    29 GLN  HE21    7.75                
         HB2    29 GLN  HE22    7.75                
         HB2    30 ALA  HN      4.70                
         HB3    29 GLN  HE21    7.75                
         HB3    29 GLN  HE22    7.75                
         HB3    30 ALA  HN      4.70                
         HG2    30 ALA  HN      5.10                
         HG3    30 ALA  HN      5.10                
         QG     30 ALA  HN      4.78                
 30 ALA  
         HN     30 ALA  QB      3.40                
         HN     31 THR  HN      5.10                
         HN     32 VAL  QQG     8.56                
         HA     31 THR  HN      3.00                
         HA     45 SER  QB      6.88                
         QB     31 THR  HN      3.60                
         QB     44 THR  HN      7.00                
         QB     45 SER  HA      7.00                
         QB     45 SER  HB2     7.00                
         QB     45 SER  HB3     7.00                
         QB     45 SER  HG      7.00                
         QB     47 LEU  HG      7.00                
         QB     47 LEU  QD1     8.00                
         QB     47 LEU  QD2     8.00                
 31 THR  
         HN     32 VAL  HN      5.00                
         HN     43 ILE  HA      5.60                
         HN     43 ILE  QG2     5.80                
         HN     43 ILE  QD1     7.00                
         HN     44 THR  HN      3.70                
         HN     44 THR  HB      3.90                
         HN     44 THR  QG2     7.00                
         HN     45 SER  HA      4.20                
         HN     45 SER  QB      6.88                
         HA     32 VAL  HN      3.00                
         HB     32 VAL  HN      4.10                
         HB     44 THR  HN      3.80                
         QG2    32 VAL  HN      6.10                
         QG2    44 THR  HN      7.00                
 32 VAL  
         HN     32 VAL  QQG     4.10                
         HN     33 GLN  HN      4.70                
         HA     33 GLN  HN      3.00                
         HA     43 ILE  HA      4.40                
         HA     43 ILE  QD1     7.00                
         HA     44 THR  HN      3.40                
         HB     33 GLN  HN      4.70                
         HB     43 ILE  QG2     7.00                
         HB     43 ILE  QD1     7.00                
         QG1    33 GLN  HN      7.00                
         QG1    43 ILE  HA      7.00                
         QG1    43 ILE  QG1     8.00                
         QG2    33 GLN  HN      7.00                
         QG2    43 ILE  HA      7.00                
         QG2    43 ILE  QG1     8.00                
         QQG    33 GLN  HN      6.05                
         QQG    34 VAL  QQG    10.62                
         QQG    43 ILE  QG2     9.56                
 33 GLN  
         HN     33 GLN  HB2     3.80                
         HN     33 GLN  HB3     3.80                
         HN     33 GLN  QB      3.55                
         HN     33 GLN  QG      5.10                
         HN     34 VAL  HN      5.40                
         HN     34 VAL  HA      6.00                
         HN     41 VAL  QQG     8.56                
         HN     42 THR  HN      3.20                
         HN     42 THR  HB      4.80                
         HN     42 THR  QG2     6.60                
         HN     43 ILE  HA      3.70                
         HN     43 ILE  QG2     7.00                
         HN     43 ILE  QG1     7.00                
         HA     34 VAL  HN      3.00                
         HB2    34 VAL  HN      4.90                
         HB2    42 THR  HN      5.30                
         HB2    42 THR  HB      6.00                
         HB3    34 VAL  HN      4.90                
         HB3    42 THR  HN      5.30                
         HB3    42 THR  HB      6.00                
         QB     42 THR  HN      4.93                
         QB     42 THR  QG2     7.88                
         QG     34 VAL  HN      6.60                
         QG     42 THR  HN      7.00                
         QG     44 THR  HN      7.00                
 34 VAL  
         HN     34 VAL  HB      4.10                
         HN     34 VAL  QG1     4.80                
         HN     34 VAL  QG2     4.80                
         HN     34 VAL  QQG     4.33                
         HN     35 ASP  HN      5.30                
         HA     35 ASP  HN      2.90                
         HA     41 VAL  HA      5.00                
         HA     41 VAL  QG1     7.00                
         HA     41 VAL  QG2     7.00                
         HA     42 THR  HN      3.70                
         HB     35 ASP  HN      4.60                
         HB     41 VAL  QG1     7.00                
         HB     41 VAL  QG2     7.00                
         QG1    35 ASP  HN      7.00                
         QG2    35 ASP  HN      7.00                
         QQG    35 ASP  HN      5.67                
         QQG    36 LEU  HN      7.96                
         QQG    39 LYS  HN      8.56                
         QQG    40 LYS  HN      8.56                
         QQG    41 VAL  HB      8.56                
 35 ASP  
         HN     35 ASP  HB2     3.60                
         HN     35 ASP  HB3     3.60                
         HN     36 LEU  HN      4.90                
         HN     40 LYS  HN      4.00                
         HN     40 LYS  QB      6.90                
         HN     40 LYS  QD      7.00                
         HN     41 VAL  HA      3.10                
         HA     36 LEU  HN      2.90                
         HA     37 THR  HN      4.70                
         HB2    36 LEU  HN      5.30                
         HB2    38 SER  HN      6.00                
         HB2    40 LYS  HN      5.10                
         HB3    36 LEU  HN      5.30                
         HB3    38 SER  HN      6.00                
         HB3    40 LYS  HN      5.10                
         QB     37 THR  HN      6.88                
         QB     38 SER  HN      5.36                
         QB     39 LYS  HN      5.28                
         QB     40 LYS  HN      4.68                
 36 LEU  
         HN     36 LEU  HB2     4.00                
         HN     36 LEU  HB3     4.00                
         HN     36 LEU  QB      3.61                
         HN     36 LEU  HG      3.60                
         HN     36 LEU  QD1     5.10                
         HN     36 LEU  QD2     5.10                
         HN     36 LEU  QQD     4.55                
         HN     37 THR  HN      3.60                
         HA     36 LEU  QD1     5.70                
         HA     36 LEU  QD2     5.70                
         HB2    37 THR  HN      4.60                
         HB3    37 THR  HN      4.60                
         QB     37 THR  HN      4.37                
         HG     37 THR  HN      6.00                
         QD1    37 THR  HN      7.00                
         QD2    37 THR  HN      7.00                
         QQD    41 VAL  HB      8.57                
         QQD    41 VAL  QQG    11.13                
 37 THR  
         HN     37 THR  HB      3.50                
         HN     37 THR  QG2     4.70                
         HN     38 SER  HN      3.50                
         HB     38 SER  HN      3.50                
         HB     39 LYS  HN      5.80                
         QG2    38 SER  HN      5.60                
 38 SER  
         HN     38 SER  QB      3.91                
         HN     39 LYS  HN      3.70                
         HN     39 LYS  HA      5.10                
         HN     39 LYS  QD      7.00                
         HN     40 LYS  HN      4.40                
         HN     40 LYS  QD      7.00                
         HB2    39 LYS  HN      5.00                
         HB2    40 LYS  HN      6.00                
         HB3    39 LYS  HN      5.00                
         HB3    40 LYS  HN      6.00                
 39 LYS  
         HN     39 LYS  HG2     3.80                
         HN     39 LYS  HG3     3.80                
         HN     39 LYS  QD      6.30                
         HN     40 LYS  HN      3.30                
         HN     40 LYS  QD      7.00                
         HA     39 LYS  QD      7.00                
         HA     40 LYS  HN      3.60                
         QB     40 LYS  HN      6.20                
         QG     40 LYS  HN      6.88                
         QD     40 LYS  HN      6.80                
 40 LYS  
         HN     40 LYS  HG2     3.80                
         HN     40 LYS  HG3     3.80                
         HN     40 LYS  QG      3.45                
         HN     40 LYS  QD      4.00                
         HN     41 VAL  HN      5.60                
         HN     41 VAL  QQG     8.56                
         HA     40 LYS  QD      7.00                
         HA     41 VAL  HN      2.90                
         QB     41 VAL  HN      6.60                
         QB     42 THR  HN      7.00                
         HG2    41 VAL  HN      6.00                
         HG3    41 VAL  HN      6.00                
         QG     41 VAL  HN      5.64                
         QD     41 VAL  HN      7.00                
 41 VAL  
         HN     41 VAL  HB      3.90                
         HN     41 VAL  QQG     4.24                
         HN     42 THR  HN      4.50                
         HA     42 THR  HN      2.90                
         HB     42 THR  HN      5.00                
         QG1    42 THR  HN      4.90                
         QG2    42 THR  HN      4.90                
         QQG    42 THR  HN      4.44                
         QQG    43 ILE  QG1     9.56                
 42 THR  
         HN     42 THR  HB      3.30                
         HN     42 THR  QG2     4.80                
         HN     43 ILE  HN      4.20                
         HN     43 ILE  HA      6.00                
         HN     43 ILE  QG1     7.00                
         HA     43 ILE  HN      3.10                
         HB     43 ILE  HN      5.10                
         QG2    43 ILE  HN      4.40                
         QG2    44 THR  HN      5.60                
 43 ILE  
         HN     43 ILE  HB      3.50                
         HN     43 ILE  QG2     4.90                
         HN     43 ILE  QG1     4.80                
         HN     43 ILE  QD1     4.80                
         HN     44 THR  HN      4.90                
         HA     44 THR  HN      3.10                
         HB     44 THR  HN      5.90                
         HB     45 SER  HN      5.00                
         HB     52 LEU  QB      6.88                
         QG2    44 THR  HN      4.20                
         QG2    44 THR  HA      7.00                
         QG2    45 SER  HN      5.30                
         QG2    45 SER  HB2     7.00                
         QG2    45 SER  HB3     7.00                
         QG2    45 SER  HG      7.00                
         QG2    46 ALA  HN      7.00                
         QG2    52 LEU  QB      6.38                
         QG1    52 LEU  QB      7.88                
         QD1    44 THR  HN      6.00                
         QD1    45 SER  HN      6.80                
         QD1    52 LEU  QB      7.18                
 44 THR  
         HN     44 THR  QG2     4.30                
         HN     45 SER  HN      4.20                
         HA     45 SER  HN      2.80                
         HB     45 SER  HN      5.00                
         QG2    45 SER  HN      5.00                
 45 SER  
         HN     45 SER  QB      3.91                
         HN     45 SER  HG      4.00                
         HA     46 ALA  HN      3.10                
         HB2    46 ALA  HN      4.20                
         HB2    47 LEU  HN      4.20                
         HB3    46 ALA  HN      4.20                
         HB3    47 LEU  HN      4.20                
         QB     46 ALA  HN      3.77                
         HG     46 ALA  HN      4.10                
         HG     47 LEU  HN      3.80                
         HG     47 LEU  HG      6.00                
 46 ALA  
         HN     46 ALA  QB      3.40                
         HN     47 LEU  HN      3.60                
         HN     47 LEU  HG      5.20                
         HN     47 LEU  QQD     8.37                
         QB     47 LEU  HN      4.40                
 47 LEU  
         HN     47 LEU  HB2     4.10                
         HN     47 LEU  HB3     4.10                
         HN     47 LEU  QB      3.53                
         HN     47 LEU  HG      2.90                
         HN     47 LEU  QD1     5.10                
         HN     47 LEU  QD2     5.10                
         HN     47 LEU  QQD     4.75                
         HN     48 GLY  HN      4.70                
         HN     49 GLU  HN      6.00                
         HA     47 LEU  QD1     5.40                
         HA     47 LEU  QD2     5.40                
         HA     48 GLY  HN      3.60                
         HA     49 GLU  HN      4.40                
         HA     50 GLU  HB2     5.60                
         HA     50 GLU  HB3     5.60                
         HA     50 GLU  QB      5.43                
         HA     50 GLU  QG      6.88                
         HA     51 GLN  HN      5.80                
         HB2    48 GLY  HN      5.20                
         HB3    48 GLY  HN      5.20                
         QB     48 GLY  HN      4.56                
         QB     51 GLN  HN      6.08                
         HG     48 GLY  HN      6.00                
         QD1    48 GLY  HN      7.00                
         QD1    51 GLN  HN      7.00                
         QD1    51 GLN  HB2     8.75                
         QD1    51 GLN  HB3     8.75                
         QD1    51 GLN  HE21   10.04                
         QD1    51 GLN  HE22   10.04                
         QD2    48 GLY  HN      7.00                
         QD2    51 GLN  HN      7.00                
         QD2    51 GLN  HB2     8.75                
         QD2    51 GLN  HB3     8.75                
         QD2    51 GLN  HE21   10.04                
         QD2    51 GLN  HE22   10.04                
         QQD    49 GLU  HN      8.57                
         QQD    50 GLU  HN      8.57                
         QQD    51 GLN  QB      7.72                
         QQD    51 GLN  QG      9.57                
         QQD    51 GLN  QE2     8.03                
         QQD    52 LEU  HA      8.57                
 48 GLY  
         HN     49 GLU  HN      5.40                
         HN     49 GLU  QB      5.28                
         HN     51 GLN  QB      4.98                
         QA     51 GLN  HN      5.78                
 49 GLU  
         HN     49 GLU  HB2     3.90                
         HN     49 GLU  HB3     3.90                
         HN     49 GLU  QB      3.55                
         HN     49 GLU  QG      4.30                
         HN     50 GLU  HN      3.50                
         HN     52 LEU  QQD     6.77                
         HA     51 GLN  HN      5.00                
         HA     52 LEU  HN      4.30                
         HA     52 LEU  HB2     5.90                
         HA     52 LEU  HB3     5.90                
         HA     52 LEU  QB      5.54                
         HA     52 LEU  QD1     7.00                
         HA     52 LEU  QD2     7.00                
         HB2    50 GLU  HN      3.80                
         HB3    50 GLU  HN      3.80                
         QG     50 GLU  HN      6.90                
 50 GLU  
         HN     50 GLU  QB      3.68                
         HN     50 GLU  HG2     4.50                
         HN     50 GLU  HG3     4.50                
         HN     50 GLU  QG      4.07                
         HN     51 GLN  HN      3.40                
         HN     51 GLN  QG      7.00                
         HN     52 LEU  HN      5.70                
         HN     52 LEU  HG      6.00                
         HA     53 ARG  HN      4.90                
         HA     53 ARG  HB2     5.20                
         HA     53 ARG  HB3     5.20                
         HA     53 ARG  QB      5.03                
         HA     54 THR  HN      4.70                
         HB2    51 GLN  HN      4.50                
         HB3    51 GLN  HN      4.50                
         QB     51 GLN  HN      4.12                
         HG2    51 GLN  HN      5.90                
         HG3    51 GLN  HN      5.90                
         QG     51 GLN  HN      5.13                
         QG     53 ARG  HN      6.18                
 51 GLN  
         HN     51 GLN  HB2     3.00                
         HN     51 GLN  HB3     3.00                
         HN     51 GLN  QG      4.20                
         HN     52 LEU  HN      2.90                
         HN     52 LEU  HG      5.50                
         HN     53 ARG  HN      4.20                
         HA     53 ARG  HN      6.00                
         HA     54 THR  HN      4.60                
         HA     54 THR  HB      5.90                
         HA     55 ALA  HN      5.00                
         HB2    51 GLN  HE21    5.60                
         HB2    51 GLN  HE22    5.60                
         HB2    52 LEU  HN      3.70                
         HB3    51 GLN  HE21    5.60                
         HB3    51 GLN  HE22    5.60                
         HB3    52 LEU  HN      3.70                
         QB     53 ARG  HN      6.38                
         QG     52 LEU  HN      6.90                
         QG     53 ARG  HN      7.00                
 52 LEU  
         HN     52 LEU  HB2     3.60                
         HN     52 LEU  HB3     3.60                
         HN     52 LEU  QB      3.15                
         HN     52 LEU  HG      2.60                
         HN     52 LEU  QD1     4.50                
         HN     52 LEU  QD2     4.50                
         HN     52 LEU  QQD     4.06                
         HN     53 ARG  HN      3.30                
         HN     54 THR  HN      6.00                
         HA     52 LEU  QD1     7.00                
         HA     52 LEU  QD2     7.00                
         HA     53 ARG  HN      3.60                
         HA     55 ALA  HN      4.50                
         HA     55 ALA  QB      5.10                
         HB2    53 ARG  HN      3.90                
         HB3    53 ARG  HN      3.90                
         QB     56 ILE  QD1     7.88                
         HG     53 ARG  HN      5.40                
         QD1    53 ARG  HN      6.50                
         QD2    53 ARG  HN      6.50                
         QQD    55 ALA  HN      8.57                
 53 ARG  
         HN     53 ARG  HB2     3.10                
         HN     53 ARG  HB3     3.10                
         HN     53 ARG  QG      4.60                
         HN     53 ARG  HD2     4.30                
         HN     53 ARG  HD3     4.30                
         HN     53 ARG  QD      4.06                
         HN     54 THR  HN      3.70                
         HN     54 THR  HB      5.90                
         HN     55 ALA  HN      4.80                
         HA     53 ARG  HD2     6.00                
         HA     53 ARG  HD3     6.00                
         HA     55 ALA  HN      6.00                
         HA     56 ILE  HN      4.60                
         HA     56 ILE  HB      5.80                
         HA     56 ILE  QG2     7.00                
         HA     56 ILE  QG1     7.00                
         HA     56 ILE  QD1     7.00                
         HB2    54 THR  HN      5.00                
         HB3    54 THR  HN      5.00                
         QG     54 THR  HN      7.00                
         QD     54 THR  HN      6.88                
         QD     54 THR  HA      6.88                
 54 THR  
         HN     54 THR  HB      3.10                
         HN     54 THR  QG2     4.50                
         HN     55 ALA  HN      2.70                
         HN     57 ALA  QB      6.20                
         HA     56 ILE  HN      5.40                
         HA     57 ALA  HN      4.40                
         HA     57 ALA  QB      5.70                
         HB     55 ALA  HN      3.50                
         QG2    55 ALA  HN      6.00                
         QG2    58 SER  HN      7.00                
 55 ALA  
         HN     55 ALA  HA      2.90                
         HN     55 ALA  QB      3.40                
         HN     56 ILE  HN      3.40                
         HN     58 SER  HN      5.70                
         HA     58 SER  HN      4.30                
         QB     56 ILE  HN      3.70                
         QB     56 ILE  QD1     8.00                
         QB     57 ALA  HN      6.00                
         QB     58 SER  HN      6.00                
 56 ILE  
         HN     56 ILE  HB      3.10                
         HN     56 ILE  QG1     5.40                
         HN     56 ILE  QD1     4.60                
         HN     57 ALA  HN      3.40                
         HA     59 ALA  QB      5.10                
         HB     57 ALA  HN      3.50                
         HB     61 HID  HD2     6.00                
         QG2    57 ALA  HN      5.80                
         QG2    61 HID  HN      5.10                
         QG2    61 HID  HB2     7.00                
         QG2    61 HID  HB3     7.00                
         QG2    61 HID  QB      6.84                
         QG2    61 HID  HD2     7.00                
         QG1    57 ALA  HN      7.00                
         QG1    61 HID  QB      7.88                
         QD1    57 ALA  HN      7.00                
         QD1    63 VAL  QQG     9.56                
 57 ALA  
         HN     57 ALA  QB      3.40                
         HN     58 SER  HN      3.30                
         HA     59 ALA  HN      5.00                
         HA     60 GLY  HN      5.10                
         HA     61 HID  HN      3.60                
         QB     58 SER  HN      3.70                
 58 SER  
         HN     58 SER  HB2     3.90                
         HN     58 SER  HB3     3.90                
         HN     59 ALA  HN      3.60                
         HA     60 GLY  HN      5.10                
         HB2    59 ALA  HN      4.90                
         HB3    59 ALA  HN      4.90                
 59 ALA  
         HN     59 ALA  QB      3.40                
         HN     60 GLY  HN      3.50                
         HN     60 GLY  QA      6.78                
         HN     61 HID  HN      4.90                
         QB     60 GLY  HN      4.10                
         QB     61 HID  HN      4.50                
         QB     61 HID  HD2     7.00                
         QB     61 HID  HE1     7.00                
 60 GLY  
         HN     61 HID  HN      3.50                
         HN     61 HID  QB      6.78                
 61 HID  
         HN     61 HID  HB2     3.80                
         HN     61 HID  HB3     3.80                
         HN     61 HID  QB      3.45                
         HN     61 HID  HD2     4.10                
         HN     62 GLU  HN      5.30                
         HA     61 HID  HD2     6.00                
         HB2    62 GLU  HN      4.50                
         HB2    63 VAL  QG1    10.12                
         HB2    63 VAL  QG2    10.12                
         HB3    62 GLU  HN      4.50                
         HB3    63 VAL  QG1    10.12                
         HB3    63 VAL  QG2    10.12                
         QB     62 GLU  HN      4.12                
         QB     63 VAL  QQG     8.52                
 62 GLU  
         HN     62 GLU  HB2     3.90                
         HN     62 GLU  HB3     3.90                
         HN     62 GLU  QB      3.65                
         HN     62 GLU  HG2     4.60                
         HN     62 GLU  HG3     4.60                
         HN     62 GLU  QG      4.37                
         HN     63 VAL  HN      3.40                
         HA     63 VAL  QQG     8.56                
         HB2    63 VAL  HN      5.00                
         HB3    63 VAL  HN      5.00                
         HG2    63 VAL  HN      6.00                
         HG3    63 VAL  HN      6.00                
         QG     63 VAL  HN      5.64                
 63 VAL  
         HN     63 VAL  HB      2.90                
         HN     63 VAL  QG1     4.80                
         HN     63 VAL  QG2     4.80                
         HN     63 VAL  QQG     3.99                
         HB     64 GLU  HN      5.00                
         QG1    64 GLU  HN      6.90                
         QG2    64 GLU  HN      6.90                
         QQG    64 GLU  HN      6.32                
 64 GLU  
         HN     64 GLU  QG      5.70                

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    MET   1           H1       MET   1   7.674   2.165  11.413
    2   2H    MET   1           H2       MET   1   8.935   2.252  12.483
    3   3H    MET   1           H3       MET   1   8.021   3.596  12.119
    4    HA   MET   1           HA       MET   1  10.068   3.751  10.920
    5   1HB   MET   1          2HB       MET   1  10.387   1.230  10.965
    6   2HB   MET   1          3HB       MET   1   9.175   1.105   9.686
    7   1HG   MET   1          2HG       MET   1  10.683   2.491   8.212
    8   2HG   MET   1          3HG       MET   1  11.871   2.519   9.525
    9   1HE   MET   1          1HE       MET   1  13.458   0.159   6.822
   10   2HE   MET   1          2HE       MET   1  12.457   1.600   6.525
   11   3HE   MET   1          3HE       MET   1  13.691   1.618   7.813
   12    H    THR   2           H        THR   2   9.973   4.628   8.630
   13    HA   THR   2           HA       THR   2   7.194   4.801   7.582
   14    HB   THR   2           HB       THR   2   8.061   6.968   8.330
   15    HG1  THR   2           1HG      THR   2   6.603   6.797   6.585
   16   1HG2  THR   2          1HG2      THR   2  10.102   6.760   6.078
   17   2HG2  THR   2          2HG2      THR   2   9.802   8.138   7.142
   18   3HG2  THR   2          3HG2      THR   2  10.503   6.653   7.807
   19    H    ILE   3           H        ILE   3   6.882   3.732   5.767
   20    HA   ILE   3           HA       ILE   3   9.164   2.786   4.078
   21    HB   ILE   3           HB       ILE   3   6.458   1.583   4.815
   22   1HG1  ILE   3          2HG1      ILE   3   7.823  -0.463   5.244
   23   2HG1  ILE   3          3HG1      ILE   3   9.297   0.483   5.012
   24   1HG2  ILE   3          1HG2      ILE   3   7.041  -0.241   3.164
   25   2HG2  ILE   3          2HG2      ILE   3   6.581   1.294   2.453
   26   3HG2  ILE   3          3HG2      ILE   3   8.301   0.833   2.524
   27   1HD1  ILE   3          1HD1      ILE   3   8.557   0.041   7.402
   28   2HD1  ILE   3          2HD1      ILE   3   8.832   1.740   7.031
   29   3HD1  ILE   3          3HD1      ILE   3   7.168   1.110   7.118
   30    H    GLN   4           H        GLN   4   9.261   4.393   2.506
   31    HA   GLN   4           HA       GLN   4   6.707   5.397   1.393
   32   1HB   GLN   4          2HB       GLN   4   8.950   6.883   2.164
   33   2HB   GLN   4          3HB       GLN   4   9.089   6.791   0.398
   34   1HG   GLN   4          2HG       GLN   4   6.595   7.386   0.289
   35   2HG   GLN   4          3HG       GLN   4   6.696   7.651   2.037
   36   1HE2  GLN   4          1HE2      GLN   4   8.220   9.401   2.772
   37   2HE2  GLN   4          2HE2      GLN   4   8.427  10.797   1.732
   38    H    LEU   5           H        LEU   5   6.008   4.259  -0.270
   39    HA   LEU   5           HA       LEU   5   7.982   3.095  -2.220
   40   1HB   LEU   5          2HB       LEU   5   5.129   2.197  -1.739
   41   2HB   LEU   5          3HB       LEU   5   6.352   1.393  -2.713
   42    HG   LEU   5           HG       LEU   5   6.393   1.725   0.310
   43   1HD1  LEU   5          1HD1      LEU   5   5.946  -0.713  -1.451
   44   2HD1  LEU   5          2HD1      LEU   5   6.071  -0.723   0.321
   45   3HD1  LEU   5          3HD1      LEU   5   4.722   0.122  -0.465
   46   1HD2  LEU   5          1HD2      LEU   5   8.686   1.724  -0.501
   47   2HD2  LEU   5          2HD2      LEU   5   8.345   0.131   0.186
   48   3HD2  LEU   5          3HD2      LEU   5   8.355   0.345  -1.576
   49    H    THR   6           H        THR   6   7.275   3.008  -4.446
   50    HA   THR   6           HA       THR   6   5.527   5.282  -5.261
   51    HB   THR   6           HB       THR   6   8.158   4.306  -6.390
   52    HG1  THR   6           1HG      THR   6   7.109   6.772  -5.449
   53   1HG2  THR   6          1HG2      THR   6   6.759   4.599  -8.341
   54   2HG2  THR   6          2HG2      THR   6   6.084   6.121  -7.703
   55   3HG2  THR   6          3HG2      THR   6   7.797   6.016  -8.183
   56    H    VAL   7           H        VAL   7   3.736   4.623  -6.188
   57    HA   VAL   7           HA       VAL   7   3.556   1.855  -7.307
   58    HB   VAL   7           HB       VAL   7   2.372   1.836  -5.360
   59   1HG1  VAL   7          1HG1      VAL   7   2.219   4.108  -4.664
   60   2HG1  VAL   7          2HG1      VAL   7   1.147   4.525  -6.009
   61   3HG1  VAL   7          3HG1      VAL   7   0.590   3.441  -4.714
   62   1HG2  VAL   7          1HG2      VAL   7   1.209   0.921  -7.385
   63   2HG2  VAL   7          2HG2      VAL   7   0.205   1.253  -5.966
   64   3HG2  VAL   7          3HG2      VAL   7   0.185   2.367  -7.337
   65    HA   PRO   8           HA       PRO   8   2.988   4.815 -10.708
   66   1HB   PRO   8          2HB       PRO   8   3.777   3.238 -12.802
   67   2HB   PRO   8          3HB       PRO   8   4.945   4.019 -11.693
   68   1HG   PRO   8          2HG       PRO   8   3.912   1.180 -11.568
   69   2HG   PRO   8          3HG       PRO   8   5.605   1.734 -11.462
   70   1HD   PRO   8          2HD       PRO   8   4.091   1.181  -9.281
   71   2HD   PRO   8          3HD       PRO   8   5.317   2.484  -9.251
   72    H    THR   9           H        THR   9   1.791   1.512 -10.284
   73    HA   THR   9           HA       THR   9  -0.430   2.085 -12.087
   74    HB   THR   9           HB       THR   9   0.910  -0.081 -12.013
   75    HG1  THR   9           1HG      THR   9  -0.843   0.254 -13.351
   76   1HG2  THR   9          1HG2      THR   9  -1.221  -0.823  -9.986
   77   2HG2  THR   9          2HG2      THR   9  -0.134  -1.880 -10.833
   78   3HG2  THR   9          3HG2      THR   9   0.536  -0.703  -9.656
   79    H    ILE  10           H        ILE  10  -0.119   3.555  -9.326
   80    HA   ILE  10           HA       ILE  10  -2.396   3.010  -7.940
   81    HB   ILE  10           HB       ILE  10  -0.653   5.281  -8.343
   82   1HG1  ILE  10          2HG1      ILE  10  -2.776   4.516  -6.346
   83   2HG1  ILE  10          3HG1      ILE  10  -1.078   4.070  -6.306
   84   1HG2  ILE  10          1HG2      ILE  10  -2.082   7.183  -8.182
   85   2HG2  ILE  10          2HG2      ILE  10  -2.551   6.285  -9.632
   86   3HG2  ILE  10          3HG2      ILE  10  -3.539   6.180  -8.151
   87   1HD1  ILE  10          1HD1      ILE  10  -0.511   6.529  -6.008
   88   2HD1  ILE  10          2HD1      ILE  10  -2.258   6.831  -5.868
   89   3HD1  ILE  10          3HD1      ILE  10  -1.438   5.817  -4.675
   90    H    ALA  11           H        ALA  11  -4.502   4.095  -7.929
   91    HA   ALA  11           HA       ALA  11  -6.520   4.511  -8.738
   92   1HB   ALA  11          1HB       ALA  11  -6.987   5.398 -10.880
   93   2HB   ALA  11          2HB       ALA  11  -5.510   6.153 -10.256
   94   3HB   ALA  11          3HB       ALA  11  -5.418   4.910 -11.529
   95    H    CYS  12           H        CYS  12  -4.550   2.134 -10.444
   96    HA   CYS  12           HA       CYS  12  -6.717   0.574 -11.499
   97   1HB   CYS  12          2HB       CYS  12  -4.319   0.570 -12.280
   98   2HB   CYS  12          3HB       CYS  12  -3.884  -0.206 -10.746
   99    HG   CYS  12           HG       CYS  12  -5.938  -1.237 -13.117
  100    H    GLU  13           H        GLU  13  -7.688  -1.220 -10.637
  101    HA   GLU  13           HA       GLU  13  -8.460  -2.784  -9.348
  102   1HB   GLU  13          2HB       GLU  13  -5.685  -3.131  -9.299
  103   2HB   GLU  13          3HB       GLU  13  -6.137  -3.325  -7.609
  104   1HG   GLU  13          2HG       GLU  13  -7.403  -4.813  -9.959
  105   2HG   GLU  13          3HG       GLU  13  -6.158  -5.449  -8.881
  106    H    ALA  14           H        ALA  14  -9.762  -1.030  -8.612
  107    HA   ALA  14           HA       ALA  14 -10.733   0.401  -7.158
  108   1HB   ALA  14          1HB       ALA  14 -11.082  -0.374  -4.864
  109   2HB   ALA  14          2HB       ALA  14 -11.272  -1.716  -6.008
  110   3HB   ALA  14          3HB       ALA  14  -9.792  -1.576  -5.041
  111    H    CYS  15           H        CYS  15  -7.713   0.687  -7.775
  112    HA   CYS  15           HA       CYS  15  -6.227   2.274  -7.395
  113   1HB   CYS  15          2HB       CYS  15  -7.722   3.488  -5.057
  114   2HB   CYS  15          3HB       CYS  15  -6.562   4.226  -6.157
  115    HG   CYS  15           HG       CYS  15  -8.319   3.613  -8.273
  116    H    ALA  16           H        ALA  16  -4.405   2.602  -6.111
  117    HA   ALA  16           HA       ALA  16  -3.530   0.390  -4.695
  118   1HB   ALA  16          1HB       ALA  16  -2.494   3.224  -4.341
  119   2HB   ALA  16          2HB       ALA  16  -1.629   1.723  -3.958
  120   3HB   ALA  16          3HB       ALA  16  -2.040   2.085  -5.643
  121    H    GLU  17           H        GLU  17  -5.409   3.077  -3.325
  122    HA   GLU  17           HA       GLU  17  -4.887   2.607  -0.606
  123   1HB   GLU  17          2HB       GLU  17  -7.049   3.616  -0.172
  124   2HB   GLU  17          3HB       GLU  17  -6.116   4.527  -1.351
  125   1HG   GLU  17          2HG       GLU  17  -7.864   4.479  -2.762
  126   2HG   GLU  17          3HG       GLU  17  -7.738   2.714  -2.877
  127    H    ALA  18           H        ALA  18  -6.663   0.572  -2.895
  128    HA   ALA  18           HA       ALA  18  -7.994  -1.220  -1.255
  129   1HB   ALA  18          1HB       ALA  18  -6.133  -1.849  -3.591
  130   2HB   ALA  18          2HB       ALA  18  -7.384  -2.922  -2.931
  131   3HB   ALA  18          3HB       ALA  18  -7.845  -1.394  -3.704
  132    H    VAL  19           H        VAL  19  -4.395  -1.080  -1.842
  133    HA   VAL  19           HA       VAL  19  -3.928  -3.409  -0.251
  134    HB   VAL  19           HB       VAL  19  -2.234  -2.276  -1.885
  135   1HG1  VAL  19          1HG1      VAL  19  -0.501  -0.946  -0.845
  136   2HG1  VAL  19          2HG1      VAL  19  -2.012  -0.076  -0.568
  137   3HG1  VAL  19          3HG1      VAL  19  -1.268  -1.023   0.742
  138   1HG2  VAL  19          1HG2      VAL  19  -0.417  -3.234  -0.183
  139   2HG2  VAL  19          2HG2      VAL  19  -1.794  -3.667   0.776
  140   3HG2  VAL  19          3HG2      VAL  19  -1.663  -4.324  -0.854
  141    H    THR  20           H        THR  20  -4.111   0.063   0.469
  142    HA   THR  20           HA       THR  20  -3.124  -0.036   3.149
  143    HB   THR  20           HB       THR  20  -4.970   1.866   1.670
  144    HG1  THR  20           1HG      THR  20  -2.649   1.811   1.453
  145   1HG2  THR  20          1HG2      THR  20  -5.950   1.953   3.828
  146   2HG2  THR  20          2HG2      THR  20  -4.359   1.892   4.610
  147   3HG2  THR  20          3HG2      THR  20  -4.850   3.329   3.666
  148    H    LYS  21           H        LYS  21  -6.447  -0.498   1.844
  149    HA   LYS  21           HA       LYS  21  -7.534  -0.929   4.488
  150   1HB   LYS  21          2HB       LYS  21  -8.763  -1.747   1.831
  151   2HB   LYS  21          3HB       LYS  21  -9.585  -1.565   3.400
  152   1HG   LYS  21          2HG       LYS  21  -8.740   0.833   3.474
  153   2HG   LYS  21          3HG       LYS  21  -8.129   0.582   1.834
  154   1HD   LYS  21          2HD       LYS  21 -10.392   0.200   0.993
  155   2HD   LYS  21          3HD       LYS  21 -11.056   0.561   2.612
  156   1HE   LYS  21          2HE       LYS  21 -10.169   2.832   2.567
  157   2HE   LYS  21          3HE       LYS  21  -9.102   2.449   1.214
  158   1HZ   LYS  21          1HZ       LYS  21 -10.732   3.694   0.355
  159   2HZ   LYS  21          2HZ       LYS  21 -10.885   2.256  -0.237
  160   3HZ   LYS  21          3HZ       LYS  21 -12.008   2.750   0.920
  161    H    ALA  22           H        ALA  22  -6.363  -3.164   1.958
  162    HA   ALA  22           HA       ALA  22  -6.986  -5.590   3.330
  163   1HB   ALA  22          1HB       ALA  22  -6.179  -5.550   1.012
  164   2HB   ALA  22          2HB       ALA  22  -4.581  -4.998   1.566
  165   3HB   ALA  22          3HB       ALA  22  -5.176  -6.598   2.043
  166    H    VAL  23           H        VAL  23  -3.906  -3.776   3.349
  167    HA   VAL  23           HA       VAL  23  -2.528  -5.321   5.255
  168    HB   VAL  23           HB       VAL  23  -2.274  -2.424   4.366
  169   1HG1  VAL  23          1HG1      VAL  23  -1.021  -2.660   6.520
  170   2HG1  VAL  23          2HG1      VAL  23  -0.161  -4.060   5.817
  171   3HG1  VAL  23          3HG1      VAL  23   0.045  -2.462   5.109
  172   1HG2  VAL  23          1HG2      VAL  23  -0.498  -4.809   3.675
  173   2HG2  VAL  23          2HG2      VAL  23  -1.951  -4.457   2.750
  174   3HG2  VAL  23          3HG2      VAL  23  -0.651  -3.250   2.838
  175    H    GLN  24           H        GLN  24  -4.636  -2.423   5.697
  176    HA   GLN  24           HA       GLN  24  -4.365  -2.173   8.482
  177   1HB   GLN  24          2HB       GLN  24  -6.688  -1.615   6.635
  178   2HB   GLN  24          3HB       GLN  24  -6.706  -1.183   8.341
  179   1HG   GLN  24          2HG       GLN  24  -4.312  -0.295   6.742
  180   2HG   GLN  24          3HG       GLN  24  -5.849   0.498   6.414
  181   1HE2  GLN  24          1HE2      GLN  24  -3.101   0.905   8.088
  182   2HE2  GLN  24          2HE2      GLN  24  -3.705   1.847   9.431
  183    H    ASN  25           H        ASN  25  -5.982  -4.821   6.742
  184    HA   ASN  25           HA       ASN  25  -7.728  -5.531   8.973
  185   1HB   ASN  25          2HB       ASN  25  -6.616  -7.213   6.679
  186   2HB   ASN  25          3HB       ASN  25  -7.562  -7.856   7.999
  187   1HD2  ASN  25          1HD2      ASN  25  -7.934  -4.942   5.765
  188   2HD2  ASN  25          2HD2      ASN  25  -9.616  -5.325   5.486
  189    H    GLU  26           H        GLU  26  -4.437  -6.539   7.912
  190    HA   GLU  26           HA       GLU  26  -3.999  -8.182  10.273
  191   1HB   GLU  26          2HB       GLU  26  -2.205  -7.198   8.032
  192   2HB   GLU  26          3HB       GLU  26  -1.710  -8.356   9.286
  193   1HG   GLU  26          2HG       GLU  26  -3.437  -9.933   8.495
  194   2HG   GLU  26          3HG       GLU  26  -3.983  -8.766   7.277
  195    H    ASP  27           H        ASP  27  -2.476  -5.176   9.022
  196    HA   ASP  27           HA       ASP  27  -1.430  -4.591  11.728
  197   1HB   ASP  27          2HB       ASP  27   0.173  -4.433   9.807
  198   2HB   ASP  27          3HB       ASP  27  -0.768  -3.089   9.158
  199    H    ALA  28           H        ALA  28  -3.566  -4.241  12.480
  200    HA   ALA  28           HA       ALA  28  -5.256  -2.115  11.439
  201   1HB   ALA  28          1HB       ALA  28  -6.586  -2.601  13.443
  202   2HB   ALA  28          2HB       ALA  28  -6.086  -4.109  12.634
  203   3HB   ALA  28          3HB       ALA  28  -5.235  -3.562  14.103
  204    H    GLN  29           H        GLN  29  -2.324  -2.024  13.136
  205    HA   GLN  29           HA       GLN  29  -3.009   0.541  14.496
  206   1HB   GLN  29          2HB       GLN  29  -1.114   0.171  15.873
  207   2HB   GLN  29          3HB       GLN  29  -2.204  -1.205  15.986
  208   1HG   GLN  29          2HG       GLN  29  -0.706  -2.559  14.601
  209   2HG   GLN  29          3HG       GLN  29   0.310  -1.149  14.249
  210   1HE2  GLN  29          1HE2      GLN  29  -1.027  -2.809  17.181
  211   2HE2  GLN  29          2HE2      GLN  29   0.488  -2.724  18.067
  212    H    ALA  30           H        ALA  30  -2.007  -0.361  11.501
  213    HA   ALA  30           HA       ALA  30   0.362   1.287  11.289
  214   1HB   ALA  30          1HB       ALA  30  -0.044   0.997   8.815
  215   2HB   ALA  30          2HB       ALA  30   0.063  -0.516   9.716
  216   3HB   ALA  30          3HB       ALA  30  -1.519   0.090   9.217
  217    H    THR  31           H        THR  31   0.585   3.321  10.438
  218    HA   THR  31           HA       THR  31  -1.864   4.971   9.947
  219    HB   THR  31           HB       THR  31   0.994   5.757  10.626
  220    HG1  THR  31           1HG      THR  31   0.039   6.453  12.520
  221   1HG2  THR  31          1HG2      THR  31  -1.463   7.494  10.077
  222   2HG2  THR  31          2HG2      THR  31   0.087   8.082  10.708
  223   3HG2  THR  31          3HG2      THR  31   0.002   7.427   9.070
  224    H    VAL  32           H        VAL  32  -2.024   5.909   7.867
  225    HA   VAL  32           HA       VAL  32  -0.168   4.885   5.779
  226    HB   VAL  32           HB       VAL  32  -2.139   4.082   4.534
  227   1HG1  VAL  32          1HG1      VAL  32  -2.016   2.786   7.287
  228   2HG1  VAL  32          2HG1      VAL  32  -2.417   2.017   5.744
  229   3HG1  VAL  32          3HG1      VAL  32  -0.770   2.581   6.042
  230   1HG2  VAL  32          1HG2      VAL  32  -3.679   4.828   7.074
  231   2HG2  VAL  32          2HG2      VAL  32  -3.988   5.350   5.404
  232   3HG2  VAL  32          3HG2      VAL  32  -4.280   3.682   5.899
  233    H    GLN  33           H        GLN  33   0.266   6.447   4.262
  234    HA   GLN  33           HA       GLN  33  -1.643   8.713   3.922
  235   1HB   GLN  33          2HB       GLN  33   1.317   8.894   4.601
  236   2HB   GLN  33          3HB       GLN  33   0.332  10.239   4.003
  237   1HG   GLN  33          2HG       GLN  33  -1.125  10.039   6.014
  238   2HG   GLN  33          3HG       GLN  33  -0.168   8.663   6.578
  239   1HE2  GLN  33          1HE2      GLN  33   0.360  12.101   5.565
  240   2HE2  GLN  33          2HE2      GLN  33   1.556  12.390   6.817
  241    H    VAL  34           H        VAL  34  -2.257   7.925   1.947
  242    HA   VAL  34           HA       VAL  34  -0.179   7.403  -0.105
  243    HB   VAL  34           HB       VAL  34  -1.607   5.505   0.241
  244   1HG1  VAL  34          1HG1      VAL  34  -3.987   7.322  -0.261
  245   2HG1  VAL  34          2HG1      VAL  34  -4.026   5.551  -0.204
  246   3HG1  VAL  34          3HG1      VAL  34  -3.588   6.468   1.241
  247   1HG2  VAL  34          1HG2      VAL  34  -2.367   5.150  -2.020
  248   2HG2  VAL  34          2HG2      VAL  34  -2.428   6.892  -2.341
  249   3HG2  VAL  34          3HG2      VAL  34  -0.869   6.095  -2.070
  250    H    ASP  35           H        ASP  35  -0.067   8.642  -1.940
  251    HA   ASP  35           HA       ASP  35  -1.732  11.123  -1.806
  252   1HB   ASP  35          2HB       ASP  35   0.884  10.982  -1.426
  253   2HB   ASP  35          3HB       ASP  35   0.925  11.023  -3.201
  254    H    LEU  36           H        LEU  36  -3.419  10.084  -2.997
  255    HA   LEU  36           HA       LEU  36  -3.043   8.846  -5.541
  256   1HB   LEU  36          2HB       LEU  36  -5.536  10.159  -4.381
  257   2HB   LEU  36          3HB       LEU  36  -5.447   9.289  -5.913
  258    HG   LEU  36           HG       LEU  36  -4.523   7.285  -4.540
  259   1HD1  LEU  36          1HD1      LEU  36  -4.281   8.412  -2.343
  260   2HD1  LEU  36          2HD1      LEU  36  -5.999   8.856  -2.368
  261   3HD1  LEU  36          3HD1      LEU  36  -5.515   7.153  -2.261
  262   1HD2  LEU  36          1HD2      LEU  36  -7.432   8.178  -4.386
  263   2HD2  LEU  36          2HD2      LEU  36  -6.669   7.311  -5.736
  264   3HD2  LEU  36          3HD2      LEU  36  -6.847   6.516  -4.166
  265    H    THR  37           H        THR  37  -3.044  12.219  -4.639
  266    HA   THR  37           HA       THR  37  -3.369  13.627  -6.939
  267    HB   THR  37           HB       THR  37  -0.949  13.867  -5.122
  268    HG1  THR  37           1HG      THR  37  -2.167  13.971  -3.494
  269   1HG2  THR  37          1HG2      THR  37  -2.855  15.953  -6.264
  270   2HG2  THR  37          2HG2      THR  37  -1.462  16.269  -5.207
  271   3HG2  THR  37          3HG2      THR  37  -1.203  15.620  -6.837
  272    H    SER  38           H        SER  38  -0.798  11.219  -6.261
  273    HA   SER  38           HA       SER  38   0.115  11.503  -9.044
  274   1HB   SER  38          2HB       SER  38   1.991  11.926  -6.680
  275   2HB   SER  38          3HB       SER  38   2.491  11.706  -8.378
  276    HG   SER  38           HG       SER  38   0.610  13.578  -8.315
  277    H    LYS  39           H        LYS  39   2.246   9.828  -6.852
  278    HA   LYS  39           HA       LYS  39   1.069   7.217  -7.498
  279   1HB   LYS  39          2HB       LYS  39   2.895   6.581  -9.022
  280   2HB   LYS  39          3HB       LYS  39   1.881   7.870  -9.658
  281   1HG   LYS  39          2HG       LYS  39   3.708   9.499  -8.708
  282   2HG   LYS  39          3HG       LYS  39   4.727   8.066  -8.604
  283   1HD   LYS  39          2HD       LYS  39   3.303   9.095 -11.110
  284   2HD   LYS  39          3HD       LYS  39   4.982   9.465 -10.680
  285   1HE   LYS  39          2HE       LYS  39   5.530   7.013 -10.744
  286   2HE   LYS  39          3HE       LYS  39   3.862   6.690 -11.251
  287   1HZ   LYS  39          1HZ       LYS  39   5.780   8.299 -12.783
  288   2HZ   LYS  39          2HZ       LYS  39   5.364   6.742 -13.097
  289   3HZ   LYS  39          3HZ       LYS  39   4.238   7.928 -13.233
  290    H    LYS  40           H        LYS  40   1.919   8.535  -4.982
  291    HA   LYS  40           HA       LYS  40   4.090   6.652  -4.235
  292   1HB   LYS  40          2HB       LYS  40   5.235   8.271  -2.952
  293   2HB   LYS  40          3HB       LYS  40   4.960   8.968  -4.545
  294   1HG   LYS  40          2HG       LYS  40   4.468  10.728  -3.159
  295   2HG   LYS  40          3HG       LYS  40   2.874  10.106  -3.509
  296   1HD   LYS  40          2HD       LYS  40   2.496   9.397  -1.357
  297   2HD   LYS  40          3HD       LYS  40   4.152   8.874  -1.081
  298   1HE   LYS  40          2HE       LYS  40   3.235  11.787  -1.090
  299   2HE   LYS  40          3HE       LYS  40   3.419  10.779   0.350
  300   1HZ   LYS  40          1HZ       LYS  40   5.584  11.521  -1.507
  301   2HZ   LYS  40          2HZ       LYS  40   5.364  12.088   0.015
  302   3HZ   LYS  40          3HZ       LYS  40   5.798  10.519  -0.246
  303    H    VAL  41           H        VAL  41   4.038   5.886  -2.123
  304    HA   VAL  41           HA       VAL  41   1.689   6.573  -0.493
  305    HB   VAL  41           HB       VAL  41   0.954   4.619  -1.721
  306   1HG1  VAL  41          1HG1      VAL  41   3.173   3.662  -2.351
  307   2HG1  VAL  41          2HG1      VAL  41   3.394   3.149  -0.661
  308   3HG1  VAL  41          3HG1      VAL  41   2.085   2.464  -1.636
  309   1HG2  VAL  41          1HG2      VAL  41   0.449   4.841   0.759
  310   2HG2  VAL  41          2HG2      VAL  41   0.378   3.180   0.129
  311   3HG2  VAL  41          3HG2      VAL  41   1.779   3.722   1.068
  312    H    THR  42           H        THR  42   2.148   6.795   1.627
  313    HA   THR  42           HA       THR  42   4.842   5.917   2.543
  314    HB   THR  42           HB       THR  42   3.066   8.174   3.561
  315    HG1  THR  42           1HG      THR  42   4.501   9.551   2.592
  316   1HG2  THR  42          1HG2      THR  42   5.940   7.397   4.216
  317   2HG2  THR  42          2HG2      THR  42   5.130   8.873   4.782
  318   3HG2  THR  42          3HG2      THR  42   4.541   7.288   5.301
  319    H    ILE  43           H        ILE  43   4.544   4.081   3.733
  320    HA   ILE  43           HA       ILE  43   2.079   3.772   5.416
  321    HB   ILE  43           HB       ILE  43   4.200   1.778   4.575
  322   1HG1  ILE  43          2HG1      ILE  43   2.714   2.434   2.690
  323   2HG1  ILE  43          3HG1      ILE  43   2.526   0.758   3.150
  324   1HG2  ILE  43          1HG2      ILE  43   1.717   1.381   6.266
  325   2HG2  ILE  43          2HG2      ILE  43   2.640   0.062   5.507
  326   3HG2  ILE  43          3HG2      ILE  43   3.413   1.108   6.704
  327   1HD1  ILE  43          1HD1      ILE  43   0.596   2.987   3.906
  328   2HD1  ILE  43          2HD1      ILE  43   0.367   1.760   2.653
  329   3HD1  ILE  43          3HD1      ILE  43   0.432   1.267   4.347
  330    H    THR  44           H        THR  44   2.326   3.942   7.590
  331    HA   THR  44           HA       THR  44   5.075   4.181   8.716
  332    HB   THR  44           HB       THR  44   2.646   5.919   9.169
  333    HG1  THR  44           1HG      THR  44   5.326   6.506   8.502
  334   1HG2  THR  44          1HG2      THR  44   4.066   7.106  10.857
  335   2HG2  THR  44          2HG2      THR  44   3.617   5.483  11.395
  336   3HG2  THR  44          3HG2      THR  44   5.252   5.786  10.767
  337    H    SER  45           H        SER  45   5.236   2.168   9.504
  338    HA   SER  45           HA       SER  45   3.453   1.342  11.718
  339   1HB   SER  45          2HB       SER  45   3.250  -0.925  10.595
  340   2HB   SER  45          3HB       SER  45   2.347   0.347   9.796
  341    HG   SER  45           HG       SER  45   3.925  -1.165   8.615
  342    H    ALA  46           H        ALA  46   4.379  -0.965  12.436
  343    HA   ALA  46           HA       ALA  46   7.310  -0.688  12.825
  344   1HB   ALA  46          1HB       ALA  46   6.992  -2.438  14.505
  345   2HB   ALA  46          2HB       ALA  46   5.896  -1.071  14.794
  346   3HB   ALA  46          3HB       ALA  46   5.274  -2.573  14.072
  347    H    LEU  47           H        LEU  47   4.908  -2.719  11.188
  348    HA   LEU  47           HA       LEU  47   6.990  -4.370   9.868
  349   1HB   LEU  47          2HB       LEU  47   5.616  -6.276   9.938
  350   2HB   LEU  47          3HB       LEU  47   5.745  -5.703  11.596
  351    HG   LEU  47           HG       LEU  47   3.418  -4.484  11.014
  352   1HD1  LEU  47          1HD1      LEU  47   3.434  -5.307   8.579
  353   2HD1  LEU  47          2HD1      LEU  47   3.363  -6.957   9.219
  354   3HD1  LEU  47          3HD1      LEU  47   2.040  -5.817   9.528
  355   1HD2  LEU  47          1HD2      LEU  47   2.233  -6.492  11.842
  356   2HD2  LEU  47          2HD2      LEU  47   3.706  -7.456  11.604
  357   3HD2  LEU  47          3HD2      LEU  47   3.686  -6.131  12.792
  358    H    GLY  48           H        GLY  48   6.698  -4.098   7.675
  359   1HA   GLY  48          2HA       GLY  48   4.203  -2.876   6.660
  360   2HA   GLY  48          3HA       GLY  48   5.639  -1.828   6.646
  361    H    GLU  49           H        GLU  49   7.622  -2.920   5.741
  362    HA   GLU  49           HA       GLU  49   7.244  -3.272   3.033
  363   1HB   GLU  49          2HB       GLU  49   9.368  -2.764   4.383
  364   2HB   GLU  49          3HB       GLU  49   9.626  -4.510   4.476
  365   1HG   GLU  49          2HG       GLU  49   9.278  -2.928   1.879
  366   2HG   GLU  49          3HG       GLU  49  10.838  -3.237   2.645
  367    H    GLU  50           H        GLU  50   7.803  -5.858   5.389
  368    HA   GLU  50           HA       GLU  50   7.665  -8.144   3.803
  369   1HB   GLU  50          2HB       GLU  50   7.415  -7.357   6.680
  370   2HB   GLU  50          3HB       GLU  50   6.521  -8.800   6.322
  371   1HG   GLU  50          2HG       GLU  50   8.559  -9.817   5.305
  372   2HG   GLU  50          3HG       GLU  50   9.463  -8.331   5.657
  373    H    GLN  51           H        GLN  51   5.005  -6.595   5.633
  374    HA   GLN  51           HA       GLN  51   3.131  -8.538   4.718
  375   1HB   GLN  51          2HB       GLN  51   3.230  -6.955   6.850
  376   2HB   GLN  51          3HB       GLN  51   2.247  -5.870   5.846
  377   1HG   GLN  51          2HG       GLN  51   0.646  -7.760   5.505
  378   2HG   GLN  51          3HG       GLN  51   1.732  -8.816   6.436
  379   1HE2  GLN  51          1HE2      GLN  51  -0.073  -5.717   6.794
  380   2HE2  GLN  51          2HE2      GLN  51  -0.352  -5.906   8.515
  381    H    LEU  52           H        LEU  52   3.795  -5.149   3.812
  382    HA   LEU  52           HA       LEU  52   1.919  -4.768   1.781
  383   1HB   LEU  52          2HB       LEU  52   4.795  -3.850   2.120
  384   2HB   LEU  52          3HB       LEU  52   3.781  -3.265   0.807
  385    HG   LEU  52           HG       LEU  52   2.864  -3.022   3.683
  386   1HD1  LEU  52          1HD1      LEU  52   3.923  -0.880   3.849
  387   2HD1  LEU  52          2HD1      LEU  52   5.172  -2.007   3.332
  388   3HD1  LEU  52          3HD1      LEU  52   4.442  -0.916   2.148
  389   1HD2  LEU  52          1HD2      LEU  52   1.260  -2.647   1.729
  390   2HD2  LEU  52          2HD2      LEU  52   1.465  -1.257   2.801
  391   3HD2  LEU  52          3HD2      LEU  52   2.289  -1.301   1.224
  392    H    ARG  53           H        ARG  53   5.185  -6.330   1.567
  393    HA   ARG  53           HA       ARG  53   5.323  -6.863  -1.103
  394   1HB   ARG  53          2HB       ARG  53   6.613  -7.785   1.223
  395   2HB   ARG  53          3HB       ARG  53   5.932  -9.241   0.581
  396   1HG   ARG  53          2HG       ARG  53   8.048  -9.140  -0.376
  397   2HG   ARG  53          3HG       ARG  53   7.043  -8.499  -1.692
  398   1HD   ARG  53          2HD       ARG  53   7.630  -6.142  -0.904
  399   2HD   ARG  53          3HD       ARG  53   8.451  -6.846   0.468
  400    HE   ARG  53           HE       ARG  53  10.297  -7.034  -0.640
  401   1HH1  ARG  53          2HH2      ARG  53   7.768  -6.507  -2.972
  402   2HH1  ARG  53          1HH2      ARG  53   8.798  -6.429  -4.368
  403   1HH2  ARG  53          2HH1      ARG  53  11.705  -7.308  -2.487
  404   2HH2  ARG  53          1HH1      ARG  53  11.109  -6.959  -4.083
  405    H    THR  54           H        THR  54   3.802  -9.107   1.261
  406    HA   THR  54           HA       THR  54   2.736 -10.795  -0.750
  407    HB   THR  54           HB       THR  54   1.873 -10.560   2.163
  408    HG1  THR  54           1HG      THR  54   3.653 -11.854   2.572
  409   1HG2  THR  54          1HG2      THR  54   0.525 -12.145   0.789
  410   2HG2  THR  54          2HG2      THR  54   2.019 -12.928   0.229
  411   3HG2  THR  54          3HG2      THR  54   1.553 -13.017   1.940
  412    H    ALA  55           H        ALA  55   1.208  -8.285   1.318
  413    HA   ALA  55           HA       ALA  55  -1.466  -8.768   0.492
  414   1HB   ALA  55          1HB       ALA  55  -0.896  -7.512   2.526
  415   2HB   ALA  55          2HB       ALA  55  -0.211  -6.199   1.543
  416   3HB   ALA  55          3HB       ALA  55  -1.950  -6.562   1.465
  417    H    ILE  56           H        ILE  56   0.811  -6.191  -0.571
  418    HA   ILE  56           HA       ILE  56  -0.608  -5.229  -2.811
  419    HB   ILE  56           HB       ILE  56   2.396  -5.663  -2.580
  420   1HG1  ILE  56          2HG1      ILE  56   0.725  -3.136  -2.139
  421   2HG1  ILE  56          3HG1      ILE  56   1.389  -4.126  -0.831
  422   1HG2  ILE  56          1HG2      ILE  56   0.891  -3.782  -4.411
  423   2HG2  ILE  56          2HG2      ILE  56   2.643  -4.120  -4.348
  424   3HG2  ILE  56          3HG2      ILE  56   1.560  -5.335  -4.963
  425   1HD1  ILE  56          1HD1      ILE  56   2.998  -2.527  -2.839
  426   2HD1  ILE  56          2HD1      ILE  56   2.810  -2.243  -1.113
  427   3HD1  ILE  56          3HD1      ILE  56   3.690  -3.681  -1.676
  428    H    ALA  57           H        ALA  57   1.815  -7.982  -2.803
  429    HA   ALA  57           HA       ALA  57   1.483  -8.554  -5.515
  430   1HB   ALA  57          1HB       ALA  57   2.376 -10.804  -4.978
  431   2HB   ALA  57          2HB       ALA  57   3.284  -9.520  -4.161
  432   3HB   ALA  57          3HB       ALA  57   2.111 -10.501  -3.250
  433    H    SER  58           H        SER  58  -0.517  -9.676  -2.783
  434    HA   SER  58           HA       SER  58  -2.097 -11.547  -4.178
  435   1HB   SER  58          2HB       SER  58  -2.056 -11.098  -1.670
  436   2HB   SER  58          3HB       SER  58  -3.122  -9.712  -1.981
  437    HG   SER  58           HG       SER  58  -4.491 -11.324  -3.109
  438    H    ALA  59           H        ALA  59  -2.226  -7.997  -4.222
  439    HA   ALA  59           HA       ALA  59  -4.768  -7.949  -5.754
  440   1HB   ALA  59          1HB       ALA  59  -4.392  -5.504  -5.716
  441   2HB   ALA  59          2HB       ALA  59  -4.415  -6.214  -4.089
  442   3HB   ALA  59          3HB       ALA  59  -2.869  -5.762  -4.832
  443    H    GLY  60           H        GLY  60  -1.271  -7.429  -6.162
  444   1HA   GLY  60          2HA       GLY  60   0.011  -7.906  -8.039
  445   2HA   GLY  60          3HA       GLY  60  -1.446  -8.106  -9.018
  446    H    HIS  61           H        HIS  61   0.318  -5.555  -7.203
  447    HA   HIS  61           HA       HIS  61  -0.225  -3.622  -9.430
  448   1HB   HIS  61          2HB       HIS  61   0.451  -3.210  -6.515
  449   2HB   HIS  61          3HB       HIS  61   0.632  -1.931  -7.714
  450    HD1  HIS  61           1HD      HIS  61  -1.417  -0.400  -7.947
  451    HD2  HIS  61           2HD      HIS  61  -2.165  -4.146  -6.203
  452    HE1  HIS  61           1HE      HIS  61  -3.763  -0.283  -7.023
  453    H    GLU  62           H        GLU  62   1.480  -2.740 -10.521
  454    HA   GLU  62           HA       GLU  62   4.072  -3.971 -10.444
  455   1HB   GLU  62          2HB       GLU  62   3.070  -1.566 -12.042
  456   2HB   GLU  62          3HB       GLU  62   4.444  -2.611 -12.426
  457   1HG   GLU  62          2HG       GLU  62   1.508  -3.485 -12.438
  458   2HG   GLU  62          3HG       GLU  62   2.499  -3.096 -13.840
  459    H    VAL  63           H        VAL  63   3.827  -2.868  -8.013
  460    HA   VAL  63           HA       VAL  63   5.148  -0.207  -7.946
  461    HB   VAL  63           HB       VAL  63   3.180  -0.236  -6.753
  462   1HG1  VAL  63          1HG1      VAL  63   3.921  -2.871  -5.570
  463   2HG1  VAL  63          2HG1      VAL  63   2.575  -1.830  -4.990
  464   3HG1  VAL  63          3HG1      VAL  63   2.546  -2.446  -6.627
  465   1HG2  VAL  63          1HG2      VAL  63   5.161   0.669  -5.391
  466   2HG2  VAL  63          2HG2      VAL  63   3.777   0.154  -4.424
  467   3HG2  VAL  63          3HG2      VAL  63   5.205  -0.888  -4.556
  468    H    GLU  64           H        GLU  64   7.007   0.188  -6.873
  469    HA   GLU  64           HA       GLU  64   8.886  -2.070  -6.721
  470   1HB   GLU  64          2HB       GLU  64  10.592  -0.326  -6.675
  471   2HB   GLU  64          3HB       GLU  64   9.498  -0.142  -8.050
  472   1HG   GLU  64          2HG       GLU  64   8.255   1.619  -6.540
  473   2HG   GLU  64          3HG       GLU  64   9.725   1.576  -5.574
  Start of MODEL    2
    1   1H    MET   1           H1       MET   1   8.070   2.030  10.828
    2   2H    MET   1           H2       MET   1   9.372   2.263  11.827
    3   3H    MET   1           H3       MET   1   8.205   3.429  11.647
    4    HA   MET   1           HA       MET   1  10.021   4.131  10.379
    5   1HB   MET   1          2HB       MET   1  10.419   1.335  10.008
    6   2HB   MET   1          3HB       MET   1  10.026   1.960   8.404
    7   1HG   MET   1          2HG       MET   1  11.792   3.762   8.799
    8   2HG   MET   1          3HG       MET   1  12.272   2.857  10.242
    9   1HE   MET   1          1HE       MET   1  13.166   0.293  10.093
   10   2HE   MET   1          2HE       MET   1  11.851  -0.227   9.003
   11   3HE   MET   1          3HE       MET   1  13.542  -0.507   8.549
   12    H    THR   2           H        THR   2   9.624   5.240   8.319
   13    HA   THR   2           HA       THR   2   6.800   5.204   7.464
   14    HB   THR   2           HB       THR   2   7.590   7.344   6.395
   15    HG1  THR   2           1HG      THR   2   9.792   6.706   6.303
   16   1HG2  THR   2          1HG2      THR   2   7.819   8.607   8.500
   17   2HG2  THR   2          2HG2      THR   2   6.539   7.390   8.634
   18   3HG2  THR   2          3HG2      THR   2   8.116   7.110   9.400
   19    H    ILE   3           H        ILE   3   6.713   3.351   6.091
   20    HA   ILE   3           HA       ILE   3   8.874   2.848   4.187
   21    HB   ILE   3           HB       ILE   3   6.179   1.507   4.598
   22   1HG1  ILE   3          2HG1      ILE   3   7.491   1.330   6.651
   23   2HG1  ILE   3          3HG1      ILE   3   7.336  -0.218   5.836
   24   1HG2  ILE   3          1HG2      ILE   3   6.965   0.959   2.425
   25   2HG2  ILE   3          2HG2      ILE   3   8.617   0.667   2.998
   26   3HG2  ILE   3          3HG2      ILE   3   7.296  -0.433   3.456
   27   1HD1  ILE   3          1HD1      ILE   3   9.819   1.554   5.806
   28   2HD1  ILE   3          2HD1      ILE   3   9.589   0.052   6.712
   29   3HD1  ILE   3          3HD1      ILE   3   9.656   0.004   4.947
   30    H    GLN   4           H        GLN   4   8.925   4.619   2.867
   31    HA   GLN   4           HA       GLN   4   6.611   5.482   1.278
   32   1HB   GLN   4          2HB       GLN   4   9.441   6.406   1.677
   33   2HB   GLN   4          3HB       GLN   4   8.651   6.778   0.137
   34   1HG   GLN   4          2HG       GLN   4   6.790   7.834   1.212
   35   2HG   GLN   4          3HG       GLN   4   7.385   7.386   2.819
   36   1HE2  GLN   4          1HE2      GLN   4   8.376   9.182  -0.159
   37   2HE2  GLN   4          2HE2      GLN   4   9.229  10.444   0.718
   38    H    LEU   5           H        LEU   5   5.954   4.135  -0.267
   39    HA   LEU   5           HA       LEU   5   7.961   2.995  -2.193
   40   1HB   LEU   5          2HB       LEU   5   5.120   2.026  -1.825
   41   2HB   LEU   5          3HB       LEU   5   6.460   1.241  -2.662
   42    HG   LEU   5           HG       LEU   5   6.204   1.616   0.356
   43   1HD1  LEU   5          1HD1      LEU   5   5.889  -0.840  -1.414
   44   2HD1  LEU   5          2HD1      LEU   5   5.884  -0.838   0.361
   45   3HD1  LEU   5          3HD1      LEU   5   4.600   0.006  -0.529
   46   1HD2  LEU   5          1HD2      LEU   5   8.274   0.080  -1.281
   47   2HD2  LEU   5          2HD2      LEU   5   8.582   1.576  -0.377
   48   3HD2  LEU   5          3HD2      LEU   5   8.160   0.090   0.484
   49    H    THR   6           H        THR   6   7.042   2.849  -4.433
   50    HA   THR   6           HA       THR   6   5.005   4.910  -5.058
   51    HB   THR   6           HB       THR   6   7.775   4.688  -6.071
   52    HG1  THR   6           1HG      THR   6   5.746   6.682  -6.178
   53   1HG2  THR   6          1HG2      THR   6   7.209   5.588  -8.306
   54   2HG2  THR   6          2HG2      THR   6   6.752   3.893  -8.125
   55   3HG2  THR   6          3HG2      THR   6   5.506   5.167  -8.056
   56    H    VAL   7           H        VAL   7   3.444   4.353  -6.255
   57    HA   VAL   7           HA       VAL   7   3.159   1.571  -7.369
   58    HB   VAL   7           HB       VAL   7   1.787   1.806  -5.492
   59   1HG1  VAL   7          1HG1      VAL   7   0.773   4.500  -6.450
   60   2HG1  VAL   7          2HG1      VAL   7   0.140   3.559  -5.092
   61   3HG1  VAL   7          3HG1      VAL   7   1.778   4.183  -5.021
   62   1HG2  VAL   7          1HG2      VAL   7   0.780   0.896  -7.643
   63   2HG2  VAL   7          2HG2      VAL   7  -0.326   1.340  -6.329
   64   3HG2  VAL   7          3HG2      VAL   7  -0.111   2.430  -7.700
   65    HA   PRO   8           HA       PRO   8   3.454   4.619 -10.686
   66   1HB   PRO   8          2HB       PRO   8   4.236   2.917 -12.728
   67   2HB   PRO   8          3HB       PRO   8   5.362   3.647 -11.546
   68   1HG   PRO   8          2HG       PRO   8   4.125   0.890 -11.464
   69   2HG   PRO   8          3HG       PRO   8   5.825   1.342 -11.178
   70   1HD   PRO   8          2HD       PRO   8   4.077   0.921  -9.160
   71   2HD   PRO   8          3HD       PRO   8   5.341   2.172  -9.023
   72    H    THR   9           H        THR   9   2.050   1.410 -10.643
   73    HA   THR   9           HA       THR   9  -0.066   2.084 -12.556
   74    HB   THR   9           HB       THR   9   1.434   0.129 -12.760
   75    HG1  THR   9           1HG      THR   9  -1.338  -0.398 -12.383
   76   1HG2  THR   9          1HG2      THR   9   1.071  -1.879 -11.603
   77   2HG2  THR   9          2HG2      THR   9   1.653  -0.641 -10.466
   78   3HG2  THR   9          3HG2      THR   9  -0.056  -1.148 -10.458
   79    H    ILE  10           H        ILE  10  -0.234   3.314  -9.817
   80    HA   ILE  10           HA       ILE  10  -2.433   2.490  -8.499
   81    HB   ILE  10           HB       ILE  10  -1.016   4.909  -8.939
   82   1HG1  ILE  10          2HG1      ILE  10  -3.344   4.183  -7.221
   83   2HG1  ILE  10          3HG1      ILE  10  -1.637   4.030  -6.834
   84   1HG2  ILE  10          1HG2      ILE  10  -3.937   5.532  -9.432
   85   2HG2  ILE  10          2HG2      ILE  10  -2.561   6.652  -9.370
   86   3HG2  ILE  10          3HG2      ILE  10  -2.690   5.504 -10.706
   87   1HD1  ILE  10          1HD1      ILE  10  -3.171   6.647  -7.109
   88   2HD1  ILE  10          2HD1      ILE  10  -2.459   5.955  -5.643
   89   3HD1  ILE  10          3HD1      ILE  10  -1.401   6.530  -6.945
   90    H    ALA  11           H        ALA  11  -4.760   3.098  -8.722
   91    HA   ALA  11           HA       ALA  11  -6.749   2.741  -9.726
   92   1HB   ALA  11          1HB       ALA  11  -6.172   5.047 -10.456
   93   2HB   ALA  11          2HB       ALA  11  -5.507   4.385 -11.966
   94   3HB   ALA  11          3HB       ALA  11  -7.232   4.209 -11.600
   95    H    CYS  12           H        CYS  12  -4.682   0.691 -10.322
   96    HA   CYS  12           HA       CYS  12  -5.555  -0.423 -12.915
   97   1HB   CYS  12          2HB       CYS  12  -3.297  -0.722 -12.495
   98   2HB   CYS  12          3HB       CYS  12  -3.535  -1.176 -10.801
   99    HG   CYS  12           HG       CYS  12  -4.722  -3.455 -11.268
  100    H    GLU  13           H        GLU  13  -5.559  -1.538  -9.490
  101    HA   GLU  13           HA       GLU  13  -7.979  -3.170 -10.012
  102   1HB   GLU  13          2HB       GLU  13  -6.073  -4.197  -8.847
  103   2HB   GLU  13          3HB       GLU  13  -6.142  -2.992  -7.564
  104   1HG   GLU  13          2HG       GLU  13  -7.088  -5.315  -7.108
  105   2HG   GLU  13          3HG       GLU  13  -8.180  -4.024  -6.672
  106    H    ALA  14           H        ALA  14  -8.122  -2.216  -6.866
  107    HA   ALA  14           HA       ALA  14 -10.120  -0.111  -7.489
  108   1HB   ALA  14          1HB       ALA  14 -10.975  -0.640  -5.249
  109   2HB   ALA  14          2HB       ALA  14 -10.846  -2.090  -6.263
  110   3HB   ALA  14          3HB       ALA  14  -9.636  -1.788  -5.003
  111    H    CYS  15           H        CYS  15  -7.347   0.597  -7.676
  112    HA   CYS  15           HA       CYS  15  -5.934   2.195  -7.159
  113   1HB   CYS  15          2HB       CYS  15  -8.364   3.352  -5.855
  114   2HB   CYS  15          3HB       CYS  15  -6.827   3.867  -5.153
  115    HG   CYS  15           HG       CYS  15  -7.821   3.961  -8.265
  116    H    ALA  16           H        ALA  16  -4.367   2.811  -5.733
  117    HA   ALA  16           HA       ALA  16  -3.315   0.789  -4.148
  118   1HB   ALA  16          1HB       ALA  16  -1.747   2.491  -3.275
  119   2HB   ALA  16          2HB       ALA  16  -1.989   2.621  -5.028
  120   3HB   ALA  16          3HB       ALA  16  -2.782   3.782  -3.932
  121    H    GLU  17           H        GLU  17  -5.602   3.322  -3.102
  122    HA   GLU  17           HA       GLU  17  -5.164   3.032  -0.346
  123   1HB   GLU  17          2HB       GLU  17  -7.031   4.321   0.013
  124   2HB   GLU  17          3HB       GLU  17  -6.408   4.859  -1.535
  125   1HG   GLU  17          2HG       GLU  17  -8.625   4.755  -2.086
  126   2HG   GLU  17          3HG       GLU  17  -8.257   3.058  -2.433
  127    H    ALA  18           H        ALA  18  -6.839   0.912  -2.621
  128    HA   ALA  18           HA       ALA  18  -8.246  -0.739  -0.816
  129   1HB   ALA  18          1HB       ALA  18  -8.031  -2.458  -2.524
  130   2HB   ALA  18          2HB       ALA  18  -8.357  -0.890  -3.287
  131   3HB   ALA  18          3HB       ALA  18  -6.717  -1.575  -3.316
  132    H    VAL  19           H        VAL  19  -4.724  -0.653  -1.675
  133    HA   VAL  19           HA       VAL  19  -4.202  -3.067  -0.199
  134    HB   VAL  19           HB       VAL  19  -2.694  -1.889  -2.032
  135   1HG1  VAL  19          1HG1      VAL  19  -2.005   0.077  -0.541
  136   2HG1  VAL  19          2HG1      VAL  19  -1.278  -1.094   0.573
  137   3HG1  VAL  19          3HG1      VAL  19  -0.665  -0.938  -1.076
  138   1HG2  VAL  19          1HG2      VAL  19  -0.918  -3.383  -1.175
  139   2HG2  VAL  19          2HG2      VAL  19  -1.744  -3.510   0.375
  140   3HG2  VAL  19          3HG2      VAL  19  -2.490  -4.168  -1.100
  141    H    THR  20           H        THR  20  -4.220   0.408   0.538
  142    HA   THR  20           HA       THR  20  -3.240   0.248   3.221
  143    HB   THR  20           HB       THR  20  -4.940   2.201   1.704
  144    HG1  THR  20           1HG      THR  20  -2.650   2.201   1.791
  145   1HG2  THR  20          1HG2      THR  20  -6.241   2.205   3.702
  146   2HG2  THR  20          2HG2      THR  20  -4.783   2.159   4.714
  147   3HG2  THR  20          3HG2      THR  20  -5.158   3.599   3.729
  148    H    LYS  21           H        LYS  21  -6.673  -0.032   2.033
  149    HA   LYS  21           HA       LYS  21  -7.687  -0.667   4.618
  150   1HB   LYS  21          2HB       LYS  21  -8.810  -1.716   1.991
  151   2HB   LYS  21          3HB       LYS  21  -9.624  -1.573   3.555
  152   1HG   LYS  21          2HG       LYS  21  -8.814   1.009   3.215
  153   2HG   LYS  21          3HG       LYS  21  -8.961   0.486   1.520
  154   1HD   LYS  21          2HD       LYS  21 -11.306  -0.422   2.213
  155   2HD   LYS  21          3HD       LYS  21 -11.101   0.499   3.707
  156   1HE   LYS  21          2HE       LYS  21 -11.461   1.451   0.856
  157   2HE   LYS  21          3HE       LYS  21 -12.377   1.941   2.289
  158   1HZ   LYS  21          1HZ       LYS  21 -10.748   3.604   1.367
  159   2HZ   LYS  21          2HZ       LYS  21 -10.355   3.215   2.953
  160   3HZ   LYS  21          3HZ       LYS  21  -9.611   2.575   1.582
  161    H    ALA  22           H        ALA  22  -6.439  -2.820   2.049
  162    HA   ALA  22           HA       ALA  22  -7.098  -5.268   3.263
  163   1HB   ALA  22          1HB       ALA  22  -5.363  -6.253   1.871
  164   2HB   ALA  22          2HB       ALA  22  -6.339  -5.085   0.945
  165   3HB   ALA  22          3HB       ALA  22  -4.705  -4.646   1.507
  166    H    VAL  23           H        VAL  23  -4.001  -3.498   3.337
  167    HA   VAL  23           HA       VAL  23  -2.608  -5.229   5.092
  168    HB   VAL  23           HB       VAL  23  -2.246  -2.293   4.373
  169   1HG1  VAL  23          1HG1      VAL  23   0.135  -2.641   5.090
  170   2HG1  VAL  23          2HG1      VAL  23  -0.994  -2.679   6.460
  171   3HG1  VAL  23          3HG1      VAL  23  -0.329  -4.196   5.800
  172   1HG2  VAL  23          1HG2      VAL  23  -0.669  -4.749   3.485
  173   2HG2  VAL  23          2HG2      VAL  23  -2.033  -4.117   2.555
  174   3HG2  VAL  23          3HG2      VAL  23  -0.605  -3.107   2.813
  175    H    GLN  24           H        GLN  24  -4.567  -2.247   5.725
  176    HA   GLN  24           HA       GLN  24  -4.196  -2.149   8.512
  177   1HB   GLN  24          2HB       GLN  24  -6.552  -1.405   6.762
  178   2HB   GLN  24          3HB       GLN  24  -6.496  -1.049   8.486
  179   1HG   GLN  24          2HG       GLN  24  -4.123  -0.179   6.831
  180   2HG   GLN  24          3HG       GLN  24  -5.638   0.683   6.618
  181   1HE2  GLN  24          1HE2      GLN  24  -2.826   0.624   8.449
  182   2HE2  GLN  24          2HE2      GLN  24  -3.399   1.663   9.743
  183    H    ASN  25           H        ASN  25  -5.977  -4.665   6.701
  184    HA   ASN  25           HA       ASN  25  -7.670  -5.428   8.927
  185   1HB   ASN  25          2HB       ASN  25  -6.402  -7.204   6.794
  186   2HB   ASN  25          3HB       ASN  25  -7.621  -7.697   7.956
  187   1HD2  ASN  25          1HD2      ASN  25  -7.274  -6.813   4.837
  188   2HD2  ASN  25          2HD2      ASN  25  -8.933  -6.289   4.525
  189    H    GLU  26           H        GLU  26  -4.401  -6.469   7.872
  190    HA   GLU  26           HA       GLU  26  -3.984  -8.116  10.240
  191   1HB   GLU  26          2HB       GLU  26  -2.023  -7.273   8.055
  192   2HB   GLU  26          3HB       GLU  26  -1.821  -8.565   9.247
  193   1HG   GLU  26          2HG       GLU  26  -3.882  -9.681   8.280
  194   2HG   GLU  26          3HG       GLU  26  -3.893  -8.455   6.997
  195    H    ASP  27           H        ASP  27  -2.416  -5.199   8.878
  196    HA   ASP  27           HA       ASP  27  -1.045  -4.690  11.416
  197   1HB   ASP  27          2HB       ASP  27   0.023  -4.457   9.088
  198   2HB   ASP  27          3HB       ASP  27  -0.905  -2.973   8.908
  199    H    ALA  28           H        ALA  28  -3.243  -4.538  12.361
  200    HA   ALA  28           HA       ALA  28  -5.054  -2.410  11.716
  201   1HB   ALA  28          1HB       ALA  28  -4.776  -4.053  14.265
  202   2HB   ALA  28          2HB       ALA  28  -6.195  -3.094  13.785
  203   3HB   ALA  28          3HB       ALA  28  -5.712  -4.509  12.822
  204    H    GLN  29           H        GLN  29  -2.052  -2.312  13.259
  205    HA   GLN  29           HA       GLN  29  -2.657   0.164  14.792
  206   1HB   GLN  29          2HB       GLN  29  -0.446  -0.400  15.849
  207   2HB   GLN  29          3HB       GLN  29  -1.783  -1.479  16.244
  208   1HG   GLN  29          2HG       GLN  29  -0.908  -3.250  14.957
  209   2HG   GLN  29          3HG       GLN  29   0.094  -2.163  13.983
  210   1HE2  GLN  29          1HE2      GLN  29   2.206  -2.010  14.473
  211   2HE2  GLN  29          2HE2      GLN  29   2.913  -2.484  16.014
  212    H    ALA  30           H        ALA  30  -1.743  -0.556  11.666
  213    HA   ALA  30           HA       ALA  30   0.602   1.189  11.546
  214   1HB   ALA  30          1HB       ALA  30  -1.144  -0.144   9.456
  215   2HB   ALA  30          2HB       ALA  30   0.132   1.017   9.030
  216   3HB   ALA  30          3HB       ALA  30   0.547  -0.456   9.891
  217    H    THR  31           H        THR  31   0.736   3.162  10.449
  218    HA   THR  31           HA       THR  31  -1.788   4.743  10.119
  219    HB   THR  31           HB       THR  31   1.038   5.588  10.839
  220    HG1  THR  31           1HG      THR  31  -0.475   4.790  12.447
  221   1HG2  THR  31          1HG2      THR  31  -1.391   7.324  10.192
  222   2HG2  THR  31          2HG2      THR  31   0.119   7.903  10.921
  223   3HG2  THR  31          3HG2      THR  31   0.132   7.270   9.269
  224    H    VAL  32           H        VAL  32  -2.003   5.775   8.094
  225    HA   VAL  32           HA       VAL  32  -0.213   4.774   5.932
  226    HB   VAL  32           HB       VAL  32  -2.277   4.273   4.665
  227   1HG1  VAL  32          1HG1      VAL  32  -2.152   2.770   7.315
  228   2HG1  VAL  32          2HG1      VAL  32  -2.743   2.157   5.763
  229   3HG1  VAL  32          3HG1      VAL  32  -1.026   2.526   5.969
  230   1HG2  VAL  32          1HG2      VAL  32  -3.924   5.699   5.819
  231   2HG2  VAL  32          2HG2      VAL  32  -4.428   4.015   5.914
  232   3HG2  VAL  32          3HG2      VAL  32  -3.717   4.776   7.326
  233    H    GLN  33           H        GLN  33   0.208   6.268   4.316
  234    HA   GLN  33           HA       GLN  33  -1.445   8.736   4.110
  235   1HB   GLN  33          2HB       GLN  33   1.441   8.412   4.908
  236   2HB   GLN  33          3HB       GLN  33   1.065   9.737   3.801
  237   1HG   GLN  33          2HG       GLN  33  -0.443   9.386   6.418
  238   2HG   GLN  33          3HG       GLN  33   1.125  10.192   6.324
  239   1HE2  GLN  33          1HE2      GLN  33   0.539  12.338   6.722
  240   2HE2  GLN  33          2HE2      GLN  33  -0.549  13.215   5.661
  241    H    VAL  34           H        VAL  34  -2.270   8.176   2.100
  242    HA   VAL  34           HA       VAL  34  -0.335   7.349  -0.018
  243    HB   VAL  34           HB       VAL  34  -1.855   5.586   0.455
  244   1HG1  VAL  34          1HG1      VAL  34  -4.265   5.716   0.138
  245   2HG1  VAL  34          2HG1      VAL  34  -3.749   6.753   1.472
  246   3HG1  VAL  34          3HG1      VAL  34  -4.176   7.467  -0.093
  247   1HG2  VAL  34          1HG2      VAL  34  -2.736   5.222  -1.774
  248   2HG2  VAL  34          2HG2      VAL  34  -2.664   6.956  -2.142
  249   3HG2  VAL  34          3HG2      VAL  34  -1.166   6.037  -1.895
  250    H    ASP  35           H        ASP  35   0.102   8.838  -1.531
  251    HA   ASP  35           HA       ASP  35  -1.519  11.323  -1.464
  252   1HB   ASP  35          2HB       ASP  35   1.017  11.210  -1.098
  253   2HB   ASP  35          3HB       ASP  35   1.107  10.797  -2.817
  254    H    LEU  36           H        LEU  36  -3.255  10.058  -2.577
  255    HA   LEU  36           HA       LEU  36  -3.071   8.889  -5.124
  256   1HB   LEU  36          2HB       LEU  36  -5.405  10.407  -3.875
  257   2HB   LEU  36          3HB       LEU  36  -5.483   9.573  -5.421
  258    HG   LEU  36           HG       LEU  36  -4.425   7.585  -3.793
  259   1HD1  LEU  36          1HD1      LEU  36  -6.622   9.041  -2.250
  260   2HD1  LEU  36          2HD1      LEU  36  -5.880   7.487  -1.821
  261   3HD1  LEU  36          3HD1      LEU  36  -4.916   8.978  -1.772
  262   1HD2  LEU  36          1HD2      LEU  36  -6.663   6.563  -3.991
  263   2HD2  LEU  36          2HD2      LEU  36  -7.342   8.128  -4.487
  264   3HD2  LEU  36          3HD2      LEU  36  -6.156   7.301  -5.521
  265    H    THR  37           H        THR  37  -3.041  12.319  -4.334
  266    HA   THR  37           HA       THR  37  -3.389  13.737  -6.570
  267    HB   THR  37           HB       THR  37  -0.818  13.791  -4.955
  268    HG1  THR  37           1HG      THR  37  -1.889  14.033  -3.221
  269   1HG2  THR  37          1HG2      THR  37  -2.689  16.026  -5.846
  270   2HG2  THR  37          2HG2      THR  37  -1.163  16.209  -4.954
  271   3HG2  THR  37          3HG2      THR  37  -1.142  15.604  -6.624
  272    H    SER  38           H        SER  38  -0.696  11.437  -5.980
  273    HA   SER  38           HA       SER  38   0.019  11.539  -8.861
  274   1HB   SER  38          2HB       SER  38   2.021  11.864  -6.595
  275   2HB   SER  38          3HB       SER  38   2.393  11.731  -8.340
  276    HG   SER  38           HG       SER  38   2.310  13.911  -7.700
  277    H    LYS  39           H        LYS  39   2.308   9.825  -6.968
  278    HA   LYS  39           HA       LYS  39   0.985   7.236  -7.208
  279   1HB   LYS  39          2HB       LYS  39   2.579   6.444  -8.991
  280   2HB   LYS  39          3HB       LYS  39   1.313   7.555  -9.500
  281   1HG   LYS  39          2HG       LYS  39   3.130   9.425  -9.226
  282   2HG   LYS  39          3HG       LYS  39   4.287   8.104  -9.241
  283   1HD   LYS  39          2HD       LYS  39   2.165   8.692 -11.391
  284   2HD   LYS  39          3HD       LYS  39   3.813   9.297 -11.416
  285   1HE   LYS  39          2HE       LYS  39   4.426   7.531 -12.581
  286   2HE   LYS  39          3HE       LYS  39   4.270   6.581 -11.117
  287   1HZ   LYS  39          1HZ       LYS  39   3.076   5.707 -13.081
  288   2HZ   LYS  39          2HZ       LYS  39   2.025   5.935 -11.881
  289   3HZ   LYS  39          3HZ       LYS  39   2.108   7.023 -13.116
  290    H    LYS  40           H        LYS  40   1.785   8.188  -4.955
  291    HA   LYS  40           HA       LYS  40   4.243   6.740  -4.189
  292   1HB   LYS  40          2HB       LYS  40   5.040   8.731  -2.966
  293   2HB   LYS  40          3HB       LYS  40   4.935   9.025  -4.710
  294   1HG   LYS  40          2HG       LYS  40   2.499   9.880  -4.132
  295   2HG   LYS  40          3HG       LYS  40   3.113  10.014  -2.490
  296   1HD   LYS  40          2HD       LYS  40   4.501  11.299  -4.891
  297   2HD   LYS  40          3HD       LYS  40   3.012  11.956  -4.224
  298   1HE   LYS  40          2HE       LYS  40   4.489  11.670  -1.903
  299   2HE   LYS  40          3HE       LYS  40   5.763  12.058  -3.069
  300   1HZ   LYS  40          1HZ       LYS  40   4.740  14.011  -2.016
  301   2HZ   LYS  40          2HZ       LYS  40   4.446  14.035  -3.641
  302   3HZ   LYS  40          3HZ       LYS  40   3.266  13.572  -2.603
  303    H    VAL  41           H        VAL  41   4.113   5.943  -2.035
  304    HA   VAL  41           HA       VAL  41   1.708   6.582  -0.464
  305    HB   VAL  41           HB       VAL  41   0.937   4.815  -1.926
  306   1HG1  VAL  41          1HG1      VAL  41   3.102   3.775  -2.572
  307   2HG1  VAL  41          2HG1      VAL  41   3.241   3.088  -0.938
  308   3HG1  VAL  41          3HG1      VAL  41   1.924   2.585  -2.007
  309   1HG2  VAL  41          1HG2      VAL  41   0.184   3.219  -0.281
  310   2HG2  VAL  41          2HG2      VAL  41   1.540   3.593   0.797
  311   3HG2  VAL  41          3HG2      VAL  41   0.283   4.806   0.508
  312    H    THR  42           H        THR  42   2.088   6.524   1.682
  313    HA   THR  42           HA       THR  42   4.771   5.621   2.602
  314    HB   THR  42           HB       THR  42   3.035   7.965   3.467
  315    HG1  THR  42           1HG      THR  42   4.491   9.203   2.433
  316   1HG2  THR  42          1HG2      THR  42   4.316   7.163   5.382
  317   2HG2  THR  42          2HG2      THR  42   5.788   7.041   4.402
  318   3HG2  THR  42          3HG2      THR  42   5.088   8.632   4.768
  319    H    ILE  43           H        ILE  43   4.428   3.775   3.772
  320    HA   ILE  43           HA       ILE  43   1.982   3.584   5.512
  321    HB   ILE  43           HB       ILE  43   3.861   1.438   4.540
  322   1HG1  ILE  43          2HG1      ILE  43   2.487   2.414   2.684
  323   2HG1  ILE  43          3HG1      ILE  43   2.116   0.744   3.021
  324   1HG2  ILE  43          1HG2      ILE  43   2.930   0.778   6.646
  325   2HG2  ILE  43          2HG2      ILE  43   1.305   1.311   6.184
  326   3HG2  ILE  43          3HG2      ILE  43   2.044  -0.097   5.392
  327   1HD1  ILE  43          1HD1      ILE  43   0.419   3.088   3.950
  328   2HD1  ILE  43          2HD1      ILE  43   0.095   2.030   2.571
  329   3HD1  ILE  43          3HD1      ILE  43   0.064   1.357   4.203
  330    H    THR  44           H        THR  44   2.377   4.290   7.503
  331    HA   THR  44           HA       THR  44   5.134   4.206   8.597
  332    HB   THR  44           HB       THR  44   2.658   5.706   9.441
  333    HG1  THR  44           1HG      THR  44   3.655   6.369   7.516
  334   1HG2  THR  44          1HG2      THR  44   4.105   5.252  11.404
  335   2HG2  THR  44          2HG2      THR  44   5.527   5.813  10.491
  336   3HG2  THR  44          3HG2      THR  44   4.231   6.952  10.916
  337    H    SER  45           H        SER  45   5.449   2.156   9.271
  338    HA   SER  45           HA       SER  45   3.763   1.084  11.452
  339   1HB   SER  45          2HB       SER  45   3.374  -1.041  10.329
  340   2HB   SER  45          3HB       SER  45   2.765   0.222   9.264
  341    HG   SER  45           HG       SER  45   4.742   0.121   8.123
  342    H    ALA  46           H        ALA  46   4.898  -1.359  11.760
  343    HA   ALA  46           HA       ALA  46   7.868  -0.961  11.797
  344   1HB   ALA  46          1HB       ALA  46   7.896  -2.782  13.413
  345   2HB   ALA  46          2HB       ALA  46   6.860  -1.455  13.977
  346   3HB   ALA  46          3HB       ALA  46   6.128  -2.936  13.314
  347    H    LEU  47           H        LEU  47   5.226  -2.907  10.452
  348    HA   LEU  47           HA       LEU  47   7.177  -4.893   9.325
  349   1HB   LEU  47          2HB       LEU  47   5.429  -6.565   9.629
  350   2HB   LEU  47          3HB       LEU  47   5.996  -5.839  11.127
  351    HG   LEU  47           HG       LEU  47   3.896  -4.351  11.110
  352   1HD1  LEU  47          1HD1      LEU  47   3.145  -6.351   8.947
  353   2HD1  LEU  47          2HD1      LEU  47   1.967  -5.401   9.854
  354   3HD1  LEU  47          3HD1      LEU  47   3.121  -4.579   8.801
  355   1HD2  LEU  47          1HD2      LEU  47   3.551  -7.366  11.284
  356   2HD2  LEU  47          2HD2      LEU  47   4.180  -6.315  12.574
  357   3HD2  LEU  47          3HD2      LEU  47   2.504  -6.139  12.030
  358    H    GLY  48           H        GLY  48   5.471  -2.302   8.378
  359   1HA   GLY  48          2HA       GLY  48   3.716  -2.863   6.446
  360   2HA   GLY  48          3HA       GLY  48   4.895  -1.544   6.323
  361    H    GLU  49           H        GLU  49   7.305  -2.804   5.920
  362    HA   GLU  49           HA       GLU  49   7.318  -3.139   3.204
  363   1HB   GLU  49          2HB       GLU  49   9.227  -2.756   4.848
  364   2HB   GLU  49          3HB       GLU  49   9.301  -4.507   5.072
  365   1HG   GLU  49          2HG       GLU  49   9.650  -4.745   2.586
  366   2HG   GLU  49          3HG       GLU  49   9.610  -2.975   2.444
  367    H    GLU  50           H        GLU  50   7.439  -5.871   5.546
  368    HA   GLU  50           HA       GLU  50   7.273  -7.996   3.651
  369   1HB   GLU  50          2HB       GLU  50   6.671  -7.693   6.625
  370   2HB   GLU  50          3HB       GLU  50   6.300  -9.192   5.790
  371   1HG   GLU  50          2HG       GLU  50   8.635  -9.426   5.055
  372   2HG   GLU  50          3HG       GLU  50   9.062  -7.914   5.883
  373    H    GLN  51           H        GLN  51   4.725  -6.447   5.690
  374    HA   GLN  51           HA       GLN  51   2.674  -8.101   4.810
  375   1HB   GLN  51          2HB       GLN  51   3.062  -5.987   6.670
  376   2HB   GLN  51          3HB       GLN  51   1.884  -5.338   5.560
  377   1HG   GLN  51          2HG       GLN  51   0.844  -6.529   7.445
  378   2HG   GLN  51          3HG       GLN  51   0.481  -7.341   5.904
  379   1HE2  GLN  51          1HE2      GLN  51   0.106  -9.420   6.772
  380   2HE2  GLN  51          2HE2      GLN  51   1.387 -10.366   7.533
  381    H    LEU  52           H        LEU  52   3.580  -4.857   3.674
  382    HA   LEU  52           HA       LEU  52   1.775  -4.566   1.557
  383   1HB   LEU  52          2HB       LEU  52   4.648  -3.631   1.940
  384   2HB   LEU  52          3HB       LEU  52   3.649  -3.064   0.622
  385    HG   LEU  52           HG       LEU  52   2.693  -2.798   3.479
  386   1HD1  LEU  52          1HD1      LEU  52   4.135  -0.583   1.989
  387   2HD1  LEU  52          2HD1      LEU  52   3.721  -0.712   3.715
  388   3HD1  LEU  52          3HD1      LEU  52   5.002  -1.711   3.041
  389   1HD2  LEU  52          1HD2      LEU  52   2.056  -1.072   1.049
  390   2HD2  LEU  52          2HD2      LEU  52   1.122  -2.514   1.432
  391   3HD2  LEU  52          3HD2      LEU  52   1.173  -1.189   2.590
  392    H    ARG  53           H        ARG  53   5.100  -6.019   1.515
  393    HA   ARG  53           HA       ARG  53   5.115  -6.514  -1.232
  394   1HB   ARG  53          2HB       ARG  53   6.863  -7.115   0.823
  395   2HB   ARG  53          3HB       ARG  53   6.240  -8.711   0.449
  396   1HG   ARG  53          2HG       ARG  53   8.167  -8.439  -0.890
  397   2HG   ARG  53          3HG       ARG  53   6.818  -8.181  -2.011
  398   1HD   ARG  53          2HD       ARG  53   7.121  -5.679  -1.654
  399   2HD   ARG  53          3HD       ARG  53   8.536  -6.045  -0.647
  400    HE   ARG  53           HE       ARG  53   8.970  -7.382  -3.045
  401   1HH1  ARG  53          2HH2      ARG  53   8.711  -3.881  -2.154
  402   2HH1  ARG  53          1HH2      ARG  53   9.543  -3.437  -3.656
  403   1HH2  ARG  53          2HH1      ARG  53  10.043  -6.555  -4.970
  404   2HH2  ARG  53          1HH1      ARG  53  10.229  -4.807  -5.080
  405    H    THR  54           H        THR  54   3.675  -8.508   1.344
  406    HA   THR  54           HA       THR  54   2.741 -10.527  -0.480
  407    HB   THR  54           HB       THR  54   1.735  -9.921   2.343
  408    HG1  THR  54           1HG      THR  54   3.948 -10.155   2.423
  409   1HG2  THR  54          1HG2      THR  54   1.309 -12.366   2.375
  410   2HG2  THR  54          2HG2      THR  54   0.348 -11.562   1.123
  411   3HG2  THR  54          3HG2      THR  54   1.802 -12.479   0.673
  412    H    ALA  55           H        ALA  55   1.021  -7.941   1.297
  413    HA   ALA  55           HA       ALA  55  -1.566  -8.486   0.340
  414   1HB   ALA  55          1HB       ALA  55  -1.095  -7.183   2.376
  415   2HB   ALA  55          2HB       ALA  55  -0.393  -5.881   1.389
  416   3HB   ALA  55          3HB       ALA  55  -2.125  -6.266   1.261
  417    H    ILE  56           H        ILE  56   0.787  -5.973  -0.723
  418    HA   ILE  56           HA       ILE  56  -0.699  -4.978  -2.922
  419    HB   ILE  56           HB       ILE  56   2.317  -5.373  -2.841
  420   1HG1  ILE  56          2HG1      ILE  56   0.847  -2.767  -2.270
  421   2HG1  ILE  56          3HG1      ILE  56   1.292  -3.860  -0.951
  422   1HG2  ILE  56          1HG2      ILE  56   1.330  -4.958  -5.115
  423   2HG2  ILE  56          2HG2      ILE  56   0.522  -3.520  -4.454
  424   3HG2  ILE  56          3HG2      ILE  56   2.299  -3.618  -4.565
  425   1HD1  ILE  56          1HD1      ILE  56   3.673  -3.686  -1.627
  426   2HD1  ILE  56          2HD1      ILE  56   3.212  -2.556  -2.905
  427   3HD1  ILE  56          3HD1      ILE  56   2.948  -2.102  -1.234
  428    H    ALA  57           H        ALA  57   1.670  -7.765  -2.859
  429    HA   ALA  57           HA       ALA  57   1.315  -8.444  -5.566
  430   1HB   ALA  57          1HB       ALA  57   1.933 -10.303  -3.230
  431   2HB   ALA  57          2HB       ALA  57   2.148 -10.676  -4.949
  432   3HB   ALA  57          3HB       ALA  57   3.109  -9.387  -4.200
  433    H    SER  58           H        SER  58  -0.617  -9.416  -2.723
  434    HA   SER  58           HA       SER  58  -2.335 -11.233  -4.011
  435   1HB   SER  58          2HB       SER  58  -2.177 -10.724  -1.513
  436   2HB   SER  58          3HB       SER  58  -3.234  -9.329  -1.821
  437    HG   SER  58           HG       SER  58  -4.663 -10.940  -2.862
  438    H    ALA  59           H        ALA  59  -2.338  -7.679  -4.149
  439    HA   ALA  59           HA       ALA  59  -4.948  -7.601  -5.565
  440   1HB   ALA  59          1HB       ALA  59  -2.968  -5.412  -4.834
  441   2HB   ALA  59          2HB       ALA  59  -4.559  -5.177  -5.590
  442   3HB   ALA  59          3HB       ALA  59  -4.446  -5.838  -3.946
  443    H    GLY  60           H        GLY  60  -1.472  -7.263  -6.176
  444   1HA   GLY  60          2HA       GLY  60  -0.325  -7.712  -8.137
  445   2HA   GLY  60          3HA       GLY  60  -1.836  -7.771  -9.049
  446    H    HIS  61           H        HIS  61   0.190  -5.428  -7.197
  447    HA   HIS  61           HA       HIS  61   0.034  -3.570  -9.533
  448   1HB   HIS  61          2HB       HIS  61   0.109  -2.820  -6.598
  449   2HB   HIS  61          3HB       HIS  61   0.439  -1.703  -7.925
  450    HD1  HIS  61           1HD      HIS  61  -1.701  -0.637  -9.141
  451    HD2  HIS  61           2HD      HIS  61  -2.386  -3.454  -6.079
  452    HE1  HIS  61           1HE      HIS  61  -4.092  -0.310  -8.366
  453    H    GLU  62           H        GLU  62   1.965  -2.761 -10.160
  454    HA   GLU  62           HA       GLU  62   4.385  -4.191  -9.491
  455   1HB   GLU  62          2HB       GLU  62   3.835  -1.854 -11.369
  456   2HB   GLU  62          3HB       GLU  62   5.250  -2.901 -11.412
  457   1HG   GLU  62          2HG       GLU  62   3.953  -4.780 -12.170
  458   2HG   GLU  62          3HG       GLU  62   2.413  -3.953 -11.901
  459    H    VAL  63           H        VAL  63   3.791  -3.011  -7.219
  460    HA   VAL  63           HA       VAL  63   4.726  -0.241  -7.027
  461    HB   VAL  63           HB       VAL  63   4.139  -2.251  -4.841
  462   1HG1  VAL  63          1HG1      VAL  63   3.706  -0.282  -3.402
  463   2HG1  VAL  63          2HG1      VAL  63   5.364  -0.273  -4.002
  464   3HG1  VAL  63          3HG1      VAL  63   4.144   0.796  -4.728
  465   1HG2  VAL  63          1HG2      VAL  63   2.306  -0.275  -6.254
  466   2HG2  VAL  63          2HG2      VAL  63   2.157  -2.029  -6.214
  467   3HG2  VAL  63          3HG2      VAL  63   1.875  -1.096  -4.738
  468    H    GLU  64           H        GLU  64   6.715   0.500  -6.111
  469    HA   GLU  64           HA       GLU  64   8.551  -1.498  -5.035
  470   1HB   GLU  64          2HB       GLU  64   8.981  -0.998  -7.629
  471   2HB   GLU  64          3HB       GLU  64   9.603   0.544  -7.014
  472   1HG   GLU  64          2HG       GLU  64  11.440  -1.026  -7.282
  473   2HG   GLU  64          3HG       GLU  64  11.185  -0.769  -5.549
  Start of MODEL    3
    1   1H    MET   1           H1       MET   1  11.465   3.715   9.484
    2   2H    MET   1           H2       MET   1  11.688   2.533  10.616
    3   3H    MET   1           H3       MET   1  10.940   2.190   9.187
    4    HA   MET   1           HA       MET   1   9.361   2.253  10.885
    5   1HB   MET   1          2HB       MET   1  10.818   4.713  11.675
    6   2HB   MET   1          3HB       MET   1   9.084   4.992  11.525
    7   1HG   MET   1          2HG       MET   1   9.135   4.322  13.692
    8   2HG   MET   1          3HG       MET   1   8.845   2.774  12.925
    9   1HE   MET   1          1HE       MET   1  11.079   1.115  15.415
   10   2HE   MET   1          2HE       MET   1   9.464   1.858  15.327
   11   3HE   MET   1          3HE       MET   1  10.027   0.779  14.023
   12    H    THR   2           H        THR   2   9.866   5.368   9.074
   13    HA   THR   2           HA       THR   2   7.268   5.010   7.781
   14    HB   THR   2           HB       THR   2   8.055   7.226   8.378
   15    HG1  THR   2           1HG      THR   2   7.848   6.909   5.578
   16   1HG2  THR   2          1HG2      THR   2  10.510   7.010   7.910
   17   2HG2  THR   2          2HG2      THR   2  10.148   6.957   6.171
   18   3HG2  THR   2          3HG2      THR   2   9.758   8.401   7.115
   19    H    ILE   3           H        ILE   3   6.972   3.872   5.992
   20    HA   ILE   3           HA       ILE   3   9.226   2.861   4.319
   21    HB   ILE   3           HB       ILE   3   6.384   1.921   4.931
   22   1HG1  ILE   3          2HG1      ILE   3   7.448  -0.254   5.296
   23   2HG1  ILE   3          3HG1      ILE   3   9.045   0.434   4.965
   24   1HG2  ILE   3          1HG2      ILE   3   8.136   1.018   2.638
   25   2HG2  ILE   3          2HG2      ILE   3   6.669   0.183   3.186
   26   3HG2  ILE   3          3HG2      ILE   3   6.532   1.807   2.524
   27   1HD1  ILE   3          1HD1      ILE   3   8.448   0.084   7.404
   28   2HD1  ILE   3          2HD1      ILE   3   8.953   1.726   7.008
   29   3HD1  ILE   3          3HD1      ILE   3   7.218   1.351   7.224
   30    H    GLN   4           H        GLN   4   9.225   3.632   2.173
   31    HA   GLN   4           HA       GLN   4   6.924   5.276   1.235
   32   1HB   GLN   4          2HB       GLN   4   9.761   6.091   1.579
   33   2HB   GLN   4          3HB       GLN   4   9.094   6.411  -0.029
   34   1HG   GLN   4          2HG       GLN   4   7.234   7.653   0.870
   35   2HG   GLN   4          3HG       GLN   4   7.670   7.210   2.522
   36   1HE2  GLN   4          1HE2      GLN   4   8.968   8.915  -0.387
   37   2HE2  GLN   4          2HE2      GLN   4   9.890  10.087   0.543
   38    H    LEU   5           H        LEU   5   6.043   4.133  -0.332
   39    HA   LEU   5           HA       LEU   5   7.745   2.650  -2.300
   40   1HB   LEU   5          2HB       LEU   5   5.228   2.014  -0.792
   41   2HB   LEU   5          3HB       LEU   5   5.263   1.544  -2.491
   42    HG   LEU   5           HG       LEU   5   7.069   0.089  -2.179
   43   1HD1  LEU   5          1HD1      LEU   5   7.481   1.390   0.507
   44   2HD1  LEU   5          2HD1      LEU   5   8.152  -0.212   0.133
   45   3HD1  LEU   5          3HD1      LEU   5   8.655   1.189  -0.809
   46   1HD2  LEU   5          1HD2      LEU   5   6.196  -1.445  -0.426
   47   2HD2  LEU   5          2HD2      LEU   5   5.246  -0.103   0.253
   48   3HD2  LEU   5          3HD2      LEU   5   4.880  -0.725  -1.373
   49    H    THR   6           H        THR   6   6.880   2.580  -4.419
   50    HA   THR   6           HA       THR   6   5.266   4.959  -5.245
   51    HB   THR   6           HB       THR   6   7.817   3.765  -6.386
   52    HG1  THR   6           1HG      THR   6   8.650   5.688  -5.772
   53   1HG2  THR   6          1HG2      THR   6   6.430   4.358  -8.304
   54   2HG2  THR   6          2HG2      THR   6   5.974   5.905  -7.553
   55   3HG2  THR   6          3HG2      THR   6   7.645   5.620  -8.087
   56    H    VAL   7           H        VAL   7   3.536   4.431  -6.389
   57    HA   VAL   7           HA       VAL   7   3.189   1.653  -7.504
   58    HB   VAL   7           HB       VAL   7   1.944   1.768  -5.559
   59   1HG1  VAL   7          1HG1      VAL   7   1.859   4.118  -5.006
   60   2HG1  VAL   7          2HG1      VAL   7   0.772   4.445  -6.368
   61   3HG1  VAL   7          3HG1      VAL   7   0.235   3.437  -5.012
   62   1HG2  VAL   7          1HG2      VAL   7  -0.181   1.201  -6.271
   63   2HG2  VAL   7          2HG2      VAL   7  -0.152   2.364  -7.594
   64   3HG2  VAL   7          3HG2      VAL   7   0.833   0.898  -7.695
   65    HA   PRO   8           HA       PRO   8   2.959   4.788 -10.787
   66   1HB   PRO   8          2HB       PRO   8   4.061   3.344 -12.850
   67   2HB   PRO   8          3HB       PRO   8   5.049   4.162 -11.602
   68   1HG   PRO   8          2HG       PRO   8   4.219   1.253 -11.673
   69   2HG   PRO   8          3HG       PRO   8   5.845   1.923 -11.365
   70   1HD   PRO   8          2HD       PRO   8   4.169   1.169  -9.366
   71   2HD   PRO   8          3HD       PRO   8   5.262   2.563  -9.175
   72    H    THR   9           H        THR   9   1.905   1.453 -10.586
   73    HA   THR   9           HA       THR   9  -0.297   1.966 -12.491
   74    HB   THR   9           HB       THR   9   1.208   0.013 -12.682
   75    HG1  THR   9           1HG      THR   9  -0.608  -1.424 -13.030
   76   1HG2  THR   9          1HG2      THR   9  -0.149  -1.004 -10.177
   77   2HG2  THR   9          2HG2      THR   9   0.708  -1.976 -11.371
   78   3HG2  THR   9          3HG2      THR   9   1.584  -0.722 -10.449
   79    H    ILE  10           H        ILE  10  -0.244   3.375  -9.755
   80    HA   ILE  10           HA       ILE  10  -2.482   2.552  -8.431
   81    HB   ILE  10           HB       ILE  10  -0.960   4.939  -8.728
   82   1HG1  ILE  10          2HG1      ILE  10  -3.275   4.119  -7.025
   83   2HG1  ILE  10          3HG1      ILE  10  -1.568   3.917  -6.666
   84   1HG2  ILE  10          1HG2      ILE  10  -3.875   5.679  -9.087
   85   2HG2  ILE  10          2HG2      ILE  10  -2.474   6.758  -8.951
   86   3HG2  ILE  10          3HG2      ILE  10  -2.654   5.743 -10.383
   87   1HD1  ILE  10          1HD1      ILE  10  -2.368   5.727  -5.306
   88   2HD1  ILE  10          2HD1      ILE  10  -1.315   6.416  -6.556
   89   3HD1  ILE  10          3HD1      ILE  10  -3.086   6.555  -6.696
   90    H    ALA  11           H        ALA  11  -4.748   3.253  -8.635
   91    HA   ALA  11           HA       ALA  11  -6.751   3.049  -9.653
   92   1HB   ALA  11          1HB       ALA  11  -5.444   4.685 -11.862
   93   2HB   ALA  11          2HB       ALA  11  -7.176   4.551 -11.512
   94   3HB   ALA  11          3HB       ALA  11  -6.102   5.337 -10.344
   95    H    CYS  12           H        CYS  12  -4.734   0.936 -10.263
   96    HA   CYS  12           HA       CYS  12  -5.507  -0.046 -12.928
   97   1HB   CYS  12          2HB       CYS  12  -3.255  -0.370 -12.394
   98   2HB   CYS  12          3HB       CYS  12  -3.615  -0.940 -10.756
   99    HG   CYS  12           HG       CYS  12  -4.440  -2.363 -13.625
  100    H    GLU  13           H        GLU  13  -5.573  -1.541  -9.643
  101    HA   GLU  13           HA       GLU  13  -7.732  -3.301 -10.511
  102   1HB   GLU  13          2HB       GLU  13  -5.579  -3.813  -9.095
  103   2HB   GLU  13          3HB       GLU  13  -6.551  -3.335  -7.711
  104   1HG   GLU  13          2HG       GLU  13  -7.287  -5.468  -9.777
  105   2HG   GLU  13          3HG       GLU  13  -6.528  -5.779  -8.217
  106    H    ALA  14           H        ALA  14  -7.538  -1.689  -7.314
  107    HA   ALA  14           HA       ALA  14  -9.947  -0.052  -7.940
  108   1HB   ALA  14          1HB       ALA  14 -11.012  -0.758  -5.859
  109   2HB   ALA  14          2HB       ALA  14 -10.708  -2.172  -6.887
  110   3HB   ALA  14          3HB       ALA  14  -9.652  -1.849  -5.497
  111    H    CYS  15           H        CYS  15  -7.184   0.631  -7.837
  112    HA   CYS  15           HA       CYS  15  -5.892   2.261  -7.172
  113   1HB   CYS  15          2HB       CYS  15  -8.414   3.320  -6.397
  114   2HB   CYS  15          3HB       CYS  15  -7.351   3.556  -4.997
  115    HG   CYS  15           HG       CYS  15  -7.397   5.680  -6.491
  116    H    ALA  16           H        ALA  16  -4.329   2.742  -5.648
  117    HA   ALA  16           HA       ALA  16  -3.474   0.553  -4.140
  118   1HB   ALA  16          1HB       ALA  16  -1.974   2.306  -4.938
  119   2HB   ALA  16          2HB       ALA  16  -2.675   3.470  -3.786
  120   3HB   ALA  16          3HB       ALA  16  -1.771   2.057  -3.194
  121    H    GLU  17           H        GLU  17  -5.619   3.177  -3.093
  122    HA   GLU  17           HA       GLU  17  -5.357   2.837  -0.328
  123   1HB   GLU  17          2HB       GLU  17  -7.343   4.054  -0.091
  124   2HB   GLU  17          3HB       GLU  17  -6.501   4.685  -1.494
  125   1HG   GLU  17          2HG       GLU  17  -8.534   4.570  -2.476
  126   2HG   GLU  17          3HG       GLU  17  -8.158   2.866  -2.740
  127    H    ALA  18           H        ALA  18  -7.001   0.788  -2.726
  128    HA   ALA  18           HA       ALA  18  -8.479  -0.890  -1.008
  129   1HB   ALA  18          1HB       ALA  18  -8.511  -0.994  -3.487
  130   2HB   ALA  18          2HB       ALA  18  -6.871  -1.683  -3.476
  131   3HB   ALA  18          3HB       ALA  18  -8.215  -2.581  -2.747
  132    H    VAL  19           H        VAL  19  -4.938  -0.956  -1.841
  133    HA   VAL  19           HA       VAL  19  -4.551  -3.353  -0.291
  134    HB   VAL  19           HB       VAL  19  -2.947  -2.349  -2.144
  135   1HG1  VAL  19          1HG1      VAL  19  -0.922  -1.383  -1.209
  136   2HG1  VAL  19          2HG1      VAL  19  -2.220  -0.341  -0.668
  137   3HG1  VAL  19          3HG1      VAL  19  -1.512  -1.524   0.445
  138   1HG2  VAL  19          1HG2      VAL  19  -2.224  -3.906   0.388
  139   2HG2  VAL  19          2HG2      VAL  19  -2.832  -4.578  -1.141
  140   3HG2  VAL  19          3HG2      VAL  19  -1.230  -3.840  -1.058
  141    H    THR  20           H        THR  20  -4.345   0.143   0.328
  142    HA   THR  20           HA       THR  20  -3.171   0.044   2.922
  143    HB   THR  20           HB       THR  20  -5.201   1.953   1.695
  144    HG1  THR  20           1HG      THR  20  -3.042   1.822   0.866
  145   1HG2  THR  20          1HG2      THR  20  -4.479   3.513   3.503
  146   2HG2  THR  20          2HG2      THR  20  -5.628   2.247   3.969
  147   3HG2  THR  20          3HG2      THR  20  -3.918   2.069   4.391
  148    H    LYS  21           H        LYS  21  -6.618  -0.154   1.955
  149    HA   LYS  21           HA       LYS  21  -7.651  -0.572   4.583
  150   1HB   LYS  21          2HB       LYS  21  -8.761  -1.467   1.898
  151   2HB   LYS  21          3HB       LYS  21  -9.683  -1.332   3.399
  152   1HG   LYS  21          2HG       LYS  21  -8.204   1.150   2.608
  153   2HG   LYS  21          3HG       LYS  21  -9.416   0.629   1.456
  154   1HD   LYS  21          2HD       LYS  21 -11.162   0.727   3.115
  155   2HD   LYS  21          3HD       LYS  21  -9.986   0.943   4.437
  156   1HE   LYS  21          2HE       LYS  21  -9.263   3.117   3.429
  157   2HE   LYS  21          3HE       LYS  21 -10.441   2.907   2.124
  158   1HZ   LYS  21          1HZ       LYS  21 -11.234   4.353   3.843
  159   2HZ   LYS  21          2HZ       LYS  21 -12.186   3.018   3.739
  160   3HZ   LYS  21          3HZ       LYS  21 -11.107   3.169   4.981
  161    H    ALA  22           H        ALA  22  -6.584  -2.848   2.041
  162    HA   ALA  22           HA       ALA  22  -7.264  -5.248   3.388
  163   1HB   ALA  22          1HB       ALA  22  -5.624  -6.360   2.030
  164   2HB   ALA  22          2HB       ALA  22  -6.524  -5.182   1.041
  165   3HB   ALA  22          3HB       ALA  22  -4.864  -4.825   1.585
  166    H    VAL  23           H        VAL  23  -4.130  -3.541   3.361
  167    HA   VAL  23           HA       VAL  23  -2.676  -5.217   5.086
  168    HB   VAL  23           HB       VAL  23  -2.433  -2.262   4.414
  169   1HG1  VAL  23          1HG1      VAL  23  -0.017  -2.525   5.037
  170   2HG1  VAL  23          2HG1      VAL  23  -1.099  -2.637   6.440
  171   3HG1  VAL  23          3HG1      VAL  23  -0.392  -4.110   5.733
  172   1HG2  VAL  23          1HG2      VAL  23  -1.128  -2.869   2.625
  173   2HG2  VAL  23          2HG2      VAL  23  -0.581  -4.390   3.358
  174   3HG2  VAL  23          3HG2      VAL  23  -2.187  -4.281   2.643
  175    H    GLN  24           H        GLN  24  -4.700  -2.327   5.765
  176    HA   GLN  24           HA       GLN  24  -4.276  -2.152   8.539
  177   1HB   GLN  24          2HB       GLN  24  -6.738  -1.582   6.873
  178   2HB   GLN  24          3HB       GLN  24  -6.620  -1.174   8.578
  179   1HG   GLN  24          2HG       GLN  24  -4.359  -0.200   6.851
  180   2HG   GLN  24          3HG       GLN  24  -5.939   0.525   6.560
  181   1HE2  GLN  24          1HE2      GLN  24  -3.160   0.997   8.311
  182   2HE2  GLN  24          2HE2      GLN  24  -3.846   1.956   9.602
  183    H    ASN  25           H        ASN  25  -5.919  -4.840   6.870
  184    HA   ASN  25           HA       ASN  25  -7.430  -5.659   9.230
  185   1HB   ASN  25          2HB       ASN  25  -6.317  -7.334   6.936
  186   2HB   ASN  25          3HB       ASN  25  -7.298  -7.947   8.262
  187   1HD2  ASN  25          1HD2      ASN  25  -7.338  -5.994   5.374
  188   2HD2  ASN  25          2HD2      ASN  25  -9.094  -5.875   5.234
  189    H    GLU  26           H        GLU  26  -4.237  -6.624   7.894
  190    HA   GLU  26           HA       GLU  26  -3.582  -8.253  10.202
  191   1HB   GLU  26          2HB       GLU  26  -1.868  -7.252   7.880
  192   2HB   GLU  26          3HB       GLU  26  -1.399  -8.460   9.081
  193   1HG   GLU  26          2HG       GLU  26  -3.923  -9.342   8.065
  194   2HG   GLU  26          3HG       GLU  26  -3.003  -8.796   6.662
  195    H    ASP  27           H        ASP  27  -2.284  -5.176   8.878
  196    HA   ASP  27           HA       ASP  27  -0.804  -4.738  11.395
  197   1HB   ASP  27          2HB       ASP  27   0.188  -4.565   8.990
  198   2HB   ASP  27          3HB       ASP  27  -0.631  -3.020   8.886
  199    H    ALA  28           H        ALA  28  -3.060  -4.510  12.361
  200    HA   ALA  28           HA       ALA  28  -4.808  -2.394  11.502
  201   1HB   ALA  28          1HB       ALA  28  -5.625  -4.401  12.683
  202   2HB   ALA  28          2HB       ALA  28  -4.742  -3.908  14.149
  203   3HB   ALA  28          3HB       ALA  28  -6.085  -2.918  13.539
  204    H    GLN  29           H        GLN  29  -2.110  -2.484  13.638
  205    HA   GLN  29           HA       GLN  29  -2.733   0.094  14.908
  206   1HB   GLN  29          2HB       GLN  29  -0.653  -0.317  16.095
  207   2HB   GLN  29          3HB       GLN  29  -1.822  -1.613  16.315
  208   1HG   GLN  29          2HG       GLN  29  -0.592  -3.091  14.862
  209   2HG   GLN  29          3HG       GLN  29   0.459  -1.778  14.298
  210   1HE2  GLN  29          1HE2      GLN  29   1.778  -3.935  15.132
  211   2HE2  GLN  29          2HE2      GLN  29   2.454  -3.684  16.737
  212    H    ALA  30           H        ALA  30  -1.641  -0.626  11.814
  213    HA   ALA  30           HA       ALA  30   0.630   1.209  11.780
  214   1HB   ALA  30          1HB       ALA  30   0.481   0.857   9.306
  215   2HB   ALA  30          2HB       ALA  30   0.632  -0.624  10.253
  216   3HB   ALA  30          3HB       ALA  30  -0.946  -0.158   9.566
  217    H    THR  31           H        THR  31   0.733   3.012  10.291
  218    HA   THR  31           HA       THR  31  -1.821   4.524   9.922
  219    HB   THR  31           HB       THR  31   0.888   5.450  10.932
  220    HG1  THR  31           1HG      THR  31  -0.869   4.627  12.300
  221   1HG2  THR  31          1HG2      THR  31   0.178   7.120   9.252
  222   2HG2  THR  31          2HG2      THR  31  -1.449   7.167   9.979
  223   3HG2  THR  31          3HG2      THR  31  -0.041   7.749  10.891
  224    H    VAL  32           H        VAL  32  -1.931   5.688   7.975
  225    HA   VAL  32           HA       VAL  32  -0.113   4.738   5.814
  226    HB   VAL  32           HB       VAL  32  -2.282   4.424   4.534
  227   1HG1  VAL  32          1HG1      VAL  32  -2.716   2.288   6.358
  228   2HG1  VAL  32          2HG1      VAL  32  -1.715   2.285   4.903
  229   3HG1  VAL  32          3HG1      VAL  32  -0.998   2.657   6.473
  230   1HG2  VAL  32          1HG2      VAL  32  -3.809   5.659   6.098
  231   2HG2  VAL  32          2HG2      VAL  32  -4.349   4.013   5.791
  232   3HG2  VAL  32          3HG2      VAL  32  -3.560   4.390   7.316
  233    H    GLN  33           H        GLN  33   0.381   6.339   4.266
  234    HA   GLN  33           HA       GLN  33  -1.312   8.764   4.105
  235   1HB   GLN  33          2HB       GLN  33   1.565   8.515   5.010
  236   2HB   GLN  33          3HB       GLN  33   1.171   9.853   3.935
  237   1HG   GLN  33          2HG       GLN  33  -0.304   9.311   6.543
  238   2HG   GLN  33          3HG       GLN  33   1.069  10.410   6.369
  239   1HE2  GLN  33          1HE2      GLN  33  -1.072  11.664   7.339
  240   2HE2  GLN  33          2HE2      GLN  33  -1.860  12.604   6.082
  241    H    VAL  34           H        VAL  34  -2.054   8.176   2.074
  242    HA   VAL  34           HA       VAL  34   0.000   7.621  -0.014
  243    HB   VAL  34           HB       VAL  34  -1.306   5.678   0.315
  244   1HG1  VAL  34          1HG1      VAL  34  -3.732   5.566  -0.030
  245   2HG1  VAL  34          2HG1      VAL  34  -3.307   6.500   1.410
  246   3HG1  VAL  34          3HG1      VAL  34  -3.823   7.333  -0.066
  247   1HG2  VAL  34          1HG2      VAL  34  -2.119   5.329  -1.927
  248   2HG2  VAL  34          2HG2      VAL  34  -2.311   7.071  -2.198
  249   3HG2  VAL  34          3HG2      VAL  34  -0.692   6.379  -2.006
  250    H    ASP  35           H        ASP  35   0.313   9.147  -1.505
  251    HA   ASP  35           HA       ASP  35  -1.612  11.405  -1.654
  252   1HB   ASP  35          2HB       ASP  35   1.077  10.941  -2.945
  253   2HB   ASP  35          3HB       ASP  35   0.101  12.394  -3.106
  254    H    LEU  36           H        LEU  36  -3.309  10.012  -2.600
  255    HA   LEU  36           HA       LEU  36  -3.098   8.791  -5.173
  256   1HB   LEU  36          2HB       LEU  36  -5.444  10.176  -3.797
  257   2HB   LEU  36          3HB       LEU  36  -5.531   9.520  -5.429
  258    HG   LEU  36           HG       LEU  36  -4.547   7.315  -4.272
  259   1HD1  LEU  36          1HD1      LEU  36  -5.502   6.950  -2.066
  260   2HD1  LEU  36          2HD1      LEU  36  -4.471   8.391  -1.992
  261   3HD1  LEU  36          3HD1      LEU  36  -6.236   8.568  -2.057
  262   1HD2  LEU  36          1HD2      LEU  36  -6.865   6.501  -4.133
  263   2HD2  LEU  36          2HD2      LEU  36  -7.468   8.172  -4.198
  264   3HD2  LEU  36          3HD2      LEU  36  -6.610   7.480  -5.590
  265    H    THR  37           H        THR  37  -3.087  12.199  -4.262
  266    HA   THR  37           HA       THR  37  -3.454  13.629  -6.507
  267    HB   THR  37           HB       THR  37  -0.927  13.867  -4.840
  268    HG1  THR  37           1HG      THR  37  -2.193  14.587  -3.131
  269   1HG2  THR  37          1HG2      THR  37  -1.519  16.256  -4.835
  270   2HG2  THR  37          2HG2      THR  37  -1.454  15.646  -6.499
  271   3HG2  THR  37          3HG2      THR  37  -3.026  15.907  -5.710
  272    H    SER  38           H        SER  38  -0.764  11.349  -5.897
  273    HA   SER  38           HA       SER  38   0.164  11.710  -8.700
  274   1HB   SER  38          2HB       SER  38   1.985  11.712  -6.257
  275   2HB   SER  38          3HB       SER  38   2.491  11.766  -7.968
  276    HG   SER  38           HG       SER  38   1.061  13.723  -8.004
  277    H    LYS  39           H        LYS  39   2.227   9.742  -6.842
  278    HA   LYS  39           HA       LYS  39   0.791   7.246  -7.310
  279   1HB   LYS  39          2HB       LYS  39   2.493   6.491  -9.033
  280   2HB   LYS  39          3HB       LYS  39   1.283   7.658  -9.533
  281   1HG   LYS  39          2HG       LYS  39   3.171   9.463  -9.011
  282   2HG   LYS  39          3HG       LYS  39   4.263   8.093  -9.151
  283   1HD   LYS  39          2HD       LYS  39   2.145   8.727 -11.262
  284   2HD   LYS  39          3HD       LYS  39   3.648   9.644 -11.214
  285   1HE   LYS  39          2HE       LYS  39   5.008   7.824 -11.760
  286   2HE   LYS  39          3HE       LYS  39   3.818   6.641 -11.242
  287   1HZ   LYS  39          1HZ       LYS  39   3.533   8.331 -13.633
  288   2HZ   LYS  39          2HZ       LYS  39   3.992   6.753 -13.629
  289   3HZ   LYS  39          3HZ       LYS  39   2.481   7.161 -13.139
  290    H    LYS  40           H        LYS  40   1.933   8.575  -5.066
  291    HA   LYS  40           HA       LYS  40   4.245   6.855  -4.310
  292   1HB   LYS  40          2HB       LYS  40   5.100   8.766  -3.036
  293   2HB   LYS  40          3HB       LYS  40   4.963   9.142  -4.760
  294   1HG   LYS  40          2HG       LYS  40   2.657  10.172  -4.170
  295   2HG   LYS  40          3HG       LYS  40   3.156  10.077  -2.484
  296   1HD   LYS  40          2HD       LYS  40   4.744  11.438  -4.694
  297   2HD   LYS  40          3HD       LYS  40   3.421  12.261  -3.877
  298   1HE   LYS  40          2HE       LYS  40   5.763  11.068  -2.325
  299   2HE   LYS  40          3HE       LYS  40   5.807  12.713  -2.977
  300   1HZ   LYS  40          1HZ       LYS  40   3.682  11.789  -1.133
  301   2HZ   LYS  40          2HZ       LYS  40   5.030  12.603  -0.655
  302   3HZ   LYS  40          3HZ       LYS  40   3.917  13.286  -1.653
  303    H    VAL  41           H        VAL  41   4.149   5.978  -2.217
  304    HA   VAL  41           HA       VAL  41   1.819   6.646  -0.538
  305    HB   VAL  41           HB       VAL  41   0.995   4.789  -1.797
  306   1HG1  VAL  41          1HG1      VAL  41   3.595   3.386  -1.157
  307   2HG1  VAL  41          2HG1      VAL  41   2.178   2.588  -1.862
  308   3HG1  VAL  41          3HG1      VAL  41   3.020   3.855  -2.771
  309   1HG2  VAL  41          1HG2      VAL  41   2.053   3.608   0.794
  310   2HG2  VAL  41          2HG2      VAL  41   0.712   4.766   0.736
  311   3HG2  VAL  41          3HG2      VAL  41   0.560   3.188  -0.063
  312    H    THR  42           H        THR  42   2.264   6.683   1.603
  313    HA   THR  42           HA       THR  42   4.992   5.887   2.433
  314    HB   THR  42           HB       THR  42   3.361   8.344   3.207
  315    HG1  THR  42           1HG      THR  42   4.950   9.430   2.114
  316   1HG2  THR  42          1HG2      THR  42   5.447   8.992   4.453
  317   2HG2  THR  42          2HG2      THR  42   4.638   7.582   5.149
  318   3HG2  THR  42          3HG2      THR  42   6.086   7.363   4.152
  319    H    ILE  43           H        ILE  43   4.774   4.270   3.957
  320    HA   ILE  43           HA       ILE  43   2.213   4.114   5.529
  321    HB   ILE  43           HB       ILE  43   4.018   1.812   4.766
  322   1HG1  ILE  43          2HG1      ILE  43   3.039   2.510   2.695
  323   2HG1  ILE  43          3HG1      ILE  43   2.197   1.079   3.262
  324   1HG2  ILE  43          1HG2      ILE  43   2.770   1.501   6.854
  325   2HG2  ILE  43          2HG2      ILE  43   1.254   1.899   6.056
  326   3HG2  ILE  43          3HG2      ILE  43   2.139   0.434   5.595
  327   1HD1  ILE  43          1HD1      ILE  43   0.366   2.597   4.164
  328   2HD1  ILE  43          2HD1      ILE  43   1.137   3.917   3.270
  329   3HD1  ILE  43          3HD1      ILE  43   0.521   2.499   2.412
  330    H    THR  44           H        THR  44   2.475   4.306   7.678
  331    HA   THR  44           HA       THR  44   5.237   4.243   8.842
  332    HB   THR  44           HB       THR  44   2.704   5.645   9.724
  333    HG1  THR  44           1HG      THR  44   4.084   6.472   7.980
  334   1HG2  THR  44          1HG2      THR  44   4.165   6.644  11.487
  335   2HG2  THR  44          2HG2      THR  44   3.934   4.903  11.730
  336   3HG2  THR  44          3HG2      THR  44   5.458   5.513  11.040
  337    H    SER  45           H        SER  45   5.487   2.090   9.166
  338    HA   SER  45           HA       SER  45   3.787   0.686  11.117
  339   1HB   SER  45          2HB       SER  45   3.661  -1.246   9.511
  340   2HB   SER  45          3HB       SER  45   2.643   0.085   9.020
  341    HG   SER  45           HG       SER  45   5.329  -0.238   8.122
  342    H    ALA  46           H        ALA  46   5.027  -1.023  12.087
  343    HA   ALA  46           HA       ALA  46   7.894  -1.083  11.425
  344   1HB   ALA  46          1HB       ALA  46   6.379  -2.765  13.441
  345   2HB   ALA  46          2HB       ALA  46   8.132  -2.497  13.326
  346   3HB   ALA  46          3HB       ALA  46   7.062  -1.153  13.772
  347    H    LEU  47           H        LEU  47   5.002  -3.031  10.740
  348    HA   LEU  47           HA       LEU  47   6.754  -5.254   9.704
  349   1HB   LEU  47          2HB       LEU  47   5.157  -6.841  10.296
  350   2HB   LEU  47          3HB       LEU  47   5.481  -5.820  11.688
  351    HG   LEU  47           HG       LEU  47   3.296  -4.565  11.084
  352   1HD1  LEU  47          1HD1      LEU  47   2.998  -7.116   9.409
  353   2HD1  LEU  47          2HD1      LEU  47   1.608  -6.203  10.009
  354   3HD1  LEU  47          3HD1      LEU  47   2.712  -5.445   8.879
  355   1HD2  LEU  47          1HD2      LEU  47   3.560  -6.031  13.032
  356   2HD2  LEU  47          2HD2      LEU  47   1.959  -6.223  12.307
  357   3HD2  LEU  47          3HD2      LEU  47   3.208  -7.455  12.023
  358    H    GLY  48           H        GLY  48   4.072  -3.117   8.974
  359   1HA   GLY  48          2HA       GLY  48   3.038  -3.879   6.671
  360   2HA   GLY  48          3HA       GLY  48   3.544  -2.220   6.928
  361    H    GLU  49           H        GLU  49   6.460  -2.715   6.949
  362    HA   GLU  49           HA       GLU  49   7.067  -2.444   4.295
  363   1HB   GLU  49          2HB       GLU  49   8.501  -2.126   6.414
  364   2HB   GLU  49          3HB       GLU  49   8.865  -3.848   6.344
  365   1HG   GLU  49          2HG       GLU  49   9.892  -3.549   4.117
  366   2HG   GLU  49          3HG       GLU  49   9.397  -1.848   4.097
  367    H    GLU  50           H        GLU  50   7.166  -5.575   6.061
  368    HA   GLU  50           HA       GLU  50   7.549  -7.061   3.553
  369   1HB   GLU  50          2HB       GLU  50   7.571  -7.727   6.452
  370   2HB   GLU  50          3HB       GLU  50   6.769  -8.924   5.442
  371   1HG   GLU  50          2HG       GLU  50   8.754  -8.953   3.911
  372   2HG   GLU  50          3HG       GLU  50   9.590  -7.856   5.031
  373    H    GLN  51           H        GLN  51   4.885  -6.440   5.864
  374    HA   GLN  51           HA       GLN  51   3.103  -8.275   4.771
  375   1HB   GLN  51          2HB       GLN  51   3.039  -6.718   6.907
  376   2HB   GLN  51          3HB       GLN  51   2.029  -5.683   5.891
  377   1HG   GLN  51          2HG       GLN  51   1.544  -8.630   6.520
  378   2HG   GLN  51          3HG       GLN  51   0.766  -7.272   7.341
  379   1HE2  GLN  51          1HE2      GLN  51  -0.631  -9.400   5.898
  380   2HE2  GLN  51          2HE2      GLN  51  -1.428  -8.639   4.530
  381    H    LEU  52           H        LEU  52   3.418  -4.814   3.943
  382    HA   LEU  52           HA       LEU  52   1.569  -4.454   1.913
  383   1HB   LEU  52          2HB       LEU  52   4.428  -3.448   2.215
  384   2HB   LEU  52          3HB       LEU  52   3.335  -2.835   0.986
  385    HG   LEU  52           HG       LEU  52   2.510  -2.721   3.892
  386   1HD1  LEU  52          1HD1      LEU  52   4.813  -1.651   3.527
  387   2HD1  LEU  52          2HD1      LEU  52   4.034  -0.536   2.400
  388   3HD1  LEU  52          3HD1      LEU  52   3.555  -0.572   4.115
  389   1HD2  LEU  52          1HD2      LEU  52   0.887  -2.309   1.969
  390   2HD2  LEU  52          2HD2      LEU  52   1.049  -0.980   3.132
  391   3HD2  LEU  52          3HD2      LEU  52   1.851  -0.892   1.546
  392    H    ARG  53           H        ARG  53   4.868  -5.897   1.694
  393    HA   ARG  53           HA       ARG  53   5.006  -6.037  -1.098
  394   1HB   ARG  53          2HB       ARG  53   6.671  -6.747   0.928
  395   2HB   ARG  53          3HB       ARG  53   6.052  -8.346   0.545
  396   1HG   ARG  53          2HG       ARG  53   8.013  -8.105  -0.696
  397   2HG   ARG  53          3HG       ARG  53   6.732  -7.890  -1.892
  398   1HD   ARG  53          2HD       ARG  53   7.056  -5.530  -2.004
  399   2HD   ARG  53          3HD       ARG  53   7.910  -5.444  -0.476
  400    HE   ARG  53           HE       ARG  53   9.020  -5.920  -3.085
  401   1HH1  ARG  53          2HH2      ARG  53   9.452  -6.679   0.324
  402   2HH1  ARG  53          1HH2      ARG  53  11.170  -6.913   0.246
  403   1HH2  ARG  53          2HH1      ARG  53  11.313  -6.202  -3.257
  404   2HH2  ARG  53          1HH1      ARG  53  12.246  -6.670  -1.873
  405    H    THR  54           H        THR  54   3.706  -8.434   1.209
  406    HA   THR  54           HA       THR  54   2.853 -10.245  -0.900
  407    HB   THR  54           HB       THR  54   2.203 -10.260   2.071
  408    HG1  THR  54           1HG      THR  54   4.438 -10.413   1.535
  409   1HG2  THR  54          1HG2      THR  54   1.974 -12.395  -0.110
  410   2HG2  THR  54          2HG2      THR  54   1.840 -12.706   1.632
  411   3HG2  THR  54          3HG2      THR  54   0.633 -11.692   0.823
  412    H    ALA  55           H        ALA  55   1.152  -7.890   1.240
  413    HA   ALA  55           HA       ALA  55  -1.474  -8.537   0.375
  414   1HB   ALA  55          1HB       ALA  55  -0.356  -5.900   1.405
  415   2HB   ALA  55          2HB       ALA  55  -2.080  -6.333   1.294
  416   3HB   ALA  55          3HB       ALA  55  -1.010  -7.236   2.379
  417    H    ILE  56           H        ILE  56   0.728  -5.927  -0.730
  418    HA   ILE  56           HA       ILE  56  -0.820  -5.032  -2.927
  419    HB   ILE  56           HB       ILE  56   2.217  -5.142  -2.756
  420   1HG1  ILE  56          2HG1      ILE  56   0.453  -2.723  -2.236
  421   2HG1  ILE  56          3HG1      ILE  56   0.952  -3.755  -0.895
  422   1HG2  ILE  56          1HG2      ILE  56   0.281  -3.487  -4.431
  423   2HG2  ILE  56          2HG2      ILE  56   2.054  -3.323  -4.429
  424   3HG2  ILE  56          3HG2      ILE  56   1.328  -4.781  -5.062
  425   1HD1  ILE  56          1HD1      ILE  56   2.808  -2.198  -2.719
  426   2HD1  ILE  56          2HD1      ILE  56   2.432  -1.875  -1.026
  427   3HD1  ILE  56          3HD1      ILE  56   3.336  -3.340  -1.469
  428    H    ALA  57           H        ALA  57   1.717  -7.669  -2.843
  429    HA   ALA  57           HA       ALA  57   1.411  -8.393  -5.540
  430   1HB   ALA  57          1HB       ALA  57   3.171  -9.300  -4.086
  431   2HB   ALA  57          2HB       ALA  57   1.962 -10.254  -3.196
  432   3HB   ALA  57          3HB       ALA  57   2.270 -10.588  -4.908
  433    H    SER  58           H        SER  58  -0.578  -9.345  -2.740
  434    HA   SER  58           HA       SER  58  -2.270 -11.208  -3.985
  435   1HB   SER  58          2HB       SER  58  -2.101 -10.324  -1.469
  436   2HB   SER  58          3HB       SER  58  -3.415  -9.253  -1.983
  437    HG   SER  58           HG       SER  58  -3.366 -12.087  -2.120
  438    H    ALA  59           H        ALA  59  -2.547  -7.634  -3.822
  439    HA   ALA  59           HA       ALA  59  -4.975  -7.509  -5.415
  440   1HB   ALA  59          1HB       ALA  59  -2.899  -5.391  -4.743
  441   2HB   ALA  59          2HB       ALA  59  -4.481  -5.091  -5.503
  442   3HB   ALA  59          3HB       ALA  59  -4.396  -5.733  -3.849
  443    H    GLY  60           H        GLY  60  -1.507  -7.273  -6.131
  444   1HA   GLY  60          2HA       GLY  60  -0.433  -7.838  -8.106
  445   2HA   GLY  60          3HA       GLY  60  -1.969  -7.860  -8.976
  446    H    HIS  61           H        HIS  61   0.174  -5.526  -7.236
  447    HA   HIS  61           HA       HIS  61  -0.001  -3.711  -9.609
  448   1HB   HIS  61          2HB       HIS  61   0.096  -2.926  -6.687
  449   2HB   HIS  61          3HB       HIS  61   0.387  -1.813  -8.022
  450    HD1  HIS  61           1HD      HIS  61  -1.797  -0.620  -8.971
  451    HD2  HIS  61           2HD      HIS  61  -2.410  -3.907  -6.407
  452    HE1  HIS  61           1HE      HIS  61  -4.222  -0.538  -8.250
  453    H    GLU  62           H        GLU  62   1.895  -2.857 -10.268
  454    HA   GLU  62           HA       GLU  62   4.368  -4.212  -9.655
  455   1HB   GLU  62          2HB       GLU  62   3.703  -1.909 -11.558
  456   2HB   GLU  62          3HB       GLU  62   5.158  -2.910 -11.592
  457   1HG   GLU  62          2HG       GLU  62   2.340  -4.016 -12.071
  458   2HG   GLU  62          3HG       GLU  62   3.453  -3.486 -13.332
  459    H    VAL  63           H        VAL  63   3.821  -3.096  -7.384
  460    HA   VAL  63           HA       VAL  63   4.761  -0.314  -7.173
  461    HB   VAL  63           HB       VAL  63   4.092  -2.283  -4.953
  462   1HG1  VAL  63          1HG1      VAL  63   4.156   0.765  -4.949
  463   2HG1  VAL  63          2HG1      VAL  63   3.710  -0.266  -3.593
  464   3HG1  VAL  63          3HG1      VAL  63   5.373  -0.282  -4.187
  465   1HG2  VAL  63          1HG2      VAL  63   1.868  -0.996  -4.969
  466   2HG2  VAL  63          2HG2      VAL  63   2.380  -0.327  -6.532
  467   3HG2  VAL  63          3HG2      VAL  63   2.145  -2.065  -6.353
  468    H    GLU  64           H        GLU  64   6.729   0.380  -6.291
  469    HA   GLU  64           HA       GLU  64   8.746  -1.678  -5.541
  470   1HB   GLU  64          2HB       GLU  64   9.084  -0.503  -7.880
  471   2HB   GLU  64          3HB       GLU  64   9.417   0.940  -6.906
  472   1HG   GLU  64          2HG       GLU  64  11.538  -0.028  -7.337
  473   2HG   GLU  64          3HG       GLU  64  11.174  -0.521  -5.676
  Start of MODEL    4
    1   1H    MET   1           H1       MET   1  11.465   3.715   9.484
    2   2H    MET   1           H2       MET   1  11.688   2.533  10.616
    3   3H    MET   1           H3       MET   1  10.940   2.190   9.187
    4    HA   MET   1           HA       MET   1   9.361   2.253  10.885
    5   1HB   MET   1          2HB       MET   1  10.818   4.713  11.675
    6   2HB   MET   1          3HB       MET   1   9.084   4.992  11.525
    7   1HG   MET   1          2HG       MET   1   9.135   4.322  13.692
    8   2HG   MET   1          3HG       MET   1   8.845   2.774  12.925
    9   1HE   MET   1          1HE       MET   1  11.079   1.115  15.415
   10   2HE   MET   1          2HE       MET   1   9.464   1.858  15.327
   11   3HE   MET   1          3HE       MET   1  10.027   0.779  14.023
   12    H    THR   2           H        THR   2   9.866   5.368   9.074
   13    HA   THR   2           HA       THR   2   7.268   5.010   7.781
   14    HB   THR   2           HB       THR   2   8.055   7.226   8.378
   15    HG1  THR   2           1HG      THR   2   7.848   6.909   5.578
   16   1HG2  THR   2          1HG2      THR   2  10.510   7.010   7.910
   17   2HG2  THR   2          2HG2      THR   2  10.148   6.957   6.171
   18   3HG2  THR   2          3HG2      THR   2   9.758   8.401   7.115
   19    H    ILE   3           H        ILE   3   6.972   3.872   5.992
   20    HA   ILE   3           HA       ILE   3   9.226   2.861   4.319
   21    HB   ILE   3           HB       ILE   3   6.384   1.921   4.931
   22   1HG1  ILE   3          2HG1      ILE   3   7.448  -0.254   5.296
   23   2HG1  ILE   3          3HG1      ILE   3   9.045   0.434   4.965
   24   1HG2  ILE   3          1HG2      ILE   3   8.136   1.018   2.638
   25   2HG2  ILE   3          2HG2      ILE   3   6.669   0.183   3.186
   26   3HG2  ILE   3          3HG2      ILE   3   6.532   1.807   2.524
   27   1HD1  ILE   3          1HD1      ILE   3   8.448   0.084   7.404
   28   2HD1  ILE   3          2HD1      ILE   3   8.953   1.726   7.008
   29   3HD1  ILE   3          3HD1      ILE   3   7.218   1.351   7.224
   30    H    GLN   4           H        GLN   4   9.225   3.632   2.173
   31    HA   GLN   4           HA       GLN   4   6.924   5.276   1.235
   32   1HB   GLN   4          2HB       GLN   4   9.761   6.091   1.579
   33   2HB   GLN   4          3HB       GLN   4   9.094   6.411  -0.029
   34   1HG   GLN   4          2HG       GLN   4   7.234   7.653   0.870
   35   2HG   GLN   4          3HG       GLN   4   7.670   7.210   2.522
   36   1HE2  GLN   4          1HE2      GLN   4   8.968   8.915  -0.387
   37   2HE2  GLN   4          2HE2      GLN   4   9.890  10.087   0.543
   38    H    LEU   5           H        LEU   5   6.043   4.133  -0.332
   39    HA   LEU   5           HA       LEU   5   7.745   2.650  -2.300
   40   1HB   LEU   5          2HB       LEU   5   5.228   2.014  -0.792
   41   2HB   LEU   5          3HB       LEU   5   5.263   1.544  -2.491
   42    HG   LEU   5           HG       LEU   5   7.069   0.089  -2.179
   43   1HD1  LEU   5          1HD1      LEU   5   7.481   1.390   0.507
   44   2HD1  LEU   5          2HD1      LEU   5   8.152  -0.212   0.133
   45   3HD1  LEU   5          3HD1      LEU   5   8.655   1.189  -0.809
   46   1HD2  LEU   5          1HD2      LEU   5   6.196  -1.445  -0.426
   47   2HD2  LEU   5          2HD2      LEU   5   5.246  -0.103   0.253
   48   3HD2  LEU   5          3HD2      LEU   5   4.880  -0.725  -1.373
   49    H    THR   6           H        THR   6   6.880   2.580  -4.419
   50    HA   THR   6           HA       THR   6   5.266   4.959  -5.245
   51    HB   THR   6           HB       THR   6   7.817   3.765  -6.386
   52    HG1  THR   6           1HG      THR   6   8.650   5.688  -5.772
   53   1HG2  THR   6          1HG2      THR   6   6.430   4.358  -8.304
   54   2HG2  THR   6          2HG2      THR   6   5.974   5.905  -7.553
   55   3HG2  THR   6          3HG2      THR   6   7.645   5.620  -8.087
   56    H    VAL   7           H        VAL   7   3.536   4.431  -6.389
   57    HA   VAL   7           HA       VAL   7   3.189   1.653  -7.504
   58    HB   VAL   7           HB       VAL   7   1.944   1.768  -5.559
   59   1HG1  VAL   7          1HG1      VAL   7   1.859   4.118  -5.006
   60   2HG1  VAL   7          2HG1      VAL   7   0.772   4.445  -6.368
   61   3HG1  VAL   7          3HG1      VAL   7   0.235   3.437  -5.012
   62   1HG2  VAL   7          1HG2      VAL   7  -0.181   1.201  -6.271
   63   2HG2  VAL   7          2HG2      VAL   7  -0.152   2.364  -7.594
   64   3HG2  VAL   7          3HG2      VAL   7   0.833   0.898  -7.695
   65    HA   PRO   8           HA       PRO   8   2.959   4.788 -10.787
   66   1HB   PRO   8          2HB       PRO   8   4.061   3.344 -12.850
   67   2HB   PRO   8          3HB       PRO   8   5.049   4.162 -11.602
   68   1HG   PRO   8          2HG       PRO   8   4.219   1.253 -11.673
   69   2HG   PRO   8          3HG       PRO   8   5.845   1.923 -11.365
   70   1HD   PRO   8          2HD       PRO   8   4.169   1.169  -9.366
   71   2HD   PRO   8          3HD       PRO   8   5.262   2.563  -9.175
   72    H    THR   9           H        THR   9   1.905   1.453 -10.586
   73    HA   THR   9           HA       THR   9  -0.297   1.966 -12.491
   74    HB   THR   9           HB       THR   9   1.208   0.013 -12.682
   75    HG1  THR   9           1HG      THR   9  -0.608  -1.424 -13.030
   76   1HG2  THR   9          1HG2      THR   9  -0.149  -1.004 -10.177
   77   2HG2  THR   9          2HG2      THR   9   0.708  -1.976 -11.371
   78   3HG2  THR   9          3HG2      THR   9   1.584  -0.722 -10.449
   79    H    ILE  10           H        ILE  10  -0.244   3.375  -9.755
   80    HA   ILE  10           HA       ILE  10  -2.482   2.552  -8.431
   81    HB   ILE  10           HB       ILE  10  -0.960   4.939  -8.728
   82   1HG1  ILE  10          2HG1      ILE  10  -3.275   4.119  -7.025
   83   2HG1  ILE  10          3HG1      ILE  10  -1.568   3.917  -6.666
   84   1HG2  ILE  10          1HG2      ILE  10  -3.875   5.679  -9.087
   85   2HG2  ILE  10          2HG2      ILE  10  -2.474   6.758  -8.951
   86   3HG2  ILE  10          3HG2      ILE  10  -2.654   5.743 -10.383
   87   1HD1  ILE  10          1HD1      ILE  10  -2.368   5.727  -5.306
   88   2HD1  ILE  10          2HD1      ILE  10  -1.315   6.416  -6.556
   89   3HD1  ILE  10          3HD1      ILE  10  -3.086   6.555  -6.696
   90    H    ALA  11           H        ALA  11  -4.748   3.253  -8.635
   91    HA   ALA  11           HA       ALA  11  -6.751   3.049  -9.653
   92   1HB   ALA  11          1HB       ALA  11  -5.444   4.685 -11.862
   93   2HB   ALA  11          2HB       ALA  11  -7.176   4.551 -11.512
   94   3HB   ALA  11          3HB       ALA  11  -6.102   5.337 -10.344
   95    H    CYS  12           H        CYS  12  -4.734   0.936 -10.263
   96    HA   CYS  12           HA       CYS  12  -5.507  -0.046 -12.928
   97   1HB   CYS  12          2HB       CYS  12  -3.255  -0.370 -12.394
   98   2HB   CYS  12          3HB       CYS  12  -3.615  -0.940 -10.756
   99    HG   CYS  12           HG       CYS  12  -4.440  -2.363 -13.625
  100    H    GLU  13           H        GLU  13  -5.573  -1.541  -9.643
  101    HA   GLU  13           HA       GLU  13  -7.732  -3.301 -10.511
  102   1HB   GLU  13          2HB       GLU  13  -5.579  -3.813  -9.095
  103   2HB   GLU  13          3HB       GLU  13  -6.551  -3.335  -7.711
  104   1HG   GLU  13          2HG       GLU  13  -7.287  -5.468  -9.777
  105   2HG   GLU  13          3HG       GLU  13  -6.528  -5.779  -8.217
  106    H    ALA  14           H        ALA  14  -7.538  -1.689  -7.314
  107    HA   ALA  14           HA       ALA  14  -9.947  -0.052  -7.940
  108   1HB   ALA  14          1HB       ALA  14 -11.012  -0.758  -5.859
  109   2HB   ALA  14          2HB       ALA  14 -10.708  -2.172  -6.887
  110   3HB   ALA  14          3HB       ALA  14  -9.652  -1.849  -5.497
  111    H    CYS  15           H        CYS  15  -7.184   0.631  -7.837
  112    HA   CYS  15           HA       CYS  15  -5.892   2.261  -7.172
  113   1HB   CYS  15          2HB       CYS  15  -8.414   3.320  -6.397
  114   2HB   CYS  15          3HB       CYS  15  -7.351   3.556  -4.997
  115    HG   CYS  15           HG       CYS  15  -7.397   5.680  -6.491
  116    H    ALA  16           H        ALA  16  -4.329   2.742  -5.648
  117    HA   ALA  16           HA       ALA  16  -3.474   0.553  -4.140
  118   1HB   ALA  16          1HB       ALA  16  -1.974   2.306  -4.938
  119   2HB   ALA  16          2HB       ALA  16  -2.675   3.470  -3.786
  120   3HB   ALA  16          3HB       ALA  16  -1.771   2.057  -3.194
  121    H    GLU  17           H        GLU  17  -5.619   3.177  -3.093
  122    HA   GLU  17           HA       GLU  17  -5.357   2.837  -0.328
  123   1HB   GLU  17          2HB       GLU  17  -7.343   4.054  -0.091
  124   2HB   GLU  17          3HB       GLU  17  -6.501   4.685  -1.494
  125   1HG   GLU  17          2HG       GLU  17  -8.534   4.570  -2.476
  126   2HG   GLU  17          3HG       GLU  17  -8.158   2.866  -2.740
  127    H    ALA  18           H        ALA  18  -7.001   0.788  -2.726
  128    HA   ALA  18           HA       ALA  18  -8.479  -0.890  -1.008
  129   1HB   ALA  18          1HB       ALA  18  -8.511  -0.994  -3.487
  130   2HB   ALA  18          2HB       ALA  18  -6.871  -1.683  -3.476
  131   3HB   ALA  18          3HB       ALA  18  -8.215  -2.581  -2.747
  132    H    VAL  19           H        VAL  19  -4.938  -0.956  -1.841
  133    HA   VAL  19           HA       VAL  19  -4.551  -3.353  -0.291
  134    HB   VAL  19           HB       VAL  19  -2.947  -2.349  -2.144
  135   1HG1  VAL  19          1HG1      VAL  19  -0.922  -1.383  -1.209
  136   2HG1  VAL  19          2HG1      VAL  19  -2.220  -0.341  -0.668
  137   3HG1  VAL  19          3HG1      VAL  19  -1.512  -1.524   0.445
  138   1HG2  VAL  19          1HG2      VAL  19  -2.224  -3.906   0.388
  139   2HG2  VAL  19          2HG2      VAL  19  -2.832  -4.578  -1.141
  140   3HG2  VAL  19          3HG2      VAL  19  -1.230  -3.840  -1.058
  141    H    THR  20           H        THR  20  -4.345   0.143   0.328
  142    HA   THR  20           HA       THR  20  -3.171   0.044   2.922
  143    HB   THR  20           HB       THR  20  -5.201   1.953   1.695
  144    HG1  THR  20           1HG      THR  20  -3.042   1.822   0.866
  145   1HG2  THR  20          1HG2      THR  20  -4.479   3.513   3.503
  146   2HG2  THR  20          2HG2      THR  20  -5.628   2.247   3.969
  147   3HG2  THR  20          3HG2      THR  20  -3.918   2.069   4.391
  148    H    LYS  21           H        LYS  21  -6.618  -0.154   1.955
  149    HA   LYS  21           HA       LYS  21  -7.651  -0.572   4.583
  150   1HB   LYS  21          2HB       LYS  21  -8.761  -1.467   1.898
  151   2HB   LYS  21          3HB       LYS  21  -9.683  -1.332   3.399
  152   1HG   LYS  21          2HG       LYS  21  -8.204   1.150   2.608
  153   2HG   LYS  21          3HG       LYS  21  -9.416   0.629   1.456
  154   1HD   LYS  21          2HD       LYS  21 -11.162   0.727   3.115
  155   2HD   LYS  21          3HD       LYS  21  -9.986   0.943   4.437
  156   1HE   LYS  21          2HE       LYS  21  -9.263   3.117   3.429
  157   2HE   LYS  21          3HE       LYS  21 -10.441   2.907   2.124
  158   1HZ   LYS  21          1HZ       LYS  21 -11.234   4.353   3.843
  159   2HZ   LYS  21          2HZ       LYS  21 -12.186   3.018   3.739
  160   3HZ   LYS  21          3HZ       LYS  21 -11.107   3.169   4.981
  161    H    ALA  22           H        ALA  22  -6.584  -2.848   2.041
  162    HA   ALA  22           HA       ALA  22  -7.264  -5.248   3.388
  163   1HB   ALA  22          1HB       ALA  22  -5.624  -6.360   2.030
  164   2HB   ALA  22          2HB       ALA  22  -6.524  -5.182   1.041
  165   3HB   ALA  22          3HB       ALA  22  -4.864  -4.825   1.585
  166    H    VAL  23           H        VAL  23  -4.130  -3.541   3.361
  167    HA   VAL  23           HA       VAL  23  -2.676  -5.217   5.086
  168    HB   VAL  23           HB       VAL  23  -2.433  -2.262   4.414
  169   1HG1  VAL  23          1HG1      VAL  23  -0.017  -2.525   5.037
  170   2HG1  VAL  23          2HG1      VAL  23  -1.099  -2.637   6.440
  171   3HG1  VAL  23          3HG1      VAL  23  -0.392  -4.110   5.733
  172   1HG2  VAL  23          1HG2      VAL  23  -1.128  -2.869   2.625
  173   2HG2  VAL  23          2HG2      VAL  23  -0.581  -4.390   3.358
  174   3HG2  VAL  23          3HG2      VAL  23  -2.187  -4.281   2.643
  175    H    GLN  24           H        GLN  24  -4.700  -2.327   5.765
  176    HA   GLN  24           HA       GLN  24  -4.276  -2.152   8.539
  177   1HB   GLN  24          2HB       GLN  24  -6.738  -1.582   6.873
  178   2HB   GLN  24          3HB       GLN  24  -6.620  -1.174   8.578
  179   1HG   GLN  24          2HG       GLN  24  -4.359  -0.200   6.851
  180   2HG   GLN  24          3HG       GLN  24  -5.939   0.525   6.560
  181   1HE2  GLN  24          1HE2      GLN  24  -3.160   0.997   8.311
  182   2HE2  GLN  24          2HE2      GLN  24  -3.846   1.956   9.602
  183    H    ASN  25           H        ASN  25  -5.919  -4.840   6.870
  184    HA   ASN  25           HA       ASN  25  -7.430  -5.659   9.230
  185   1HB   ASN  25          2HB       ASN  25  -6.317  -7.334   6.936
  186   2HB   ASN  25          3HB       ASN  25  -7.298  -7.947   8.262
  187   1HD2  ASN  25          1HD2      ASN  25  -7.338  -5.994   5.374
  188   2HD2  ASN  25          2HD2      ASN  25  -9.094  -5.875   5.234
  189    H    GLU  26           H        GLU  26  -4.237  -6.624   7.894
  190    HA   GLU  26           HA       GLU  26  -3.582  -8.253  10.202
  191   1HB   GLU  26          2HB       GLU  26  -1.868  -7.252   7.880
  192   2HB   GLU  26          3HB       GLU  26  -1.399  -8.460   9.081
  193   1HG   GLU  26          2HG       GLU  26  -3.923  -9.342   8.065
  194   2HG   GLU  26          3HG       GLU  26  -3.003  -8.796   6.662
  195    H    ASP  27           H        ASP  27  -2.284  -5.176   8.878
  196    HA   ASP  27           HA       ASP  27  -0.804  -4.738  11.395
  197   1HB   ASP  27          2HB       ASP  27   0.188  -4.565   8.990
  198   2HB   ASP  27          3HB       ASP  27  -0.631  -3.020   8.886
  199    H    ALA  28           H        ALA  28  -3.060  -4.510  12.361
  200    HA   ALA  28           HA       ALA  28  -4.808  -2.394  11.502
  201   1HB   ALA  28          1HB       ALA  28  -5.625  -4.401  12.683
  202   2HB   ALA  28          2HB       ALA  28  -4.742  -3.908  14.149
  203   3HB   ALA  28          3HB       ALA  28  -6.085  -2.918  13.539
  204    H    GLN  29           H        GLN  29  -2.110  -2.484  13.638
  205    HA   GLN  29           HA       GLN  29  -2.733   0.094  14.908
  206   1HB   GLN  29          2HB       GLN  29  -0.653  -0.317  16.095
  207   2HB   GLN  29          3HB       GLN  29  -1.822  -1.613  16.315
  208   1HG   GLN  29          2HG       GLN  29  -0.592  -3.091  14.862
  209   2HG   GLN  29          3HG       GLN  29   0.459  -1.778  14.298
  210   1HE2  GLN  29          1HE2      GLN  29   1.778  -3.935  15.132
  211   2HE2  GLN  29          2HE2      GLN  29   2.454  -3.684  16.737
  212    H    ALA  30           H        ALA  30  -1.641  -0.626  11.814
  213    HA   ALA  30           HA       ALA  30   0.630   1.209  11.780
  214   1HB   ALA  30          1HB       ALA  30   0.481   0.857   9.306
  215   2HB   ALA  30          2HB       ALA  30   0.632  -0.624  10.253
  216   3HB   ALA  30          3HB       ALA  30  -0.946  -0.158   9.566
  217    H    THR  31           H        THR  31   0.733   3.012  10.291
  218    HA   THR  31           HA       THR  31  -1.821   4.524   9.922
  219    HB   THR  31           HB       THR  31   0.888   5.450  10.932
  220    HG1  THR  31           1HG      THR  31  -0.869   4.627  12.300
  221   1HG2  THR  31          1HG2      THR  31   0.178   7.120   9.252
  222   2HG2  THR  31          2HG2      THR  31  -1.449   7.167   9.979
  223   3HG2  THR  31          3HG2      THR  31  -0.041   7.749  10.891
  224    H    VAL  32           H        VAL  32  -1.931   5.688   7.975
  225    HA   VAL  32           HA       VAL  32  -0.113   4.738   5.814
  226    HB   VAL  32           HB       VAL  32  -2.282   4.424   4.534
  227   1HG1  VAL  32          1HG1      VAL  32  -2.716   2.288   6.358
  228   2HG1  VAL  32          2HG1      VAL  32  -1.715   2.285   4.903
  229   3HG1  VAL  32          3HG1      VAL  32  -0.998   2.657   6.473
  230   1HG2  VAL  32          1HG2      VAL  32  -3.809   5.659   6.098
  231   2HG2  VAL  32          2HG2      VAL  32  -4.349   4.013   5.791
  232   3HG2  VAL  32          3HG2      VAL  32  -3.560   4.390   7.316
  233    H    GLN  33           H        GLN  33   0.381   6.339   4.266
  234    HA   GLN  33           HA       GLN  33  -1.312   8.764   4.105
  235   1HB   GLN  33          2HB       GLN  33   1.565   8.515   5.010
  236   2HB   GLN  33          3HB       GLN  33   1.171   9.853   3.935
  237   1HG   GLN  33          2HG       GLN  33  -0.304   9.311   6.543
  238   2HG   GLN  33          3HG       GLN  33   1.069  10.410   6.369
  239   1HE2  GLN  33          1HE2      GLN  33  -1.072  11.664   7.339
  240   2HE2  GLN  33          2HE2      GLN  33  -1.860  12.604   6.082
  241    H    VAL  34           H        VAL  34  -2.054   8.176   2.074
  242    HA   VAL  34           HA       VAL  34   0.000   7.621  -0.014
  243    HB   VAL  34           HB       VAL  34  -1.306   5.678   0.315
  244   1HG1  VAL  34          1HG1      VAL  34  -3.732   5.566  -0.030
  245   2HG1  VAL  34          2HG1      VAL  34  -3.307   6.500   1.410
  246   3HG1  VAL  34          3HG1      VAL  34  -3.823   7.333  -0.066
  247   1HG2  VAL  34          1HG2      VAL  34  -2.119   5.329  -1.927
  248   2HG2  VAL  34          2HG2      VAL  34  -2.311   7.071  -2.198
  249   3HG2  VAL  34          3HG2      VAL  34  -0.692   6.379  -2.006
  250    H    ASP  35           H        ASP  35   0.313   9.147  -1.505
  251    HA   ASP  35           HA       ASP  35  -1.612  11.405  -1.654
  252   1HB   ASP  35          2HB       ASP  35   1.077  10.941  -2.945
  253   2HB   ASP  35          3HB       ASP  35   0.101  12.394  -3.106
  254    H    LEU  36           H        LEU  36  -3.309  10.012  -2.600
  255    HA   LEU  36           HA       LEU  36  -3.098   8.791  -5.173
  256   1HB   LEU  36          2HB       LEU  36  -5.444  10.176  -3.797
  257   2HB   LEU  36          3HB       LEU  36  -5.531   9.520  -5.429
  258    HG   LEU  36           HG       LEU  36  -4.547   7.315  -4.272
  259   1HD1  LEU  36          1HD1      LEU  36  -5.502   6.950  -2.066
  260   2HD1  LEU  36          2HD1      LEU  36  -4.471   8.391  -1.992
  261   3HD1  LEU  36          3HD1      LEU  36  -6.236   8.568  -2.057
  262   1HD2  LEU  36          1HD2      LEU  36  -6.865   6.501  -4.133
  263   2HD2  LEU  36          2HD2      LEU  36  -7.468   8.172  -4.198
  264   3HD2  LEU  36          3HD2      LEU  36  -6.610   7.480  -5.590
  265    H    THR  37           H        THR  37  -3.087  12.199  -4.262
  266    HA   THR  37           HA       THR  37  -3.454  13.629  -6.507
  267    HB   THR  37           HB       THR  37  -0.927  13.867  -4.840
  268    HG1  THR  37           1HG      THR  37  -2.193  14.587  -3.131
  269   1HG2  THR  37          1HG2      THR  37  -1.519  16.256  -4.835
  270   2HG2  THR  37          2HG2      THR  37  -1.454  15.646  -6.499
  271   3HG2  THR  37          3HG2      THR  37  -3.026  15.907  -5.710
  272    H    SER  38           H        SER  38  -0.764  11.349  -5.897
  273    HA   SER  38           HA       SER  38   0.164  11.710  -8.700
  274   1HB   SER  38          2HB       SER  38   1.985  11.712  -6.257
  275   2HB   SER  38          3HB       SER  38   2.491  11.766  -7.968
  276    HG   SER  38           HG       SER  38   1.061  13.723  -8.004
  277    H    LYS  39           H        LYS  39   2.227   9.742  -6.842
  278    HA   LYS  39           HA       LYS  39   0.791   7.246  -7.310
  279   1HB   LYS  39          2HB       LYS  39   2.493   6.491  -9.033
  280   2HB   LYS  39          3HB       LYS  39   1.283   7.658  -9.533
  281   1HG   LYS  39          2HG       LYS  39   3.171   9.463  -9.011
  282   2HG   LYS  39          3HG       LYS  39   4.263   8.093  -9.151
  283   1HD   LYS  39          2HD       LYS  39   2.145   8.727 -11.262
  284   2HD   LYS  39          3HD       LYS  39   3.648   9.644 -11.214
  285   1HE   LYS  39          2HE       LYS  39   5.008   7.824 -11.760
  286   2HE   LYS  39          3HE       LYS  39   3.818   6.641 -11.242
  287   1HZ   LYS  39          1HZ       LYS  39   3.533   8.331 -13.633
  288   2HZ   LYS  39          2HZ       LYS  39   3.992   6.753 -13.629
  289   3HZ   LYS  39          3HZ       LYS  39   2.481   7.161 -13.139
  290    H    LYS  40           H        LYS  40   1.933   8.575  -5.066
  291    HA   LYS  40           HA       LYS  40   4.245   6.855  -4.310
  292   1HB   LYS  40          2HB       LYS  40   5.100   8.766  -3.036
  293   2HB   LYS  40          3HB       LYS  40   4.963   9.142  -4.760
  294   1HG   LYS  40          2HG       LYS  40   2.657  10.172  -4.170
  295   2HG   LYS  40          3HG       LYS  40   3.156  10.077  -2.484
  296   1HD   LYS  40          2HD       LYS  40   4.744  11.438  -4.694
  297   2HD   LYS  40          3HD       LYS  40   3.421  12.261  -3.877
  298   1HE   LYS  40          2HE       LYS  40   5.763  11.068  -2.325
  299   2HE   LYS  40          3HE       LYS  40   5.807  12.713  -2.977
  300   1HZ   LYS  40          1HZ       LYS  40   3.682  11.789  -1.133
  301   2HZ   LYS  40          2HZ       LYS  40   5.030  12.603  -0.655
  302   3HZ   LYS  40          3HZ       LYS  40   3.917  13.286  -1.653
  303    H    VAL  41           H        VAL  41   4.149   5.978  -2.217
  304    HA   VAL  41           HA       VAL  41   1.819   6.646  -0.538
  305    HB   VAL  41           HB       VAL  41   0.995   4.789  -1.797
  306   1HG1  VAL  41          1HG1      VAL  41   3.595   3.386  -1.157
  307   2HG1  VAL  41          2HG1      VAL  41   2.178   2.588  -1.862
  308   3HG1  VAL  41          3HG1      VAL  41   3.020   3.855  -2.771
  309   1HG2  VAL  41          1HG2      VAL  41   2.053   3.608   0.794
  310   2HG2  VAL  41          2HG2      VAL  41   0.712   4.766   0.736
  311   3HG2  VAL  41          3HG2      VAL  41   0.560   3.188  -0.063
  312    H    THR  42           H        THR  42   2.264   6.683   1.603
  313    HA   THR  42           HA       THR  42   4.992   5.887   2.433
  314    HB   THR  42           HB       THR  42   3.361   8.344   3.207
  315    HG1  THR  42           1HG      THR  42   4.950   9.430   2.114
  316   1HG2  THR  42          1HG2      THR  42   5.447   8.992   4.453
  317   2HG2  THR  42          2HG2      THR  42   4.638   7.582   5.149
  318   3HG2  THR  42          3HG2      THR  42   6.086   7.363   4.152
  319    H    ILE  43           H        ILE  43   4.774   4.270   3.957
  320    HA   ILE  43           HA       ILE  43   2.213   4.114   5.529
  321    HB   ILE  43           HB       ILE  43   4.018   1.812   4.766
  322   1HG1  ILE  43          2HG1      ILE  43   3.039   2.510   2.695
  323   2HG1  ILE  43          3HG1      ILE  43   2.197   1.079   3.262
  324   1HG2  ILE  43          1HG2      ILE  43   2.770   1.501   6.854
  325   2HG2  ILE  43          2HG2      ILE  43   1.254   1.899   6.056
  326   3HG2  ILE  43          3HG2      ILE  43   2.139   0.434   5.595
  327   1HD1  ILE  43          1HD1      ILE  43   0.366   2.597   4.164
  328   2HD1  ILE  43          2HD1      ILE  43   1.137   3.917   3.270
  329   3HD1  ILE  43          3HD1      ILE  43   0.521   2.499   2.412
  330    H    THR  44           H        THR  44   2.475   4.306   7.678
  331    HA   THR  44           HA       THR  44   5.237   4.243   8.842
  332    HB   THR  44           HB       THR  44   2.704   5.645   9.724
  333    HG1  THR  44           1HG      THR  44   4.084   6.472   7.980
  334   1HG2  THR  44          1HG2      THR  44   4.165   6.644  11.487
  335   2HG2  THR  44          2HG2      THR  44   3.934   4.903  11.730
  336   3HG2  THR  44          3HG2      THR  44   5.458   5.513  11.040
  337    H    SER  45           H        SER  45   5.487   2.090   9.166
  338    HA   SER  45           HA       SER  45   3.787   0.686  11.117
  339   1HB   SER  45          2HB       SER  45   3.661  -1.246   9.511
  340   2HB   SER  45          3HB       SER  45   2.643   0.085   9.020
  341    HG   SER  45           HG       SER  45   5.329  -0.238   8.122
  342    H    ALA  46           H        ALA  46   5.027  -1.023  12.087
  343    HA   ALA  46           HA       ALA  46   7.894  -1.083  11.425
  344   1HB   ALA  46          1HB       ALA  46   6.379  -2.765  13.441
  345   2HB   ALA  46          2HB       ALA  46   8.132  -2.497  13.326
  346   3HB   ALA  46          3HB       ALA  46   7.062  -1.153  13.772
  347    H    LEU  47           H        LEU  47   5.002  -3.031  10.740
  348    HA   LEU  47           HA       LEU  47   6.754  -5.254   9.704
  349   1HB   LEU  47          2HB       LEU  47   5.157  -6.841  10.296
  350   2HB   LEU  47          3HB       LEU  47   5.481  -5.820  11.688
  351    HG   LEU  47           HG       LEU  47   3.296  -4.565  11.084
  352   1HD1  LEU  47          1HD1      LEU  47   2.998  -7.116   9.409
  353   2HD1  LEU  47          2HD1      LEU  47   1.608  -6.203  10.009
  354   3HD1  LEU  47          3HD1      LEU  47   2.712  -5.445   8.879
  355   1HD2  LEU  47          1HD2      LEU  47   3.560  -6.031  13.032
  356   2HD2  LEU  47          2HD2      LEU  47   1.959  -6.223  12.307
  357   3HD2  LEU  47          3HD2      LEU  47   3.208  -7.455  12.023
  358    H    GLY  48           H        GLY  48   4.072  -3.117   8.974
  359   1HA   GLY  48          2HA       GLY  48   3.038  -3.879   6.671
  360   2HA   GLY  48          3HA       GLY  48   3.544  -2.220   6.928
  361    H    GLU  49           H        GLU  49   6.460  -2.715   6.949
  362    HA   GLU  49           HA       GLU  49   7.067  -2.444   4.295
  363   1HB   GLU  49          2HB       GLU  49   8.501  -2.126   6.414
  364   2HB   GLU  49          3HB       GLU  49   8.865  -3.848   6.344
  365   1HG   GLU  49          2HG       GLU  49   9.892  -3.549   4.117
  366   2HG   GLU  49          3HG       GLU  49   9.397  -1.848   4.097
  367    H    GLU  50           H        GLU  50   7.166  -5.575   6.061
  368    HA   GLU  50           HA       GLU  50   7.549  -7.061   3.553
  369   1HB   GLU  50          2HB       GLU  50   7.571  -7.727   6.452
  370   2HB   GLU  50          3HB       GLU  50   6.769  -8.924   5.442
  371   1HG   GLU  50          2HG       GLU  50   8.754  -8.953   3.911
  372   2HG   GLU  50          3HG       GLU  50   9.590  -7.856   5.031
  373    H    GLN  51           H        GLN  51   4.885  -6.440   5.864
  374    HA   GLN  51           HA       GLN  51   3.103  -8.275   4.771
  375   1HB   GLN  51          2HB       GLN  51   3.039  -6.718   6.907
  376   2HB   GLN  51          3HB       GLN  51   2.029  -5.683   5.891
  377   1HG   GLN  51          2HG       GLN  51   1.544  -8.630   6.520
  378   2HG   GLN  51          3HG       GLN  51   0.766  -7.272   7.341
  379   1HE2  GLN  51          1HE2      GLN  51  -0.631  -9.400   5.898
  380   2HE2  GLN  51          2HE2      GLN  51  -1.428  -8.639   4.530
  381    H    LEU  52           H        LEU  52   3.418  -4.814   3.943
  382    HA   LEU  52           HA       LEU  52   1.569  -4.454   1.913
  383   1HB   LEU  52          2HB       LEU  52   4.428  -3.448   2.215
  384   2HB   LEU  52          3HB       LEU  52   3.335  -2.835   0.986
  385    HG   LEU  52           HG       LEU  52   2.510  -2.721   3.892
  386   1HD1  LEU  52          1HD1      LEU  52   4.813  -1.651   3.527
  387   2HD1  LEU  52          2HD1      LEU  52   4.034  -0.536   2.400
  388   3HD1  LEU  52          3HD1      LEU  52   3.555  -0.572   4.115
  389   1HD2  LEU  52          1HD2      LEU  52   0.887  -2.309   1.969
  390   2HD2  LEU  52          2HD2      LEU  52   1.049  -0.980   3.132
  391   3HD2  LEU  52          3HD2      LEU  52   1.851  -0.892   1.546
  392    H    ARG  53           H        ARG  53   4.868  -5.897   1.694
  393    HA   ARG  53           HA       ARG  53   5.006  -6.037  -1.098
  394   1HB   ARG  53          2HB       ARG  53   6.671  -6.747   0.928
  395   2HB   ARG  53          3HB       ARG  53   6.052  -8.346   0.545
  396   1HG   ARG  53          2HG       ARG  53   8.013  -8.105  -0.696
  397   2HG   ARG  53          3HG       ARG  53   6.732  -7.890  -1.892
  398   1HD   ARG  53          2HD       ARG  53   7.056  -5.530  -2.004
  399   2HD   ARG  53          3HD       ARG  53   7.910  -5.444  -0.476
  400    HE   ARG  53           HE       ARG  53   9.020  -5.920  -3.085
  401   1HH1  ARG  53          2HH2      ARG  53   9.452  -6.679   0.324
  402   2HH1  ARG  53          1HH2      ARG  53  11.170  -6.913   0.246
  403   1HH2  ARG  53          2HH1      ARG  53  11.313  -6.202  -3.257
  404   2HH2  ARG  53          1HH1      ARG  53  12.246  -6.670  -1.873
  405    H    THR  54           H        THR  54   3.706  -8.434   1.209
  406    HA   THR  54           HA       THR  54   2.853 -10.245  -0.900
  407    HB   THR  54           HB       THR  54   2.203 -10.260   2.071
  408    HG1  THR  54           1HG      THR  54   4.438 -10.413   1.535
  409   1HG2  THR  54          1HG2      THR  54   1.974 -12.395  -0.110
  410   2HG2  THR  54          2HG2      THR  54   1.840 -12.706   1.632
  411   3HG2  THR  54          3HG2      THR  54   0.633 -11.692   0.823
  412    H    ALA  55           H        ALA  55   1.152  -7.890   1.240
  413    HA   ALA  55           HA       ALA  55  -1.474  -8.537   0.375
  414   1HB   ALA  55          1HB       ALA  55  -0.356  -5.900   1.405
  415   2HB   ALA  55          2HB       ALA  55  -2.080  -6.333   1.294
  416   3HB   ALA  55          3HB       ALA  55  -1.010  -7.236   2.379
  417    H    ILE  56           H        ILE  56   0.728  -5.927  -0.730
  418    HA   ILE  56           HA       ILE  56  -0.820  -5.032  -2.927
  419    HB   ILE  56           HB       ILE  56   2.217  -5.142  -2.756
  420   1HG1  ILE  56          2HG1      ILE  56   0.453  -2.723  -2.236
  421   2HG1  ILE  56          3HG1      ILE  56   0.952  -3.755  -0.895
  422   1HG2  ILE  56          1HG2      ILE  56   0.281  -3.487  -4.431
  423   2HG2  ILE  56          2HG2      ILE  56   2.054  -3.323  -4.429
  424   3HG2  ILE  56          3HG2      ILE  56   1.328  -4.781  -5.062
  425   1HD1  ILE  56          1HD1      ILE  56   2.808  -2.198  -2.719
  426   2HD1  ILE  56          2HD1      ILE  56   2.432  -1.875  -1.026
  427   3HD1  ILE  56          3HD1      ILE  56   3.336  -3.340  -1.469
  428    H    ALA  57           H        ALA  57   1.717  -7.669  -2.843
  429    HA   ALA  57           HA       ALA  57   1.411  -8.393  -5.540
  430   1HB   ALA  57          1HB       ALA  57   3.171  -9.300  -4.086
  431   2HB   ALA  57          2HB       ALA  57   1.962 -10.254  -3.196
  432   3HB   ALA  57          3HB       ALA  57   2.270 -10.588  -4.908
  433    H    SER  58           H        SER  58  -0.578  -9.345  -2.740
  434    HA   SER  58           HA       SER  58  -2.270 -11.208  -3.985
  435   1HB   SER  58          2HB       SER  58  -2.101 -10.324  -1.469
  436   2HB   SER  58          3HB       SER  58  -3.415  -9.253  -1.983
  437    HG   SER  58           HG       SER  58  -3.366 -12.087  -2.120
  438    H    ALA  59           H        ALA  59  -2.547  -7.634  -3.822
  439    HA   ALA  59           HA       ALA  59  -4.975  -7.509  -5.415
  440   1HB   ALA  59          1HB       ALA  59  -2.899  -5.391  -4.743
  441   2HB   ALA  59          2HB       ALA  59  -4.481  -5.091  -5.503
  442   3HB   ALA  59          3HB       ALA  59  -4.396  -5.733  -3.849
  443    H    GLY  60           H        GLY  60  -1.507  -7.273  -6.131
  444   1HA   GLY  60          2HA       GLY  60  -0.433  -7.838  -8.106
  445   2HA   GLY  60          3HA       GLY  60  -1.969  -7.860  -8.976
  446    H    HIS  61           H        HIS  61   0.174  -5.526  -7.236
  447    HA   HIS  61           HA       HIS  61  -0.001  -3.711  -9.609
  448   1HB   HIS  61          2HB       HIS  61   0.096  -2.926  -6.687
  449   2HB   HIS  61          3HB       HIS  61   0.387  -1.813  -8.022
  450    HD1  HIS  61           1HD      HIS  61  -1.797  -0.620  -8.971
  451    HD2  HIS  61           2HD      HIS  61  -2.410  -3.907  -6.407
  452    HE1  HIS  61           1HE      HIS  61  -4.222  -0.538  -8.250
  453    H    GLU  62           H        GLU  62   1.895  -2.857 -10.268
  454    HA   GLU  62           HA       GLU  62   4.368  -4.212  -9.655
  455   1HB   GLU  62          2HB       GLU  62   3.703  -1.909 -11.558
  456   2HB   GLU  62          3HB       GLU  62   5.158  -2.910 -11.592
  457   1HG   GLU  62          2HG       GLU  62   2.340  -4.016 -12.071
  458   2HG   GLU  62          3HG       GLU  62   3.453  -3.486 -13.332
  459    H    VAL  63           H        VAL  63   3.821  -3.096  -7.384
  460    HA   VAL  63           HA       VAL  63   4.761  -0.314  -7.173
  461    HB   VAL  63           HB       VAL  63   4.092  -2.283  -4.953
  462   1HG1  VAL  63          1HG1      VAL  63   4.156   0.765  -4.949
  463   2HG1  VAL  63          2HG1      VAL  63   3.710  -0.266  -3.593
  464   3HG1  VAL  63          3HG1      VAL  63   5.373  -0.282  -4.187
  465   1HG2  VAL  63          1HG2      VAL  63   1.868  -0.996  -4.969
  466   2HG2  VAL  63          2HG2      VAL  63   2.380  -0.327  -6.532
  467   3HG2  VAL  63          3HG2      VAL  63   2.145  -2.065  -6.353
  468    H    GLU  64           H        GLU  64   6.729   0.380  -6.291
  469    HA   GLU  64           HA       GLU  64   8.746  -1.678  -5.541
  470   1HB   GLU  64          2HB       GLU  64   9.084  -0.503  -7.880
  471   2HB   GLU  64          3HB       GLU  64   9.417   0.940  -6.906
  472   1HG   GLU  64          2HG       GLU  64  11.538  -0.028  -7.337
  473   2HG   GLU  64          3HG       GLU  64  11.174  -0.521  -5.676
  Start of MODEL    5
    1   1H    MET   1           H1       MET   1  11.381   1.605   8.216
    2   2H    MET   1           H2       MET   1  11.452   1.027   9.778
    3   3H    MET   1           H3       MET   1  10.049   0.930   8.902
    4    HA   MET   1           HA       MET   1   9.751   2.735  10.324
    5   1HB   MET   1          2HB       MET   1  12.426   2.916  10.490
    6   2HB   MET   1          3HB       MET   1  12.234   4.060   9.168
    7   1HG   MET   1          2HG       MET   1  12.226   5.357  11.156
    8   2HG   MET   1          3HG       MET   1  10.547   5.294  10.630
    9   1HE   MET   1          1HE       MET   1  12.333   3.139  14.321
   10   2HE   MET   1          2HE       MET   1  12.812   2.645  12.689
   11   3HE   MET   1          3HE       MET   1  13.208   4.279  13.277
   12    H    THR   2           H        THR   2   8.274   4.187   9.324
   13    HA   THR   2           HA       THR   2   7.005   4.976   7.544
   14    HB   THR   2           HB       THR   2   8.138   6.980   6.620
   15    HG1  THR   2           1HG      THR   2  10.220   5.935   6.547
   16   1HG2  THR   2          1HG2      THR   2   8.513   8.123   8.748
   17   2HG2  THR   2          2HG2      THR   2   7.084   7.080   8.856
   18   3HG2  THR   2          3HG2      THR   2   8.618   6.578   9.608
   19    H    ILE   3           H        ILE   3   6.790   3.022   6.198
   20    HA   ILE   3           HA       ILE   3   8.900   2.476   4.250
   21    HB   ILE   3           HB       ILE   3   6.179   1.186   4.664
   22   1HG1  ILE   3          2HG1      ILE   3   7.372   0.990   6.755
   23   2HG1  ILE   3          3HG1      ILE   3   7.309  -0.556   5.929
   24   1HG2  ILE   3          1HG2      ILE   3   8.663   0.237   3.186
   25   2HG2  ILE   3          2HG2      ILE   3   7.226  -0.750   3.530
   26   3HG2  ILE   3          3HG2      ILE   3   7.091   0.667   2.490
   27   1HD1  ILE   3          1HD1      ILE   3   9.489  -0.225   6.946
   28   2HD1  ILE   3          2HD1      ILE   3   9.665  -0.289   5.188
   29   3HD1  ILE   3          3HD1      ILE   3   9.739   1.271   6.029
   30    H    GLN   4           H        GLN   4   8.982   4.071   2.720
   31    HA   GLN   4           HA       GLN   4   6.508   4.975   1.400
   32   1HB   GLN   4          2HB       GLN   4   8.499   6.509   2.189
   33   2HB   GLN   4          3HB       GLN   4   9.252   5.983   0.672
   34   1HG   GLN   4          2HG       GLN   4   6.940   6.608  -0.424
   35   2HG   GLN   4          3HG       GLN   4   6.611   7.359   1.147
   36   1HE2  GLN   4          1HE2      GLN   4   9.445   7.376  -1.090
   37   2HE2  GLN   4          2HE2      GLN   4   9.544   9.127  -1.140
   38    H    LEU   5           H        LEU   5   5.805   3.821  -0.327
   39    HA   LEU   5           HA       LEU   5   7.807   2.564  -2.176
   40   1HB   LEU   5          2HB       LEU   5   4.945   1.654  -1.835
   41   2HB   LEU   5          3HB       LEU   5   6.271   0.848  -2.658
   42    HG   LEU   5           HG       LEU   5   6.038   1.236   0.361
   43   1HD1  LEU   5          1HD1      LEU   5   5.670  -1.207   0.369
   44   2HD1  LEU   5          2HD1      LEU   5   4.399  -0.331  -0.509
   45   3HD1  LEU   5          3HD1      LEU   5   5.660  -1.211  -1.408
   46   1HD2  LEU   5          1HD2      LEU   5   8.382   1.180  -0.314
   47   2HD2  LEU   5          2HD2      LEU   5   7.965  -0.376   0.415
   48   3HD2  LEU   5          3HD2      LEU   5   8.099  -0.234  -1.352
   49    H    THR   6           H        THR   6   7.152   2.565  -4.441
   50    HA   THR   6           HA       THR   6   5.399   4.863  -5.192
   51    HB   THR   6           HB       THR   6   7.873   3.737  -6.527
   52    HG1  THR   6           1HG      THR   6   8.066   5.106  -4.657
   53   1HG2  THR   6          1HG2      THR   6   6.252   4.513  -8.244
   54   2HG2  THR   6          2HG2      THR   6   6.020   6.033  -7.350
   55   3HG2  THR   6          3HG2      THR   6   7.592   5.658  -8.085
   56    H    VAL   7           H        VAL   7   3.626   4.345  -6.288
   57    HA   VAL   7           HA       VAL   7   3.225   1.554  -7.324
   58    HB   VAL   7           HB       VAL   7   2.018   1.732  -5.358
   59   1HG1  VAL   7          1HG1      VAL   7   0.347   3.435  -4.815
   60   2HG1  VAL   7          2HG1      VAL   7   1.972   4.109  -4.875
   61   3HG1  VAL   7          3HG1      VAL   7   0.844   4.398  -6.214
   62   1HG2  VAL   7          1HG2      VAL   7   0.852   0.811  -7.423
   63   2HG2  VAL   7          2HG2      VAL   7  -0.152   1.219  -6.018
   64   3HG2  VAL   7          3HG2      VAL   7  -0.088   2.309  -7.401
   65    HA   PRO   8           HA       PRO   8   3.272   4.763 -10.578
   66   1HB   PRO   8          2HB       PRO   8   4.054   3.149 -12.696
   67   2HB   PRO   8          3HB       PRO   8   5.181   3.925 -11.546
   68   1HG   PRO   8          2HG       PRO   8   4.111   1.096 -11.447
   69   2HG   PRO   8          3HG       PRO   8   5.799   1.642 -11.254
   70   1HD   PRO   8          2HD       PRO   8   4.250   1.105  -9.126
   71   2HD   PRO   8          3HD       PRO   8   5.376   2.482  -9.091
   72    H    THR   9           H        THR   9   1.955   1.478 -10.607
   73    HA   THR   9           HA       THR   9  -0.274   2.274 -12.359
   74    HB   THR   9           HB       THR   9   1.253   0.216 -12.580
   75    HG1  THR   9           1HG      THR   9  -0.474   0.477 -13.917
   76   1HG2  THR   9          1HG2      THR   9   0.613  -1.804 -11.651
   77   2HG2  THR   9          2HG2      THR   9   0.906  -0.694 -10.279
   78   3HG2  THR   9          3HG2      THR   9  -0.752  -1.146 -10.776
   79    H    ILE  10           H        ILE  10  -0.155   3.434  -9.511
   80    HA   ILE  10           HA       ILE  10  -2.319   2.598  -8.179
   81    HB   ILE  10           HB       ILE  10  -0.804   4.941  -8.371
   82   1HG1  ILE  10          2HG1      ILE  10  -3.290   4.227  -6.895
   83   2HG1  ILE  10          3HG1      ILE  10  -1.629   3.901  -6.438
   84   1HG2  ILE  10          1HG2      ILE  10  -2.200   6.830  -8.754
   85   2HG2  ILE  10          2HG2      ILE  10  -2.334   5.791 -10.180
   86   3HG2  ILE  10          3HG2      ILE  10  -3.645   5.824  -8.976
   87   1HD1  ILE  10          1HD1      ILE  10  -2.963   6.654  -6.520
   88   2HD1  ILE  10          2HD1      ILE  10  -2.478   5.756  -5.074
   89   3HD1  ILE  10          3HD1      ILE  10  -1.239   6.378  -6.177
   90    H    ALA  11           H        ALA  11  -4.587   3.237  -8.232
   91    HA   ALA  11           HA       ALA  11  -6.641   3.260  -9.091
   92   1HB   ALA  11          1HB       ALA  11  -7.172   4.511 -11.061
   93   2HB   ALA  11          2HB       ALA  11  -5.935   5.374 -10.130
   94   3HB   ALA  11          3HB       ALA  11  -5.492   4.494 -11.613
   95    H    CYS  12           H        CYS  12  -4.244   1.627 -11.038
   96    HA   CYS  12           HA       CYS  12  -5.497   0.245 -12.951
   97   1HB   CYS  12          2HB       CYS  12  -3.193  -0.127 -12.461
   98   2HB   CYS  12          3HB       CYS  12  -3.560  -0.779 -10.852
   99    HG   CYS  12           HG       CYS  12  -4.877  -2.896 -11.708
  100    H    GLU  13           H        GLU  13  -5.536  -0.968  -9.566
  101    HA   GLU  13           HA       GLU  13  -7.588  -2.960 -10.307
  102   1HB   GLU  13          2HB       GLU  13  -5.632  -3.703  -9.052
  103   2HB   GLU  13          3HB       GLU  13  -5.951  -2.556  -7.756
  104   1HG   GLU  13          2HG       GLU  13  -6.670  -4.804  -7.140
  105   2HG   GLU  13          3HG       GLU  13  -8.081  -3.746  -7.237
  106    H    ALA  14           H        ALA  14  -7.333  -1.195  -7.229
  107    HA   ALA  14           HA       ALA  14  -9.818   0.331  -7.772
  108   1HB   ALA  14          1HB       ALA  14 -10.592  -1.838  -6.890
  109   2HB   ALA  14          2HB       ALA  14  -9.521  -1.668  -5.486
  110   3HB   ALA  14          3HB       ALA  14 -10.878  -0.541  -5.716
  111    H    CYS  15           H        CYS  15  -7.169   1.188  -7.637
  112    HA   CYS  15           HA       CYS  15  -5.888   2.783  -6.803
  113   1HB   CYS  15          2HB       CYS  15  -8.253   3.471  -5.012
  114   2HB   CYS  15          3HB       CYS  15  -6.679   4.253  -4.864
  115    HG   CYS  15           HG       CYS  15  -8.536   4.007  -7.553
  116    H    ALA  16           H        ALA  16  -4.370   3.174  -5.237
  117    HA   ALA  16           HA       ALA  16  -3.386   0.948  -3.829
  118   1HB   ALA  16          1HB       ALA  16  -1.932   2.613  -2.645
  119   2HB   ALA  16          2HB       ALA  16  -1.942   2.774  -4.412
  120   3HB   ALA  16          3HB       ALA  16  -2.882   3.908  -3.414
  121    H    GLU  17           H        GLU  17  -5.699   3.457  -2.701
  122    HA   GLU  17           HA       GLU  17  -5.949   2.936  -0.072
  123   1HB   GLU  17          2HB       GLU  17  -7.584   3.969  -2.191
  124   2HB   GLU  17          3HB       GLU  17  -8.594   2.807  -1.341
  125   1HG   GLU  17          2HG       GLU  17  -7.001   4.939   0.147
  126   2HG   GLU  17          3HG       GLU  17  -8.568   5.244  -0.592
  127    H    ALA  18           H        ALA  18  -6.955   0.708  -2.716
  128    HA   ALA  18           HA       ALA  18  -8.308  -1.229  -1.215
  129   1HB   ALA  18          1HB       ALA  18  -6.365  -1.683  -3.520
  130   2HB   ALA  18          2HB       ALA  18  -7.643  -2.786  -2.972
  131   3HB   ALA  18          3HB       ALA  18  -8.069  -1.216  -3.680
  132    H    VAL  19           H        VAL  19  -4.722  -0.800  -1.646
  133    HA   VAL  19           HA       VAL  19  -4.229  -3.174  -0.090
  134    HB   VAL  19           HB       VAL  19  -2.558  -1.961  -1.788
  135   1HG1  VAL  19          1HG1      VAL  19  -0.679  -0.960  -0.595
  136   2HG1  VAL  19          2HG1      VAL  19  -2.103   0.019  -0.232
  137   3HG1  VAL  19          3HG1      VAL  19  -1.476  -1.136   0.971
  138   1HG2  VAL  19          1HG2      VAL  19  -0.817  -3.376  -0.495
  139   2HG2  VAL  19          2HG2      VAL  19  -2.049  -3.625   0.711
  140   3HG2  VAL  19          3HG2      VAL  19  -2.316  -4.214  -0.937
  141    H    THR  20           H        THR  20  -4.362   0.370   0.615
  142    HA   THR  20           HA       THR  20  -3.505   0.323   3.273
  143    HB   THR  20           HB       THR  20  -5.786   1.894   1.986
  144    HG1  THR  20           1HG      THR  20  -4.238   3.272   1.510
  145   1HG2  THR  20          1HG2      THR  20  -6.208   2.035   4.307
  146   2HG2  THR  20          2HG2      THR  20  -4.499   2.314   4.671
  147   3HG2  THR  20          3HG2      THR  20  -5.449   3.528   3.763
  148    H    LYS  21           H        LYS  21  -6.848  -0.241   2.075
  149    HA   LYS  21           HA       LYS  21  -7.809  -0.856   4.719
  150   1HB   LYS  21          2HB       LYS  21  -9.142  -1.437   2.041
  151   2HB   LYS  21          3HB       LYS  21  -9.904  -1.370   3.652
  152   1HG   LYS  21          2HG       LYS  21  -8.678   0.990   3.784
  153   2HG   LYS  21          3HG       LYS  21  -8.645   0.882   2.044
  154   1HD   LYS  21          2HD       LYS  21 -11.210   0.671   3.686
  155   2HD   LYS  21          3HD       LYS  21 -10.456   2.190   3.170
  156   1HE   LYS  21          2HE       LYS  21 -10.502   0.993   0.754
  157   2HE   LYS  21          3HE       LYS  21 -11.883   0.145   1.476
  158   1HZ   LYS  21          1HZ       LYS  21 -12.536   2.199   0.388
  159   2HZ   LYS  21          2HZ       LYS  21 -12.703   2.443   2.021
  160   3HZ   LYS  21          3HZ       LYS  21 -11.374   3.026   1.211
  161    H    ALA  22           H        ALA  22  -6.622  -2.876   2.069
  162    HA   ALA  22           HA       ALA  22  -7.225  -5.393   3.263
  163   1HB   ALA  22          1HB       ALA  22  -4.797  -4.689   1.599
  164   2HB   ALA  22          2HB       ALA  22  -5.409  -6.314   1.955
  165   3HB   ALA  22          3HB       ALA  22  -6.388  -5.195   0.971
  166    H    VAL  23           H        VAL  23  -4.228  -3.471   3.479
  167    HA   VAL  23           HA       VAL  23  -2.784  -5.231   5.154
  168    HB   VAL  23           HB       VAL  23  -2.486  -2.298   4.407
  169   1HG1  VAL  23          1HG1      VAL  23  -1.176  -2.536   6.477
  170   2HG1  VAL  23          2HG1      VAL  23  -0.390  -3.993   5.816
  171   3HG1  VAL  23          3HG1      VAL  23  -0.119  -2.433   5.051
  172   1HG2  VAL  23          1HG2      VAL  23  -0.741  -4.644   3.569
  173   2HG2  VAL  23          2HG2      VAL  23  -2.252  -4.304   2.729
  174   3HG2  VAL  23          3HG2      VAL  23  -0.971  -3.072   2.772
  175    H    GLN  24           H        GLN  24  -4.777  -2.337   5.852
  176    HA   GLN  24           HA       GLN  24  -4.441  -2.226   8.642
  177   1HB   GLN  24          2HB       GLN  24  -6.768  -1.647   6.796
  178   2HB   GLN  24          3HB       GLN  24  -6.851  -1.305   8.520
  179   1HG   GLN  24          2HG       GLN  24  -4.480  -0.284   6.919
  180   2HG   GLN  24          3HG       GLN  24  -6.032   0.528   6.784
  181   1HE2  GLN  24          1HE2      GLN  24  -3.328   1.298   8.001
  182   2HE2  GLN  24          2HE2      GLN  24  -3.715   1.846   9.618
  183    H    ASN  25           H        ASN  25  -5.975  -4.868   6.802
  184    HA   ASN  25           HA       ASN  25  -7.683  -5.713   8.995
  185   1HB   ASN  25          2HB       ASN  25  -6.349  -7.396   6.834
  186   2HB   ASN  25          3HB       ASN  25  -7.519  -7.971   8.011
  187   1HD2  ASN  25          1HD2      ASN  25  -7.245  -6.838   4.919
  188   2HD2  ASN  25          2HD2      ASN  25  -8.954  -6.468   4.639
  189    H    GLU  26           H        GLU  26  -4.300  -6.556   7.994
  190    HA   GLU  26           HA       GLU  26  -3.857  -8.059  10.468
  191   1HB   GLU  26          2HB       GLU  26  -1.991  -7.195   8.225
  192   2HB   GLU  26          3HB       GLU  26  -1.537  -8.192   9.621
  193   1HG   GLU  26          2HG       GLU  26  -3.379  -9.813   8.887
  194   2HG   GLU  26          3HG       GLU  26  -3.484  -8.877   7.383
  195    H    ASP  27           H        ASP  27  -2.398  -5.077   9.046
  196    HA   ASP  27           HA       ASP  27  -1.348  -4.499  11.760
  197   1HB   ASP  27          2HB       ASP  27   0.173  -4.558   9.692
  198   2HB   ASP  27          3HB       ASP  27  -0.534  -3.030   9.221
  199    H    ALA  28           H        ALA  28  -3.637  -4.134  12.254
  200    HA   ALA  28           HA       ALA  28  -5.157  -1.938  11.215
  201   1HB   ALA  28          1HB       ALA  28  -6.112  -3.844  12.472
  202   2HB   ALA  28          2HB       ALA  28  -5.286  -3.291  13.947
  203   3HB   ALA  28          3HB       ALA  28  -6.558  -2.289  13.209
  204    H    GLN  29           H        GLN  29  -2.571  -2.116  13.445
  205    HA   GLN  29           HA       GLN  29  -2.908   0.526  14.640
  206   1HB   GLN  29          2HB       GLN  29  -0.770  -0.037  15.714
  207   2HB   GLN  29          3HB       GLN  29  -1.986  -1.288  15.971
  208   1HG   GLN  29          2HG       GLN  29  -0.924  -2.742  14.311
  209   2HG   GLN  29          3HG       GLN  29   0.136  -1.417  13.787
  210   1HE2  GLN  29          1HE2      GLN  29   1.535  -3.329  14.075
  211   2HE2  GLN  29          2HE2      GLN  29   2.347  -3.482  15.660
  212    H    ALA  30           H        ALA  30  -2.044  -0.289  11.489
  213    HA   ALA  30           HA       ALA  30   0.396   1.252  11.296
  214   1HB   ALA  30          1HB       ALA  30  -1.553   0.351   9.124
  215   2HB   ALA  30          2HB       ALA  30   0.102   0.940   8.871
  216   3HB   ALA  30          3HB       ALA  30  -0.186  -0.590   9.714
  217    H    THR  31           H        THR  31   0.680   3.326  10.436
  218    HA   THR  31           HA       THR  31  -1.777   5.013  10.080
  219    HB   THR  31           HB       THR  31   1.088   5.822  10.641
  220    HG1  THR  31           1HG      THR  31  -0.212   4.882  12.370
  221   1HG2  THR  31          1HG2      THR  31  -0.084   7.524   9.268
  222   2HG2  THR  31          2HG2      THR  31  -1.465   7.480  10.388
  223   3HG2  THR  31          3HG2      THR  31   0.107   8.092  10.936
  224    H    VAL  32           H        VAL  32  -2.128   5.772   8.051
  225    HA   VAL  32           HA       VAL  32  -0.211   4.981   5.895
  226    HB   VAL  32           HB       VAL  32  -2.223   4.731   4.480
  227   1HG1  VAL  32          1HG1      VAL  32  -2.336   2.516   4.978
  228   2HG1  VAL  32          2HG1      VAL  32  -1.050   2.890   6.122
  229   3HG1  VAL  32          3HG1      VAL  32  -2.721   2.795   6.691
  230   1HG2  VAL  32          1HG2      VAL  32  -3.802   4.903   7.103
  231   2HG2  VAL  32          2HG2      VAL  32  -3.844   6.101   5.793
  232   3HG2  VAL  32          3HG2      VAL  32  -4.449   4.473   5.526
  233    H    GLN  33           H        GLN  33   0.275   6.436   4.364
  234    HA   GLN  33           HA       GLN  33  -1.324   8.904   4.061
  235   1HB   GLN  33          2HB       GLN  33   1.672   8.706   4.595
  236   2HB   GLN  33          3HB       GLN  33   0.968  10.092   3.752
  237   1HG   GLN  33          2HG       GLN  33   0.220   9.170   6.569
  238   2HG   GLN  33          3HG       GLN  33   1.368  10.453   6.185
  239   1HE2  GLN  33          1HE2      GLN  33  -0.721  11.132   7.819
  240   2HE2  GLN  33          2HE2      GLN  33  -1.837  12.144   6.920
  241    H    VAL  34           H        VAL  34  -2.112   8.395   2.062
  242    HA   VAL  34           HA       VAL  34  -0.183   7.404   0.020
  243    HB   VAL  34           HB       VAL  34  -1.600   5.602   0.664
  244   1HG1  VAL  34          1HG1      VAL  34  -3.560   6.662   1.577
  245   2HG1  VAL  34          2HG1      VAL  34  -4.020   7.303  -0.008
  246   3HG1  VAL  34          3HG1      VAL  34  -4.016   5.559   0.274
  247   1HG2  VAL  34          1HG2      VAL  34  -0.885   5.808  -1.675
  248   2HG2  VAL  34          2HG2      VAL  34  -2.459   5.008  -1.523
  249   3HG2  VAL  34          3HG2      VAL  34  -2.362   6.692  -2.074
  250    H    ASP  35           H        ASP  35   0.244   8.886  -1.441
  251    HA   ASP  35           HA       ASP  35  -1.484  11.274  -1.560
  252   1HB   ASP  35          2HB       ASP  35   1.213  10.652  -2.787
  253   2HB   ASP  35          3HB       ASP  35   0.371  12.201  -2.863
  254    H    LEU  36           H        LEU  36  -3.256  10.013  -2.547
  255    HA   LEU  36           HA       LEU  36  -3.195   8.852  -5.116
  256   1HB   LEU  36          2HB       LEU  36  -5.401  10.384  -3.676
  257   2HB   LEU  36          3HB       LEU  36  -5.587   9.762  -5.316
  258    HG   LEU  36           HG       LEU  36  -4.955   7.459  -4.447
  259   1HD1  LEU  36          1HD1      LEU  36  -5.637   8.797  -1.785
  260   2HD1  LEU  36          2HD1      LEU  36  -5.485   7.047  -2.057
  261   3HD1  LEU  36          3HD1      LEU  36  -4.075   8.094  -2.245
  262   1HD2  LEU  36          1HD2      LEU  36  -7.278   7.039  -3.705
  263   2HD2  LEU  36          2HD2      LEU  36  -7.534   8.786  -3.509
  264   3HD2  LEU  36          3HD2      LEU  36  -7.234   8.099  -5.121
  265    H    THR  37           H        THR  37  -2.975  12.270  -4.251
  266    HA   THR  37           HA       THR  37  -3.416  13.632  -6.574
  267    HB   THR  37           HB       THR  37  -0.946  13.915  -4.811
  268    HG1  THR  37           1HG      THR  37  -3.602  14.692  -4.196
  269   1HG2  THR  37          1HG2      THR  37  -1.163  15.583  -6.624
  270   2HG2  THR  37          2HG2      THR  37  -2.805  15.987  -6.076
  271   3HG2  THR  37          3HG2      THR  37  -1.407  16.330  -5.034
  272    H    SER  38           H        SER  38  -0.720  11.427  -5.830
  273    HA   SER  38           HA       SER  38   0.381  11.779  -8.584
  274   1HB   SER  38          2HB       SER  38   1.933  11.490  -5.982
  275   2HB   SER  38          3HB       SER  38   2.621  11.612  -7.629
  276    HG   SER  38           HG       SER  38   2.557  13.638  -6.514
  277    H    LYS  39           H        LYS  39   2.247   9.558  -6.931
  278    HA   LYS  39           HA       LYS  39   0.560   7.224  -7.346
  279   1HB   LYS  39          2HB       LYS  39   1.910   6.309  -9.217
  280   2HB   LYS  39          3HB       LYS  39   0.976   7.737  -9.631
  281   1HG   LYS  39          2HG       LYS  39   3.236   9.017  -9.064
  282   2HG   LYS  39          3HG       LYS  39   3.976   7.455  -9.360
  283   1HD   LYS  39          2HD       LYS  39   2.098   8.917 -11.321
  284   2HD   LYS  39          3HD       LYS  39   3.827   9.184 -11.233
  285   1HE   LYS  39          2HE       LYS  39   3.825   7.743 -12.948
  286   2HE   LYS  39          3HE       LYS  39   4.086   6.606 -11.636
  287   1HZ   LYS  39          1HZ       LYS  39   1.463   7.207 -12.904
  288   2HZ   LYS  39          2HZ       LYS  39   2.420   5.939 -13.294
  289   3HZ   LYS  39          3HZ       LYS  39   1.731   5.973 -11.842
  290    H    LYS  40           H        LYS  40   1.831   8.222  -5.060
  291    HA   LYS  40           HA       LYS  40   3.713   6.028  -4.507
  292   1HB   LYS  40          2HB       LYS  40   5.118   7.527  -3.133
  293   2HB   LYS  40          3HB       LYS  40   5.155   7.879  -4.852
  294   1HG   LYS  40          2HG       LYS  40   5.076   9.991  -3.968
  295   2HG   LYS  40          3HG       LYS  40   3.409   9.719  -4.403
  296   1HD   LYS  40          2HD       LYS  40   3.439  10.819  -2.340
  297   2HD   LYS  40          3HD       LYS  40   2.907   9.179  -1.981
  298   1HE   LYS  40          2HE       LYS  40   5.308   8.715  -1.190
  299   2HE   LYS  40          3HE       LYS  40   5.635  10.434  -1.477
  300   1HZ   LYS  40          1HZ       LYS  40   3.491  10.619   0.035
  301   2HZ   LYS  40          2HZ       LYS  40   4.051   9.192   0.617
  302   3HZ   LYS  40          3HZ       LYS  40   5.027  10.501   0.675
  303    H    VAL  41           H        VAL  41   3.832   5.425  -2.294
  304    HA   VAL  41           HA       VAL  41   1.449   6.123  -0.680
  305    HB   VAL  41           HB       VAL  41   0.839   4.153  -1.977
  306   1HG1  VAL  41          1HG1      VAL  41   3.343   2.843  -0.862
  307   2HG1  VAL  41          2HG1      VAL  41   2.073   2.021  -1.787
  308   3HG1  VAL  41          3HG1      VAL  41   3.057   3.263  -2.570
  309   1HG2  VAL  41          1HG2      VAL  41   0.184   4.281   0.456
  310   2HG2  VAL  41          2HG2      VAL  41   0.259   2.635  -0.195
  311   3HG2  VAL  41          3HG2      VAL  41   1.566   3.240   0.833
  312    H    THR  42           H        THR  42   1.827   6.011   1.578
  313    HA   THR  42           HA       THR  42   4.566   5.238   2.426
  314    HB   THR  42           HB       THR  42   3.124   7.770   3.265
  315    HG1  THR  42           1HG      THR  42   4.654   7.112   1.068
  316   1HG2  THR  42          1HG2      THR  42   5.409   8.429   3.979
  317   2HG2  THR  42          2HG2      THR  42   4.844   6.983   4.835
  318   3HG2  THR  42          3HG2      THR  42   6.019   6.827   3.513
  319    H    ILE  43           H        ILE  43   4.406   3.695   3.861
  320    HA   ILE  43           HA       ILE  43   1.978   3.500   5.603
  321    HB   ILE  43           HB       ILE  43   3.869   1.393   4.527
  322   1HG1  ILE  43          2HG1      ILE  43   2.372   2.258   2.776
  323   2HG1  ILE  43          3HG1      ILE  43   2.022   0.595   3.191
  324   1HG2  ILE  43          1HG2      ILE  43   1.503   1.185   6.419
  325   2HG2  ILE  43          2HG2      ILE  43   2.132  -0.200   5.497
  326   3HG2  ILE  43          3HG2      ILE  43   3.177   0.644   6.641
  327   1HD1  ILE  43          1HD1      ILE  43  -0.049   1.799   2.866
  328   2HD1  ILE  43          2HD1      ILE  43   0.079   1.317   4.561
  329   3HD1  ILE  43          3HD1      ILE  43   0.392   3.005   4.080
  330    H    THR  44           H        THR  44   2.460   4.415   7.472
  331    HA   THR  44           HA       THR  44   5.182   4.194   8.641
  332    HB   THR  44           HB       THR  44   2.816   5.978   9.244
  333    HG1  THR  44           1HG      THR  44   4.173   7.518   8.357
  334   1HG2  THR  44          1HG2      THR  44   4.410   7.180  10.745
  335   2HG2  THR  44          2HG2      THR  44   4.063   5.551  11.338
  336   3HG2  THR  44          3HG2      THR  44   5.598   5.883  10.507
  337    H    SER  45           H        SER  45   5.221   2.116   9.305
  338    HA   SER  45           HA       SER  45   3.792   1.471  11.783
  339   1HB   SER  45          2HB       SER  45   3.399  -0.860  10.770
  340   2HB   SER  45          3HB       SER  45   2.310   0.391  10.196
  341    HG   SER  45           HG       SER  45   3.623  -1.102   8.697
  342    H    ALA  46           H        ALA  46   4.779  -0.672  12.584
  343    HA   ALA  46           HA       ALA  46   7.688  -0.507  12.529
  344   1HB   ALA  46          1HB       ALA  46   6.453  -1.004  14.598
  345   2HB   ALA  46          2HB       ALA  46   5.792  -2.484  13.867
  346   3HB   ALA  46          3HB       ALA  46   7.538  -2.340  14.163
  347    H    LEU  47           H        LEU  47   5.173  -2.587  11.119
  348    HA   LEU  47           HA       LEU  47   7.154  -4.225   9.615
  349   1HB   LEU  47          2HB       LEU  47   5.746  -6.098   9.733
  350   2HB   LEU  47          3HB       LEU  47   6.005  -5.558  11.385
  351    HG   LEU  47           HG       LEU  47   3.657  -4.286  10.968
  352   1HD1  LEU  47          1HD1      LEU  47   3.426  -5.093   8.555
  353   2HD1  LEU  47          2HD1      LEU  47   3.465  -6.755   9.165
  354   3HD1  LEU  47          3HD1      LEU  47   2.148  -5.663   9.626
  355   1HD2  LEU  47          1HD2      LEU  47   3.915  -7.258  11.548
  356   2HD2  LEU  47          2HD2      LEU  47   4.071  -5.935  12.728
  357   3HD2  LEU  47          3HD2      LEU  47   2.516  -6.231  11.932
  358    H    GLY  48           H        GLY  48   6.746  -3.938   7.446
  359   1HA   GLY  48          2HA       GLY  48   4.147  -2.960   6.525
  360   2HA   GLY  48          3HA       GLY  48   5.423  -1.732   6.459
  361    H    GLU  49           H        GLU  49   7.572  -2.665   5.517
  362    HA   GLU  49           HA       GLU  49   7.120  -3.080   2.836
  363   1HB   GLU  49          2HB       GLU  49   9.249  -2.310   3.976
  364   2HB   GLU  49          3HB       GLU  49   9.647  -4.011   4.277
  365   1HG   GLU  49          2HG       GLU  49   9.541  -4.450   1.869
  366   2HG   GLU  49          3HG       GLU  49   9.079  -2.752   1.566
  367    H    GLU  50           H        GLU  50   7.794  -5.571   5.246
  368    HA   GLU  50           HA       GLU  50   7.879  -7.892   3.591
  369   1HB   GLU  50          2HB       GLU  50   7.603  -7.155   6.507
  370   2HB   GLU  50          3HB       GLU  50   6.906  -8.693   6.098
  371   1HG   GLU  50          2HG       GLU  50   9.048  -9.423   5.084
  372   2HG   GLU  50          3HG       GLU  50   9.762  -7.837   5.445
  373    H    GLN  51           H        GLN  51   5.172  -6.663   5.619
  374    HA   GLN  51           HA       GLN  51   3.376  -8.572   4.647
  375   1HB   GLN  51          2HB       GLN  51   3.210  -6.980   6.719
  376   2HB   GLN  51          3HB       GLN  51   2.507  -5.813   5.579
  377   1HG   GLN  51          2HG       GLN  51   1.097  -8.001   4.864
  378   2HG   GLN  51          3HG       GLN  51   1.528  -8.501   6.504
  379   1HE2  GLN  51          1HE2      GLN  51   1.087  -6.614   8.190
  380   2HE2  GLN  51          2HE2      GLN  51  -0.380  -5.681   7.944
  381    H    LEU  52           H        LEU  52   3.822  -5.138   3.710
  382    HA   LEU  52           HA       LEU  52   1.992  -4.886   1.672
  383   1HB   LEU  52          2HB       LEU  52   4.787  -3.743   1.989
  384   2HB   LEU  52          3HB       LEU  52   3.686  -3.197   0.731
  385    HG   LEU  52           HG       LEU  52   2.852  -3.139   3.649
  386   1HD1  LEU  52          1HD1      LEU  52   5.015  -1.844   3.205
  387   2HD1  LEU  52          2HD1      LEU  52   4.069  -0.795   2.139
  388   3HD1  LEU  52          3HD1      LEU  52   3.666  -0.924   3.866
  389   1HD2  LEU  52          1HD2      LEU  52   1.232  -1.516   2.891
  390   2HD2  LEU  52          2HD2      LEU  52   1.956  -1.454   1.267
  391   3HD2  LEU  52          3HD2      LEU  52   1.110  -2.909   1.815
  392    H    ARG  53           H        ARG  53   5.312  -6.318   1.416
  393    HA   ARG  53           HA       ARG  53   5.378  -6.652  -1.343
  394   1HB   ARG  53          2HB       ARG  53   6.837  -7.627   0.894
  395   2HB   ARG  53          3HB       ARG  53   6.232  -9.064   0.134
  396   1HG   ARG  53          2HG       ARG  53   8.346  -8.656  -0.843
  397   2HG   ARG  53          3HG       ARG  53   7.203  -8.104  -2.087
  398   1HD   ARG  53          2HD       ARG  53   7.481  -5.757  -1.266
  399   2HD   ARG  53          3HD       ARG  53   8.506  -6.367   0.051
  400    HE   ARG  53           HE       ARG  53   9.507  -7.048  -2.605
  401   1HH1  ARG  53          2HH2      ARG  53   9.310  -4.463  -0.233
  402   2HH1  ARG  53          1HH2      ARG  53  10.961  -3.987  -0.300
  403   1HH2  ARG  53          2HH1      ARG  53  11.634  -6.149  -3.114
  404   2HH2  ARG  53          1HH1      ARG  53  12.192  -4.760  -2.227
  405    H    THR  54           H        THR  54   3.992  -8.956   1.050
  406    HA   THR  54           HA       THR  54   2.862 -10.617  -0.992
  407    HB   THR  54           HB       THR  54   2.090 -10.494   1.953
  408    HG1  THR  54           1HG      THR  54   4.290 -11.712   0.642
  409   1HG2  THR  54          1HG2      THR  54   0.687 -12.008   0.575
  410   2HG2  THR  54          2HG2      THR  54   2.146 -12.778  -0.084
  411   3HG2  THR  54          3HG2      THR  54   1.759 -12.932   1.643
  412    H    ALA  55           H        ALA  55   1.384  -8.226   1.231
  413    HA   ALA  55           HA       ALA  55  -1.299  -8.667   0.491
  414   1HB   ALA  55          1HB       ALA  55  -0.034  -6.151   1.650
  415   2HB   ALA  55          2HB       ALA  55  -1.765  -6.545   1.639
  416   3HB   ALA  55          3HB       ALA  55  -0.642  -7.536   2.578
  417    H    ILE  56           H        ILE  56   0.936  -6.033  -0.593
  418    HA   ILE  56           HA       ILE  56  -0.698  -5.021  -2.677
  419    HB   ILE  56           HB       ILE  56   2.335  -5.306  -2.711
  420   1HG1  ILE  56          2HG1      ILE  56   0.622  -2.867  -2.033
  421   2HG1  ILE  56          3HG1      ILE  56   1.332  -3.912  -0.786
  422   1HG2  ILE  56          1HG2      ILE  56   1.325  -4.929  -4.980
  423   2HG2  ILE  56          2HG2      ILE  56   0.491  -3.504  -4.321
  424   3HG2  ILE  56          3HG2      ILE  56   2.270  -3.577  -4.418
  425   1HD1  ILE  56          1HD1      ILE  56   2.717  -1.992  -1.059
  426   2HD1  ILE  56          2HD1      ILE  56   3.601  -3.392  -1.717
  427   3HD1  ILE  56          3HD1      ILE  56   2.820  -2.218  -2.801
  428    H    ALA  57           H        ALA  57   1.785  -7.708  -2.900
  429    HA   ALA  57           HA       ALA  57   1.320  -8.218  -5.606
  430   1HB   ALA  57          1HB       ALA  57   3.217  -9.170  -4.400
  431   2HB   ALA  57          2HB       ALA  57   2.130 -10.199  -3.435
  432   3HB   ALA  57          3HB       ALA  57   2.287 -10.458  -5.183
  433    H    SER  58           H        SER  58  -0.552  -9.374  -2.821
  434    HA   SER  58           HA       SER  58  -2.198 -11.270  -4.049
  435   1HB   SER  58          2HB       SER  58  -2.116 -10.477  -1.590
  436   2HB   SER  58          3HB       SER  58  -3.264  -9.214  -2.085
  437    HG   SER  58           HG       SER  58  -4.321 -11.087  -1.321
  438    H    ALA  59           H        ALA  59  -2.432  -7.694  -4.165
  439    HA   ALA  59           HA       ALA  59  -4.839  -7.741  -5.879
  440   1HB   ALA  59          1HB       ALA  59  -3.003  -5.470  -5.011
  441   2HB   ALA  59          2HB       ALA  59  -4.505  -5.300  -5.940
  442   3HB   ALA  59          3HB       ALA  59  -4.559  -5.913  -4.275
  443    H    GLY  60           H        GLY  60  -1.336  -7.208  -6.112
  444   1HA   GLY  60          2HA       GLY  60   0.061  -7.738  -7.885
  445   2HA   GLY  60          3HA       GLY  60  -1.330  -8.009  -8.939
  446    H    HIS  61           H        HIS  61  -0.148  -5.214  -7.007
  447    HA   HIS  61           HA       HIS  61  -0.247  -3.475  -9.443
  448   1HB   HIS  61          2HB       HIS  61   0.126  -2.820  -6.514
  449   2HB   HIS  61          3HB       HIS  61   0.414  -1.670  -7.820
  450    HD1  HIS  61           1HD      HIS  61  -1.764  -0.573  -8.997
  451    HD2  HIS  61           2HD      HIS  61  -2.358  -3.210  -5.756
  452    HE1  HIS  61           1HE      HIS  61  -4.086  -0.124  -8.102
  453    H    GLU  62           H        GLU  62   1.618  -2.648 -10.260
  454    HA   GLU  62           HA       GLU  62   4.073  -4.125  -9.927
  455   1HB   GLU  62          2HB       GLU  62   3.395  -1.699 -11.657
  456   2HB   GLU  62          3HB       GLU  62   4.746  -2.808 -11.896
  457   1HG   GLU  62          2HG       GLU  62   1.842  -3.760 -12.081
  458   2HG   GLU  62          3HG       GLU  62   2.706  -3.027 -13.429
  459    H    VAL  63           H        VAL  63   3.808  -3.115  -7.587
  460    HA   VAL  63           HA       VAL  63   4.756  -0.366  -7.298
  461    HB   VAL  63           HB       VAL  63   4.350  -2.513  -5.178
  462   1HG1  VAL  63          1HG1      VAL  63   5.734  -0.616  -4.362
  463   2HG1  VAL  63          2HG1      VAL  63   4.467   0.519  -4.889
  464   3HG1  VAL  63          3HG1      VAL  63   4.151  -0.633  -3.597
  465   1HG2  VAL  63          1HG2      VAL  63   2.158  -1.212  -4.832
  466   2HG2  VAL  63          2HG2      VAL  63   2.502  -0.414  -6.374
  467   3HG2  VAL  63          3HG2      VAL  63   2.270  -2.165  -6.319
  468    H    GLU  64           H        GLU  64   6.749   0.368  -6.441
  469    HA   GLU  64           HA       GLU  64   8.890  -1.604  -5.980
  470   1HB   GLU  64          2HB       GLU  64   8.953  -0.777  -8.382
  471   2HB   GLU  64          3HB       GLU  64   9.210   0.860  -7.759
  472   1HG   GLU  64          2HG       GLU  64  11.349   0.228  -6.832
  473   2HG   GLU  64          3HG       GLU  64  11.016  -1.496  -7.068
  Start of MODEL    6
    1   1H    MET   1           H1       MET   1  10.744   2.355  10.028
    2   2H    MET   1           H2       MET   1  11.352   2.988  11.446
    3   3H    MET   1           H3       MET   1   9.716   2.792  11.200
    4    HA   MET   1           HA       MET   1  10.205   5.085  10.906
    5   1HB   MET   1          2HB       MET   1  12.304   3.912   9.051
    6   2HB   MET   1          3HB       MET   1  11.578   5.465   8.646
    7   1HG   MET   1          2HG       MET   1  12.205   6.393  10.826
    8   2HG   MET   1          3HG       MET   1  13.034   4.879  11.241
    9   1HE   MET   1          1HE       MET   1  15.884   7.552  10.610
   10   2HE   MET   1          2HE       MET   1  14.264   7.897  11.255
   11   3HE   MET   1          3HE       MET   1  15.154   6.452  11.803
   12    H    THR   2           H        THR   2   9.434   6.285   8.765
   13    HA   THR   2           HA       THR   2   7.147   4.760   7.801
   14    HB   THR   2           HB       THR   2   7.090   7.216   8.363
   15    HG1  THR   2           1HG      THR   2   5.464   6.396   7.215
   16   1HG2  THR   2          1HG2      THR   2   9.233   7.904   7.215
   17   2HG2  THR   2          2HG2      THR   2   8.442   7.600   5.654
   18   3HG2  THR   2          3HG2      THR   2   7.811   8.849   6.733
   19    H    ILE   3           H        ILE   3   6.964   3.823   5.756
   20    HA   ILE   3           HA       ILE   3   9.435   3.667   4.105
   21    HB   ILE   3           HB       ILE   3   6.993   1.861   4.122
   22   1HG1  ILE   3          2HG1      ILE   3   7.920   1.587   6.312
   23   2HG1  ILE   3          3HG1      ILE   3   8.366   0.203   5.324
   24   1HG2  ILE   3          1HG2      ILE   3   9.792   1.533   2.966
   25   2HG2  ILE   3          2HG2      ILE   3   8.483   0.331   2.905
   26   3HG2  ILE   3          3HG2      ILE   3   8.310   1.885   2.069
   27   1HD1  ILE   3          1HD1      ILE   3  10.202   2.527   6.067
   28   2HD1  ILE   3          2HD1      ILE   3  10.236   0.886   6.720
   29   3HD1  ILE   3          3HD1      ILE   3  10.659   1.160   5.025
   30    H    GLN   4           H        GLN   4   9.366   5.047   2.433
   31    HA   GLN   4           HA       GLN   4   6.810   5.914   1.235
   32   1HB   GLN   4          2HB       GLN   4   9.641   6.912   1.163
   33   2HB   GLN   4          3HB       GLN   4   8.578   7.252  -0.210
   34   1HG   GLN   4          2HG       GLN   4   6.931   8.309   1.141
   35   2HG   GLN   4          3HG       GLN   4   7.742   7.852   2.637
   36   1HE2  GLN   4          1HE2      GLN   4   7.218  10.448   0.627
   37   2HE2  GLN   4          2HE2      GLN   4   8.697  11.347   0.936
   38    H    LEU   5           H        LEU   5   6.049   4.274  -0.048
   39    HA   LEU   5           HA       LEU   5   7.924   3.060  -2.057
   40   1HB   LEU   5          2HB       LEU   5   5.101   2.162  -1.434
   41   2HB   LEU   5          3HB       LEU   5   6.280   1.373  -2.467
   42    HG   LEU   5           HG       LEU   5   6.484   1.714   0.557
   43   1HD1  LEU   5          1HD1      LEU   5   6.034  -0.750  -1.172
   44   2HD1  LEU   5          2HD1      LEU   5   6.182  -0.715   0.599
   45   3HD1  LEU   5          3HD1      LEU   5   4.803   0.078  -0.191
   46   1HD2  LEU   5          1HD2      LEU   5   8.727   1.763  -0.386
   47   2HD2  LEU   5          2HD2      LEU   5   8.457   0.154   0.300
   48   3HD2  LEU   5          3HD2      LEU   5   8.362   0.386  -1.454
   49    H    THR   6           H        THR   6   7.067   2.828  -4.231
   50    HA   THR   6           HA       THR   6   5.560   5.248  -5.150
   51    HB   THR   6           HB       THR   6   8.168   4.018  -6.097
   52    HG1  THR   6           1HG      THR   6   8.864   6.093  -5.730
   53   1HG2  THR   6          1HG2      THR   6   8.049   5.703  -7.984
   54   2HG2  THR   6          2HG2      THR   6   6.972   4.315  -8.163
   55   3HG2  THR   6          3HG2      THR   6   6.317   5.878  -7.636
   56    H    VAL   7           H        VAL   7   3.673   4.479  -5.872
   57    HA   VAL   7           HA       VAL   7   3.557   1.801  -7.144
   58    HB   VAL   7           HB       VAL   7   2.286   1.840  -5.225
   59   1HG1  VAL   7          1HG1      VAL   7   2.067   4.158  -4.647
   60   2HG1  VAL   7          2HG1      VAL   7   0.991   4.460  -6.021
   61   3HG1  VAL   7          3HG1      VAL   7   0.476   3.417  -4.683
   62   1HG2  VAL   7          1HG2      VAL   7   1.233   0.791  -7.189
   63   2HG2  VAL   7          2HG2      VAL   7   0.123   1.245  -5.890
   64   3HG2  VAL   7          3HG2      VAL   7   0.205   2.233  -7.354
   65    HA   PRO   8           HA       PRO   8   3.038   4.778 -10.614
   66   1HB   PRO   8          2HB       PRO   8   3.898   3.209 -12.669
   67   2HB   PRO   8          3HB       PRO   8   5.026   4.012 -11.538
   68   1HG   PRO   8          2HG       PRO   8   4.033   1.151 -11.423
   69   2HG   PRO   8          3HG       PRO   8   5.716   1.732 -11.295
   70   1HD   PRO   8          2HD       PRO   8   4.217   1.164  -9.108
   71   2HD   PRO   8          3HD       PRO   8   5.383   2.512  -9.114
   72    H    THR   9           H        THR   9   1.911   1.485 -10.174
   73    HA   THR   9           HA       THR   9  -0.181   1.720 -12.163
   74    HB   THR   9           HB       THR   9   1.025  -0.367 -11.776
   75    HG1  THR   9           1HG      THR   9  -1.729  -0.342 -11.176
   76   1HG2  THR   9          1HG2      THR   9   0.105  -1.575  -9.656
   77   2HG2  THR   9          2HG2      THR   9   1.542  -0.531  -9.496
   78   3HG2  THR   9          3HG2      THR   9  -0.059   0.020  -8.971
   79    H    ILE  10           H        ILE  10  -0.133   3.433  -9.304
   80    HA   ILE  10           HA       ILE  10  -2.535   2.938  -8.140
   81    HB   ILE  10           HB       ILE  10  -0.772   5.212  -8.499
   82   1HG1  ILE  10          2HG1      ILE  10  -2.973   4.510  -6.553
   83   2HG1  ILE  10          3HG1      ILE  10  -1.281   4.057  -6.429
   84   1HG2  ILE  10          1HG2      ILE  10  -2.269   7.095  -8.424
   85   2HG2  ILE  10          2HG2      ILE  10  -2.563   6.187  -9.906
   86   3HG2  ILE  10          3HG2      ILE  10  -3.690   6.036  -8.530
   87   1HD1  ILE  10          1HD1      ILE  10  -0.670   6.494  -6.242
   88   2HD1  ILE  10          2HD1      ILE  10  -2.409   6.870  -6.156
   89   3HD1  ILE  10          3HD1      ILE  10  -1.658   5.875  -4.903
   90    H    ALA  11           H        ALA  11  -4.702   3.705  -8.395
   91    HA   ALA  11           HA       ALA  11  -6.677   3.782  -9.460
   92   1HB   ALA  11          1HB       ALA  11  -5.776   6.025 -10.055
   93   2HB   ALA  11          2HB       ALA  11  -5.200   5.360 -11.601
   94   3HB   ALA  11          3HB       ALA  11  -6.934   5.394 -11.239
   95    H    CYS  12           H        CYS  12  -4.789   1.533 -10.166
   96    HA   CYS  12           HA       CYS  12  -5.704   0.715 -12.841
   97   1HB   CYS  12          2HB       CYS  12  -3.468   0.195 -12.339
   98   2HB   CYS  12          3HB       CYS  12  -3.884  -0.433 -10.727
   99    HG   CYS  12           HG       CYS  12  -4.842  -1.605 -13.677
  100    H    GLU  13           H        GLU  13  -5.762  -0.976  -9.670
  101    HA   GLU  13           HA       GLU  13  -8.161  -2.461 -10.485
  102   1HB   GLU  13          2HB       GLU  13  -6.200  -3.554  -9.568
  103   2HB   GLU  13          3HB       GLU  13  -6.332  -2.697  -8.043
  104   1HG   GLU  13          2HG       GLU  13  -8.563  -4.486  -9.155
  105   2HG   GLU  13          3HG       GLU  13  -7.190  -5.140  -8.259
  106    H    ALA  14           H        ALA  14  -7.970  -1.686  -7.071
  107    HA   ALA  14           HA       ALA  14 -10.035   0.476  -7.399
  108   1HB   ALA  14          1HB       ALA  14  -9.651  -1.554  -5.171
  109   2HB   ALA  14          2HB       ALA  14 -10.927  -0.322  -5.280
  110   3HB   ALA  14          3HB       ALA  14 -10.862  -1.647  -6.461
  111    H    CYS  15           H        CYS  15  -7.281   1.078  -7.582
  112    HA   CYS  15           HA       CYS  15  -5.842   2.623  -6.937
  113   1HB   CYS  15          2HB       CYS  15  -7.988   3.444  -4.932
  114   2HB   CYS  15          3HB       CYS  15  -6.369   4.149  -4.948
  115    HG   CYS  15           HG       CYS  15  -8.009   5.743  -6.099
  116    H    ALA  16           H        ALA  16  -4.164   2.964  -5.476
  117    HA   ALA  16           HA       ALA  16  -3.185   0.675  -4.173
  118   1HB   ALA  16          1HB       ALA  16  -2.462   3.586  -3.689
  119   2HB   ALA  16          2HB       ALA  16  -1.526   2.189  -3.105
  120   3HB   ALA  16          3HB       ALA  16  -1.719   2.458  -4.847
  121    H    GLU  17           H        GLU  17  -5.316   3.216  -2.821
  122    HA   GLU  17           HA       GLU  17  -5.022   2.538  -0.120
  123   1HB   GLU  17          2HB       GLU  17  -7.296   3.414   0.204
  124   2HB   GLU  17          3HB       GLU  17  -6.225   4.515  -0.660
  125   1HG   GLU  17          2HG       GLU  17  -7.297   4.095  -2.754
  126   2HG   GLU  17          3HG       GLU  17  -8.202   2.708  -2.118
  127    H    ALA  18           H        ALA  18  -6.588   0.703  -2.710
  128    HA   ALA  18           HA       ALA  18  -8.160  -1.112  -1.298
  129   1HB   ALA  18          1HB       ALA  18  -7.857  -1.106  -3.758
  130   2HB   ALA  18          2HB       ALA  18  -6.207  -1.735  -3.559
  131   3HB   ALA  18          3HB       ALA  18  -7.599  -2.711  -3.059
  132    H    VAL  19           H        VAL  19  -4.518  -1.125  -1.700
  133    HA   VAL  19           HA       VAL  19  -4.382  -3.542  -0.133
  134    HB   VAL  19           HB       VAL  19  -2.470  -2.708  -1.652
  135   1HG1  VAL  19          1HG1      VAL  19  -1.543  -1.390   0.956
  136   2HG1  VAL  19          2HG1      VAL  19  -0.654  -1.519  -0.557
  137   3HG1  VAL  19          3HG1      VAL  19  -2.069  -0.484  -0.482
  138   1HG2  VAL  19          1HG2      VAL  19  -1.938  -4.690  -0.639
  139   2HG2  VAL  19          2HG2      VAL  19  -0.937  -3.712   0.462
  140   3HG2  VAL  19          3HG2      VAL  19  -2.540  -4.213   0.938
  141    H    THR  20           H        THR  20  -4.033  -0.048   0.581
  142    HA   THR  20           HA       THR  20  -3.217  -0.187   3.245
  143    HB   THR  20           HB       THR  20  -5.164   1.753   1.935
  144    HG1  THR  20           1HG      THR  20  -2.936   1.589   1.189
  145   1HG2  THR  20          1HG2      THR  20  -4.480   3.289   3.768
  146   2HG2  THR  20          2HG2      THR  20  -5.611   2.008   4.234
  147   3HG2  THR  20          3HG2      THR  20  -3.894   1.847   4.646
  148    H    LYS  21           H        LYS  21  -6.601  -0.370   2.053
  149    HA   LYS  21           HA       LYS  21  -7.728  -0.724   4.670
  150   1HB   LYS  21          2HB       LYS  21  -8.964  -1.656   2.062
  151   2HB   LYS  21          3HB       LYS  21  -9.780  -1.215   3.569
  152   1HG   LYS  21          2HG       LYS  21  -8.203   1.048   2.880
  153   2HG   LYS  21          3HG       LYS  21  -8.863   0.454   1.348
  154   1HD   LYS  21          2HD       LYS  21 -11.163   0.640   2.320
  155   2HD   LYS  21          3HD       LYS  21 -10.447   1.168   3.851
  156   1HE   LYS  21          2HE       LYS  21 -10.529   3.317   3.094
  157   2HE   LYS  21          3HE       LYS  21  -9.228   2.885   1.990
  158   1HZ   LYS  21          1HZ       LYS  21 -12.066   3.095   1.374
  159   2HZ   LYS  21          2HZ       LYS  21 -10.730   3.719   0.612
  160   3HZ   LYS  21          3HZ       LYS  21 -11.058   2.161   0.440
  161    H    ALA  22           H        ALA  22  -6.327  -2.970   2.338
  162    HA   ALA  22           HA       ALA  22  -7.309  -5.378   3.607
  163   1HB   ALA  22          1HB       ALA  22  -5.765  -6.557   2.232
  164   2HB   ALA  22          2HB       ALA  22  -6.588  -5.319   1.249
  165   3HB   ALA  22          3HB       ALA  22  -4.909  -5.073   1.793
  166    H    VAL  23           H        VAL  23  -4.108  -3.730   3.576
  167    HA   VAL  23           HA       VAL  23  -2.742  -5.401   5.358
  168    HB   VAL  23           HB       VAL  23  -2.341  -2.398   4.992
  169   1HG1  VAL  23          1HG1      VAL  23  -0.029  -2.812   5.629
  170   2HG1  VAL  23          2HG1      VAL  23  -1.041  -3.475   6.919
  171   3HG1  VAL  23          3HG1      VAL  23  -0.303  -4.553   5.695
  172   1HG2  VAL  23          1HG2      VAL  23  -2.072  -3.201   2.816
  173   2HG2  VAL  23          2HG2      VAL  23  -0.442  -3.315   3.431
  174   3HG2  VAL  23          3HG2      VAL  23  -1.436  -4.779   3.345
  175    H    GLN  24           H        GLN  24  -4.843  -2.517   6.004
  176    HA   GLN  24           HA       GLN  24  -4.505  -2.426   8.775
  177   1HB   GLN  24          2HB       GLN  24  -6.815  -1.800   6.943
  178   2HB   GLN  24          3HB       GLN  24  -6.935  -1.507   8.675
  179   1HG   GLN  24          2HG       GLN  24  -4.519  -0.494   7.123
  180   2HG   GLN  24          3HG       GLN  24  -6.044   0.364   7.039
  181   1HE2  GLN  24          1HE2      GLN  24  -3.736   1.574   8.035
  182   2HE2  GLN  24          2HE2      GLN  24  -3.807   1.795   9.770
  183    H    ASN  25           H        ASN  25  -6.073  -5.098   7.051
  184    HA   ASN  25           HA       ASN  25  -7.565  -6.003   9.397
  185   1HB   ASN  25          2HB       ASN  25  -6.430  -7.620   7.076
  186   2HB   ASN  25          3HB       ASN  25  -7.470  -8.235   8.358
  187   1HD2  ASN  25          1HD2      ASN  25  -7.352  -6.332   5.464
  188   2HD2  ASN  25          2HD2      ASN  25  -9.096  -6.124   5.270
  189    H    GLU  26           H        GLU  26  -4.315  -6.670   8.033
  190    HA   GLU  26           HA       GLU  26  -3.525  -8.501  10.135
  191   1HB   GLU  26          2HB       GLU  26  -2.009  -6.972   7.973
  192   2HB   GLU  26          3HB       GLU  26  -1.252  -8.138   9.064
  193   1HG   GLU  26          2HG       GLU  26  -3.656  -8.962   7.382
  194   2HG   GLU  26          3HG       GLU  26  -2.021  -8.957   6.716
  195    H    ASP  27           H        ASP  27  -2.658  -5.145   9.261
  196    HA   ASP  27           HA       ASP  27  -1.557  -4.714  11.989
  197   1HB   ASP  27          2HB       ASP  27  -0.010  -4.599   9.932
  198   2HB   ASP  27          3HB       ASP  27  -0.832  -3.120   9.489
  199    H    ALA  28           H        ALA  28  -3.799  -4.309  12.668
  200    HA   ALA  28           HA       ALA  28  -5.319  -2.126  11.511
  201   1HB   ALA  28          1HB       ALA  28  -6.852  -2.517  13.371
  202   2HB   ALA  28          2HB       ALA  28  -6.375  -4.063  12.643
  203   3HB   ALA  28          3HB       ALA  28  -5.648  -3.543  14.184
  204    H    GLN  29           H        GLN  29  -2.615  -2.163  13.556
  205    HA   GLN  29           HA       GLN  29  -3.313   0.419  14.872
  206   1HB   GLN  29          2HB       GLN  29  -1.402  -0.098  16.314
  207   2HB   GLN  29          3HB       GLN  29  -2.682  -1.306  16.423
  208   1HG   GLN  29          2HG       GLN  29  -1.412  -2.894  15.107
  209   2HG   GLN  29          3HG       GLN  29  -0.237  -1.640  14.654
  210   1HE2  GLN  29          1HE2      GLN  29   1.328  -3.250  15.391
  211   2HE2  GLN  29          2HE2      GLN  29   1.728  -3.282  17.107
  212    H    ALA  30           H        ALA  30  -2.198  -0.382  11.927
  213    HA   ALA  30           HA       ALA  30   0.262   1.215  11.914
  214   1HB   ALA  30          1HB       ALA  30   0.198  -0.678  10.481
  215   2HB   ALA  30          2HB       ALA  30  -1.340  -0.188   9.742
  216   3HB   ALA  30          3HB       ALA  30   0.137   0.745   9.438
  217    H    THR  31           H        THR  31   0.600   3.005  10.538
  218    HA   THR  31           HA       THR  31  -1.796   4.756  10.133
  219    HB   THR  31           HB       THR  31   1.062   5.432  10.856
  220    HG1  THR  31           1HG      THR  31   0.152   6.049  12.778
  221   1HG2  THR  31          1HG2      THR  31  -1.320   7.276  10.357
  222   2HG2  THR  31          2HG2      THR  31   0.251   7.782  11.010
  223   3HG2  THR  31          3HG2      THR  31   0.144   7.184   9.350
  224    H    VAL  32           H        VAL  32  -2.030   5.635   8.137
  225    HA   VAL  32           HA       VAL  32  -0.188   4.779   5.965
  226    HB   VAL  32           HB       VAL  32  -2.260   4.151   4.710
  227   1HG1  VAL  32          1HG1      VAL  32  -0.765   2.631   6.572
  228   2HG1  VAL  32          2HG1      VAL  32  -2.446   2.199   6.854
  229   3HG1  VAL  32          3HG1      VAL  32  -1.759   2.044   5.239
  230   1HG2  VAL  32          1HG2      VAL  32  -4.308   3.558   6.090
  231   2HG2  VAL  32          2HG2      VAL  32  -3.615   4.412   7.448
  232   3HG2  VAL  32          3HG2      VAL  32  -4.016   5.287   5.956
  233    H    GLN  33           H        GLN  33   0.172   6.357   4.404
  234    HA   GLN  33           HA       GLN  33  -1.942   8.378   3.960
  235   1HB   GLN  33          2HB       GLN  33   0.939   8.872   4.798
  236   2HB   GLN  33          3HB       GLN  33   0.150   9.999   3.689
  237   1HG   GLN  33          2HG       GLN  33  -0.953   9.296   6.449
  238   2HG   GLN  33          3HG       GLN  33   0.047  10.696   6.076
  239   1HE2  GLN  33          1HE2      GLN  33  -3.167   9.283   5.703
  240   2HE2  GLN  33          2HE2      GLN  33  -3.903  10.748   5.044
  241    H    VAL  34           H        VAL  34  -2.419   8.282   1.841
  242    HA   VAL  34           HA       VAL  34  -0.247   7.557  -0.041
  243    HB   VAL  34           HB       VAL  34  -1.634   5.598   0.248
  244   1HG1  VAL  34          1HG1      VAL  34  -3.784   6.592   0.917
  245   2HG1  VAL  34          2HG1      VAL  34  -4.004   7.232  -0.725
  246   3HG1  VAL  34          3HG1      VAL  34  -3.947   5.484  -0.454
  247   1HG2  VAL  34          1HG2      VAL  34  -2.186   6.901  -2.449
  248   2HG2  VAL  34          2HG2      VAL  34  -0.615   6.241  -1.969
  249   3HG2  VAL  34          3HG2      VAL  34  -2.024   5.172  -2.080
  250    H    ASP  35           H        ASP  35   0.076   8.963  -1.617
  251    HA   ASP  35           HA       ASP  35  -1.664  11.370  -1.733
  252   1HB   ASP  35          2HB       ASP  35   1.061  10.544  -2.566
  253   2HB   ASP  35          3HB       ASP  35   0.295  11.831  -3.521
  254    H    LEU  36           H        LEU  36  -3.479  10.361  -2.606
  255    HA   LEU  36           HA       LEU  36  -3.519   9.031  -5.191
  256   1HB   LEU  36          2HB       LEU  36  -5.632  10.325  -3.445
  257   2HB   LEU  36          3HB       LEU  36  -6.019   9.513  -4.965
  258    HG   LEU  36           HG       LEU  36  -4.338   7.959  -3.010
  259   1HD1  LEU  36          1HD1      LEU  36  -6.368   7.198  -1.801
  260   2HD1  LEU  36          2HD1      LEU  36  -6.034   8.916  -1.522
  261   3HD1  LEU  36          3HD1      LEU  36  -7.328   8.431  -2.641
  262   1HD2  LEU  36          1HD2      LEU  36  -4.987   7.060  -5.249
  263   2HD2  LEU  36          2HD2      LEU  36  -5.607   6.097  -3.891
  264   3HD2  LEU  36          3HD2      LEU  36  -6.695   7.191  -4.773
  265    H    THR  37           H        THR  37  -1.980  10.746  -5.847
  266    HA   THR  37           HA       THR  37  -3.242  12.927  -7.428
  267    HB   THR  37           HB       THR  37  -0.851  13.226  -5.548
  268    HG1  THR  37           1HG      THR  37  -2.269  14.558  -4.407
  269   1HG2  THR  37          1HG2      THR  37  -1.110  15.680  -6.146
  270   2HG2  THR  37          2HG2      THR  37  -0.517  14.670  -7.474
  271   3HG2  THR  37          3HG2      THR  37  -2.217  15.188  -7.445
  272    H    SER  38           H        SER  38  -0.294  10.881  -6.787
  273    HA   SER  38           HA       SER  38   0.026  10.716  -9.699
  274   1HB   SER  38          2HB       SER  38   2.329  11.640  -7.925
  275   2HB   SER  38          3HB       SER  38   2.383  11.279  -9.667
  276    HG   SER  38           HG       SER  38   0.437  12.953  -9.439
  277    H    LYS  39           H        LYS  39   2.545   9.687  -7.411
  278    HA   LYS  39           HA       LYS  39   1.552   6.951  -7.334
  279   1HB   LYS  39          2HB       LYS  39   3.349   6.030  -8.720
  280   2HB   LYS  39          3HB       LYS  39   2.210   7.027  -9.630
  281   1HG   LYS  39          2HG       LYS  39   4.056   8.919  -9.277
  282   2HG   LYS  39          3HG       LYS  39   5.095   7.531  -8.923
  283   1HD   LYS  39          2HD       LYS  39   3.779   6.738 -11.259
  284   2HD   LYS  39          3HD       LYS  39   3.925   8.463 -11.508
  285   1HE   LYS  39          2HE       LYS  39   6.182   6.477 -10.871
  286   2HE   LYS  39          3HE       LYS  39   5.820   7.151 -12.464
  287   1HZ   LYS  39          1HZ       LYS  39   6.711   8.705 -10.125
  288   2HZ   LYS  39          2HZ       LYS  39   7.633   8.290 -11.420
  289   3HZ   LYS  39          3HZ       LYS  39   6.372   9.325 -11.614
  290    H    LYS  40           H        LYS  40   1.871   7.995  -5.075
  291    HA   LYS  40           HA       LYS  40   4.500   7.210  -4.039
  292   1HB   LYS  40          2HB       LYS  40   4.869   9.421  -2.988
  293   2HB   LYS  40          3HB       LYS  40   4.965   9.457  -4.748
  294   1HG   LYS  40          2HG       LYS  40   2.274  10.025  -4.218
  295   2HG   LYS  40          3HG       LYS  40   3.127  10.876  -2.932
  296   1HD   LYS  40          2HD       LYS  40   3.985  11.249  -5.829
  297   2HD   LYS  40          3HD       LYS  40   2.465  11.942  -5.262
  298   1HE   LYS  40          2HE       LYS  40   4.168  13.632  -5.091
  299   2HE   LYS  40          3HE       LYS  40   3.536  13.207  -3.505
  300   1HZ   LYS  40          1HZ       LYS  40   5.869  13.386  -3.412
  301   2HZ   LYS  40          2HZ       LYS  40   5.462  11.808  -3.179
  302   3HZ   LYS  40          3HZ       LYS  40   6.093  12.294  -4.626
  303    H    VAL  41           H        VAL  41   4.236   6.266  -2.035
  304    HA   VAL  41           HA       VAL  41   1.774   6.837  -0.512
  305    HB   VAL  41           HB       VAL  41   1.189   4.888  -1.889
  306   1HG1  VAL  41          1HG1      VAL  41   3.382   3.969  -2.423
  307   2HG1  VAL  41          2HG1      VAL  41   3.654   3.589  -0.702
  308   3HG1  VAL  41          3HG1      VAL  41   2.400   2.737  -1.621
  309   1HG2  VAL  41          1HG2      VAL  41   0.496   3.402  -0.132
  310   2HG2  VAL  41          2HG2      VAL  41   1.817   3.916   0.928
  311   3HG2  VAL  41          3HG2      VAL  41   0.496   5.035   0.564
  312    H    THR  42           H        THR  42   2.039   6.463   1.735
  313    HA   THR  42           HA       THR  42   4.838   6.058   2.641
  314    HB   THR  42           HB       THR  42   2.886   8.326   3.254
  315    HG1  THR  42           1HG      THR  42   4.527   8.078   1.332
  316   1HG2  THR  42          1HG2      THR  42   4.135   7.723   5.304
  317   2HG2  THR  42          2HG2      THR  42   5.664   7.811   4.388
  318   3HG2  THR  42          3HG2      THR  42   4.689   9.272   4.646
  319    H    ILE  43           H        ILE  43   4.680   4.264   3.876
  320    HA   ILE  43           HA       ILE  43   2.234   3.873   5.581
  321    HB   ILE  43           HB       ILE  43   4.182   1.848   4.439
  322   1HG1  ILE  43          2HG1      ILE  43   2.582   2.663   2.761
  323   2HG1  ILE  43          3HG1      ILE  43   2.283   0.990   3.189
  324   1HG2  ILE  43          1HG2      ILE  43   1.933   1.576   6.466
  325   2HG2  ILE  43          2HG2      ILE  43   2.509   0.202   5.509
  326   3HG2  ILE  43          3HG2      ILE  43   3.619   1.047   6.591
  327   1HD1  ILE  43          1HD1      ILE  43   0.436   1.691   4.690
  328   2HD1  ILE  43          2HD1      ILE  43   0.636   3.367   4.111
  329   3HD1  ILE  43          3HD1      ILE  43   0.168   2.085   2.988
  330    H    THR  44           H        THR  44   2.486   4.057   7.681
  331    HA   THR  44           HA       THR  44   5.228   3.949   8.873
  332    HB   THR  44           HB       THR  44   2.803   5.600   9.613
  333    HG1  THR  44           1HG      THR  44   4.121   7.285   8.990
  334   1HG2  THR  44          1HG2      THR  44   5.565   5.429  10.918
  335   2HG2  THR  44          2HG2      THR  44   4.321   6.635  11.308
  336   3HG2  THR  44          3HG2      THR  44   4.031   4.927  11.664
  337    H    SER  45           H        SER  45   5.277   1.811   9.322
  338    HA   SER  45           HA       SER  45   3.787   0.909  11.637
  339   1HB   SER  45          2HB       SER  45   3.257  -1.301  10.528
  340   2HB   SER  45          3HB       SER  45   2.297   0.025   9.913
  341    HG   SER  45           HG       SER  45   3.253  -1.382   8.305
  342    H    ALA  46           H        ALA  46   4.777  -1.395  12.117
  343    HA   ALA  46           HA       ALA  46   7.700  -1.400  11.663
  344   1HB   ALA  46          1HB       ALA  46   7.633  -3.448  13.025
  345   2HB   ALA  46          2HB       ALA  46   6.843  -2.093  13.855
  346   3HB   ALA  46          3HB       ALA  46   5.860  -3.364  13.097
  347    H    LEU  47           H        LEU  47   4.771  -3.333  10.823
  348    HA   LEU  47           HA       LEU  47   6.393  -4.907   8.874
  349   1HB   LEU  47          2HB       LEU  47   4.596  -6.497   8.843
  350   2HB   LEU  47          3HB       LEU  47   5.329  -6.330  10.429
  351    HG   LEU  47           HG       LEU  47   3.052  -4.527  10.276
  352   1HD1  LEU  47          1HD1      LEU  47   2.548  -7.394   9.397
  353   2HD1  LEU  47          2HD1      LEU  47   1.303  -6.391  10.153
  354   3HD1  LEU  47          3HD1      LEU  47   2.038  -5.863   8.632
  355   1HD2  LEU  47          1HD2      LEU  47   3.503  -7.078  11.869
  356   2HD2  LEU  47          2HD2      LEU  47   4.059  -5.453  12.344
  357   3HD2  LEU  47          3HD2      LEU  47   2.321  -5.798  12.232
  358    H    GLY  48           H        GLY  48   6.439  -2.799   7.917
  359   1HA   GLY  48          2HA       GLY  48   4.075  -2.027   6.263
  360   2HA   GLY  48          3HA       GLY  48   5.629  -1.175   6.355
  361    H    GLU  49           H        GLU  49   7.522  -2.301   5.501
  362    HA   GLU  49           HA       GLU  49   7.079  -2.694   2.829
  363   1HB   GLU  49          2HB       GLU  49   9.221  -2.009   4.021
  364   2HB   GLU  49          3HB       GLU  49   9.574  -3.734   4.225
  365   1HG   GLU  49          2HG       GLU  49   9.399  -3.988   1.731
  366   2HG   GLU  49          3HG       GLU  49   9.081  -2.244   1.611
  367    H    GLU  50           H        GLU  50   8.028  -5.351   5.076
  368    HA   GLU  50           HA       GLU  50   7.869  -7.496   3.290
  369   1HB   GLU  50          2HB       GLU  50   7.344  -7.266   6.288
  370   2HB   GLU  50          3HB       GLU  50   7.214  -8.805   5.430
  371   1HG   GLU  50          2HG       GLU  50   9.530  -8.622   4.647
  372   2HG   GLU  50          3HG       GLU  50   9.720  -7.075   5.496
  373    H    GLN  51           H        GLN  51   5.252  -6.234   5.426
  374    HA   GLN  51           HA       GLN  51   3.423  -8.207   4.553
  375   1HB   GLN  51          2HB       GLN  51   3.494  -6.415   6.621
  376   2HB   GLN  51          3HB       GLN  51   2.305  -5.625   5.601
  377   1HG   GLN  51          2HG       GLN  51   2.261  -8.545   6.556
  378   2HG   GLN  51          3HG       GLN  51   1.242  -7.263   7.195
  379   1HE2  GLN  51          1HE2      GLN  51  -0.614  -6.588   6.078
  380   2HE2  GLN  51          2HE2      GLN  51  -1.223  -7.503   4.711
  381    H    LEU  52           H        LEU  52   3.789  -4.749   3.650
  382    HA   LEU  52           HA       LEU  52   1.868  -4.531   1.654
  383   1HB   LEU  52          2HB       LEU  52   4.677  -3.401   1.833
  384   2HB   LEU  52          3HB       LEU  52   3.520  -2.864   0.624
  385    HG   LEU  52           HG       LEU  52   2.823  -2.762   3.577
  386   1HD1  LEU  52          1HD1      LEU  52   3.747  -0.609   3.788
  387   2HD1  LEU  52          2HD1      LEU  52   5.016  -1.519   2.983
  388   3HD1  LEU  52          3HD1      LEU  52   4.001  -0.424   2.038
  389   1HD2  LEU  52          1HD2      LEU  52   1.012  -2.482   1.814
  390   2HD2  LEU  52          2HD2      LEU  52   1.207  -1.118   2.921
  391   3HD2  LEU  52          3HD2      LEU  52   1.858  -1.026   1.271
  392    H    ARG  53           H        ARG  53   5.226  -5.824   1.318
  393    HA   ARG  53           HA       ARG  53   5.248  -6.365  -1.378
  394   1HB   ARG  53          2HB       ARG  53   6.904  -7.012   0.691
  395   2HB   ARG  53          3HB       ARG  53   6.189  -8.590   0.439
  396   1HG   ARG  53          2HG       ARG  53   8.137  -8.606  -0.835
  397   2HG   ARG  53          3HG       ARG  53   6.868  -8.327  -2.047
  398   1HD   ARG  53          2HD       ARG  53   7.346  -5.893  -1.963
  399   2HD   ARG  53          3HD       ARG  53   8.537  -6.160  -0.665
  400    HE   ARG  53           HE       ARG  53   9.360  -7.718  -2.861
  401   1HH1  ARG  53          2HH2      ARG  53   8.918  -4.380  -1.892
  402   2HH1  ARG  53          1HH2      ARG  53   9.705  -3.633  -3.201
  403   1HH2  ARG  53          2HH1      ARG  53  10.886  -6.846  -4.463
  404   2HH2  ARG  53          1HH1      ARG  53  11.139  -5.126  -4.537
  405    H    THR  54           H        THR  54   3.956  -8.588   1.111
  406    HA   THR  54           HA       THR  54   3.012 -10.478  -0.884
  407    HB   THR  54           HB       THR  54   2.493 -10.363   2.115
  408    HG1  THR  54           1HG      THR  54   4.702 -10.500   1.540
  409   1HG2  THR  54          1HG2      THR  54   2.149 -12.824   1.818
  410   2HG2  THR  54          2HG2      THR  54   0.904 -11.874   0.989
  411   3HG2  THR  54          3HG2      THR  54   2.227 -12.611   0.057
  412    H    ALA  55           H        ALA  55   1.332  -8.264   1.408
  413    HA   ALA  55           HA       ALA  55  -1.307  -8.878   0.656
  414   1HB   ALA  55          1HB       ALA  55  -0.138  -6.236   1.638
  415   2HB   ALA  55          2HB       ALA  55  -1.866  -6.661   1.613
  416   3HB   ALA  55          3HB       ALA  55  -0.746  -7.572   2.638
  417    H    ILE  56           H        ILE  56   0.827  -6.229  -0.559
  418    HA   ILE  56           HA       ILE  56  -0.959  -5.438  -2.619
  419    HB   ILE  56           HB       ILE  56   2.077  -5.204  -2.688
  420   1HG1  ILE  56          2HG1      ILE  56  -0.054  -3.146  -1.960
  421   2HG1  ILE  56          3HG1      ILE  56   0.842  -4.055  -0.735
  422   1HG2  ILE  56          1HG2      ILE  56   1.336  -3.314  -4.276
  423   2HG2  ILE  56          2HG2      ILE  56   1.233  -4.952  -4.905
  424   3HG2  ILE  56          3HG2      ILE  56  -0.230  -4.106  -4.330
  425   1HD1  ILE  56          1HD1      ILE  56   2.986  -3.143  -1.688
  426   2HD1  ILE  56          2HD1      ILE  56   2.000  -2.019  -2.650
  427   3HD1  ILE  56          3HD1      ILE  56   1.914  -1.967  -0.897
  428    H    ALA  57           H        ALA  57   1.728  -7.924  -2.780
  429    HA   ALA  57           HA       ALA  57   1.361  -8.567  -5.477
  430   1HB   ALA  57          1HB       ALA  57   2.231 -10.784  -4.957
  431   2HB   ALA  57          2HB       ALA  57   3.151  -9.534  -4.102
  432   3HB   ALA  57          3HB       ALA  57   1.961 -10.528  -3.227
  433    H    SER  58           H        SER  58  -0.598  -9.631  -2.687
  434    HA   SER  58           HA       SER  58  -2.308 -11.441  -3.989
  435   1HB   SER  58          2HB       SER  58  -2.189 -10.713  -1.481
  436   2HB   SER  58          3HB       SER  58  -3.375  -9.472  -1.947
  437    HG   SER  58           HG       SER  58  -4.396 -11.369  -1.245
  438    H    ALA  59           H        ALA  59  -2.500  -7.859  -3.881
  439    HA   ALA  59           HA       ALA  59  -4.989  -7.740  -5.422
  440   1HB   ALA  59          1HB       ALA  59  -4.545  -5.309  -5.414
  441   2HB   ALA  59          2HB       ALA  59  -4.476  -6.007  -3.784
  442   3HB   ALA  59          3HB       ALA  59  -2.971  -5.603  -4.637
  443    H    GLY  60           H        GLY  60  -1.514  -7.440  -6.049
  444   1HA   GLY  60          2HA       GLY  60  -0.377  -7.904  -8.014
  445   2HA   GLY  60          3HA       GLY  60  -1.898  -7.972  -8.911
  446    H    HIS  61           H        HIS  61   0.135  -5.602  -7.110
  447    HA   HIS  61           HA       HIS  61  -0.325  -3.625  -9.303
  448   1HB   HIS  61          2HB       HIS  61   0.256  -3.256  -6.359
  449   2HB   HIS  61          3HB       HIS  61   0.523  -1.964  -7.492
  450    HD1  HIS  61           1HD      HIS  61  -1.446  -0.314  -7.552
  451    HD2  HIS  61           2HD      HIS  61  -2.462  -4.200  -6.342
  452    HE1  HIS  61           1HE      HIS  61  -3.872  -0.220  -6.800
  453    H    GLU  62           H        GLU  62   1.446  -2.794 -10.333
  454    HA   GLU  62           HA       GLU  62   3.998  -4.092 -10.157
  455   1HB   GLU  62          2HB       GLU  62   3.147  -1.648 -11.786
  456   2HB   GLU  62          3HB       GLU  62   4.494  -2.743 -12.115
  457   1HG   GLU  62          2HG       GLU  62   1.532  -3.479 -12.254
  458   2HG   GLU  62          3HG       GLU  62   2.605  -3.158 -13.614
  459    H    VAL  63           H        VAL  63   3.734  -2.995  -7.738
  460    HA   VAL  63           HA       VAL  63   5.317  -0.465  -7.669
  461    HB   VAL  63           HB       VAL  63   3.287  -0.262  -6.613
  462   1HG1  VAL  63          1HG1      VAL  63   3.686  -2.798  -5.055
  463   2HG1  VAL  63          2HG1      VAL  63   2.431  -1.545  -4.807
  464   3HG1  VAL  63          3HG1      VAL  63   2.471  -2.441  -6.316
  465   1HG2  VAL  63          1HG2      VAL  63   5.120  -0.902  -4.261
  466   2HG2  VAL  63          2HG2      VAL  63   5.355   0.537  -5.263
  467   3HG2  VAL  63          3HG2      VAL  63   3.861   0.338  -4.334
  468    H    GLU  64           H        GLU  64   7.204  -0.310  -6.604
  469    HA   GLU  64           HA       GLU  64   8.643  -2.817  -5.873
  470   1HB   GLU  64          2HB       GLU  64   9.547   0.014  -6.530
  471   2HB   GLU  64          3HB       GLU  64  10.540  -1.072  -5.560
  472   1HG   GLU  64          2HG       GLU  64  10.492  -2.773  -7.372
  473   2HG   GLU  64          3HG       GLU  64   9.633  -1.615  -8.408
  Start of MODEL    7
    1   1H    MET   1           H1       MET   1   9.801   1.661   9.387
    2   2H    MET   1           H2       MET   1   9.540   1.335  11.009
    3   3H    MET   1           H3       MET   1   8.292   1.239   9.939
    4    HA   MET   1           HA       MET   1   7.855   3.224  10.829
    5   1HB   MET   1          2HB       MET   1   9.693   4.946  11.159
    6   2HB   MET   1          3HB       MET   1   9.658   3.575  12.269
    7   1HG   MET   1          2HG       MET   1  11.500   2.487  11.074
    8   2HG   MET   1          3HG       MET   1  11.556   3.814   9.897
    9   1HE   MET   1          1HE       MET   1  13.930   2.508  11.813
   10   2HE   MET   1          2HE       MET   1  14.207   3.679  10.497
   11   3HE   MET   1          3HE       MET   1  14.839   4.001  12.129
   12    H    THR   2           H        THR   2   7.080   4.807   9.472
   13    HA   THR   2           HA       THR   2   6.354   5.312   7.339
   14    HB   THR   2           HB       THR   2   7.154   7.282   8.368
   15    HG1  THR   2           1HG      THR   2   8.272   7.113   5.781
   16   1HG2  THR   2          1HG2      THR   2   9.499   8.088   8.159
   17   2HG2  THR   2          2HG2      THR   2   9.371   6.639   9.161
   18   3HG2  THR   2          3HG2      THR   2   9.979   6.516   7.498
   19    H    ILE   3           H        ILE   3   6.699   3.159   6.292
   20    HA   ILE   3           HA       ILE   3   9.075   2.942   4.568
   21    HB   ILE   3           HB       ILE   3   6.616   1.168   4.704
   22   1HG1  ILE   3          2HG1      ILE   3   7.534   1.294   7.000
   23   2HG1  ILE   3          3HG1      ILE   3   7.698  -0.290   6.266
   24   1HG2  ILE   3          1HG2      ILE   3   8.072  -0.513   3.754
   25   2HG2  ILE   3          2HG2      ILE   3   8.158   0.950   2.776
   26   3HG2  ILE   3          3HG2      ILE   3   9.486   0.566   3.854
   27   1HD1  ILE   3          1HD1      ILE   3  10.001   1.686   6.336
   28   2HD1  ILE   3          2HD1      ILE   3   9.692   0.450   7.574
   29   3HD1  ILE   3          3HD1      ILE   3  10.051  -0.041   5.922
   30    H    GLN   4           H        GLN   4   9.037   4.223   2.718
   31    HA   GLN   4           HA       GLN   4   6.464   4.758   1.380
   32   1HB   GLN   4          2HB       GLN   4   7.900   6.708   1.961
   33   2HB   GLN   4          3HB       GLN   4   9.157   6.052   0.892
   34   1HG   GLN   4          2HG       GLN   4   7.451   6.090  -1.004
   35   2HG   GLN   4          3HG       GLN   4   6.318   6.855   0.104
   36   1HE2  GLN   4          1HE2      GLN   4   9.408   7.234  -1.630
   37   2HE2  GLN   4          2HE2      GLN   4   9.414   8.987  -1.566
   38    H    LEU   5           H        LEU   5   5.970   3.756  -0.495
   39    HA   LEU   5           HA       LEU   5   8.169   2.581  -2.179
   40   1HB   LEU   5          2HB       LEU   5   5.399   1.397  -1.699
   41   2HB   LEU   5          3HB       LEU   5   6.525   0.885  -2.941
   42    HG   LEU   5           HG       LEU   5   6.514  -0.674  -1.166
   43   1HD1  LEU   5          1HD1      LEU   5   8.904  -0.862  -0.743
   44   2HD1  LEU   5          2HD1      LEU   5   8.641  -0.265  -2.393
   45   3HD1  LEU   5          3HD1      LEU   5   9.149   0.854  -1.111
   46   1HD2  LEU   5          1HD2      LEU   5   7.727   1.303   0.735
   47   2HD2  LEU   5          2HD2      LEU   5   5.971   1.063   0.676
   48   3HD2  LEU   5          3HD2      LEU   5   7.058  -0.296   1.072
   49    H    THR   6           H        THR   6   7.543   2.323  -4.482
   50    HA   THR   6           HA       THR   6   5.972   4.701  -5.389
   51    HB   THR   6           HB       THR   6   8.315   3.198  -6.615
   52    HG1  THR   6           1HG      THR   6   9.464   4.920  -5.951
   53   1HG2  THR   6          1HG2      THR   6   8.328   5.107  -8.238
   54   2HG2  THR   6          2HG2      THR   6   6.867   4.120  -8.390
   55   3HG2  THR   6          3HG2      THR   6   6.798   5.686  -7.546
   56    H    VAL   7           H        VAL   7   4.021   4.141  -6.208
   57    HA   VAL   7           HA       VAL   7   3.608   1.366  -7.285
   58    HB   VAL   7           HB       VAL   7   2.622   1.488  -5.193
   59   1HG1  VAL   7          1HG1      VAL   7   2.556   3.842  -4.677
   60   2HG1  VAL   7          2HG1      VAL   7   1.321   4.123  -5.914
   61   3HG1  VAL   7          3HG1      VAL   7   0.950   3.142  -4.482
   62   1HG2  VAL   7          1HG2      VAL   7   0.343   0.997  -5.608
   63   2HG2  VAL   7          2HG2      VAL   7   0.312   1.955  -7.091
   64   3HG2  VAL   7          3HG2      VAL   7   1.258   0.472  -7.025
   65    HA   PRO   8           HA       PRO   8   3.122   4.589 -10.502
   66   1HB   PRO   8          2HB       PRO   8   3.766   3.098 -12.733
   67   2HB   PRO   8          3HB       PRO   8   4.974   3.829 -11.632
   68   1HG   PRO   8          2HG       PRO   8   3.930   0.987 -11.588
   69   2HG   PRO   8          3HG       PRO   8   5.630   1.534 -11.531
   70   1HD   PRO   8          2HD       PRO   8   4.283   0.888  -9.288
   71   2HD   PRO   8          3HD       PRO   8   5.410   2.266  -9.299
   72    H    THR   9           H        THR   9   1.725   1.449 -10.197
   73    HA   THR   9           HA       THR   9  -0.469   1.790 -12.069
   74    HB   THR   9           HB       THR   9   0.592  -0.338 -11.857
   75    HG1  THR   9           1HG      THR   9  -1.805  -0.444 -11.848
   76   1HG2  THR   9          1HG2      THR   9   1.708  -0.369  -9.767
   77   2HG2  THR   9          2HG2      THR   9   0.178  -0.053  -8.892
   78   3HG2  THR   9          3HG2      THR   9   0.461  -1.594  -9.712
   79    H    ILE  10           H        ILE  10  -0.037   3.240  -8.991
   80    HA   ILE  10           HA       ILE  10  -2.415   2.806  -7.771
   81    HB   ILE  10           HB       ILE  10  -0.419   4.909  -7.745
   82   1HG1  ILE  10          2HG1      ILE  10  -2.647   4.019  -5.933
   83   2HG1  ILE  10          3HG1      ILE  10  -1.010   3.381  -5.932
   84   1HG2  ILE  10          1HG2      ILE  10  -3.237   6.023  -7.443
   85   2HG2  ILE  10          2HG2      ILE  10  -1.721   6.853  -7.085
   86   3HG2  ILE  10          3HG2      ILE  10  -2.091   6.432  -8.748
   87   1HD1  ILE  10          1HD1      ILE  10  -1.931   6.100  -4.938
   88   2HD1  ILE  10          2HD1      ILE  10  -1.114   4.804  -4.055
   89   3HD1  ILE  10          3HD1      ILE  10  -0.219   5.738  -5.257
   90    H    ALA  11           H        ALA  11  -4.501   3.358  -7.903
   91    HA   ALA  11           HA       ALA  11  -6.492   3.734  -8.868
   92   1HB   ALA  11          1HB       ALA  11  -5.756   6.094  -8.659
   93   2HB   ALA  11          2HB       ALA  11  -5.145   6.035 -10.328
   94   3HB   ALA  11          3HB       ALA  11  -6.875   5.827 -10.007
   95    H    CYS  12           H        CYS  12  -4.251   2.110 -10.437
   96    HA   CYS  12           HA       CYS  12  -5.955   1.750 -12.861
   97   1HB   CYS  12          2HB       CYS  12  -3.717   2.975 -13.241
   98   2HB   CYS  12          3HB       CYS  12  -2.934   1.442 -12.806
   99    HG   CYS  12           HG       CYS  12  -5.153   2.144 -15.135
  100    H    GLU  13           H        GLU  13  -6.583   0.487 -10.689
  101    HA   GLU  13           HA       GLU  13  -6.675  -2.150 -11.516
  102   1HB   GLU  13          2HB       GLU  13  -4.319  -2.139 -10.396
  103   2HB   GLU  13          3HB       GLU  13  -5.174  -2.051  -8.863
  104   1HG   GLU  13          2HG       GLU  13  -5.541  -4.203 -11.001
  105   2HG   GLU  13          3HG       GLU  13  -4.529  -4.352  -9.559
  106    H    ALA  14           H        ALA  14  -6.960  -2.111  -8.075
  107    HA   ALA  14           HA       ALA  14  -9.721  -1.022  -8.198
  108   1HB   ALA  14          1HB       ALA  14 -10.043  -2.408  -6.218
  109   2HB   ALA  14          2HB       ALA  14  -9.302  -3.355  -7.524
  110   3HB   ALA  14          3HB       ALA  14  -8.303  -2.779  -6.173
  111    H    CYS  15           H        CYS  15  -7.190   0.707  -7.809
  112    HA   CYS  15           HA       CYS  15  -6.657   2.599  -6.773
  113   1HB   CYS  15          2HB       CYS  15  -9.376   2.440  -5.398
  114   2HB   CYS  15          3HB       CYS  15  -8.183   3.704  -5.089
  115    HG   CYS  15           HG       CYS  15  -9.515   2.829  -7.947
  116    H    ALA  16           H        ALA  16  -5.460   3.286  -5.054
  117    HA   ALA  16           HA       ALA  16  -4.196   1.253  -3.583
  118   1HB   ALA  16          1HB       ALA  16  -4.223   4.264  -3.167
  119   2HB   ALA  16          2HB       ALA  16  -3.260   3.133  -2.192
  120   3HB   ALA  16          3HB       ALA  16  -2.978   3.235  -3.928
  121    H    GLU  17           H        GLU  17  -7.152   2.987  -2.715
  122    HA   GLU  17           HA       GLU  17  -7.130   2.524   0.052
  123   1HB   GLU  17          2HB       GLU  17  -9.546   2.614  -0.046
  124   2HB   GLU  17          3HB       GLU  17  -8.798   3.890  -1.011
  125   1HG   GLU  17          2HG       GLU  17  -9.203   2.481  -3.074
  126   2HG   GLU  17          3HG       GLU  17 -10.087   1.332  -2.056
  127    H    ALA  18           H        ALA  18  -7.690   0.284  -2.680
  128    HA   ALA  18           HA       ALA  18  -8.661  -1.959  -1.282
  129   1HB   ALA  18          1HB       ALA  18  -8.522  -1.776  -3.744
  130   2HB   ALA  18          2HB       ALA  18  -6.754  -1.894  -3.666
  131   3HB   ALA  18          3HB       ALA  18  -7.756  -3.262  -3.149
  132    H    VAL  19           H        VAL  19  -5.199  -1.135  -2.050
  133    HA   VAL  19           HA       VAL  19  -4.242  -3.294  -0.446
  134    HB   VAL  19           HB       VAL  19  -2.903  -1.916  -2.226
  135   1HG1  VAL  19          1HG1      VAL  19  -2.788   0.254  -0.910
  136   2HG1  VAL  19          2HG1      VAL  19  -1.915  -0.615   0.375
  137   3HG1  VAL  19          3HG1      VAL  19  -1.206  -0.459  -1.235
  138   1HG2  VAL  19          1HG2      VAL  19  -1.772  -3.096   0.357
  139   2HG2  VAL  19          2HG2      VAL  19  -2.212  -3.991  -1.107
  140   3HG2  VAL  19          3HG2      VAL  19  -0.857  -2.848  -1.128
  141    H    THR  20           H        THR  20  -4.987   0.108   0.234
  142    HA   THR  20           HA       THR  20  -3.828   0.346   2.780
  143    HB   THR  20           HB       THR  20  -6.478   1.563   1.900
  144    HG1  THR  20           1HG      THR  20  -4.741   2.051   0.458
  145   1HG2  THR  20          1HG2      THR  20  -6.107   1.838   4.299
  146   2HG2  THR  20          2HG2      THR  20  -4.470   2.447   3.956
  147   3HG2  THR  20          3HG2      THR  20  -5.894   3.369   3.431
  148    H    LYS  21           H        LYS  21  -7.191  -0.787   1.995
  149    HA   LYS  21           HA       LYS  21  -7.835  -1.470   4.690
  150   1HB   LYS  21          2HB       LYS  21  -8.872  -2.795   2.153
  151   2HB   LYS  21          3HB       LYS  21  -9.589  -2.848   3.774
  152   1HG   LYS  21          2HG       LYS  21  -9.374  -0.137   3.426
  153   2HG   LYS  21          3HG       LYS  21  -9.589  -0.647   1.748
  154   1HD   LYS  21          2HD       LYS  21 -11.407  -1.359   4.078
  155   2HD   LYS  21          3HD       LYS  21 -11.723  -0.071   2.910
  156   1HE   LYS  21          2HE       LYS  21 -12.412  -1.479   1.260
  157   2HE   LYS  21          3HE       LYS  21 -11.174  -2.687   1.600
  158   1HZ   LYS  21          1HZ       LYS  21 -13.640  -2.346   3.163
  159   2HZ   LYS  21          2HZ       LYS  21 -13.349  -3.525   2.052
  160   3HZ   LYS  21          3HZ       LYS  21 -12.464  -3.469   3.435
  161    H    ALA  22           H        ALA  22  -6.380  -3.419   2.060
  162    HA   ALA  22           HA       ALA  22  -6.309  -5.904   3.440
  163   1HB   ALA  22          1HB       ALA  22  -5.790  -5.619   1.036
  164   2HB   ALA  22          2HB       ALA  22  -4.268  -4.809   1.491
  165   3HB   ALA  22          3HB       ALA  22  -4.520  -6.513   1.915
  166    H    VAL  23           H        VAL  23  -3.942  -3.253   3.377
  167    HA   VAL  23           HA       VAL  23  -1.975  -4.497   5.018
  168    HB   VAL  23           HB       VAL  23  -2.564  -1.581   4.382
  169   1HG1  VAL  23          1HG1      VAL  23  -1.115  -1.702   6.408
  170   2HG1  VAL  23          2HG1      VAL  23  -0.045  -2.852   5.561
  171   3HG1  VAL  23          3HG1      VAL  23  -0.173  -1.183   4.992
  172   1HG2  VAL  23          1HG2      VAL  23  -0.270  -3.223   3.275
  173   2HG2  VAL  23          2HG2      VAL  23  -1.845  -3.308   2.518
  174   3HG2  VAL  23          3HG2      VAL  23  -1.014  -1.744   2.633
  175    H    GLN  24           H        GLN  24  -4.663  -2.236   5.662
  176    HA   GLN  24           HA       GLN  24  -4.142  -2.125   8.502
  177   1HB   GLN  24          2HB       GLN  24  -6.675  -1.406   6.984
  178   2HB   GLN  24          3HB       GLN  24  -6.352  -1.090   8.694
  179   1HG   GLN  24          2HG       GLN  24  -4.074  -0.036   7.447
  180   2HG   GLN  24          3HG       GLN  24  -5.371   0.363   6.322
  181   1HE2  GLN  24          1HE2      GLN  24  -3.723   1.588   8.990
  182   2HE2  GLN  24          2HE2      GLN  24  -4.947   2.734   9.428
  183    H    ASN  25           H        ASN  25  -5.858  -4.524   6.537
  184    HA   ASN  25           HA       ASN  25  -7.457  -5.620   8.609
  185   1HB   ASN  25          2HB       ASN  25  -6.036  -7.057   6.329
  186   2HB   ASN  25          3HB       ASN  25  -7.176  -7.820   7.428
  187   1HD2  ASN  25          1HD2      ASN  25  -7.567  -7.782   4.649
  188   2HD2  ASN  25          2HD2      ASN  25  -9.016  -6.837   4.340
  189    H    GLU  26           H        GLU  26  -4.064  -6.525   7.703
  190    HA   GLU  26           HA       GLU  26  -3.715  -8.074  10.156
  191   1HB   GLU  26          2HB       GLU  26  -1.622  -7.003   8.215
  192   2HB   GLU  26          3HB       GLU  26  -1.422  -8.279   9.421
  193   1HG   GLU  26          2HG       GLU  26  -3.194  -8.443   6.930
  194   2HG   GLU  26          3HG       GLU  26  -1.650  -9.267   7.192
  195    H    ASP  27           H        ASP  27  -2.357  -5.035   8.815
  196    HA   ASP  27           HA       ASP  27  -1.111  -4.456  11.375
  197   1HB   ASP  27          2HB       ASP  27  -0.033  -4.349   9.020
  198   2HB   ASP  27          3HB       ASP  27  -0.895  -2.840   8.782
  199    H    ALA  28           H        ALA  28  -3.519  -4.286  12.070
  200    HA   ALA  28           HA       ALA  28  -5.110  -2.034  11.273
  201   1HB   ALA  28          1HB       ALA  28  -6.521  -2.646  13.193
  202   2HB   ALA  28          2HB       ALA  28  -6.037  -4.095  12.291
  203   3HB   ALA  28          3HB       ALA  28  -5.236  -3.698  13.828
  204    H    GLN  29           H        GLN  29  -2.443  -2.312  13.379
  205    HA   GLN  29           HA       GLN  29  -3.012   0.091  14.947
  206   1HB   GLN  29          2HB       GLN  29  -0.940  -0.477  16.055
  207   2HB   GLN  29          3HB       GLN  29  -2.046  -1.844  16.022
  208   1HG   GLN  29          2HG       GLN  29  -0.704  -2.877  14.180
  209   2HG   GLN  29          3HG       GLN  29   0.371  -1.476  14.190
  210   1HE2  GLN  29          1HE2      GLN  29  -0.489  -4.479  15.817
  211   2HE2  GLN  29          2HE2      GLN  29   0.792  -4.394  17.015
  212    H    ALA  30           H        ALA  30  -1.629  -0.534  11.815
  213    HA   ALA  30           HA       ALA  30   0.395   1.573  12.024
  214   1HB   ALA  30          1HB       ALA  30   0.668   1.063   9.568
  215   2HB   ALA  30          2HB       ALA  30   0.940  -0.266  10.707
  216   3HB   ALA  30          3HB       ALA  30  -0.568  -0.195   9.753
  217    H    THR  31           H        THR  31   0.534   3.315  10.504
  218    HA   THR  31           HA       THR  31  -2.116   4.587   9.898
  219    HB   THR  31           HB       THR  31   0.559   5.840  10.591
  220    HG1  THR  31           1HG      THR  31  -0.821   4.869  12.265
  221   1HG2  THR  31          1HG2      THR  31  -2.129   7.132   9.937
  222   2HG2  THR  31          2HG2      THR  31  -0.724   7.976  10.615
  223   3HG2  THR  31          3HG2      THR  31  -0.633   7.288   8.986
  224    H    VAL  32           H        VAL  32  -2.425   5.331   7.853
  225    HA   VAL  32           HA       VAL  32  -0.487   4.466   5.765
  226    HB   VAL  32           HB       VAL  32  -2.522   4.340   4.334
  227   1HG1  VAL  32          1HG1      VAL  32  -1.853   2.555   6.600
  228   2HG1  VAL  32          2HG1      VAL  32  -3.526   2.390   6.067
  229   3HG1  VAL  32          3HG1      VAL  32  -2.210   2.183   4.907
  230   1HG2  VAL  32          1HG2      VAL  32  -4.105   4.695   6.923
  231   2HG2  VAL  32          2HG2      VAL  32  -3.997   5.896   5.614
  232   3HG2  VAL  32          3HG2      VAL  32  -4.748   4.334   5.324
  233    H    GLN  33           H        GLN  33   0.055   6.009   4.105
  234    HA   GLN  33           HA       GLN  33  -1.329   8.608   4.102
  235   1HB   GLN  33          2HB       GLN  33   0.708   8.376   5.844
  236   2HB   GLN  33          3HB       GLN  33   1.674   8.744   4.432
  237   1HG   GLN  33          2HG       GLN  33  -0.670  10.404   5.439
  238   2HG   GLN  33          3HG       GLN  33   1.017  10.683   5.871
  239   1HE2  GLN  33          1HE2      GLN  33  -1.126  12.224   4.175
  240   2HE2  GLN  33          2HE2      GLN  33  -0.202  12.662   2.748
  241    H    VAL  34           H        VAL  34  -2.002   7.495   2.156
  242    HA   VAL  34           HA       VAL  34   0.063   7.123   0.082
  243    HB   VAL  34           HB       VAL  34  -1.279   5.202   0.614
  244   1HG1  VAL  34          1HG1      VAL  34  -3.751   6.680  -0.367
  245   2HG1  VAL  34          2HG1      VAL  34  -3.627   4.976   0.089
  246   3HG1  VAL  34          3HG1      VAL  34  -3.419   6.228   1.319
  247   1HG2  VAL  34          1HG2      VAL  34  -2.129   6.185  -2.134
  248   2HG2  VAL  34          2HG2      VAL  34  -0.451   5.764  -1.763
  249   3HG2  VAL  34          3HG2      VAL  34  -1.703   4.539  -1.611
  250    H    ASP  35           H        ASP  35   0.298   8.481  -1.588
  251    HA   ASP  35           HA       ASP  35  -1.554  10.804  -1.637
  252   1HB   ASP  35          2HB       ASP  35   1.232  10.383  -2.725
  253   2HB   ASP  35          3HB       ASP  35   0.248  11.819  -2.997
  254    H    LEU  36           H        LEU  36  -3.167   9.415  -2.572
  255    HA   LEU  36           HA       LEU  36  -3.195   8.314  -5.158
  256   1HB   LEU  36          2HB       LEU  36  -5.312   9.875  -3.636
  257   2HB   LEU  36          3HB       LEU  36  -5.636   9.005  -5.133
  258    HG   LEU  36           HG       LEU  36  -4.225   7.282  -3.202
  259   1HD1  LEU  36          1HD1      LEU  36  -5.377   8.646  -1.520
  260   2HD1  LEU  36          2HD1      LEU  36  -6.928   8.400  -2.357
  261   3HD1  LEU  36          3HD1      LEU  36  -6.086   7.024  -1.613
  262   1HD2  LEU  36          1HD2      LEU  36  -6.946   7.070  -4.560
  263   2HD2  LEU  36          2HD2      LEU  36  -5.405   6.482  -5.225
  264   3HD2  LEU  36          3HD2      LEU  36  -6.076   5.756  -3.749
  265    H    THR  37           H        THR  37  -3.092  11.745  -4.218
  266    HA   THR  37           HA       THR  37  -3.597  13.170  -6.452
  267    HB   THR  37           HB       THR  37  -1.032  13.447  -4.832
  268    HG1  THR  37           1HG      THR  37  -2.332  14.291  -3.178
  269   1HG2  THR  37          1HG2      THR  37  -1.592  15.842  -4.899
  270   2HG2  THR  37          2HG2      THR  37  -1.520  15.184  -6.543
  271   3HG2  THR  37          3HG2      THR  37  -3.096  15.489  -5.778
  272    H    SER  38           H        SER  38  -0.740  11.100  -5.862
  273    HA   SER  38           HA       SER  38   0.159  11.425  -8.672
  274   1HB   SER  38          2HB       SER  38   1.935  11.554  -6.193
  275   2HB   SER  38          3HB       SER  38   2.480  11.558  -7.897
  276    HG   SER  38           HG       SER  38   2.316  13.680  -7.017
  277    H    LYS  39           H        LYS  39   2.359   9.532  -6.914
  278    HA   LYS  39           HA       LYS  39   0.714   7.152  -6.803
  279   1HB   LYS  39          2HB       LYS  39   1.731   5.961  -8.645
  280   2HB   LYS  39          3HB       LYS  39   0.891   7.388  -9.194
  281   1HG   LYS  39          2HG       LYS  39   3.276   8.527  -9.157
  282   2HG   LYS  39          3HG       LYS  39   3.852   6.847  -9.079
  283   1HD   LYS  39          2HD       LYS  39   2.103   6.495 -11.056
  284   2HD   LYS  39          3HD       LYS  39   2.180   8.249 -11.204
  285   1HE   LYS  39          2HE       LYS  39   4.586   8.163 -11.687
  286   2HE   LYS  39          3HE       LYS  39   4.663   6.447 -11.258
  287   1HZ   LYS  39          1HZ       LYS  39   3.209   7.544 -13.568
  288   2HZ   LYS  39          2HZ       LYS  39   4.626   6.708 -13.609
  289   3HZ   LYS  39          3HZ       LYS  39   3.242   5.959 -13.130
  290    H    LYS  40           H        LYS  40   2.293   8.437  -4.855
  291    HA   LYS  40           HA       LYS  40   4.265   6.271  -4.317
  292   1HB   LYS  40          2HB       LYS  40   5.376   7.623  -2.763
  293   2HB   LYS  40          3HB       LYS  40   5.241   8.531  -4.259
  294   1HG   LYS  40          2HG       LYS  40   4.920  10.069  -2.560
  295   2HG   LYS  40          3HG       LYS  40   3.319   9.829  -3.221
  296   1HD   LYS  40          2HD       LYS  40   2.539   8.806  -1.263
  297   2HD   LYS  40          3HD       LYS  40   4.127   8.147  -0.829
  298   1HE   LYS  40          2HE       LYS  40   4.854  10.236   0.070
  299   2HE   LYS  40          3HE       LYS  40   3.514  11.121  -0.669
  300   1HZ   LYS  40          1HZ       LYS  40   3.067  10.720   1.687
  301   2HZ   LYS  40          2HZ       LYS  40   1.986  10.003   0.765
  302   3HZ   LYS  40          3HZ       LYS  40   3.188   9.087   1.463
  303    H    VAL  41           H        VAL  41   4.051   5.198  -2.324
  304    HA   VAL  41           HA       VAL  41   1.576   5.760  -0.764
  305    HB   VAL  41           HB       VAL  41   1.113   3.753  -2.036
  306   1HG1  VAL  41          1HG1      VAL  41   3.664   2.565  -0.878
  307   2HG1  VAL  41          2HG1      VAL  41   2.467   1.713  -1.869
  308   3HG1  VAL  41          3HG1      VAL  41   3.427   3.013  -2.582
  309   1HG2  VAL  41          1HG2      VAL  41   0.438   3.847   0.387
  310   2HG2  VAL  41          2HG2      VAL  41   0.639   2.204  -0.240
  311   3HG2  VAL  41          3HG2      VAL  41   1.889   2.919   0.792
  312    H    THR  42           H        THR  42   1.920   5.853   1.462
  313    HA   THR  42           HA       THR  42   4.622   5.099   2.414
  314    HB   THR  42           HB       THR  42   2.995   7.455   3.400
  315    HG1  THR  42           1HG      THR  42   5.211   7.540   1.659
  316   1HG2  THR  42          1HG2      THR  42   5.114   8.186   4.421
  317   2HG2  THR  42          2HG2      THR  42   4.611   6.603   5.031
  318   3HG2  THR  42          3HG2      THR  42   5.915   6.715   3.829
  319    H    ILE  43           H        ILE  43   4.419   3.575   3.966
  320    HA   ILE  43           HA       ILE  43   1.904   3.416   5.605
  321    HB   ILE  43           HB       ILE  43   3.822   1.260   4.675
  322   1HG1  ILE  43          2HG1      ILE  43   2.286   1.758   2.900
  323   2HG1  ILE  43          3HG1      ILE  43   1.776   0.261   3.705
  324   1HG2  ILE  43          1HG2      ILE  43   1.441   0.943   6.543
  325   2HG2  ILE  43          2HG2      ILE  43   2.413  -0.363   5.818
  326   3HG2  ILE  43          3HG2      ILE  43   3.150   0.760   6.961
  327   1HD1  ILE  43          1HD1      ILE  43  -0.175   1.509   3.164
  328   2HD1  ILE  43          2HD1      ILE  43   0.018   1.549   4.923
  329   3HD1  ILE  43          3HD1      ILE  43   0.437   2.971   3.938
  330    H    THR  44           H        THR  44   2.270   4.317   7.518
  331    HA   THR  44           HA       THR  44   4.964   4.216   8.762
  332    HB   THR  44           HB       THR  44   2.411   5.645   9.518
  333    HG1  THR  44           1HG      THR  44   3.550   6.451   7.718
  334   1HG2  THR  44          1HG2      THR  44   5.194   5.743  10.783
  335   2HG2  THR  44          2HG2      THR  44   3.841   6.824  11.170
  336   3HG2  THR  44          3HG2      THR  44   3.723   5.101  11.556
  337    H    SER  45           H        SER  45   5.172   2.101   9.120
  338    HA   SER  45           HA       SER  45   3.721   1.029  11.458
  339   1HB   SER  45          2HB       SER  45   3.396  -1.142  10.468
  340   2HB   SER  45          3HB       SER  45   2.682  -0.017   9.307
  341    HG   SER  45           HG       SER  45   4.529  -0.142   8.080
  342    H    ALA  46           H        ALA  46   4.980  -1.115  12.045
  343    HA   ALA  46           HA       ALA  46   7.891  -0.719  11.925
  344   1HB   ALA  46          1HB       ALA  46   6.871  -1.615  13.963
  345   2HB   ALA  46          2HB       ALA  46   6.208  -2.992  13.051
  346   3HB   ALA  46          3HB       ALA  46   7.967  -2.797  13.219
  347    H    LEU  47           H        LEU  47   5.416  -2.963  10.544
  348    HA   LEU  47           HA       LEU  47   7.601  -4.527   9.286
  349   1HB   LEU  47          2HB       LEU  47   6.090  -6.322   9.145
  350   2HB   LEU  47          3HB       LEU  47   6.060  -5.722  10.791
  351    HG   LEU  47           HG       LEU  47   3.933  -4.669   8.914
  352   1HD1  LEU  47          1HD1      LEU  47   4.051  -7.110   8.368
  353   2HD1  LEU  47          2HD1      LEU  47   3.833  -7.479  10.087
  354   3HD1  LEU  47          3HD1      LEU  47   2.544  -6.657   9.181
  355   1HD2  LEU  47          1HD2      LEU  47   2.501  -4.954  10.897
  356   2HD2  LEU  47          2HD2      LEU  47   3.868  -5.623  11.805
  357   3HD2  LEU  47          3HD2      LEU  47   3.890  -3.930  11.262
  358    H    GLY  48           H        GLY  48   6.227  -1.936   8.262
  359   1HA   GLY  48          2HA       GLY  48   4.309  -2.311   6.485
  360   2HA   GLY  48          3HA       GLY  48   5.510  -1.028   6.278
  361    H    GLU  49           H        GLU  49   7.778  -2.407   5.580
  362    HA   GLU  49           HA       GLU  49   7.450  -2.737   2.822
  363   1HB   GLU  49          2HB       GLU  49   9.541  -2.337   4.359
  364   2HB   GLU  49          3HB       GLU  49   9.677  -4.096   4.385
  365   1HG   GLU  49          2HG       GLU  49   9.606  -2.350   1.868
  366   2HG   GLU  49          3HG       GLU  49  11.072  -2.986   2.627
  367    H    GLU  50           H        GLU  50   7.798  -5.258   5.338
  368    HA   GLU  50           HA       GLU  50   7.598  -7.494   3.641
  369   1HB   GLU  50          2HB       GLU  50   8.260  -7.108   6.272
  370   2HB   GLU  50          3HB       GLU  50   6.604  -7.693   6.483
  371   1HG   GLU  50          2HG       GLU  50   7.242  -9.642   4.974
  372   2HG   GLU  50          3HG       GLU  50   8.907  -9.017   5.026
  373    H    GLN  51           H        GLN  51   5.176  -5.883   5.742
  374    HA   GLN  51           HA       GLN  51   3.014  -7.553   5.140
  375   1HB   GLN  51          2HB       GLN  51   3.369  -5.581   6.885
  376   2HB   GLN  51          3HB       GLN  51   2.577  -4.588   5.683
  377   1HG   GLN  51          2HG       GLN  51   1.493  -7.201   6.852
  378   2HG   GLN  51          3HG       GLN  51   1.056  -5.582   7.413
  379   1HE2  GLN  51          1HE2      GLN  51  -0.856  -7.551   6.395
  380   2HE2  GLN  51          2HE2      GLN  51  -1.579  -6.798   4.997
  381    H    LEU  52           H        LEU  52   3.782  -4.319   3.726
  382    HA   LEU  52           HA       LEU  52   1.974  -4.204   1.703
  383   1HB   LEU  52          2HB       LEU  52   4.879  -3.331   1.926
  384   2HB   LEU  52          3HB       LEU  52   3.952  -2.970   0.500
  385    HG   LEU  52           HG       LEU  52   3.084  -2.097   3.280
  386   1HD1  LEU  52          1HD1      LEU  52   4.536  -0.654   1.040
  387   2HD1  LEU  52          2HD1      LEU  52   3.978   0.107   2.547
  388   3HD1  LEU  52          3HD1      LEU  52   5.232  -1.145   2.608
  389   1HD2  LEU  52          1HD2      LEU  52   1.181  -2.167   1.843
  390   2HD2  LEU  52          2HD2      LEU  52   1.710  -0.485   1.723
  391   3HD2  LEU  52          3HD2      LEU  52   2.090  -1.605   0.434
  392    H    ARG  53           H        ARG  53   5.203  -5.837   1.559
  393    HA   ARG  53           HA       ARG  53   5.206  -6.561  -1.076
  394   1HB   ARG  53          2HB       ARG  53   6.737  -7.265   1.111
  395   2HB   ARG  53          3HB       ARG  53   5.916  -8.783   0.810
  396   1HG   ARG  53          2HG       ARG  53   7.839  -8.960  -0.515
  397   2HG   ARG  53          3HG       ARG  53   6.650  -8.375  -1.697
  398   1HD   ARG  53          2HD       ARG  53   7.464  -5.986  -1.028
  399   2HD   ARG  53          3HD       ARG  53   8.765  -6.801  -0.154
  400    HE   ARG  53           HE       ARG  53   8.600  -7.729  -2.879
  401   1HH1  ARG  53          2HH2      ARG  53   9.728  -4.966  -0.938
  402   2HH1  ARG  53          1HH2      ARG  53  10.823  -4.380  -2.139
  403   1HH2  ARG  53          2HH1      ARG  53  10.050  -6.940  -4.501
  404   2HH2  ARG  53          1HH1      ARG  53  11.010  -5.528  -4.197
  405    H    THR  54           H        THR  54   3.641  -8.494   1.535
  406    HA   THR  54           HA       THR  54   2.415 -10.285  -0.332
  407    HB   THR  54           HB       THR  54   1.664  -9.799   2.580
  408    HG1  THR  54           1HG      THR  54   3.740 -11.309   1.379
  409   1HG2  THR  54          1HG2      THR  54   1.469 -12.260   0.769
  410   2HG2  THR  54          2HG2      THR  54   1.107 -12.222   2.506
  411   3HG2  THR  54          3HG2      THR  54   0.103 -11.299   1.373
  412    H    ALA  55           H        ALA  55   1.128  -7.499   1.567
  413    HA   ALA  55           HA       ALA  55  -1.589  -7.881   0.825
  414   1HB   ALA  55          1HB       ALA  55  -1.901  -5.564   1.628
  415   2HB   ALA  55          2HB       ALA  55  -0.951  -6.557   2.745
  416   3HB   ALA  55          3HB       ALA  55  -0.138  -5.357   1.716
  417    H    ILE  56           H        ILE  56   0.800  -5.528  -0.455
  418    HA   ILE  56           HA       ILE  56  -0.584  -4.620  -2.734
  419    HB   ILE  56           HB       ILE  56   2.377  -5.314  -2.601
  420   1HG1  ILE  56          2HG1      ILE  56   1.097  -2.558  -2.224
  421   2HG1  ILE  56          3HG1      ILE  56   1.557  -3.564  -0.855
  422   1HG2  ILE  56          1HG2      ILE  56   1.324  -4.955  -4.923
  423   2HG2  ILE  56          2HG2      ILE  56   0.894  -3.333  -4.339
  424   3HG2  ILE  56          3HG2      ILE  56   2.598  -3.847  -4.503
  425   1HD1  ILE  56          1HD1      ILE  56   3.908  -3.602  -1.677
  426   2HD1  ILE  56          2HD1      ILE  56   3.453  -2.570  -3.030
  427   3HD1  ILE  56          3HD1      ILE  56   3.331  -1.936  -1.406
  428    H    ALA  57           H        ALA  57   1.571  -7.582  -2.552
  429    HA   ALA  57           HA       ALA  57   1.051  -8.406  -5.178
  430   1HB   ALA  57          1HB       ALA  57   1.591 -10.158  -2.749
  431   2HB   ALA  57          2HB       ALA  57   1.717 -10.657  -4.446
  432   3HB   ALA  57          3HB       ALA  57   2.803  -9.408  -3.814
  433    H    SER  58           H        SER  58  -0.915  -8.978  -2.260
  434    HA   SER  58           HA       SER  58  -2.762 -10.787  -3.406
  435   1HB   SER  58          2HB       SER  58  -2.494 -10.175  -0.940
  436   2HB   SER  58          3HB       SER  58  -3.466  -8.729  -1.286
  437    HG   SER  58           HG       SER  58  -5.017 -10.297  -2.228
  438    H    ALA  59           H        ALA  59  -2.497  -7.264  -3.764
  439    HA   ALA  59           HA       ALA  59  -5.124  -7.056  -5.126
  440   1HB   ALA  59          1HB       ALA  59  -4.487  -4.728  -5.492
  441   2HB   ALA  59          2HB       ALA  59  -4.331  -5.158  -3.776
  442   3HB   ALA  59          3HB       ALA  59  -2.882  -5.018  -4.796
  443    H    GLY  60           H        GLY  60  -1.641  -6.871  -5.856
  444   1HA   GLY  60          2HA       GLY  60  -0.580  -7.853  -7.731
  445   2HA   GLY  60          3HA       GLY  60  -2.096  -7.839  -8.640
  446    H    HIS  61           H        HIS  61   0.238  -5.601  -7.056
  447    HA   HIS  61           HA       HIS  61  -0.074  -3.706  -9.343
  448   1HB   HIS  61          2HB       HIS  61   0.288  -3.241  -6.385
  449   2HB   HIS  61          3HB       HIS  61   0.721  -2.004  -7.536
  450    HD1  HIS  61           1HD      HIS  61  -1.656  -1.468  -9.320
  451    HD2  HIS  61           2HD      HIS  61  -1.825  -2.531  -5.239
  452    HE1  HIS  61           1HE      HIS  61  -3.686  -0.310  -8.338
  453    H    GLU  62           H        GLU  62   1.782  -2.899 -10.213
  454    HA   GLU  62           HA       GLU  62   4.216  -4.431  -9.879
  455   1HB   GLU  62          2HB       GLU  62   3.545  -2.136 -11.779
  456   2HB   GLU  62          3HB       GLU  62   4.834  -3.337 -11.947
  457   1HG   GLU  62          2HG       GLU  62   1.823  -3.925 -12.090
  458   2HG   GLU  62          3HG       GLU  62   2.942  -3.805 -13.444
  459    H    VAL  63           H        VAL  63   4.105  -3.372  -7.627
  460    HA   VAL  63           HA       VAL  63   5.041  -0.614  -7.432
  461    HB   VAL  63           HB       VAL  63   4.815  -2.767  -5.284
  462   1HG1  VAL  63          1HG1      VAL  63   5.081   0.260  -5.013
  463   2HG1  VAL  63          2HG1      VAL  63   4.799  -0.872  -3.690
  464   3HG1  VAL  63          3HG1      VAL  63   6.325  -0.928  -4.565
  465   1HG2  VAL  63          1HG2      VAL  63   2.978  -0.604  -6.337
  466   2HG2  VAL  63          2HG2      VAL  63   2.646  -2.334  -6.253
  467   3HG2  VAL  63          3HG2      VAL  63   2.694  -1.363  -4.769
  468    H    GLU  64           H        GLU  64   7.018   0.206  -7.002
  469    HA   GLU  64           HA       GLU  64   9.357  -1.629  -6.874
  470   1HB   GLU  64          2HB       GLU  64   8.895   0.407  -8.747
  471   2HB   GLU  64          3HB       GLU  64   9.811   1.225  -7.481
  472   1HG   GLU  64          2HG       GLU  64  11.558   0.494  -8.745
  473   2HG   GLU  64          3HG       GLU  64  11.395  -0.955  -7.752
  Start of MODEL    8
    1   1H    MET   1           H1       MET   1   8.950   0.149   8.013
    2   2H    MET   1           H2       MET   1   8.657  -0.734   9.388
    3   3H    MET   1           H3       MET   1   7.538   0.337   8.893
    4    HA   MET   1           HA       MET   1   8.476   1.417  10.598
    5   1HB   MET   1          2HB       MET   1  10.814   1.585  11.042
    6   2HB   MET   1          3HB       MET   1  10.324  -0.095  10.886
    7   1HG   MET   1          2HG       MET   1  11.214   0.292   8.348
    8   2HG   MET   1          3HG       MET   1  12.142   1.545   9.174
    9   1HE   MET   1          1HE       MET   1  12.596  -2.998   9.699
   10   2HE   MET   1          2HE       MET   1  11.052  -2.198  10.060
   11   3HE   MET   1          3HE       MET   1  11.697  -2.194   8.397
   12    H    THR   2           H        THR   2   7.189   2.882   9.294
   13    HA   THR   2           HA       THR   2   6.780   4.597   7.866
   14    HB   THR   2           HB       THR   2   7.615   5.634   9.851
   15    HG1  THR   2           1HG      THR   2   6.862   6.955   8.281
   16   1HG2  THR   2          1HG2      THR   2   9.921   4.953  10.039
   17   2HG2  THR   2          2HG2      THR   2  10.350   5.786   8.532
   18   3HG2  THR   2          3HG2      THR   2   9.821   6.712   9.941
   19    H    ILE   3           H        ILE   3   7.149   3.024   6.045
   20    HA   ILE   3           HA       ILE   3   9.639   3.609   4.495
   21    HB   ILE   3           HB       ILE   3   7.673   1.301   4.355
   22   1HG1  ILE   3          2HG1      ILE   3   9.205   1.306   6.353
   23   2HG1  ILE   3          3HG1      ILE   3   9.352  -0.088   5.298
   24   1HG2  ILE   3          1HG2      ILE   3   8.504   1.716   2.147
   25   2HG2  ILE   3          2HG2      ILE   3  10.168   1.915   2.726
   26   3HG2  ILE   3          3HG2      ILE   3   9.385   0.323   2.779
   27   1HD1  ILE   3          1HD1      ILE   3  11.428   0.766   4.339
   28   2HD1  ILE   3          2HD1      ILE   3  11.276   2.280   5.262
   29   3HD1  ILE   3          3HD1      ILE   3  11.544   0.747   6.096
   30    H    GLN   4           H        GLN   4   9.521   4.440   2.480
   31    HA   GLN   4           HA       GLN   4   6.892   5.288   1.416
   32   1HB   GLN   4          2HB       GLN   4   8.431   7.105   1.947
   33   2HB   GLN   4          3HB       GLN   4   9.669   6.392   0.894
   34   1HG   GLN   4          2HG       GLN   4   8.134   6.620  -1.060
   35   2HG   GLN   4          3HG       GLN   4   6.919   7.366  -0.020
   36   1HE2  GLN   4          1HE2      GLN   4   8.582   9.124   1.534
   37   2HE2  GLN   4          2HE2      GLN   4   9.256  10.298   0.418
   38    H    LEU   5           H        LEU   5   6.208   4.058  -0.248
   39    HA   LEU   5           HA       LEU   5   8.151   2.775  -2.126
   40   1HB   LEU   5          2HB       LEU   5   5.290   1.907  -1.595
   41   2HB   LEU   5          3HB       LEU   5   6.516   1.064  -2.518
   42    HG   LEU   5           HG       LEU   5   6.558   1.485   0.504
   43   1HD1  LEU   5          1HD1      LEU   5   6.138  -0.942   0.564
   44   2HD1  LEU   5          2HD1      LEU   5   4.819  -0.057  -0.236
   45   3HD1  LEU   5          3HD1      LEU   5   5.998  -0.967  -1.208
   46   1HD2  LEU   5          1HD2      LEU   5   8.465  -0.126   0.399
   47   2HD2  LEU   5          2HD2      LEU   5   8.431  -0.028  -1.374
   48   3HD2  LEU   5          3HD2      LEU   5   8.826   1.406  -0.405
   49    H    THR   6           H        THR   6   6.935   2.425  -4.304
   50    HA   THR   6           HA       THR   6   5.270   4.781  -5.033
   51    HB   THR   6           HB       THR   6   7.967   3.948  -6.112
   52    HG1  THR   6           1HG      THR   6   7.471   5.610  -4.445
   53   1HG2  THR   6          1HG2      THR   6   7.589   5.668  -7.921
   54   2HG2  THR   6          2HG2      THR   6   6.727   4.144  -8.155
   55   3HG2  THR   6          3HG2      THR   6   5.848   5.575  -7.557
   56    H    VAL   7           H        VAL   7   3.572   4.283  -6.143
   57    HA   VAL   7           HA       VAL   7   3.215   1.546  -7.332
   58    HB   VAL   7           HB       VAL   7   1.996   1.654  -5.373
   59   1HG1  VAL   7          1HG1      VAL   7   0.293   3.351  -4.808
   60   2HG1  VAL   7          2HG1      VAL   7   1.939   3.976  -4.760
   61   3HG1  VAL   7          3HG1      VAL   7   0.885   4.372  -6.129
   62   1HG2  VAL   7          1HG2      VAL   7  -0.162   1.150  -6.021
   63   2HG2  VAL   7          2HG2      VAL   7  -0.138   2.293  -7.360
   64   3HG2  VAL   7          3HG2      VAL   7   0.820   0.801  -7.456
   65    HA   PRO   8           HA       PRO   8   2.990   4.714 -10.680
   66   1HB   PRO   8          2HB       PRO   8   3.826   3.071 -12.733
   67   2HB   PRO   8          3HB       PRO   8   4.932   3.975 -11.664
   68   1HG   PRO   8          2HG       PRO   8   4.102   1.081 -11.415
   69   2HG   PRO   8          3HG       PRO   8   5.744   1.774 -11.292
   70   1HD   PRO   8          2HD       PRO   8   4.312   1.183  -9.107
   71   2HD   PRO   8          3HD       PRO   8   5.321   2.646  -9.150
   72    H    THR   9           H        THR   9   1.912   1.333 -10.509
   73    HA   THR   9           HA       THR   9  -0.326   1.892 -12.326
   74    HB   THR   9           HB       THR   9   1.129  -0.125 -12.444
   75    HG1  THR   9           1HG      THR   9  -1.677  -0.322 -12.156
   76   1HG2  THR   9          1HG2      THR   9   1.249  -0.798 -10.091
   77   2HG2  THR   9          2HG2      THR   9  -0.494  -1.164 -10.090
   78   3HG2  THR   9          3HG2      THR   9   0.565  -2.057 -11.167
   79    H    ILE  10           H        ILE  10  -0.266   3.236  -9.545
   80    HA   ILE  10           HA       ILE  10  -2.434   2.622  -8.124
   81    HB   ILE  10           HB       ILE  10  -0.976   4.957  -8.821
   82   1HG1  ILE  10          2HG1      ILE  10  -3.212   4.396  -6.908
   83   2HG1  ILE  10          3HG1      ILE  10  -1.482   4.209  -6.649
   84   1HG2  ILE  10          1HG2      ILE  10  -3.912   5.625  -9.169
   85   2HG2  ILE  10          2HG2      ILE  10  -2.516   6.719  -9.246
   86   3HG2  ILE  10          3HG2      ILE  10  -2.740   5.497 -10.505
   87   1HD1  ILE  10          1HD1      ILE  10  -1.217   6.711  -6.890
   88   2HD1  ILE  10          2HD1      ILE  10  -2.993   6.844  -6.928
   89   3HD1  ILE  10          3HD1      ILE  10  -2.181   6.211  -5.487
   90    H    ALA  11           H        ALA  11  -4.716   3.155  -8.211
   91    HA   ALA  11           HA       ALA  11  -6.788   3.185  -9.059
   92   1HB   ALA  11          1HB       ALA  11  -5.696   3.836 -11.807
   93   2HB   ALA  11          2HB       ALA  11  -7.338   4.046 -11.191
   94   3HB   ALA  11          3HB       ALA  11  -6.021   5.021 -10.519
   95    H    CYS  12           H        CYS  12  -4.420   1.085 -10.481
   96    HA   CYS  12           HA       CYS  12  -5.802  -0.576 -12.140
   97   1HB   CYS  12          2HB       CYS  12  -3.494  -0.867 -11.786
   98   2HB   CYS  12          3HB       CYS  12  -3.703  -1.162 -10.049
   99    HG   CYS  12           HG       CYS  12  -3.039  -3.422 -11.177
  100    H    GLU  13           H        GLU  13  -5.597  -1.301  -8.569
  101    HA   GLU  13           HA       GLU  13  -7.973  -3.066  -8.888
  102   1HB   GLU  13          2HB       GLU  13  -5.738  -3.763  -7.732
  103   2HB   GLU  13          3HB       GLU  13  -6.321  -2.810  -6.359
  104   1HG   GLU  13          2HG       GLU  13  -7.825  -5.102  -7.730
  105   2HG   GLU  13          3HG       GLU  13  -6.896  -5.246  -6.239
  106    H    ALA  14           H        ALA  14  -8.763  -0.816  -9.460
  107    HA   ALA  14           HA       ALA  14 -10.265   0.804  -9.113
  108   1HB   ALA  14          1HB       ALA  14 -11.387  -0.675  -7.479
  109   2HB   ALA  14          2HB       ALA  14 -10.393   0.009  -6.175
  110   3HB   ALA  14          3HB       ALA  14 -11.520   1.046  -7.060
  111    H    CYS  15           H        CYS  15  -7.671   0.630  -6.725
  112    HA   CYS  15           HA       CYS  15  -6.732   3.313  -6.796
  113   1HB   CYS  15          2HB       CYS  15  -7.785   4.096  -4.643
  114   2HB   CYS  15          3HB       CYS  15  -8.894   4.099  -6.012
  115    HG   CYS  15           HG       CYS  15  -8.539   1.585  -3.880
  116    H    ALA  16           H        ALA  16  -4.869   3.393  -5.563
  117    HA   ALA  16           HA       ALA  16  -3.861   0.960  -4.544
  118   1HB   ALA  16          1HB       ALA  16  -2.914   3.815  -4.121
  119   2HB   ALA  16          2HB       ALA  16  -2.014   2.366  -3.618
  120   3HB   ALA  16          3HB       ALA  16  -2.363   2.625  -5.331
  121    H    GLU  17           H        GLU  17  -5.770   3.451  -2.847
  122    HA   GLU  17           HA       GLU  17  -5.076   2.602  -0.215
  123   1HB   GLU  17          2HB       GLU  17  -7.054   3.713   0.531
  124   2HB   GLU  17          3HB       GLU  17  -6.175   4.742  -0.596
  125   1HG   GLU  17          2HG       GLU  17  -7.920   4.802  -2.077
  126   2HG   GLU  17          3HG       GLU  17  -8.270   3.077  -1.900
  127    H    ALA  18           H        ALA  18  -6.852   0.935  -2.685
  128    HA   ALA  18           HA       ALA  18  -8.431  -0.855  -1.193
  129   1HB   ALA  18          1HB       ALA  18  -6.606  -1.413  -3.579
  130   2HB   ALA  18          2HB       ALA  18  -7.924  -2.449  -2.997
  131   3HB   ALA  18          3HB       ALA  18  -8.288  -0.847  -3.662
  132    H    VAL  19           H        VAL  19  -4.833  -0.686  -1.668
  133    HA   VAL  19           HA       VAL  19  -4.388  -3.087  -0.209
  134    HB   VAL  19           HB       VAL  19  -2.635  -1.724  -1.637
  135   1HG1  VAL  19          1HG1      VAL  19  -1.857  -0.812   1.185
  136   2HG1  VAL  19          2HG1      VAL  19  -0.979  -0.545  -0.324
  137   3HG1  VAL  19          3HG1      VAL  19  -2.518   0.278  -0.062
  138   1HG2  VAL  19          1HG2      VAL  19  -2.050  -3.862  -0.936
  139   2HG2  VAL  19          2HG2      VAL  19  -0.889  -2.903   0.016
  140   3HG2  VAL  19          3HG2      VAL  19  -2.338  -3.546   0.764
  141    H    THR  20           H        THR  20  -4.605   0.350   0.848
  142    HA   THR  20           HA       THR  20  -3.671   0.113   3.475
  143    HB   THR  20           HB       THR  20  -5.954   1.810   2.363
  144    HG1  THR  20           1HG      THR  20  -3.710   2.081   1.681
  145   1HG2  THR  20          1HG2      THR  20  -4.715   2.027   5.110
  146   2HG2  THR  20          2HG2      THR  20  -5.803   3.203   4.329
  147   3HG2  THR  20          3HG2      THR  20  -6.396   1.607   4.738
  148    H    LYS  21           H        LYS  21  -7.036  -0.429   2.325
  149    HA   LYS  21           HA       LYS  21  -7.970  -1.175   4.937
  150   1HB   LYS  21          2HB       LYS  21  -9.249  -1.866   2.264
  151   2HB   LYS  21          3HB       LYS  21 -10.011  -1.796   3.869
  152   1HG   LYS  21          2HG       LYS  21  -8.933   0.662   3.867
  153   2HG   LYS  21          3HG       LYS  21  -8.989   0.441   2.110
  154   1HD   LYS  21          2HD       LYS  21 -11.417   0.141   2.206
  155   2HD   LYS  21          3HD       LYS  21 -11.387   0.153   3.990
  156   1HE   LYS  21          2HE       LYS  21 -10.494   2.473   3.992
  157   2HE   LYS  21          3HE       LYS  21 -10.443   2.464   2.229
  158   1HZ   LYS  21          1HZ       LYS  21 -12.881   2.321   3.858
  159   2HZ   LYS  21          2HZ       LYS  21 -12.329   3.617   2.999
  160   3HZ   LYS  21          3HZ       LYS  21 -12.821   2.270   2.205
  161    H    ALA  22           H        ALA  22  -6.532  -3.027   2.302
  162    HA   ALA  22           HA       ALA  22  -7.054  -5.623   3.415
  163   1HB   ALA  22          1HB       ALA  22  -4.725  -4.856   1.648
  164   2HB   ALA  22          2HB       ALA  22  -5.377  -6.465   1.969
  165   3HB   ALA  22          3HB       ALA  22  -6.355  -5.279   1.074
  166    H    VAL  23           H        VAL  23  -4.130  -3.562   3.489
  167    HA   VAL  23           HA       VAL  23  -2.462  -5.085   5.123
  168    HB   VAL  23           HB       VAL  23  -2.662  -2.035   4.975
  169   1HG1  VAL  23          1HG1      VAL  23  -0.176  -3.665   5.463
  170   2HG1  VAL  23          2HG1      VAL  23  -0.386  -1.930   5.673
  171   3HG1  VAL  23          3HG1      VAL  23  -1.131  -3.036   6.839
  172   1HG2  VAL  23          1HG2      VAL  23  -0.763  -2.268   3.338
  173   2HG2  VAL  23          2HG2      VAL  23  -1.032  -4.025   3.320
  174   3HG2  VAL  23          3HG2      VAL  23  -2.276  -2.911   2.748
  175    H    GLN  24           H        GLN  24  -4.863  -2.593   5.982
  176    HA   GLN  24           HA       GLN  24  -4.473  -2.576   8.769
  177   1HB   GLN  24          2HB       GLN  24  -6.877  -1.918   7.067
  178   2HB   GLN  24          3HB       GLN  24  -6.799  -1.572   8.791
  179   1HG   GLN  24          2HG       GLN  24  -4.546  -0.569   7.028
  180   2HG   GLN  24          3HG       GLN  24  -6.116   0.228   6.933
  181   1HE2  GLN  24          1HE2      GLN  24  -3.337   1.034   7.983
  182   2HE2  GLN  24          2HE2      GLN  24  -3.692   1.697   9.571
  183    H    ASN  25           H        ASN  25  -6.048  -5.112   6.836
  184    HA   ASN  25           HA       ASN  25  -7.768  -6.061   8.969
  185   1HB   ASN  25          2HB       ASN  25  -6.386  -7.614   6.736
  186   2HB   ASN  25          3HB       ASN  25  -7.564  -8.280   7.861
  187   1HD2  ASN  25          1HD2      ASN  25  -7.331  -7.209   4.807
  188   2HD2  ASN  25          2HD2      ASN  25  -8.992  -6.667   4.565
  189    H    GLU  26           H        GLU  26  -4.434  -6.903   7.955
  190    HA   GLU  26           HA       GLU  26  -3.930  -8.625  10.248
  191   1HB   GLU  26          2HB       GLU  26  -2.161  -7.325   8.150
  192   2HB   GLU  26          3HB       GLU  26  -1.565  -8.467   9.356
  193   1HG   GLU  26          2HG       GLU  26  -3.806  -9.209   7.415
  194   2HG   GLU  26          3HG       GLU  26  -2.093  -9.376   7.009
  195    H    ASP  27           H        ASP  27  -2.752  -5.406   9.153
  196    HA   ASP  27           HA       ASP  27  -1.674  -4.938  11.864
  197   1HB   ASP  27          2HB       ASP  27  -0.192  -4.745   9.790
  198   2HB   ASP  27          3HB       ASP  27  -1.058  -3.279   9.383
  199    H    ALA  28           H        ALA  28  -3.871  -4.627  12.613
  200    HA   ALA  28           HA       ALA  28  -5.543  -2.485  11.609
  201   1HB   ALA  28          1HB       ALA  28  -6.399  -4.498  12.749
  202   2HB   ALA  28          2HB       ALA  28  -5.589  -3.982  14.252
  203   3HB   ALA  28          3HB       ALA  28  -6.917  -3.006  13.573
  204    H    GLN  29           H        GLN  29  -2.680  -2.419  13.382
  205    HA   GLN  29           HA       GLN  29  -3.313   0.196  14.657
  206   1HB   GLN  29          2HB       GLN  29  -1.420  -0.272  16.090
  207   2HB   GLN  29          3HB       GLN  29  -2.667  -1.506  16.243
  208   1HG   GLN  29          2HG       GLN  29  -1.338  -3.047  14.838
  209   2HG   GLN  29          3HG       GLN  29  -0.107  -1.786  14.611
  210   1HE2  GLN  29          1HE2      GLN  29   0.970  -3.969  15.481
  211   2HE2  GLN  29          2HE2      GLN  29   1.267  -3.939  17.217
  212    H    ALA  30           H        ALA  30  -2.295  -0.798  11.712
  213    HA   ALA  30           HA       ALA  30   0.148   0.786  11.499
  214   1HB   ALA  30          1HB       ALA  30  -0.223   0.408   9.032
  215   2HB   ALA  30          2HB       ALA  30  -0.180  -1.078   9.972
  216   3HB   ALA  30          3HB       ALA  30  -1.734  -0.431   9.426
  217    H    THR  31           H        THR  31   0.327   2.696  10.074
  218    HA   THR  31           HA       THR  31  -2.219   4.173   9.557
  219    HB   THR  31           HB       THR  31   0.380   5.214  10.735
  220    HG1  THR  31           1HG      THR  31  -1.680   4.235  11.888
  221   1HG2  THR  31          1HG2      THR  31  -2.077   6.759   9.773
  222   2HG2  THR  31          2HG2      THR  31  -0.775   7.435  10.773
  223   3HG2  THR  31          3HG2      THR  31  -0.423   6.891   9.126
  224    H    VAL  32           H        VAL  32  -2.250   5.220   7.583
  225    HA   VAL  32           HA       VAL  32   0.012   4.594   5.759
  226    HB   VAL  32           HB       VAL  32  -1.528   4.224   4.003
  227   1HG1  VAL  32          1HG1      VAL  32  -2.445   2.141   4.676
  228   2HG1  VAL  32          2HG1      VAL  32  -1.046   2.372   5.729
  229   3HG1  VAL  32          3HG1      VAL  32  -2.669   2.669   6.358
  230   1HG2  VAL  32          1HG2      VAL  32  -3.922   4.314   4.205
  231   2HG2  VAL  32          2HG2      VAL  32  -3.843   4.747   5.925
  232   3HG2  VAL  32          3HG2      VAL  32  -3.313   5.881   4.663
  233    H    GLN  33           H        GLN  33   0.417   6.113   4.111
  234    HA   GLN  33           HA       GLN  33  -1.169   8.582   3.894
  235   1HB   GLN  33          2HB       GLN  33   1.714   8.363   4.776
  236   2HB   GLN  33          3HB       GLN  33   1.312   9.655   3.639
  237   1HG   GLN  33          2HG       GLN  33  -0.096   9.252   6.309
  238   2HG   GLN  33          3HG       GLN  33   1.275  10.333   6.036
  239   1HE2  GLN  33          1HE2      GLN  33  -0.719  11.720   6.994
  240   2HE2  GLN  33          2HE2      GLN  33  -1.588  12.572   5.729
  241    H    VAL  34           H        VAL  34  -1.930   7.796   1.932
  242    HA   VAL  34           HA       VAL  34   0.082   7.297  -0.205
  243    HB   VAL  34           HB       VAL  34  -1.304   5.353   0.108
  244   1HG1  VAL  34          1HG1      VAL  34  -3.744   7.073  -0.411
  245   2HG1  VAL  34          2HG1      VAL  34  -3.690   5.310  -0.280
  246   3HG1  VAL  34          3HG1      VAL  34  -3.316   6.307   1.132
  247   1HG2  VAL  34          1HG2      VAL  34  -2.183   6.828  -2.407
  248   2HG2  VAL  34          2HG2      VAL  34  -0.583   6.098  -2.187
  249   3HG2  VAL  34          3HG2      VAL  34  -2.030   5.077  -2.168
  250    H    ASP  35           H        ASP  35   0.247   8.785  -1.783
  251    HA   ASP  35           HA       ASP  35  -1.555  11.152  -1.595
  252   1HB   ASP  35          2HB       ASP  35   1.175  10.669  -2.825
  253   2HB   ASP  35          3HB       ASP  35   0.226  12.140  -3.061
  254    H    LEU  36           H        LEU  36  -3.390  10.370  -2.669
  255    HA   LEU  36           HA       LEU  36  -3.302   9.205  -5.346
  256   1HB   LEU  36          2HB       LEU  36  -5.622  10.439  -3.796
  257   2HB   LEU  36          3HB       LEU  36  -5.714   9.671  -5.377
  258    HG   LEU  36           HG       LEU  36  -4.537   7.632  -4.046
  259   1HD1  LEU  36          1HD1      LEU  36  -6.339   9.007  -1.990
  260   2HD1  LEU  36          2HD1      LEU  36  -5.633   7.389  -1.841
  261   3HD1  LEU  36          3HD1      LEU  36  -4.581   8.817  -1.847
  262   1HD2  LEU  36          1HD2      LEU  36  -7.521   8.261  -4.100
  263   2HD2  LEU  36          2HD2      LEU  36  -6.588   7.492  -5.402
  264   3HD2  LEU  36          3HD2      LEU  36  -6.805   6.655  -3.856
  265    H    THR  37           H        THR  37  -1.697  10.933  -5.818
  266    HA   THR  37           HA       THR  37  -2.914  13.253  -7.234
  267    HB   THR  37           HB       THR  37  -0.502  13.434  -5.358
  268    HG1  THR  37           1HG      THR  37  -1.879  14.469  -3.954
  269   1HG2  THR  37          1HG2      THR  37  -2.146  15.575  -6.784
  270   2HG2  THR  37          2HG2      THR  37  -0.800  15.874  -5.664
  271   3HG2  THR  37          3HG2      THR  37  -0.497  15.084  -7.222
  272    H    SER  38           H        SER  38   0.111  11.452  -6.450
  273    HA   SER  38           HA       SER  38   0.831  11.428  -9.338
  274   1HB   SER  38          2HB       SER  38   2.675  11.728  -6.920
  275   2HB   SER  38          3HB       SER  38   3.203  11.417  -8.595
  276    HG   SER  38           HG       SER  38   1.525  13.588  -7.933
  277    H    LYS  39           H        LYS  39   2.787   9.647  -7.085
  278    HA   LYS  39           HA       LYS  39   1.168   7.219  -7.252
  279   1HB   LYS  39          2HB       LYS  39   2.763   6.069  -8.752
  280   2HB   LYS  39          3HB       LYS  39   1.909   7.397  -9.531
  281   1HG   LYS  39          2HG       LYS  39   4.040   8.829  -8.998
  282   2HG   LYS  39          3HG       LYS  39   4.801   7.280  -8.616
  283   1HD   LYS  39          2HD       LYS  39   3.458   6.886 -11.088
  284   2HD   LYS  39          3HD       LYS  39   4.077   8.514 -11.215
  285   1HE   LYS  39          2HE       LYS  39   5.737   6.025 -10.471
  286   2HE   LYS  39          3HE       LYS  39   5.587   6.657 -12.114
  287   1HZ   LYS  39          1HZ       LYS  39   6.631   8.680 -11.398
  288   2HZ   LYS  39          2HZ       LYS  39   6.761   8.128  -9.849
  289   3HZ   LYS  39          3HZ       LYS  39   7.590   7.389 -11.057
  290    H    LYS  40           H        LYS  40   2.555   8.788  -5.079
  291    HA   LYS  40           HA       LYS  40   4.630   6.788  -4.307
  292   1HB   LYS  40          2HB       LYS  40   5.740   8.349  -3.044
  293   2HB   LYS  40          3HB       LYS  40   5.378   9.156  -4.561
  294   1HG   LYS  40          2HG       LYS  40   5.002  10.752  -2.898
  295   2HG   LYS  40          3HG       LYS  40   3.385  10.250  -3.391
  296   1HD   LYS  40          2HD       LYS  40   2.894   9.402  -1.353
  297   2HD   LYS  40          3HD       LYS  40   4.465   8.607  -1.153
  298   1HE   LYS  40          2HE       LYS  40   5.501  10.556  -0.283
  299   2HE   LYS  40          3HE       LYS  40   4.139  11.591  -0.771
  300   1HZ   LYS  40          1HZ       LYS  40   4.020  11.081   1.551
  301   2HZ   LYS  40          2HZ       LYS  40   2.740  10.505   0.699
  302   3HZ   LYS  40          3HZ       LYS  40   3.934   9.455   1.258
  303    H    VAL  41           H        VAL  41   4.472   5.890  -2.194
  304    HA   VAL  41           HA       VAL  41   2.061   6.554  -0.640
  305    HB   VAL  41           HB       VAL  41   1.303   4.722  -2.055
  306   1HG1  VAL  41          1HG1      VAL  41   3.485   3.698  -2.664
  307   2HG1  VAL  41          2HG1      VAL  41   3.667   3.156  -0.978
  308   3HG1  VAL  41          3HG1      VAL  41   2.372   2.496  -1.992
  309   1HG2  VAL  41          1HG2      VAL  41   1.982   3.527   0.635
  310   2HG2  VAL  41          2HG2      VAL  41   0.766   4.795   0.470
  311   3HG2  VAL  41          3HG2      VAL  41   0.536   3.228  -0.347
  312    H    THR  42           H        THR  42   2.304   6.228   1.576
  313    HA   THR  42           HA       THR  42   4.984   5.378   2.503
  314    HB   THR  42           HB       THR  42   3.451   7.839   3.423
  315    HG1  THR  42           1HG      THR  42   5.423   7.485   1.463
  316   1HG2  THR  42          1HG2      THR  42   5.004   6.956   5.097
  317   2HG2  THR  42          2HG2      THR  42   6.307   6.858   3.898
  318   3HG2  THR  42          3HG2      THR  42   5.675   8.440   4.403
  319    H    ILE  43           H        ILE  43   4.752   3.800   4.013
  320    HA   ILE  43           HA       ILE  43   2.184   3.688   5.590
  321    HB   ILE  43           HB       ILE  43   3.888   1.508   4.447
  322   1HG1  ILE  43          2HG1      ILE  43   1.601   0.518   4.032
  323   2HG1  ILE  43          3HG1      ILE  43   0.863   1.938   4.740
  324   1HG2  ILE  43          1HG2      ILE  43   3.778   0.864   6.800
  325   2HG2  ILE  43          2HG2      ILE  43   2.038   1.257   6.863
  326   3HG2  ILE  43          3HG2      ILE  43   2.617  -0.111   5.905
  327   1HD1  ILE  43          1HD1      ILE  43   0.940   1.802   2.202
  328   2HD1  ILE  43          2HD1      ILE  43   1.517   3.309   2.919
  329   3HD1  ILE  43          3HD1      ILE  43   2.691   2.097   2.326
  330    H    THR  44           H        THR  44   2.362   4.147   7.624
  331    HA   THR  44           HA       THR  44   4.975   3.932   9.037
  332    HB   THR  44           HB       THR  44   2.531   5.607   9.695
  333    HG1  THR  44           1HG      THR  44   3.811   6.227   7.843
  334   1HG2  THR  44          1HG2      THR  44   4.014   6.683  11.330
  335   2HG2  THR  44          2HG2      THR  44   3.886   4.957  11.708
  336   3HG2  THR  44          3HG2      THR  44   5.341   5.589  10.902
  337    H    SER  45           H        SER  45   4.624   1.668   8.922
  338    HA   SER  45           HA       SER  45   3.414   0.867  11.472
  339   1HB   SER  45          2HB       SER  45   2.948  -1.371  10.612
  340   2HB   SER  45          3HB       SER  45   1.968  -0.207   9.728
  341    HG   SER  45           HG       SER  45   3.094  -1.823   8.435
  342    H    ALA  46           H        ALA  46   4.672  -1.135  12.178
  343    HA   ALA  46           HA       ALA  46   7.534  -0.870  11.885
  344   1HB   ALA  46          1HB       ALA  46   7.561  -3.052  13.068
  345   2HB   ALA  46          2HB       ALA  46   6.515  -1.874  13.884
  346   3HB   ALA  46          3HB       ALA  46   5.799  -3.170  12.904
  347    H    LEU  47           H        LEU  47   5.032  -3.015  10.547
  348    HA   LEU  47           HA       LEU  47   6.978  -4.399   8.783
  349   1HB   LEU  47          2HB       LEU  47   5.154  -6.155   8.680
  350   2HB   LEU  47          3HB       LEU  47   6.107  -5.988  10.140
  351    HG   LEU  47           HG       LEU  47   4.135  -4.673  11.181
  352   1HD1  LEU  47          1HD1      LEU  47   2.706  -4.244   9.254
  353   2HD1  LEU  47          2HD1      LEU  47   2.744  -5.975   8.806
  354   3HD1  LEU  47          3HD1      LEU  47   1.915  -5.441  10.270
  355   1HD2  LEU  47          1HD2      LEU  47   3.014  -6.702  11.820
  356   2HD2  LEU  47          2HD2      LEU  47   3.786  -7.594  10.489
  357   3HD2  LEU  47          3HD2      LEU  47   4.772  -6.942  11.824
  358    H    GLY  48           H        GLY  48   6.877  -2.331   7.730
  359   1HA   GLY  48          2HA       GLY  48   4.424  -1.649   6.211
  360   2HA   GLY  48          3HA       GLY  48   5.968  -0.782   6.167
  361    H    GLU  49           H        GLU  49   7.788  -1.956   5.209
  362    HA   GLU  49           HA       GLU  49   7.297  -2.322   2.526
  363   1HB   GLU  49          2HB       GLU  49   9.462  -1.740   3.731
  364   2HB   GLU  49          3HB       GLU  49   9.713  -3.459   4.028
  365   1HG   GLU  49          2HG       GLU  49   9.675  -3.846   1.568
  366   2HG   GLU  49          3HG       GLU  49   9.423  -2.106   1.322
  367    H    GLU  50           H        GLU  50   8.144  -4.873   4.851
  368    HA   GLU  50           HA       GLU  50   8.145  -7.019   3.058
  369   1HB   GLU  50          2HB       GLU  50   8.941  -6.596   5.648
  370   2HB   GLU  50          3HB       GLU  50   7.466  -7.518   5.958
  371   1HG   GLU  50          2HG       GLU  50   8.362  -9.321   4.483
  372   2HG   GLU  50          3HG       GLU  50   9.797  -8.316   4.170
  373    H    GLN  51           H        GLN  51   5.606  -5.900   5.344
  374    HA   GLN  51           HA       GLN  51   3.701  -7.870   4.726
  375   1HB   GLN  51          2HB       GLN  51   3.772  -6.162   6.676
  376   2HB   GLN  51          3HB       GLN  51   3.074  -5.002   5.535
  377   1HG   GLN  51          2HG       GLN  51   1.389  -6.997   5.035
  378   2HG   GLN  51          3HG       GLN  51   1.974  -7.618   6.586
  379   1HE2  GLN  51          1HE2      GLN  51  -0.747  -7.085   6.263
  380   2HE2  GLN  51          2HE2      GLN  51  -1.183  -5.615   7.119
  381    H    LEU  52           H        LEU  52   4.065  -4.473   3.549
  382    HA   LEU  52           HA       LEU  52   2.003  -4.402   1.707
  383   1HB   LEU  52          2HB       LEU  52   4.744  -3.113   1.754
  384   2HB   LEU  52          3HB       LEU  52   3.579  -2.712   0.500
  385    HG   LEU  52           HG       LEU  52   2.778  -2.569   3.408
  386   1HD1  LEU  52          1HD1      LEU  52   3.634  -0.499   3.717
  387   2HD1  LEU  52          2HD1      LEU  52   4.936  -1.178   2.758
  388   3HD1  LEU  52          3HD1      LEU  52   3.762  -0.102   1.983
  389   1HD2  LEU  52          1HD2      LEU  52   1.101  -1.003   2.572
  390   2HD2  LEU  52          2HD2      LEU  52   1.834  -0.995   0.963
  391   3HD2  LEU  52          3HD2      LEU  52   1.027  -2.448   1.572
  392    H    ARG  53           H        ARG  53   5.363  -5.558   1.150
  393    HA   ARG  53           HA       ARG  53   5.260  -6.202  -1.515
  394   1HB   ARG  53          2HB       ARG  53   6.999  -6.785   0.516
  395   2HB   ARG  53          3HB       ARG  53   6.274  -8.369   0.318
  396   1HG   ARG  53          2HG       ARG  53   8.068  -8.493  -1.114
  397   2HG   ARG  53          3HG       ARG  53   6.791  -8.013  -2.246
  398   1HD   ARG  53          2HD       ARG  53   7.566  -5.581  -1.910
  399   2HD   ARG  53          3HD       ARG  53   8.807  -6.187  -0.834
  400    HE   ARG  53           HE       ARG  53  10.062  -7.026  -2.537
  401   1HH1  ARG  53          2HH2      ARG  53   7.013  -5.826  -3.857
  402   2HH1  ARG  53          1HH2      ARG  53   7.574  -5.717  -5.492
  403   1HH2  ARG  53          2HH1      ARG  53  10.783  -7.076  -4.719
  404   2HH2  ARG  53          1HH1      ARG  53   9.735  -6.566  -6.004
  405    H    THR  54           H        THR  54   4.015  -8.229   1.148
  406    HA   THR  54           HA       THR  54   2.961 -10.267  -0.620
  407    HB   THR  54           HB       THR  54   2.466  -9.836   2.358
  408    HG1  THR  54           1HG      THR  54   4.666  -9.988   1.979
  409   1HG2  THR  54          1HG2      THR  54   2.160 -12.304   2.339
  410   2HG2  THR  54          2HG2      THR  54   0.931 -11.489   1.355
  411   3HG2  THR  54          3HG2      THR  54   2.301 -12.307   0.570
  412    H    ALA  55           H        ALA  55   1.463  -7.771   1.478
  413    HA   ALA  55           HA       ALA  55  -1.232  -8.402   0.957
  414   1HB   ALA  55          1HB       ALA  55  -1.705  -6.144   1.831
  415   2HB   ALA  55          2HB       ALA  55  -0.492  -6.977   2.823
  416   3HB   ALA  55          3HB       ALA  55   0.012  -5.713   1.682
  417    H    ILE  56           H        ILE  56   0.794  -5.817  -0.507
  418    HA   ILE  56           HA       ILE  56  -0.974  -5.022  -2.561
  419    HB   ILE  56           HB       ILE  56   2.066  -5.163  -2.664
  420   1HG1  ILE  56          2HG1      ILE  56   0.210  -2.800  -2.062
  421   2HG1  ILE  56          3HG1      ILE  56   1.029  -3.729  -0.800
  422   1HG2  ILE  56          1HG2      ILE  56   1.057  -4.986  -4.923
  423   2HG2  ILE  56          2HG2      ILE  56   0.084  -3.609  -4.354
  424   3HG2  ILE  56          3HG2      ILE  56   1.859  -3.508  -4.457
  425   1HD1  ILE  56          1HD1      ILE  56   2.372  -2.045  -2.924
  426   2HD1  ILE  56          2HD1      ILE  56   2.296  -1.745  -1.198
  427   3HD1  ILE  56          3HD1      ILE  56   3.233  -3.128  -1.815
  428    H    ALA  57           H        ALA  57   1.491  -7.712  -2.646
  429    HA   ALA  57           HA       ALA  57   0.954  -8.460  -5.293
  430   1HB   ALA  57          1HB       ALA  57   1.782 -10.273  -2.998
  431   2HB   ALA  57          2HB       ALA  57   1.890 -10.643  -4.725
  432   3HB   ALA  57          3HB       ALA  57   2.858  -9.326  -4.050
  433    H    SER  58           H        SER  58  -1.080  -9.033  -2.451
  434    HA   SER  58           HA       SER  58  -2.703 -11.114  -3.521
  435   1HB   SER  58          2HB       SER  58  -2.728 -10.120  -1.147
  436   2HB   SER  58          3HB       SER  58  -3.731  -8.814  -1.813
  437    HG   SER  58           HG       SER  58  -4.346 -11.582  -1.983
  438    H    ALA  59           H        ALA  59  -2.726  -7.582  -4.014
  439    HA   ALA  59           HA       ALA  59  -5.109  -7.654  -5.770
  440   1HB   ALA  59          1HB       ALA  59  -3.263  -5.458  -4.771
  441   2HB   ALA  59          2HB       ALA  59  -4.570  -5.187  -5.938
  442   3HB   ALA  59          3HB       ALA  59  -4.947  -5.765  -4.302
  443    H    GLY  60           H        GLY  60  -1.588  -7.227  -5.931
  444   1HA   GLY  60          2HA       GLY  60  -0.164  -7.793  -7.680
  445   2HA   GLY  60          3HA       GLY  60  -1.538  -8.008  -8.769
  446    H    HIS  61           H        HIS  61   0.129  -5.418  -6.898
  447    HA   HIS  61           HA       HIS  61  -0.012  -3.661  -9.321
  448   1HB   HIS  61          2HB       HIS  61   0.325  -2.851  -6.433
  449   2HB   HIS  61          3HB       HIS  61   0.451  -1.768  -7.813
  450    HD1  HIS  61           1HD      HIS  61  -1.808  -0.573  -8.440
  451    HD2  HIS  61           2HD      HIS  61  -2.093  -3.861  -5.830
  452    HE1  HIS  61           1HE      HIS  61  -4.104  -0.450  -7.349
  453    H    GLU  62           H        GLU  62   1.845  -2.812 -10.042
  454    HA   GLU  62           HA       GLU  62   4.323  -4.210  -9.632
  455   1HB   GLU  62          2HB       GLU  62   3.552  -1.842 -11.418
  456   2HB   GLU  62          3HB       GLU  62   4.976  -2.875 -11.601
  457   1HG   GLU  62          2HG       GLU  62   2.077  -3.840 -11.894
  458   2HG   GLU  62          3HG       GLU  62   3.187  -3.450 -13.207
  459    H    VAL  63           H        VAL  63   3.964  -3.147  -7.299
  460    HA   VAL  63           HA       VAL  63   4.821  -0.370  -7.121
  461    HB   VAL  63           HB       VAL  63   4.338  -2.369  -4.888
  462   1HG1  VAL  63          1HG1      VAL  63   5.658  -0.344  -4.182
  463   2HG1  VAL  63          2HG1      VAL  63   4.342   0.679  -4.798
  464   3HG1  VAL  63          3HG1      VAL  63   4.055  -0.423  -3.449
  465   1HG2  VAL  63          1HG2      VAL  63   2.102  -1.035  -4.841
  466   2HG2  VAL  63          2HG2      VAL  63   2.576  -0.416  -6.425
  467   3HG2  VAL  63          3HG2      VAL  63   2.358  -2.147  -6.196
  468    H    GLU  64           H        GLU  64   6.712   0.484  -6.661
  469    HA   GLU  64           HA       GLU  64   9.157  -1.180  -6.376
  470   1HB   GLU  64          2HB       GLU  64   8.654   1.770  -6.961
  471   2HB   GLU  64          3HB       GLU  64  10.250   1.027  -6.862
  472   1HG   GLU  64          2HG       GLU  64   9.933  -0.187  -8.884
  473   2HG   GLU  64          3HG       GLU  64   8.179   0.041  -8.873
  Start of MODEL    9
    1   1H    MET   1           H1       MET   1  12.257   3.751   8.343
    2   2H    MET   1           H2       MET   1  12.494   2.936   9.780
    3   3H    MET   1           H3       MET   1  11.397   2.396   8.659
    4    HA   MET   1           HA       MET   1  10.080   3.444  10.209
    5   1HB   MET   1          2HB       MET   1  10.593   5.625  11.149
    6   2HB   MET   1          3HB       MET   1  11.958   4.534  11.381
    7   1HG   MET   1          2HG       MET   1  12.864   5.681   9.143
    8   2HG   MET   1          3HG       MET   1  11.725   6.953   9.598
    9   1HE   MET   1          1HE       MET   1  15.249   8.415  10.514
   10   2HE   MET   1          2HE       MET   1  14.781   7.435   9.104
   11   3HE   MET   1          3HE       MET   1  13.706   8.735   9.687
   12    H    THR   2           H        THR   2   8.269   4.626   9.426
   13    HA   THR   2           HA       THR   2   6.871   5.347   7.774
   14    HB   THR   2           HB       THR   2   7.268   7.660   7.216
   15    HG1  THR   2           1HG      THR   2   9.590   7.291   6.815
   16   1HG2  THR   2          1HG2      THR   2   7.519   8.584   9.433
   17   2HG2  THR   2          2HG2      THR   2   6.638   7.050   9.564
   18   3HG2  THR   2          3HG2      THR   2   8.354   7.137  10.019
   19    H    ILE   3           H        ILE   3   7.129   3.602   6.196
   20    HA   ILE   3           HA       ILE   3   9.437   3.795   4.398
   21    HB   ILE   3           HB       ILE   3   7.219   1.727   4.415
   22   1HG1  ILE   3          2HG1      ILE   3   8.085   1.753   6.689
   23   2HG1  ILE   3          3HG1      ILE   3   8.597   0.322   5.820
   24   1HG2  ILE   3          1HG2      ILE   3   8.962   0.317   3.387
   25   2HG2  ILE   3          2HG2      ILE   3   8.659   1.767   2.429
   26   3HG2  ILE   3          3HG2      ILE   3  10.106   1.675   3.433
   27   1HD1  ILE   3          1HD1      ILE   3  10.362   2.756   6.301
   28   2HD1  ILE   3          2HD1      ILE   3  10.393   1.232   7.215
   29   3HD1  ILE   3          3HD1      ILE   3  10.859   1.242   5.512
   30    H    GLN   4           H        GLN   4   9.366   4.570   2.368
   31    HA   GLN   4           HA       GLN   4   6.776   5.276   1.113
   32   1HB   GLN   4          2HB       GLN   4   9.601   6.290   0.843
   33   2HB   GLN   4          3HB       GLN   4   8.435   6.513  -0.477
   34   1HG   GLN   4          2HG       GLN   4   6.874   7.643   0.903
   35   2HG   GLN   4          3HG       GLN   4   7.781   7.290   2.382
   36   1HE2  GLN   4          1HE2      GLN   4   6.993   9.866   1.860
   37   2HE2  GLN   4          2HE2      GLN   4   8.416  10.833   1.474
   38    H    LEU   5           H        LEU   5   5.995   3.875  -0.303
   39    HA   LEU   5           HA       LEU   5   7.788   2.167  -1.996
   40   1HB   LEU   5          2HB       LEU   5   5.128   1.801  -0.658
   41   2HB   LEU   5          3HB       LEU   5   5.271   1.175  -2.300
   42    HG   LEU   5           HG       LEU   5   7.061  -0.296  -1.666
   43   1HD1  LEU   5          1HD1      LEU   5   6.899   0.989   1.097
   44   2HD1  LEU   5          2HD1      LEU   5   7.792  -0.502   0.728
   45   3HD1  LEU   5          3HD1      LEU   5   8.301   1.023  -0.004
   46   1HD2  LEU   5          1HD2      LEU   5   4.693  -0.956  -1.194
   47   2HD2  LEU   5          2HD2      LEU   5   5.812  -1.706  -0.040
   48   3HD2  LEU   5          3HD2      LEU   5   4.851  -0.287   0.439
   49    H    THR   6           H        THR   6   7.185   2.025  -4.244
   50    HA   THR   6           HA       THR   6   5.875   4.529  -5.264
   51    HB   THR   6           HB       THR   6   8.178   2.889  -6.365
   52    HG1  THR   6           1HG      THR   6   9.336   4.238  -5.260
   53   1HG2  THR   6          1HG2      THR   6   6.891   5.488  -7.322
   54   2HG2  THR   6          2HG2      THR   6   8.411   4.809  -7.948
   55   3HG2  THR   6          3HG2      THR   6   6.890   3.935  -8.200
   56    H    VAL   7           H        VAL   7   3.950   4.089  -6.087
   57    HA   VAL   7           HA       VAL   7   3.350   1.438  -7.318
   58    HB   VAL   7           HB       VAL   7   2.358   1.672  -5.202
   59   1HG1  VAL   7          1HG1      VAL   7   1.076   4.289  -6.043
   60   2HG1  VAL   7          2HG1      VAL   7   0.761   3.388  -4.552
   61   3HG1  VAL   7          3HG1      VAL   7   2.349   4.092  -4.848
   62   1HG2  VAL   7          1HG2      VAL   7   0.996   0.560  -6.911
   63   2HG2  VAL   7          2HG2      VAL   7   0.028   1.319  -5.647
   64   3HG2  VAL   7          3HG2      VAL   7   0.155   2.079  -7.237
   65    HA   PRO   8           HA       PRO   8   2.910   4.627 -10.659
   66   1HB   PRO   8          2HB       PRO   8   3.589   3.081 -12.787
   67   2HB   PRO   8          3HB       PRO   8   4.789   3.828 -11.696
   68   1HG   PRO   8          2HG       PRO   8   3.746   0.989 -11.609
   69   2HG   PRO   8          3HG       PRO   8   5.444   1.537 -11.534
   70   1HD   PRO   8          2HD       PRO   8   4.027   0.918  -9.312
   71   2HD   PRO   8          3HD       PRO   8   5.206   2.251  -9.300
   72    H    THR   9           H        THR   9   1.570   1.460 -10.179
   73    HA   THR   9           HA       THR   9  -0.610   1.753 -12.081
   74    HB   THR   9           HB       THR   9   0.400  -0.354 -11.885
   75    HG1  THR   9           1HG      THR   9  -2.013  -0.400 -11.732
   76   1HG2  THR   9          1HG2      THR   9   1.630  -0.381  -9.870
   77   2HG2  THR   9          2HG2      THR   9   0.158  -0.066  -8.900
   78   3HG2  THR   9          3HG2      THR   9   0.396  -1.609  -9.732
   79    H    ILE  10           H        ILE  10  -0.215   3.339  -9.103
   80    HA   ILE  10           HA       ILE  10  -2.599   3.027  -7.861
   81    HB   ILE  10           HB       ILE  10  -0.627   5.161  -8.096
   82   1HG1  ILE  10          2HG1      ILE  10  -2.773   4.421  -6.098
   83   2HG1  ILE  10          3HG1      ILE  10  -1.148   3.760  -6.145
   84   1HG2  ILE  10          1HG2      ILE  10  -2.363   6.556  -9.152
   85   2HG2  ILE  10          2HG2      ILE  10  -3.481   6.198  -7.806
   86   3HG2  ILE  10          3HG2      ILE  10  -2.001   7.112  -7.527
   87   1HD1  ILE  10          1HD1      ILE  10  -1.080   5.347  -4.420
   88   2HD1  ILE  10          2HD1      ILE  10  -0.315   6.191  -5.776
   89   3HD1  ILE  10          3HD1      ILE  10  -1.999   6.559  -5.328
   90    H    ALA  11           H        ALA  11  -4.672   3.583  -8.021
   91    HA   ALA  11           HA       ALA  11  -6.675   3.905  -8.974
   92   1HB   ALA  11          1HB       ALA  11  -5.302   6.072 -10.612
   93   2HB   ALA  11          2HB       ALA  11  -7.033   5.928 -10.262
   94   3HB   ALA  11          3HB       ALA  11  -5.893   6.258  -8.946
   95    H    CYS  12           H        CYS  12  -4.445   2.187 -10.532
   96    HA   CYS  12           HA       CYS  12  -6.208   1.710 -12.901
   97   1HB   CYS  12          2HB       CYS  12  -4.039   2.916 -13.407
   98   2HB   CYS  12          3HB       CYS  12  -3.175   1.470 -12.843
   99    HG   CYS  12           HG       CYS  12  -3.309   1.592 -15.469
  100    H    GLU  13           H        GLU  13  -6.872   0.527 -10.704
  101    HA   GLU  13           HA       GLU  13  -6.972  -2.093 -11.466
  102   1HB   GLU  13          2HB       GLU  13  -4.559  -1.899 -10.148
  103   2HB   GLU  13          3HB       GLU  13  -5.593  -2.400  -8.816
  104   1HG   GLU  13          2HG       GLU  13  -5.257  -3.782 -11.492
  105   2HG   GLU  13          3HG       GLU  13  -4.626  -4.313  -9.927
  106    H    ALA  14           H        ALA  14  -6.894  -1.337  -7.967
  107    HA   ALA  14           HA       ALA  14  -9.831  -0.770  -7.997
  108   1HB   ALA  14          1HB       ALA  14  -8.355  -2.698  -6.160
  109   2HB   ALA  14          2HB       ALA  14 -10.091  -2.318  -6.123
  110   3HB   ALA  14          3HB       ALA  14  -9.402  -3.170  -7.517
  111    H    CYS  15           H        CYS  15  -7.334   0.888  -7.661
  112    HA   CYS  15           HA       CYS  15  -6.716   2.724  -6.552
  113   1HB   CYS  15          2HB       CYS  15  -9.119   3.269  -6.182
  114   2HB   CYS  15          3HB       CYS  15  -9.056   2.381  -4.637
  115    HG   CYS  15           HG       CYS  15  -8.866   4.760  -3.923
  116    H    ALA  16           H        ALA  16  -5.056   3.063  -5.146
  117    HA   ALA  16           HA       ALA  16  -3.938   0.920  -3.727
  118   1HB   ALA  16          1HB       ALA  16  -2.593   2.764  -4.461
  119   2HB   ALA  16          2HB       ALA  16  -3.500   3.913  -3.441
  120   3HB   ALA  16          3HB       ALA  16  -2.470   2.663  -2.699
  121    H    GLU  17           H        GLU  17  -6.330   3.329  -2.575
  122    HA   GLU  17           HA       GLU  17  -5.971   2.870   0.164
  123   1HB   GLU  17          2HB       GLU  17  -8.036   3.882   0.532
  124   2HB   GLU  17          3HB       GLU  17  -7.317   4.658  -0.868
  125   1HG   GLU  17          2HG       GLU  17  -9.439   4.442  -1.674
  126   2HG   GLU  17          3HG       GLU  17  -8.868   2.839  -2.173
  127    H    ALA  18           H        ALA  18  -7.447   0.760  -2.275
  128    HA   ALA  18           HA       ALA  18  -8.731  -1.119  -0.620
  129   1HB   ALA  18          1HB       ALA  18  -8.296  -2.708  -2.424
  130   2HB   ALA  18          2HB       ALA  18  -8.753  -1.131  -3.103
  131   3HB   ALA  18          3HB       ALA  18  -7.053  -1.645  -3.113
  132    H    VAL  19           H        VAL  19  -5.207  -0.737  -1.388
  133    HA   VAL  19           HA       VAL  19  -4.600  -3.182   0.030
  134    HB   VAL  19           HB       VAL  19  -3.200  -2.004  -1.861
  135   1HG1  VAL  19          1HG1      VAL  19  -1.677  -1.167   0.665
  136   2HG1  VAL  19          2HG1      VAL  19  -1.144  -1.013  -1.013
  137   3HG1  VAL  19          3HG1      VAL  19  -2.484  -0.026  -0.430
  138   1HG2  VAL  19          1HG2      VAL  19  -2.952  -4.291  -0.885
  139   2HG2  VAL  19          2HG2      VAL  19  -1.399  -3.516  -1.131
  140   3HG2  VAL  19          3HG2      VAL  19  -2.074  -3.593   0.496
  141    H    THR  20           H        THR  20  -4.693   0.267   0.826
  142    HA   THR  20           HA       THR  20  -3.605   0.155   3.485
  143    HB   THR  20           HB       THR  20  -5.716   1.870   2.157
  144    HG1  THR  20           1HG      THR  20  -3.467   2.179   1.883
  145   1HG2  THR  20          1HG2      THR  20  -6.666   1.617   4.372
  146   2HG2  THR  20          2HG2      THR  20  -5.112   2.037   5.109
  147   3HG2  THR  20          3HG2      THR  20  -6.010   3.213   4.114
  148    H    LYS  21           H        LYS  21  -7.000  -0.385   2.348
  149    HA   LYS  21           HA       LYS  21  -8.011  -1.114   4.885
  150   1HB   LYS  21          2HB       LYS  21  -8.971  -2.186   2.209
  151   2HB   LYS  21          3HB       LYS  21  -9.880  -2.105   3.714
  152   1HG   LYS  21          2HG       LYS  21  -8.913   0.575   3.028
  153   2HG   LYS  21          3HG       LYS  21  -9.655  -0.170   1.621
  154   1HD   LYS  21          2HD       LYS  21 -11.674  -0.713   3.092
  155   2HD   LYS  21          3HD       LYS  21 -10.911   0.288   4.357
  156   1HE   LYS  21          2HE       LYS  21 -10.797   2.186   2.656
  157   2HE   LYS  21          3HE       LYS  21 -11.673   1.146   1.511
  158   1HZ   LYS  21          1HZ       LYS  21 -12.732   2.141   4.052
  159   2HZ   LYS  21          2HZ       LYS  21 -13.097   2.661   2.531
  160   3HZ   LYS  21          3HZ       LYS  21 -13.522   1.141   2.994
  161    H    ALA  22           H        ALA  22  -6.638  -3.172   2.285
  162    HA   ALA  22           HA       ALA  22  -7.104  -5.663   3.556
  163   1HB   ALA  22          1HB       ALA  22  -6.475  -5.426   1.184
  164   2HB   ALA  22          2HB       ALA  22  -4.845  -4.898   1.673
  165   3HB   ALA  22          3HB       ALA  22  -5.393  -6.543   2.052
  166    H    VAL  23           H        VAL  23  -4.149  -3.651   3.523
  167    HA   VAL  23           HA       VAL  23  -2.528  -5.352   5.111
  168    HB   VAL  23           HB       VAL  23  -2.448  -2.372   4.533
  169   1HG1  VAL  23          1HG1      VAL  23  -1.030  -2.768   6.503
  170   2HG1  VAL  23          2HG1      VAL  23  -0.265  -4.161   5.701
  171   3HG1  VAL  23          3HG1      VAL  23  -0.010  -2.525   5.073
  172   1HG2  VAL  23          1HG2      VAL  23  -2.191  -4.306   2.675
  173   2HG2  VAL  23          2HG2      VAL  23  -1.168  -2.868   2.689
  174   3HG2  VAL  23          3HG2      VAL  23  -0.561  -4.405   3.336
  175    H    GLN  24           H        GLN  24  -4.671  -2.580   5.957
  176    HA   GLN  24           HA       GLN  24  -4.166  -2.542   8.741
  177   1HB   GLN  24          2HB       GLN  24  -6.594  -1.854   7.076
  178   2HB   GLN  24          3HB       GLN  24  -6.534  -1.561   8.805
  179   1HG   GLN  24          2HG       GLN  24  -4.257  -0.519   7.093
  180   2HG   GLN  24          3HG       GLN  24  -5.822   0.277   6.991
  181   1HE2  GLN  24          1HE2      GLN  24  -3.206   1.311   8.037
  182   2HE2  GLN  24          2HE2      GLN  24  -3.520   1.783   9.704
  183    H    ASN  25           H        ASN  25  -5.730  -5.143   6.917
  184    HA   ASN  25           HA       ASN  25  -7.326  -6.128   9.123
  185   1HB   ASN  25          2HB       ASN  25  -5.894  -7.693   6.931
  186   2HB   ASN  25          3HB       ASN  25  -7.039  -8.351   8.087
  187   1HD2  ASN  25          1HD2      ASN  25  -7.020  -7.856   5.007
  188   2HD2  ASN  25          2HD2      ASN  25  -8.663  -7.269   4.753
  189    H    GLU  26           H        GLU  26  -3.973  -6.876   8.017
  190    HA   GLU  26           HA       GLU  26  -3.341  -8.326  10.472
  191   1HB   GLU  26          2HB       GLU  26  -1.592  -7.333   8.173
  192   2HB   GLU  26          3HB       GLU  26  -1.059  -8.374   9.503
  193   1HG   GLU  26          2HG       GLU  26  -3.255  -9.111   7.504
  194   2HG   GLU  26          3HG       GLU  26  -1.568  -9.632   7.425
  195    H    ASP  27           H        ASP  27  -2.062  -5.319   8.970
  196    HA   ASP  27           HA       ASP  27  -0.725  -4.693  11.499
  197   1HB   ASP  27          2HB       ASP  27   0.294  -4.564   9.100
  198   2HB   ASP  27          3HB       ASP  27  -0.556  -3.034   8.947
  199    H    ALA  28           H        ALA  28  -3.070  -4.571  12.302
  200    HA   ALA  28           HA       ALA  28  -4.835  -2.484  11.451
  201   1HB   ALA  28          1HB       ALA  28  -5.578  -4.574  12.562
  202   2HB   ALA  28          2HB       ALA  28  -4.784  -4.058  14.067
  203   3HB   ALA  28          3HB       ALA  28  -6.162  -3.137  13.424
  204    H    GLN  29           H        GLN  29  -2.156  -2.472  13.561
  205    HA   GLN  29           HA       GLN  29  -2.905  -0.004  14.986
  206   1HB   GLN  29          2HB       GLN  29  -0.708  -0.418  16.080
  207   2HB   GLN  29          3HB       GLN  29  -1.899  -1.695  16.323
  208   1HG   GLN  29          2HG       GLN  29  -0.764  -3.177  14.811
  209   2HG   GLN  29          3HG       GLN  29   0.221  -1.857  14.150
  210   1HE2  GLN  29          1HE2      GLN  29   2.148  -3.028  14.596
  211   2HE2  GLN  29          2HE2      GLN  29   2.752  -3.166  16.246
  212    H    ALA  30           H        ALA  30  -1.647  -0.657  11.885
  213    HA   ALA  30           HA       ALA  30   0.468   1.372  11.959
  214   1HB   ALA  30          1HB       ALA  30  -0.758  -0.229   9.682
  215   2HB   ALA  30          2HB       ALA  30   0.630   0.856   9.529
  216   3HB   ALA  30          3HB       ALA  30   0.754  -0.557  10.571
  217    H    THR  31           H        THR  31   0.464   2.949  10.040
  218    HA   THR  31           HA       THR  31  -2.200   4.171   9.523
  219    HB   THR  31           HB       THR  31   0.268   5.459  10.721
  220    HG1  THR  31           1HG      THR  31  -1.801   4.431  11.805
  221   1HG2  THR  31          1HG2      THR  31  -0.485   7.020   8.997
  222   2HG2  THR  31          2HG2      THR  31  -2.175   6.856   9.544
  223   3HG2  THR  31          3HG2      THR  31  -0.962   7.621  10.591
  224    H    VAL  32           H        VAL  32  -2.281   5.278   7.578
  225    HA   VAL  32           HA       VAL  32  -0.104   4.658   5.640
  226    HB   VAL  32           HB       VAL  32  -1.999   4.535   3.989
  227   1HG1  VAL  32          1HG1      VAL  32  -1.301   2.404   4.397
  228   2HG1  VAL  32          2HG1      VAL  32  -1.537   2.502   6.160
  229   3HG1  VAL  32          3HG1      VAL  32  -2.905   2.253   5.077
  230   1HG2  VAL  32          1HG2      VAL  32  -3.700   5.749   5.481
  231   2HG2  VAL  32          2HG2      VAL  32  -4.234   4.310   4.651
  232   3HG2  VAL  32          3HG2      VAL  32  -3.852   4.223   6.382
  233    H    GLN  33           H        GLN  33   0.320   6.318   4.097
  234    HA   GLN  33           HA       GLN  33  -1.615   8.488   3.807
  235   1HB   GLN  33          2HB       GLN  33   1.328   8.966   4.474
  236   2HB   GLN  33          3HB       GLN  33   0.318  10.106   3.580
  237   1HG   GLN  33          2HG       GLN  33  -1.345   9.850   5.627
  238   2HG   GLN  33          3HG       GLN  33   0.078   9.224   6.470
  239   1HE2  GLN  33          1HE2      GLN  33  -0.914  11.965   4.316
  240   2HE2  GLN  33          2HE2      GLN  33  -0.022  13.182   5.210
  241    H    VAL  34           H        VAL  34  -2.177   7.996   1.772
  242    HA   VAL  34           HA       VAL  34  -0.026   7.459  -0.210
  243    HB   VAL  34           HB       VAL  34  -1.405   5.493   0.096
  244   1HG1  VAL  34          1HG1      VAL  34  -3.816   7.140  -0.728
  245   2HG1  VAL  34          2HG1      VAL  34  -3.758   5.392  -0.470
  246   3HG1  VAL  34          3HG1      VAL  34  -3.525   6.488   0.900
  247   1HG2  VAL  34          1HG2      VAL  34  -0.531   6.245  -2.172
  248   2HG2  VAL  34          2HG2      VAL  34  -1.890   5.107  -2.197
  249   3HG2  VAL  34          3HG2      VAL  34  -2.163   6.831  -2.528
  250    H    ASP  35           H        ASP  35   0.185   8.911  -1.812
  251    HA   ASP  35           HA       ASP  35  -1.673  11.240  -1.813
  252   1HB   ASP  35          2HB       ASP  35   0.915  10.606  -3.186
  253   2HB   ASP  35          3HB       ASP  35  -0.058  11.996  -3.644
  254    H    LEU  36           H        LEU  36  -3.561  10.451  -2.700
  255    HA   LEU  36           HA       LEU  36  -3.646   9.095  -5.299
  256   1HB   LEU  36          2HB       LEU  36  -5.914  10.527  -3.856
  257   2HB   LEU  36          3HB       LEU  36  -5.996   9.430  -5.239
  258    HG   LEU  36           HG       LEU  36  -4.763   7.767  -3.489
  259   1HD1  LEU  36          1HD1      LEU  36  -6.599   9.559  -1.805
  260   2HD1  LEU  36          2HD1      LEU  36  -5.908   8.018  -1.280
  261   3HD1  LEU  36          3HD1      LEU  36  -4.852   9.402  -1.587
  262   1HD2  LEU  36          1HD2      LEU  36  -6.805   7.284  -4.763
  263   2HD2  LEU  36          2HD2      LEU  36  -7.022   6.839  -3.060
  264   3HD2  LEU  36          3HD2      LEU  36  -7.754   8.330  -3.685
  265    H    THR  37           H        THR  37  -2.046  10.624  -6.009
  266    HA   THR  37           HA       THR  37  -3.162  12.902  -7.538
  267    HB   THR  37           HB       THR  37  -0.922  13.245  -5.497
  268    HG1  THR  37           1HG      THR  37  -3.597  13.539  -5.368
  269   1HG2  THR  37          1HG2      THR  37  -1.030  15.648  -6.143
  270   2HG2  THR  37          2HG2      THR  37  -0.432  14.626  -7.461
  271   3HG2  THR  37          3HG2      THR  37  -2.109  15.224  -7.491
  272    H    SER  38           H        SER  38  -0.261  10.858  -6.767
  273    HA   SER  38           HA       SER  38   0.051  10.591  -9.670
  274   1HB   SER  38          2HB       SER  38   2.424  11.476  -7.974
  275   2HB   SER  38          3HB       SER  38   2.417  11.068  -9.711
  276    HG   SER  38           HG       SER  38   0.552  12.826  -9.492
  277    H    LYS  39           H        LYS  39   2.746   9.423  -7.784
  278    HA   LYS  39           HA       LYS  39   1.446   6.826  -7.284
  279   1HB   LYS  39          2HB       LYS  39   3.207   5.747  -8.722
  280   2HB   LYS  39          3HB       LYS  39   1.854   6.547  -9.516
  281   1HG   LYS  39          2HG       LYS  39   3.558   7.133 -10.839
  282   2HG   LYS  39          3HG       LYS  39   3.456   8.576  -9.883
  283   1HD   LYS  39          2HD       LYS  39   5.445   8.086  -8.699
  284   2HD   LYS  39          3HD       LYS  39   5.372   6.357  -9.069
  285   1HE   LYS  39          2HE       LYS  39   6.304   6.534 -11.129
  286   2HE   LYS  39          3HE       LYS  39   5.604   8.122 -11.470
  287   1HZ   LYS  39          1HZ       LYS  39   7.864   7.679  -9.637
  288   2HZ   LYS  39          2HZ       LYS  39   7.990   8.179 -11.199
  289   3HZ   LYS  39          3HZ       LYS  39   7.229   9.131 -10.097
  290    H    LYS  40           H        LYS  40   1.981   7.848  -5.153
  291    HA   LYS  40           HA       LYS  40   4.614   6.927  -4.192
  292   1HB   LYS  40          2HB       LYS  40   5.059   9.127  -3.146
  293   2HB   LYS  40          3HB       LYS  40   5.000   9.229  -4.912
  294   1HG   LYS  40          2HG       LYS  40   2.408   9.746  -4.357
  295   2HG   LYS  40          3HG       LYS  40   3.103  10.363  -2.865
  296   1HD   LYS  40          2HD       LYS  40   4.017  11.249  -5.659
  297   2HD   LYS  40          3HD       LYS  40   2.549  11.859  -4.905
  298   1HE   LYS  40          2HE       LYS  40   4.204  13.487  -4.469
  299   2HE   LYS  40          3HE       LYS  40   3.791  12.695  -2.950
  300   1HZ   LYS  40          1HZ       LYS  40   6.106  12.971  -3.122
  301   2HZ   LYS  40          2HZ       LYS  40   5.757  11.362  -3.154
  302   3HZ   LYS  40          3HZ       LYS  40   6.188  12.144  -4.545
  303    H    VAL  41           H        VAL  41   4.259   5.812  -2.283
  304    HA   VAL  41           HA       VAL  41   1.854   6.509  -0.693
  305    HB   VAL  41           HB       VAL  41   1.107   4.707  -2.098
  306   1HG1  VAL  41          1HG1      VAL  41   2.189   2.500  -2.171
  307   2HG1  VAL  41          2HG1      VAL  41   3.246   3.746  -2.846
  308   3HG1  VAL  41          3HG1      VAL  41   3.532   3.137  -1.209
  309   1HG2  VAL  41          1HG2      VAL  41   1.899   3.421   0.529
  310   2HG2  VAL  41          2HG2      VAL  41   0.618   4.638   0.423
  311   3HG2  VAL  41          3HG2      VAL  41   0.457   3.094  -0.444
  312    H    THR  42           H        THR  42   2.214   6.483   1.487
  313    HA   THR  42           HA       THR  42   4.894   5.624   2.414
  314    HB   THR  42           HB       THR  42   3.247   7.994   3.374
  315    HG1  THR  42           1HG      THR  42   4.090   8.330   1.314
  316   1HG2  THR  42          1HG2      THR  42   5.379   8.602   4.524
  317   2HG2  THR  42          2HG2      THR  42   4.699   7.082   5.132
  318   3HG2  THR  42          3HG2      THR  42   6.080   7.050   4.017
  319    H    ILE  43           H        ILE  43   4.658   4.010   3.924
  320    HA   ILE  43           HA       ILE  43   2.157   3.994   5.594
  321    HB   ILE  43           HB       ILE  43   3.723   1.659   4.510
  322   1HG1  ILE  43          2HG1      ILE  43   1.304   0.783   4.368
  323   2HG1  ILE  43          3HG1      ILE  43   0.780   2.364   4.911
  324   1HG2  ILE  43          1HG2      ILE  43   1.980   1.694   7.018
  325   2HG2  ILE  43          2HG2      ILE  43   2.530   0.231   6.189
  326   3HG2  ILE  43          3HG2      ILE  43   3.718   1.304   6.923
  327   1HD1  ILE  43          1HD1      ILE  43   0.646   1.895   2.418
  328   2HD1  ILE  43          2HD1      ILE  43   1.507   3.374   2.844
  329   3HD1  ILE  43          3HD1      ILE  43   2.423   1.912   2.385
  330    H    THR  44           H        THR  44   2.335   4.408   7.628
  331    HA   THR  44           HA       THR  44   4.982   4.636   8.941
  332    HB   THR  44           HB       THR  44   2.199   5.532   9.736
  333    HG1  THR  44           1HG      THR  44   4.214   6.857   8.312
  334   1HG2  THR  44          1HG2      THR  44   3.826   5.359  11.642
  335   2HG2  THR  44          2HG2      THR  44   4.877   6.511  10.794
  336   3HG2  THR  44          3HG2      THR  44   3.262   7.008  11.319
  337    H    SER  45           H        SER  45   5.273   2.316   9.007
  338    HA   SER  45           HA       SER  45   3.870   1.055  11.274
  339   1HB   SER  45          2HB       SER  45   3.633  -1.050  10.090
  340   2HB   SER  45          3HB       SER  45   2.794   0.157   9.153
  341    HG   SER  45           HG       SER  45   5.300  -1.042   8.638
  342    H    ALA  46           H        ALA  46   5.119  -1.085  11.688
  343    HA   ALA  46           HA       ALA  46   8.038  -0.839  11.082
  344   1HB   ALA  46          1HB       ALA  46   6.682  -2.223  13.424
  345   2HB   ALA  46          2HB       ALA  46   8.427  -2.170  13.086
  346   3HB   ALA  46          3HB       ALA  46   7.557  -0.675  13.475
  347    H    LEU  47           H        LEU  47   5.134  -2.941  10.917
  348    HA   LEU  47           HA       LEU  47   6.845  -5.115   9.772
  349   1HB   LEU  47          2HB       LEU  47   5.456  -6.698  10.588
  350   2HB   LEU  47          3HB       LEU  47   5.436  -5.492  11.860
  351    HG   LEU  47           HG       LEU  47   3.240  -4.642  10.796
  352   1HD1  LEU  47          1HD1      LEU  47   3.713  -7.165   9.201
  353   2HD1  LEU  47          2HD1      LEU  47   2.070  -6.891   9.790
  354   3HD1  LEU  47          3HD1      LEU  47   2.819  -5.699   8.747
  355   1HD2  LEU  47          1HD2      LEU  47   1.913  -6.284  12.016
  356   2HD2  LEU  47          2HD2      LEU  47   3.319  -7.374  12.102
  357   3HD2  LEU  47          3HD2      LEU  47   3.345  -5.797  12.930
  358    H    GLY  48           H        GLY  48   3.890  -3.155   9.189
  359   1HA   GLY  48          2HA       GLY  48   2.862  -3.948   6.953
  360   2HA   GLY  48          3HA       GLY  48   3.227  -2.247   7.207
  361    H    GLU  49           H        GLU  49   6.130  -2.446   7.005
  362    HA   GLU  49           HA       GLU  49   6.679  -2.033   4.376
  363   1HB   GLU  49          2HB       GLU  49   8.117  -1.749   6.439
  364   2HB   GLU  49          3HB       GLU  49   8.537  -3.450   6.362
  365   1HG   GLU  49          2HG       GLU  49   8.920  -1.885   3.821
  366   2HG   GLU  49          3HG       GLU  49   9.985  -1.464   5.174
  367    H    GLU  50           H        GLU  50   7.196  -5.229   5.960
  368    HA   GLU  50           HA       GLU  50   7.721  -6.534   3.422
  369   1HB   GLU  50          2HB       GLU  50   8.134  -7.170   6.168
  370   2HB   GLU  50          3HB       GLU  50   6.953  -8.354   5.601
  371   1HG   GLU  50          2HG       GLU  50   8.500  -8.786   3.626
  372   2HG   GLU  50          3HG       GLU  50   9.689  -7.742   4.438
  373    H    GLN  51           H        GLN  51   4.988  -6.386   5.703
  374    HA   GLN  51           HA       GLN  51   3.403  -8.335   4.524
  375   1HB   GLN  51          2HB       GLN  51   3.216  -7.019   6.749
  376   2HB   GLN  51          3HB       GLN  51   2.212  -5.873   5.857
  377   1HG   GLN  51          2HG       GLN  51   1.747  -8.884   6.049
  378   2HG   GLN  51          3HG       GLN  51   1.025  -7.706   7.149
  379   1HE2  GLN  51          1HE2      GLN  51  -0.507  -9.524   5.517
  380   2HE2  GLN  51          2HE2      GLN  51  -1.441  -8.525   4.423
  381    H    LEU  52           H        LEU  52   3.416  -4.824   3.852
  382    HA   LEU  52           HA       LEU  52   1.558  -4.545   1.829
  383   1HB   LEU  52          2HB       LEU  52   4.298  -3.324   2.325
  384   2HB   LEU  52          3HB       LEU  52   3.305  -2.782   0.987
  385    HG   LEU  52           HG       LEU  52   2.157  -2.807   3.776
  386   1HD1  LEU  52          1HD1      LEU  52   2.991  -0.628   4.182
  387   2HD1  LEU  52          2HD1      LEU  52   4.399  -1.542   3.665
  388   3HD1  LEU  52          3HD1      LEU  52   3.614  -0.436   2.529
  389   1HD2  LEU  52          1HD2      LEU  52   1.628  -0.963   1.404
  390   2HD2  LEU  52          2HD2      LEU  52   0.737  -2.462   1.679
  391   3HD2  LEU  52          3HD2      LEU  52   0.658  -1.153   2.879
  392    H    ARG  53           H        ARG  53   4.991  -5.622   1.555
  393    HA   ARG  53           HA       ARG  53   5.138  -5.655  -1.240
  394   1HB   ARG  53          2HB       ARG  53   6.829  -6.381   0.832
  395   2HB   ARG  53          3HB       ARG  53   6.428  -7.963   0.177
  396   1HG   ARG  53          2HG       ARG  53   8.386  -7.305  -0.936
  397   2HG   ARG  53          3HG       ARG  53   7.110  -6.975  -2.125
  398   1HD   ARG  53          2HD       ARG  53   7.101  -4.582  -1.334
  399   2HD   ARG  53          3HD       ARG  53   8.434  -4.963  -0.224
  400    HE   ARG  53           HE       ARG  53   9.389  -5.768  -2.682
  401   1HH1  ARG  53          2HH2      ARG  53   8.235  -2.669  -1.313
  402   2HH1  ARG  53          1HH2      ARG  53   8.959  -1.752  -2.650
  403   1HH2  ARG  53          2HH1      ARG  53  10.405  -4.350  -4.361
  404   2HH2  ARG  53          1HH1      ARG  53  10.110  -2.621  -4.173
  405    H    THR  54           H        THR  54   4.132  -8.323   0.926
  406    HA   THR  54           HA       THR  54   3.310 -10.025  -1.212
  407    HB   THR  54           HB       THR  54   2.576 -10.154   1.739
  408    HG1  THR  54           1HG      THR  54   4.532 -11.272   1.904
  409   1HG2  THR  54          1HG2      THR  54   1.340 -11.791   0.333
  410   2HG2  THR  54          2HG2      THR  54   2.867 -12.306  -0.418
  411   3HG2  THR  54          3HG2      THR  54   2.573 -12.615   1.306
  412    H    ALA  55           H        ALA  55   1.441  -7.930   1.036
  413    HA   ALA  55           HA       ALA  55  -1.140  -8.830   0.220
  414   1HB   ALA  55          1HB       ALA  55  -0.760  -7.676   2.339
  415   2HB   ALA  55          2HB       ALA  55  -0.300  -6.187   1.489
  416   3HB   ALA  55          3HB       ALA  55  -1.964  -6.801   1.381
  417    H    ILE  56           H        ILE  56   0.758  -5.950  -0.728
  418    HA   ILE  56           HA       ILE  56  -0.905  -4.995  -2.804
  419    HB   ILE  56           HB       ILE  56   2.146  -5.007  -2.695
  420   1HG1  ILE  56          2HG1      ILE  56   0.332  -2.644  -2.049
  421   2HG1  ILE  56          3HG1      ILE  56   0.850  -3.739  -0.761
  422   1HG2  ILE  56          1HG2      ILE  56   1.235  -4.573  -4.955
  423   2HG2  ILE  56          2HG2      ILE  56   0.110  -3.370  -4.240
  424   3HG2  ILE  56          3HG2      ILE  56   1.870  -3.107  -4.249
  425   1HD1  ILE  56          1HD1      ILE  56   3.234  -3.236  -1.375
  426   2HD1  ILE  56          2HD1      ILE  56   2.641  -2.043  -2.545
  427   3HD1  ILE  56          3HD1      ILE  56   2.296  -1.820  -0.837
  428    H    ALA  57           H        ALA  57   1.755  -7.504  -2.984
  429    HA   ALA  57           HA       ALA  57   1.357  -8.049  -5.723
  430   1HB   ALA  57          1HB       ALA  57   2.454 -10.179  -5.323
  431   2HB   ALA  57          2HB       ALA  57   3.283  -8.879  -4.447
  432   3HB   ALA  57          3HB       ALA  57   2.233 -10.017  -3.573
  433    H    SER  58           H        SER  58  -0.391  -9.342  -2.889
  434    HA   SER  58           HA       SER  58  -2.010 -11.233  -4.225
  435   1HB   SER  58          2HB       SER  58  -1.795 -10.763  -1.691
  436   2HB   SER  58          3HB       SER  58  -3.040  -9.516  -1.942
  437    HG   SER  58           HG       SER  58  -3.990 -11.487  -1.392
  438    H    ALA  59           H        ALA  59  -2.541  -7.705  -3.711
  439    HA   ALA  59           HA       ALA  59  -5.024  -7.589  -5.176
  440   1HB   ALA  59          1HB       ALA  59  -4.293  -5.789  -3.651
  441   2HB   ALA  59          2HB       ALA  59  -2.955  -5.389  -4.754
  442   3HB   ALA  59          3HB       ALA  59  -4.633  -5.183  -5.285
  443    H    GLY  60           H        GLY  60  -1.624  -7.149  -6.122
  444   1HA   GLY  60          2HA       GLY  60  -0.723  -7.912  -8.177
  445   2HA   GLY  60          3HA       GLY  60  -2.295  -7.757  -8.964
  446    H    HIS  61           H        HIS  61   0.094  -5.700  -7.200
  447    HA   HIS  61           HA       HIS  61  -0.107  -3.696  -9.400
  448   1HB   HIS  61          2HB       HIS  61   0.036  -3.289  -6.414
  449   2HB   HIS  61          3HB       HIS  61   0.489  -2.018  -7.520
  450    HD1  HIS  61           1HD      HIS  61  -1.742  -1.386  -9.345
  451    HD2  HIS  61           2HD      HIS  61  -2.230  -2.818  -5.414
  452    HE1  HIS  61           1HE      HIS  61  -3.857  -0.321  -8.431
  453    H    GLU  62           H        GLU  62   1.820  -2.888 -10.131
  454    HA   GLU  62           HA       GLU  62   4.199  -4.475  -9.627
  455   1HB   GLU  62          2HB       GLU  62   3.626  -2.205 -11.592
  456   2HB   GLU  62          3HB       GLU  62   5.005  -3.314 -11.632
  457   1HG   GLU  62          2HG       GLU  62   2.082  -4.176 -11.973
  458   2HG   GLU  62          3HG       GLU  62   3.248  -3.918 -13.272
  459    H    VAL  63           H        VAL  63   3.943  -3.377  -7.388
  460    HA   VAL  63           HA       VAL  63   4.972  -0.653  -7.206
  461    HB   VAL  63           HB       VAL  63   4.383  -2.692  -5.023
  462   1HG1  VAL  63          1HG1      VAL  63   4.336  -0.756  -3.503
  463   2HG1  VAL  63          2HG1      VAL  63   5.952  -0.961  -4.176
  464   3HG1  VAL  63          3HG1      VAL  63   4.877   0.312  -4.800
  465   1HG2  VAL  63          1HG2      VAL  63   2.376  -2.140  -6.208
  466   2HG2  VAL  63          2HG2      VAL  63   2.365  -1.042  -4.803
  467   3HG2  VAL  63          3HG2      VAL  63   2.861  -0.457  -6.390
  468    H    GLU  64           H        GLU  64   6.941   0.098  -6.755
  469    HA   GLU  64           HA       GLU  64   9.189  -1.822  -6.370
  470   1HB   GLU  64          2HB       GLU  64   9.083   0.189  -8.191
  471   2HB   GLU  64          3HB       GLU  64   9.638   1.103  -6.779
  472   1HG   GLU  64          2HG       GLU  64  11.633   0.442  -7.804
  473   2HG   GLU  64          3HG       GLU  64  11.439  -0.802  -6.560
  Start of MODEL   10
    1   1H    MET   1           H1       MET   1  10.433   2.922   9.950
    2   2H    MET   1           H2       MET   1  10.466   2.485  11.545
    3   3H    MET   1           H3       MET   1   9.278   1.901  10.538
    4    HA   MET   1           HA       MET   1   8.344   3.511  11.911
    5   1HB   MET   1          2HB       MET   1  10.600   5.314  10.915
    6   2HB   MET   1          3HB       MET   1   9.103   5.917  11.650
    7   1HG   MET   1          2HG       MET   1  10.743   5.763  13.401
    8   2HG   MET   1          3HG       MET   1   9.515   4.526  13.650
    9   1HE   MET   1          1HE       MET   1  11.477   3.829  15.481
   10   2HE   MET   1          2HE       MET   1  10.402   2.545  14.872
   11   3HE   MET   1          3HE       MET   1  12.148   2.246  15.020
   12    H    THR   2           H        THR   2   9.573   5.246   8.999
   13    HA   THR   2           HA       THR   2   6.876   4.924   7.782
   14    HB   THR   2           HB       THR   2   7.215   7.150   8.694
   15    HG1  THR   2           1HG      THR   2   6.685   8.196   6.781
   16   1HG2  THR   2          1HG2      THR   2   9.484   7.522   6.689
   17   2HG2  THR   2          2HG2      THR   2   8.826   8.720   7.808
   18   3HG2  THR   2          3HG2      THR   2   9.728   7.336   8.439
   19    H    ILE   3           H        ILE   3   6.929   3.826   5.884
   20    HA   ILE   3           HA       ILE   3   9.496   3.630   4.378
   21    HB   ILE   3           HB       ILE   3   7.066   1.802   4.290
   22   1HG1  ILE   3          2HG1      ILE   3   7.909   1.526   6.525
   23   2HG1  ILE   3          3HG1      ILE   3   8.333   0.129   5.545
   24   1HG2  ILE   3          1HG2      ILE   3   8.610   0.276   3.136
   25   2HG2  ILE   3          2HG2      ILE   3   8.477   1.826   2.291
   26   3HG2  ILE   3          3HG2      ILE   3   9.911   1.483   3.261
   27   1HD1  ILE   3          1HD1      ILE   3  10.245   2.382   6.309
   28   2HD1  ILE   3          2HD1      ILE   3  10.179   0.760   7.013
   29   3HD1  ILE   3          3HD1      ILE   3  10.665   0.962   5.325
   30    H    GLN   4           H        GLN   4   9.433   4.649   2.411
   31    HA   GLN   4           HA       GLN   4   6.825   5.625   1.328
   32   1HB   GLN   4          2HB       GLN   4   9.640   6.694   1.256
   33   2HB   GLN   4          3HB       GLN   4   8.517   7.069  -0.065
   34   1HG   GLN   4          2HG       GLN   4   6.937   8.091   1.352
   35   2HG   GLN   4          3HG       GLN   4   7.669   7.425   2.807
   36   1HE2  GLN   4          1HE2      GLN   4   8.078   9.842   0.206
   37   2HE2  GLN   4          2HE2      GLN   4   9.220  10.836   1.099
   38    H    LEU   5           H        LEU   5   6.073   4.090  -0.049
   39    HA   LEU   5           HA       LEU   5   8.008   2.727  -1.867
   40   1HB   LEU   5          2HB       LEU   5   5.098   2.009  -1.419
   41   2HB   LEU   5          3HB       LEU   5   6.339   1.143  -2.279
   42    HG   LEU   5           HG       LEU   5   7.584   0.894  -0.046
   43   1HD1  LEU   5          1HD1      LEU   5   4.838   1.774   1.014
   44   2HD1  LEU   5          2HD1      LEU   5   6.051   0.893   1.969
   45   3HD1  LEU   5          3HD1      LEU   5   6.390   2.514   1.423
   46   1HD2  LEU   5          1HD2      LEU   5   4.817  -0.303  -0.403
   47   2HD2  LEU   5          2HD2      LEU   5   6.305  -0.892  -1.181
   48   3HD2  LEU   5          3HD2      LEU   5   6.132  -1.008   0.577
   49    H    THR   6           H        THR   6   7.375   2.539  -4.091
   50    HA   THR   6           HA       THR   6   5.923   4.932  -5.143
   51    HB   THR   6           HB       THR   6   8.196   3.308  -6.358
   52    HG1  THR   6           1HG      THR   6   9.458   4.778  -5.525
   53   1HG2  THR   6          1HG2      THR   6   6.745   4.317  -8.099
   54   2HG2  THR   6          2HG2      THR   6   6.830   5.888  -7.271
   55   3HG2  THR   6          3HG2      THR   6   8.288   5.181  -7.997
   56    H    VAL   7           H        VAL   7   4.117   4.478  -6.266
   57    HA   VAL   7           HA       VAL   7   3.533   1.667  -7.175
   58    HB   VAL   7           HB       VAL   7   2.327   1.991  -5.206
   59   1HG1  VAL   7          1HG1      VAL   7   1.223   4.630  -6.239
   60   2HG1  VAL   7          2HG1      VAL   7   0.720   3.778  -4.776
   61   3HG1  VAL   7          3HG1      VAL   7   2.360   4.418  -4.891
   62   1HG2  VAL   7          1HG2      VAL   7   1.109   0.993  -7.200
   63   2HG2  VAL   7          2HG2      VAL   7   0.079   1.645  -5.914
   64   3HG2  VAL   7          3HG2      VAL   7   0.327   2.565  -7.401
   65    HA   PRO   8           HA       PRO   8   3.569   4.605 -10.689
   66   1HB   PRO   8          2HB       PRO   8   4.651   2.975 -12.590
   67   2HB   PRO   8          3HB       PRO   8   5.638   3.771 -11.328
   68   1HG   PRO   8          2HG       PRO   8   4.573   0.941 -11.302
   69   2HG   PRO   8          3HG       PRO   8   6.239   1.489 -10.968
   70   1HD   PRO   8          2HD       PRO   8   4.463   0.992  -8.990
   71   2HD   PRO   8          3HD       PRO   8   5.633   2.331  -8.846
   72    H    THR   9           H        THR   9   2.299   1.320 -10.433
   73    HA   THR   9           HA       THR   9   0.674   1.525 -12.812
   74    HB   THR   9           HB       THR   9   1.673  -0.531 -12.186
   75    HG1  THR   9           1HG      THR   9  -0.530  -0.578 -13.069
   76   1HG2  THR   9          1HG2      THR   9   1.037  -1.866 -10.326
   77   2HG2  THR   9          2HG2      THR   9   1.870  -0.423  -9.758
   78   3HG2  THR   9          3HG2      THR   9   0.096  -0.553  -9.606
   79    H    ILE  10           H        ILE  10  -0.080   1.570  -9.274
   80    HA   ILE  10           HA       ILE  10  -1.804   2.069  -8.128
   81    HB   ILE  10           HB       ILE  10  -1.425   4.219  -9.889
   82   1HG1  ILE  10          2HG1      ILE  10  -2.883   3.836  -7.305
   83   2HG1  ILE  10          3HG1      ILE  10  -1.191   4.294  -7.531
   84   1HG2  ILE  10          1HG2      ILE  10  -3.530   5.243 -10.293
   85   2HG2  ILE  10          2HG2      ILE  10  -3.596   3.639 -11.011
   86   3HG2  ILE  10          3HG2      ILE  10  -4.412   3.960  -9.455
   87   1HD1  ILE  10          1HD1      ILE  10  -1.965   6.455  -8.569
   88   2HD1  ILE  10          2HD1      ILE  10  -3.626   6.036  -8.072
   89   3HD1  ILE  10          3HD1      ILE  10  -2.366   6.262  -6.850
   90    H    ALA  11           H        ALA  11  -3.612   1.158  -7.428
   91    HA   ALA  11           HA       ALA  11  -4.724  -0.813  -9.210
   92   1HB   ALA  11          1HB       ALA  11  -5.998  -0.259  -6.566
   93   2HB   ALA  11          2HB       ALA  11  -5.666  -1.784  -7.364
   94   3HB   ALA  11          3HB       ALA  11  -4.342  -0.900  -6.579
   95    H    CYS  12           H        CYS  12  -5.408   2.361  -9.036
   96    HA   CYS  12           HA       CYS  12  -7.037   3.692  -9.879
   97   1HB   CYS  12          2HB       CYS  12  -5.668   2.941 -11.683
   98   2HB   CYS  12          3HB       CYS  12  -6.563   1.449 -11.847
   99    HG   CYS  12           HG       CYS  12  -7.555   4.589 -12.225
  100    H    GLU  13           H        GLU  13  -8.494   0.609 -11.025
  101    HA   GLU  13           HA       GLU  13 -11.200   1.495 -10.769
  102   1HB   GLU  13          2HB       GLU  13 -10.052  -1.349 -10.742
  103   2HB   GLU  13          3HB       GLU  13 -11.728  -0.881 -11.026
  104   1HG   GLU  13          2HG       GLU  13 -11.076  -1.134 -13.187
  105   2HG   GLU  13          3HG       GLU  13 -10.609   0.562 -13.013
  106    H    ALA  14           H        ALA  14  -9.068  -0.517  -8.776
  107    HA   ALA  14           HA       ALA  14 -10.942  -0.561  -6.481
  108   1HB   ALA  14          1HB       ALA  14  -9.706  -2.611  -7.119
  109   2HB   ALA  14          2HB       ALA  14  -8.169  -1.769  -6.826
  110   3HB   ALA  14          3HB       ALA  14  -9.296  -2.060  -5.484
  111    H    CYS  15           H        CYS  15  -8.210   1.210  -7.696
  112    HA   CYS  15           HA       CYS  15  -6.961   2.909  -6.939
  113   1HB   CYS  15          2HB       CYS  15  -9.228   3.226  -4.967
  114   2HB   CYS  15          3HB       CYS  15  -7.697   4.050  -4.662
  115    HG   CYS  15           HG       CYS  15  -9.406   4.081  -7.465
  116    H    ALA  16           H        ALA  16  -5.121   3.254  -5.823
  117    HA   ALA  16           HA       ALA  16  -3.773   1.059  -4.795
  118   1HB   ALA  16          1HB       ALA  16  -2.226   2.756  -3.675
  119   2HB   ALA  16          2HB       ALA  16  -2.449   2.918  -5.410
  120   3HB   ALA  16          3HB       ALA  16  -3.305   4.021  -4.297
  121    H    GLU  17           H        GLU  17  -5.828   3.309  -2.945
  122    HA   GLU  17           HA       GLU  17  -4.942   2.521  -0.396
  123   1HB   GLU  17          2HB       GLU  17  -6.608   3.855   0.454
  124   2HB   GLU  17          3HB       GLU  17  -6.278   4.570  -1.112
  125   1HG   GLU  17          2HG       GLU  17  -8.598   4.563  -1.105
  126   2HG   GLU  17          3HG       GLU  17  -8.296   3.034  -1.942
  127    H    ALA  18           H        ALA  18  -6.843   0.706  -2.662
  128    HA   ALA  18           HA       ALA  18  -8.096  -1.222  -1.093
  129   1HB   ALA  18          1HB       ALA  18  -7.460  -2.784  -2.902
  130   2HB   ALA  18          2HB       ALA  18  -8.008  -1.225  -3.555
  131   3HB   ALA  18          3HB       ALA  18  -6.277  -1.606  -3.516
  132    H    VAL  19           H        VAL  19  -4.550  -0.806  -1.725
  133    HA   VAL  19           HA       VAL  19  -3.754  -3.106  -0.256
  134    HB   VAL  19           HB       VAL  19  -2.297  -1.686  -1.812
  135   1HG1  VAL  19          1HG1      VAL  19  -2.452   0.508  -0.468
  136   2HG1  VAL  19          2HG1      VAL  19  -1.490  -0.301   0.787
  137   3HG1  VAL  19          3HG1      VAL  19  -0.822  -0.072  -0.832
  138   1HG2  VAL  19          1HG2      VAL  19  -1.415  -2.806   0.887
  139   2HG2  VAL  19          2HG2      VAL  19  -1.469  -3.667  -0.659
  140   3HG2  VAL  19          3HG2      VAL  19  -0.275  -2.379  -0.361
  141    H    THR  20           H        THR  20  -4.372   0.282   0.703
  142    HA   THR  20           HA       THR  20  -3.449   0.106   3.402
  143    HB   THR  20           HB       THR  20  -5.288   1.954   1.889
  144    HG1  THR  20           1HG      THR  20  -3.001   2.141   2.056
  145   1HG2  THR  20          1HG2      THR  20  -5.210   1.898   4.906
  146   2HG2  THR  20          2HG2      THR  20  -5.762   3.249   3.881
  147   3HG2  THR  20          3HG2      THR  20  -6.631   1.721   3.859
  148    H    LYS  21           H        LYS  21  -6.755  -0.430   2.024
  149    HA   LYS  21           HA       LYS  21  -7.822  -1.217   4.561
  150   1HB   LYS  21          2HB       LYS  21  -8.828  -2.071   1.819
  151   2HB   LYS  21          3HB       LYS  21  -9.704  -2.095   3.361
  152   1HG   LYS  21          2HG       LYS  21  -8.794   0.507   3.281
  153   2HG   LYS  21          3HG       LYS  21  -9.037   0.175   1.557
  154   1HD   LYS  21          2HD       LYS  21 -11.381  -0.601   2.100
  155   2HD   LYS  21          3HD       LYS  21 -11.099  -0.216   3.804
  156   1HE   LYS  21          2HE       LYS  21 -11.453   1.662   1.449
  157   2HE   LYS  21          3HE       LYS  21 -12.356   1.603   2.964
  158   1HZ   LYS  21          1HZ       LYS  21 -10.886   3.450   2.968
  159   2HZ   LYS  21          2HZ       LYS  21 -10.225   2.372   4.032
  160   3HZ   LYS  21          3HZ       LYS  21  -9.632   2.575   2.497
  161    H    ALA  22           H        ALA  22  -6.302  -3.139   1.981
  162    HA   ALA  22           HA       ALA  22  -6.811  -5.708   3.146
  163   1HB   ALA  22          1HB       ALA  22  -5.953  -5.463   0.860
  164   2HB   ALA  22          2HB       ALA  22  -4.407  -4.844   1.495
  165   3HB   ALA  22          3HB       ALA  22  -4.910  -6.506   1.862
  166    H    VAL  23           H        VAL  23  -3.858  -3.696   3.352
  167    HA   VAL  23           HA       VAL  23  -2.422  -5.297   5.161
  168    HB   VAL  23           HB       VAL  23  -2.329  -2.305   4.621
  169   1HG1  VAL  23          1HG1      VAL  23  -1.026  -2.798   6.695
  170   2HG1  VAL  23          2HG1      VAL  23  -0.232  -4.164   5.861
  171   3HG1  VAL  23          3HG1      VAL  23   0.082  -2.509   5.330
  172   1HG2  VAL  23          1HG2      VAL  23  -1.898  -3.984   2.689
  173   2HG2  VAL  23          2HG2      VAL  23  -0.653  -2.771   3.036
  174   3HG2  VAL  23          3HG2      VAL  23  -0.444  -4.447   3.569
  175    H    GLN  24           H        GLN  24  -4.685  -2.557   5.768
  176    HA   GLN  24           HA       GLN  24  -4.456  -2.419   8.565
  177   1HB   GLN  24          2HB       GLN  24  -6.832  -1.984   6.744
  178   2HB   GLN  24          3HB       GLN  24  -6.857  -1.592   8.456
  179   1HG   GLN  24          2HG       GLN  24  -4.581  -0.446   6.851
  180   2HG   GLN  24          3HG       GLN  24  -6.200   0.178   6.517
  181   1HE2  GLN  24          1HE2      GLN  24  -3.605   1.212   7.963
  182   2HE2  GLN  24          2HE2      GLN  24  -4.261   1.947   9.408
  183    H    ASN  25           H        ASN  25  -5.854  -5.107   6.683
  184    HA   ASN  25           HA       ASN  25  -7.520  -6.063   8.887
  185   1HB   ASN  25          2HB       ASN  25  -6.313  -7.520   6.494
  186   2HB   ASN  25          3HB       ASN  25  -7.194  -8.310   7.782
  187   1HD2  ASN  25          1HD2      ASN  25  -7.729  -5.426   5.550
  188   2HD2  ASN  25          2HD2      ASN  25  -9.410  -5.853   5.336
  189    H    GLU  26           H        GLU  26  -4.194  -6.836   7.749
  190    HA   GLU  26           HA       GLU  26  -3.669  -8.547  10.043
  191   1HB   GLU  26          2HB       GLU  26  -1.782  -7.451   7.910
  192   2HB   GLU  26          3HB       GLU  26  -1.418  -8.703   9.108
  193   1HG   GLU  26          2HG       GLU  26  -3.293 -10.098   8.166
  194   2HG   GLU  26          3HG       GLU  26  -3.522  -8.883   6.895
  195    H    ASP  27           H        ASP  27  -2.416  -5.371   8.948
  196    HA   ASP  27           HA       ASP  27  -1.289  -4.883  11.639
  197   1HB   ASP  27          2HB       ASP  27   0.123  -4.706   9.502
  198   2HB   ASP  27          3HB       ASP  27  -0.781  -3.257   9.109
  199    H    ALA  28           H        ALA  28  -3.587  -4.614  12.345
  200    HA   ALA  28           HA       ALA  28  -5.217  -2.466  11.303
  201   1HB   ALA  28          1HB       ALA  28  -5.394  -3.962  13.951
  202   2HB   ALA  28          2HB       ALA  28  -6.663  -2.950  13.226
  203   3HB   ALA  28          3HB       ALA  28  -6.160  -4.452  12.421
  204    H    GLN  29           H        GLN  29  -2.516  -2.482  13.376
  205    HA   GLN  29           HA       GLN  29  -3.213   0.100  14.661
  206   1HB   GLN  29          2HB       GLN  29  -1.213  -0.372  16.003
  207   2HB   GLN  29          3HB       GLN  29  -2.457  -1.608  16.174
  208   1HG   GLN  29          2HG       GLN  29  -1.211  -3.176  14.826
  209   2HG   GLN  29          3HG       GLN  29  -0.132  -1.888  14.250
  210   1HE2  GLN  29          1HE2      GLN  29   1.718  -3.023  14.877
  211   2HE2  GLN  29          2HE2      GLN  29   2.182  -3.136  16.574
  212    H    ALA  30           H        ALA  30  -2.138  -0.665  11.648
  213    HA   ALA  30           HA       ALA  30   0.266   0.968  11.555
  214   1HB   ALA  30          1HB       ALA  30  -0.117  -0.828   9.925
  215   2HB   ALA  30          2HB       ALA  30  -1.601  -0.042   9.364
  216   3HB   ALA  30          3HB       ALA  30  -0.022   0.721   9.091
  217    H    THR  31           H        THR  31   0.473   2.915  10.241
  218    HA   THR  31           HA       THR  31  -2.032   4.502   9.855
  219    HB   THR  31           HB       THR  31   0.705   5.393  10.807
  220    HG1  THR  31           1HG      THR  31  -1.055   4.520  12.217
  221   1HG2  THR  31          1HG2      THR  31  -0.140   7.088   9.201
  222   2HG2  THR  31          2HG2      THR  31  -1.722   7.079  10.018
  223   3HG2  THR  31          3HG2      THR  31  -0.284   7.685  10.861
  224    H    VAL  32           H        VAL  32  -2.180   5.534   7.897
  225    HA   VAL  32           HA       VAL  32  -0.306   4.650   5.752
  226    HB   VAL  32           HB       VAL  32  -2.478   4.465   4.416
  227   1HG1  VAL  32          1HG1      VAL  32  -1.733   2.544   6.645
  228   2HG1  VAL  32          2HG1      VAL  32  -3.123   2.218   5.606
  229   3HG1  VAL  32          3HG1      VAL  32  -1.544   2.400   4.882
  230   1HG2  VAL  32          1HG2      VAL  32  -4.550   4.102   5.575
  231   2HG2  VAL  32          2HG2      VAL  32  -3.799   4.294   7.157
  232   3HG2  VAL  32          3HG2      VAL  32  -3.963   5.685   6.055
  233    H    GLN  33           H        GLN  33   0.251   6.341   4.266
  234    HA   GLN  33           HA       GLN  33  -1.626   8.618   4.027
  235   1HB   GLN  33          2HB       GLN  33   1.326   8.830   4.763
  236   2HB   GLN  33          3HB       GLN  33   0.416  10.131   3.976
  237   1HG   GLN  33          2HG       GLN  33  -1.219  10.074   5.886
  238   2HG   GLN  33          3HG       GLN  33  -0.176   8.898   6.702
  239   1HE2  GLN  33          1HE2      GLN  33   1.418   9.739   8.050
  240   2HE2  GLN  33          2HE2      GLN  33   1.926  11.418   7.998
  241    H    VAL  34           H        VAL  34  -2.234   8.072   1.970
  242    HA   VAL  34           HA       VAL  34  -0.084   7.552  -0.021
  243    HB   VAL  34           HB       VAL  34  -1.459   5.583   0.332
  244   1HG1  VAL  34          1HG1      VAL  34  -3.581   6.595   1.072
  245   2HG1  VAL  34          2HG1      VAL  34  -3.843   7.224  -0.567
  246   3HG1  VAL  34          3HG1      VAL  34  -3.804   5.477  -0.285
  247   1HG2  VAL  34          1HG2      VAL  34  -0.535   6.229  -1.940
  248   2HG2  VAL  34          2HG2      VAL  34  -1.929   5.133  -1.984
  249   3HG2  VAL  34          3HG2      VAL  34  -2.135   6.857  -2.354
  250    H    ASP  35           H        ASP  35   0.039   8.803  -1.783
  251    HA   ASP  35           HA       ASP  35  -1.688  11.225  -1.824
  252   1HB   ASP  35          2HB       ASP  35   1.087  10.602  -2.298
  253   2HB   ASP  35          3HB       ASP  35   0.409  11.326  -3.768
  254    H    LEU  36           H        LEU  36  -3.572  10.323  -2.691
  255    HA   LEU  36           HA       LEU  36  -3.623   9.110  -5.366
  256   1HB   LEU  36          2HB       LEU  36  -5.839  10.336  -3.676
  257   2HB   LEU  36          3HB       LEU  36  -6.035   9.628  -5.279
  258    HG   LEU  36           HG       LEU  36  -4.640   7.621  -3.914
  259   1HD1  LEU  36          1HD1      LEU  36  -5.880   7.250  -1.838
  260   2HD1  LEU  36          2HD1      LEU  36  -5.056   8.824  -1.765
  261   3HD1  LEU  36          3HD1      LEU  36  -6.803   8.745  -2.079
  262   1HD2  LEU  36          1HD2      LEU  36  -7.645   7.912  -4.318
  263   2HD2  LEU  36          2HD2      LEU  36  -6.482   7.289  -5.510
  264   3HD2  LEU  36          3HD2      LEU  36  -6.772   6.397  -4.006
  265    H    THR  37           H        THR  37  -2.087  10.613  -6.009
  266    HA   THR  37           HA       THR  37  -3.137  12.923  -7.509
  267    HB   THR  37           HB       THR  37  -0.968  13.245  -5.380
  268    HG1  THR  37           1HG      THR  37  -3.643  13.544  -5.329
  269   1HG2  THR  37          1HG2      THR  37  -2.104  15.240  -7.392
  270   2HG2  THR  37          2HG2      THR  37  -1.054  15.652  -6.023
  271   3HG2  THR  37          3HG2      THR  37  -0.431  14.643  -7.337
  272    H    SER  38           H        SER  38  -0.275  10.821  -6.646
  273    HA   SER  38           HA       SER  38   0.148  10.648  -9.542
  274   1HB   SER  38          2HB       SER  38   2.489  11.390  -7.744
  275   2HB   SER  38          3HB       SER  38   2.483  11.133  -9.504
  276    HG   SER  38           HG       SER  38   0.687  12.890  -9.244
  277    H    LYS  39           H        LYS  39   2.564   9.427  -7.232
  278    HA   LYS  39           HA       LYS  39   1.477   6.716  -7.412
  279   1HB   LYS  39          2HB       LYS  39   3.451   5.972  -8.832
  280   2HB   LYS  39          3HB       LYS  39   2.145   6.857  -9.619
  281   1HG   LYS  39          2HG       LYS  39   3.668   8.948  -9.392
  282   2HG   LYS  39          3HG       LYS  39   4.950   7.829  -8.928
  283   1HD   LYS  39          2HD       LYS  39   3.447   7.014 -11.373
  284   2HD   LYS  39          3HD       LYS  39   4.148   8.623 -11.514
  285   1HE   LYS  39          2HE       LYS  39   6.387   7.784 -11.030
  286   2HE   LYS  39          3HE       LYS  39   5.758   6.169 -10.663
  287   1HZ   LYS  39          1HZ       LYS  39   5.615   7.483 -13.303
  288   2HZ   LYS  39          2HZ       LYS  39   6.686   6.313 -12.876
  289   3HZ   LYS  39          3HZ       LYS  39   5.081   5.967 -12.952
  290    H    LYS  40           H        LYS  40   2.020   8.126  -5.170
  291    HA   LYS  40           HA       LYS  40   4.569   7.023  -4.089
  292   1HB   LYS  40          2HB       LYS  40   4.951   9.187  -2.972
  293   2HB   LYS  40          3HB       LYS  40   4.992   9.312  -4.728
  294   1HG   LYS  40          2HG       LYS  40   2.301   9.845  -4.070
  295   2HG   LYS  40          3HG       LYS  40   3.198  10.600  -2.768
  296   1HD   LYS  40          2HD       LYS  40   4.055  11.132  -5.626
  297   2HD   LYS  40          3HD       LYS  40   2.515  11.790  -5.090
  298   1HE   LYS  40          2HE       LYS  40   4.601  12.360  -3.100
  299   2HE   LYS  40          3HE       LYS  40   5.080  12.926  -4.703
  300   1HZ   LYS  40          1HZ       LYS  40   3.822  14.588  -3.479
  301   2HZ   LYS  40          2HZ       LYS  40   2.996  14.143  -4.829
  302   3HZ   LYS  40          3HZ       LYS  40   2.529  13.598  -3.369
  303    H    VAL  41           H        VAL  41   4.317   6.057  -2.052
  304    HA   VAL  41           HA       VAL  41   1.865   6.681  -0.530
  305    HB   VAL  41           HB       VAL  41   1.173   4.797  -1.891
  306   1HG1  VAL  41          1HG1      VAL  41   2.283   2.610  -1.806
  307   2HG1  VAL  41          2HG1      VAL  41   3.351   3.828  -2.517
  308   3HG1  VAL  41          3HG1      VAL  41   3.574   3.317  -0.823
  309   1HG2  VAL  41          1HG2      VAL  41   0.597   4.881   0.601
  310   2HG2  VAL  41          2HG2      VAL  41   0.510   3.270  -0.146
  311   3HG2  VAL  41          3HG2      VAL  41   1.895   3.714   0.863
  312    H    THR  42           H        THR  42   2.195   6.727   1.650
  313    HA   THR  42           HA       THR  42   4.906   5.967   2.594
  314    HB   THR  42           HB       THR  42   3.071   8.236   3.466
  315    HG1  THR  42           1HG      THR  42   4.509   9.534   2.419
  316   1HG2  THR  42          1HG2      THR  42   4.457   7.420   5.328
  317   2HG2  THR  42          2HG2      THR  42   5.899   7.470   4.298
  318   3HG2  THR  42          3HG2      THR  42   5.079   8.978   4.757
  319    H    ILE  43           H        ILE  43   4.710   4.221   3.908
  320    HA   ILE  43           HA       ILE  43   2.177   3.832   5.477
  321    HB   ILE  43           HB       ILE  43   4.204   1.817   4.468
  322   1HG1  ILE  43          2HG1      ILE  43   2.696   2.585   2.695
  323   2HG1  ILE  43          3HG1      ILE  43   2.293   0.943   3.170
  324   1HG2  ILE  43          1HG2      ILE  43   2.520   0.159   5.472
  325   2HG2  ILE  43          2HG2      ILE  43   3.538   1.050   6.607
  326   3HG2  ILE  43          3HG2      ILE  43   1.850   1.530   6.376
  327   1HD1  ILE  43          1HD1      ILE  43   0.722   3.427   3.857
  328   2HD1  ILE  43          2HD1      ILE  43   0.248   2.051   2.852
  329   3HD1  ILE  43          3HD1      ILE  43   0.470   1.818   4.595
  330    H    THR  44           H        THR  44   2.319   4.193   7.545
  331    HA   THR  44           HA       THR  44   4.978   4.330   8.840
  332    HB   THR  44           HB       THR  44   2.369   5.705   9.461
  333    HG1  THR  44           1HG      THR  44   3.816   6.397   7.704
  334   1HG2  THR  44          1HG2      THR  44   3.689   6.925  11.187
  335   2HG2  THR  44          2HG2      THR  44   3.563   5.203  11.582
  336   3HG2  THR  44          3HG2      THR  44   5.068   5.848  10.888
  337    H    SER  45           H        SER  45   5.246   2.161   9.355
  338    HA   SER  45           HA       SER  45   3.769   1.217  11.639
  339   1HB   SER  45          2HB       SER  45   3.203  -0.992  10.654
  340   2HB   SER  45          3HB       SER  45   2.296   0.292   9.880
  341    HG   SER  45           HG       SER  45   3.310  -1.257   8.449
  342    H    ALA  46           H        ALA  46   4.774  -1.059  12.185
  343    HA   ALA  46           HA       ALA  46   7.705  -0.972  11.940
  344   1HB   ALA  46          1HB       ALA  46   6.673  -1.734  14.034
  345   2HB   ALA  46          2HB       ALA  46   5.814  -3.027  13.168
  346   3HB   ALA  46          3HB       ALA  46   7.587  -3.049  13.266
  347    H    LEU  47           H        LEU  47   4.936  -2.914  10.748
  348    HA   LEU  47           HA       LEU  47   6.734  -4.416   8.907
  349   1HB   LEU  47          2HB       LEU  47   5.003  -6.130   8.841
  350   2HB   LEU  47          3HB       LEU  47   5.828  -5.960  10.376
  351    HG   LEU  47           HG       LEU  47   3.473  -4.344  10.603
  352   1HD1  LEU  47          1HD1      LEU  47   1.737  -6.134  10.263
  353   2HD1  LEU  47          2HD1      LEU  47   2.424  -5.470   8.776
  354   3HD1  LEU  47          3HD1      LEU  47   2.937  -7.073   9.359
  355   1HD2  LEU  47          1HD2      LEU  47   4.087  -7.113  11.711
  356   2HD2  LEU  47          2HD2      LEU  47   4.617  -5.571  12.427
  357   3HD2  LEU  47          3HD2      LEU  47   2.890  -5.964  12.345
  358    H    GLY  48           H        GLY  48   6.690  -2.410   7.794
  359   1HA   GLY  48          2HA       GLY  48   4.227  -1.785   6.231
  360   2HA   GLY  48          3HA       GLY  48   5.767  -0.911   6.187
  361    H    GLU  49           H        GLU  49   7.628  -2.097   5.354
  362    HA   GLU  49           HA       GLU  49   7.223  -2.545   2.699
  363   1HB   GLU  49          2HB       GLU  49   9.349  -1.955   3.984
  364   2HB   GLU  49          3HB       GLU  49   9.622  -3.688   4.195
  365   1HG   GLU  49          2HG       GLU  49   9.597  -3.933   1.702
  366   2HG   GLU  49          3HG       GLU  49   9.346  -2.179   1.561
  367    H    GLU  50           H        GLU  50   8.118  -5.193   4.950
  368    HA   GLU  50           HA       GLU  50   7.859  -7.367   3.206
  369   1HB   GLU  50          2HB       GLU  50   7.540  -7.022   6.212
  370   2HB   GLU  50          3HB       GLU  50   7.297  -8.598   5.454
  371   1HG   GLU  50          2HG       GLU  50   9.528  -8.616   4.536
  372   2HG   GLU  50          3HG       GLU  50   9.846  -6.965   5.094
  373    H    GLN  51           H        GLN  51   5.383  -5.977   5.395
  374    HA   GLN  51           HA       GLN  51   3.407  -7.908   4.778
  375   1HB   GLN  51          2HB       GLN  51   3.640  -5.922   6.636
  376   2HB   GLN  51          3HB       GLN  51   2.512  -5.132   5.542
  377   1HG   GLN  51          2HG       GLN  51   2.220  -7.778   7.008
  378   2HG   GLN  51          3HG       GLN  51   1.212  -6.332   7.176
  379   1HE2  GLN  51          1HE2      GLN  51   0.988  -9.377   6.124
  380   2HE2  GLN  51          2HE2      GLN  51  -0.301  -9.144   5.024
  381    H    LEU  52           H        LEU  52   3.922  -4.583   3.589
  382    HA   LEU  52           HA       LEU  52   1.882  -4.400   1.713
  383   1HB   LEU  52          2HB       LEU  52   4.692  -3.264   1.678
  384   2HB   LEU  52          3HB       LEU  52   3.450  -2.770   0.526
  385    HG   LEU  52           HG       LEU  52   2.882  -2.622   3.500
  386   1HD1  LEU  52          1HD1      LEU  52   5.084  -1.402   2.813
  387   2HD1  LEU  52          2HD1      LEU  52   4.011  -0.290   1.950
  388   3HD1  LEU  52          3HD1      LEU  52   3.867  -0.512   3.710
  389   1HD2  LEU  52          1HD2      LEU  52   1.225  -1.025   2.855
  390   2HD2  LEU  52          2HD2      LEU  52   1.891  -0.869   1.212
  391   3HD2  LEU  52          3HD2      LEU  52   1.076  -2.352   1.700
  392    H    ARG  53           H        ARG  53   5.158  -5.848   1.318
  393    HA   ARG  53           HA       ARG  53   5.021  -6.478  -1.380
  394   1HB   ARG  53          2HB       ARG  53   6.725  -7.152   0.691
  395   2HB   ARG  53          3HB       ARG  53   5.959  -8.704   0.412
  396   1HG   ARG  53          2HG       ARG  53   7.904  -8.687  -0.920
  397   2HG   ARG  53          3HG       ARG  53   6.581  -8.409  -2.077
  398   1HD   ARG  53          2HD       ARG  53   7.038  -5.963  -1.989
  399   2HD   ARG  53          3HD       ARG  53   8.269  -6.238  -0.733
  400    HE   ARG  53           HE       ARG  53   8.982  -7.741  -3.034
  401   1HH1  ARG  53          2HH2      ARG  53   8.607  -4.432  -1.896
  402   2HH1  ARG  53          1HH2      ARG  53   9.647  -3.681  -3.024
  403   1HH2  ARG  53          2HH1      ARG  53  10.585  -6.826  -4.538
  404   2HH2  ARG  53          1HH1      ARG  53  10.889  -5.111  -4.495
  405    H    THR  54           H        THR  54   3.750  -8.545   1.276
  406    HA   THR  54           HA       THR  54   2.548 -10.436  -0.502
  407    HB   THR  54           HB       THR  54   2.023  -9.873   2.451
  408    HG1  THR  54           1HG      THR  54   3.911 -11.490   1.079
  409   1HG2  THR  54          1HG2      THR  54   1.534 -12.343   0.717
  410   2HG2  THR  54          2HG2      THR  54   1.493 -12.324   2.494
  411   3HG2  THR  54          3HG2      THR  54   0.314 -11.374   1.575
  412    H    ALA  55           H        ALA  55   1.169  -7.724   1.418
  413    HA   ALA  55           HA       ALA  55  -1.539  -8.122   0.674
  414   1HB   ALA  55          1HB       ALA  55  -1.197  -6.671   2.467
  415   2HB   ALA  55          2HB       ALA  55   0.040  -5.725   1.609
  416   3HB   ALA  55          3HB       ALA  55  -1.671  -5.588   1.143
  417    H    ILE  56           H        ILE  56   0.754  -5.696  -0.704
  418    HA   ILE  56           HA       ILE  56  -0.747  -5.012  -2.978
  419    HB   ILE  56           HB       ILE  56   2.273  -5.351  -2.824
  420   1HG1  ILE  56          2HG1      ILE  56   1.301  -3.574  -1.308
  421   2HG1  ILE  56          3HG1      ILE  56   2.465  -3.017  -2.500
  422   1HG2  ILE  56          1HG2      ILE  56   0.486  -4.198  -4.940
  423   2HG2  ILE  56          2HG2      ILE  56   2.224  -3.801  -4.828
  424   3HG2  ILE  56          3HG2      ILE  56   1.726  -5.458  -5.136
  425   1HD1  ILE  56          1HD1      ILE  56   0.560  -1.467  -2.332
  426   2HD1  ILE  56          2HD1      ILE  56   0.664  -2.154  -3.948
  427   3HD1  ILE  56          3HD1      ILE  56  -0.553  -2.763  -2.829
  428    H    ALA  57           H        ALA  57   1.546  -7.841  -2.697
  429    HA   ALA  57           HA       ALA  57   1.196  -8.746  -5.312
  430   1HB   ALA  57          1HB       ALA  57   1.619 -10.441  -2.826
  431   2HB   ALA  57          2HB       ALA  57   1.864 -10.961  -4.500
  432   3HB   ALA  57          3HB       ALA  57   2.880  -9.678  -3.823
  433    H    SER  58           H        SER  58  -1.112  -9.021  -2.633
  434    HA   SER  58           HA       SER  58  -2.824 -10.997  -3.729
  435   1HB   SER  58          2HB       SER  58  -2.925  -9.816  -1.425
  436   2HB   SER  58          3HB       SER  58  -3.807  -8.523  -2.262
  437    HG   SER  58           HG       SER  58  -4.540 -11.266  -2.170
  438    H    ALA  59           H        ALA  59  -2.468  -7.524  -4.461
  439    HA   ALA  59           HA       ALA  59  -4.702  -7.513  -6.398
  440   1HB   ALA  59          1HB       ALA  59  -2.639  -5.392  -5.686
  441   2HB   ALA  59          2HB       ALA  59  -4.072  -5.176  -6.714
  442   3HB   ALA  59          3HB       ALA  59  -4.269  -5.528  -4.986
  443    H    GLY  60           H        GLY  60  -1.142  -7.393  -6.309
  444   1HA   GLY  60          2HA       GLY  60   0.371  -8.194  -7.903
  445   2HA   GLY  60          3HA       GLY  60  -0.938  -8.437  -9.065
  446    H    HIS  61           H        HIS  61   0.909  -5.880  -7.356
  447    HA   HIS  61           HA       HIS  61   0.854  -4.202  -9.822
  448   1HB   HIS  61          2HB       HIS  61   0.412  -3.396  -6.931
  449   2HB   HIS  61          3HB       HIS  61   0.874  -2.234  -8.140
  450    HD1  HIS  61           1HD      HIS  61  -1.056  -2.691 -10.499
  451    HD2  HIS  61           2HD      HIS  61  -2.070  -3.217  -6.437
  452    HE1  HIS  61           1HE      HIS  61  -3.591  -2.561 -10.367
  453    H    GLU  62           H        GLU  62   2.716  -3.010 -10.213
  454    HA   GLU  62           HA       GLU  62   5.155  -4.239  -9.195
  455   1HB   GLU  62          2HB       GLU  62   4.722  -2.069 -11.305
  456   2HB   GLU  62          3HB       GLU  62   6.192  -3.015 -11.022
  457   1HG   GLU  62          2HG       GLU  62   3.516  -4.129 -12.007
  458   2HG   GLU  62          3HG       GLU  62   4.989  -3.900 -12.954
  459    H    VAL  63           H        VAL  63   4.208  -3.181  -7.090
  460    HA   VAL  63           HA       VAL  63   5.140  -0.404  -6.710
  461    HB   VAL  63           HB       VAL  63   4.019  -2.363  -4.669
  462   1HG1  VAL  63          1HG1      VAL  63   4.343   0.664  -4.525
  463   2HG1  VAL  63          2HG1      VAL  63   3.607  -0.379  -3.297
  464   3HG1  VAL  63          3HG1      VAL  63   5.332  -0.524  -3.648
  465   1HG2  VAL  63          1HG2      VAL  63   2.775  -0.323  -6.531
  466   2HG2  VAL  63          2HG2      VAL  63   2.267  -1.984  -6.235
  467   3HG2  VAL  63          3HG2      VAL  63   1.979  -0.732  -5.008
  468    H    GLU  64           H        GLU  64   7.080   0.140  -5.775
  469    HA   GLU  64           HA       GLU  64   9.091  -2.009  -5.700
  470   1HB   GLU  64          2HB       GLU  64   9.426   0.300  -6.777
  471   2HB   GLU  64          3HB       GLU  64   9.487   0.941  -5.120
  472   1HG   GLU  64          2HG       GLU  64  11.399  -0.604  -4.640
  473   2HG   GLU  64          3HG       GLU  64  11.330  -1.183  -6.310
  Start of MODEL   11
    1   1H    MET   1           H1       MET   1  11.446   4.460  10.965
    2   2H    MET   1           H2       MET   1  13.036   4.892  11.064
    3   3H    MET   1           H3       MET   1  11.904   5.994  10.582
    4    HA   MET   1           HA       MET   1  13.161   5.261   8.736
    5   1HB   MET   1          2HB       MET   1  12.267   2.530   9.703
    6   2HB   MET   1          3HB       MET   1  12.587   2.829   7.988
    7   1HG   MET   1          2HG       MET   1  14.835   3.662   8.496
    8   2HG   MET   1          3HG       MET   1  14.598   3.315  10.218
    9   1HE   MET   1          1HE       MET   1  16.987   2.066  10.012
   10   2HE   MET   1          2HE       MET   1  17.274   0.728   8.874
   11   3HE   MET   1          3HE       MET   1  17.019   2.374   8.256
   12    H    THR   2           H        THR   2  10.072   3.498   9.264
   13    HA   THR   2           HA       THR   2   8.114   3.527   8.278
   14    HB   THR   2           HB       THR   2   7.015   5.381   7.377
   15    HG1  THR   2           1HG      THR   2   8.053   7.296   6.811
   16   1HG2  THR   2          1HG2      THR   2   7.226   7.066   9.076
   17   2HG2  THR   2          2HG2      THR   2   7.503   5.483   9.826
   18   3HG2  THR   2          3HG2      THR   2   8.877   6.557   9.474
   19    H    ILE   3           H        ILE   3   7.079   3.593   5.970
   20    HA   ILE   3           HA       ILE   3   9.105   2.424   4.086
   21    HB   ILE   3           HB       ILE   3   6.168   1.865   4.639
   22   1HG1  ILE   3          2HG1      ILE   3   6.918  -0.456   4.837
   23   2HG1  ILE   3          3HG1      ILE   3   8.611   0.046   4.708
   24   1HG2  ILE   3          1HG2      ILE   3   6.386   0.175   2.753
   25   2HG2  ILE   3          2HG2      ILE   3   6.335   1.862   2.267
   26   3HG2  ILE   3          3HG2      ILE   3   7.893   0.984   2.301
   27   1HD1  ILE   3          1HD1      ILE   3   8.497   1.098   6.884
   28   2HD1  ILE   3          2HD1      ILE   3   6.713   1.016   6.904
   29   3HD1  ILE   3          3HD1      ILE   3   7.693  -0.455   7.050
   30    H    GLN   4           H        GLN   4   9.151   3.296   2.030
   31    HA   GLN   4           HA       GLN   4   6.973   5.092   1.122
   32   1HB   GLN   4          2HB       GLN   4   9.851   5.781   1.499
   33   2HB   GLN   4          3HB       GLN   4   9.206   6.152  -0.107
   34   1HG   GLN   4          2HG       GLN   4   7.417   7.451   0.774
   35   2HG   GLN   4          3HG       GLN   4   7.787   6.977   2.436
   36   1HE2  GLN   4          1HE2      GLN   4   9.648   8.319  -0.389
   37   2HE2  GLN   4          2HE2      GLN   4  10.362   9.623   0.544
   38    H    LEU   5           H        LEU   5   6.065   3.855  -0.431
   39    HA   LEU   5           HA       LEU   5   7.862   2.620  -2.503
   40   1HB   LEU   5          2HB       LEU   5   5.045   1.782  -1.757
   41   2HB   LEU   5          3HB       LEU   5   6.147   0.951  -2.851
   42    HG   LEU   5           HG       LEU   5   6.617   1.319   0.143
   43   1HD1  LEU   5          1HD1      LEU   5   5.596  -1.088  -1.369
   44   2HD1  LEU   5          2HD1      LEU   5   6.012  -1.032   0.362
   45   3HD1  LEU   5          3HD1      LEU   5   4.673  -0.041  -0.254
   46   1HD2  LEU   5          1HD2      LEU   5   8.067  -0.348  -1.948
   47   2HD2  LEU   5          2HD2      LEU   5   8.697   1.065  -1.067
   48   3HD2  LEU   5          3HD2      LEU   5   8.347  -0.432  -0.192
   49    H    THR   6           H        THR   6   6.821   2.499  -4.679
   50    HA   THR   6           HA       THR   6   4.902   4.685  -5.204
   51    HB   THR   6           HB       THR   6   7.718   4.499  -6.146
   52    HG1  THR   6           1HG      THR   6   5.753   6.546  -6.006
   53   1HG2  THR   6          1HG2      THR   6   7.253   5.700  -8.246
   54   2HG2  THR   6          2HG2      THR   6   6.716   4.020  -8.307
   55   3HG2  THR   6          3HG2      THR   6   5.524   5.327  -8.097
   56    H    VAL   7           H        VAL   7   3.295   4.150  -6.369
   57    HA   VAL   7           HA       VAL   7   3.173   1.447  -7.644
   58    HB   VAL   7           HB       VAL   7   1.882   1.403  -5.769
   59   1HG1  VAL   7          1HG1      VAL   7   0.772   4.151  -6.389
   60   2HG1  VAL   7          2HG1      VAL   7   0.088   3.037  -5.185
   61   3HG1  VAL   7          3HG1      VAL   7   1.730   3.644  -4.988
   62   1HG2  VAL   7          1HG2      VAL   7   0.799   0.567  -7.847
   63   2HG2  VAL   7          2HG2      VAL   7  -0.283   0.928  -6.489
   64   3HG2  VAL   7          3HG2      VAL   7  -0.181   2.049  -7.846
   65    HA   PRO   8           HA       PRO   8   2.862   4.639 -10.897
   66   1HB   PRO   8          2HB       PRO   8   3.855   3.190 -13.020
   67   2HB   PRO   8          3HB       PRO   8   4.907   3.955 -11.788
   68   1HG   PRO   8          2HG       PRO   8   3.946   1.085 -11.846
   69   2HG   PRO   8          3HG       PRO   8   5.619   1.674 -11.630
   70   1HD   PRO   8          2HD       PRO   8   4.087   1.010  -9.519
   71   2HD   PRO   8          3HD       PRO   8   5.161   2.432  -9.430
   72    H    THR   9           H        THR   9   1.658   1.334 -10.776
   73    HA   THR   9           HA       THR   9  -0.454   1.980 -12.707
   74    HB   THR   9           HB       THR   9   0.879  -0.168 -12.662
   75    HG1  THR   9           1HG      THR   9  -1.002  -1.269 -13.399
   76   1HG2  THR   9          1HG2      THR   9  -1.163  -1.018 -10.574
   77   2HG2  THR   9          2HG2      THR   9  -0.030  -2.026 -11.440
   78   3HG2  THR   9          3HG2      THR   9   0.584  -0.807 -10.285
   79    H    ILE  10           H        ILE  10  -0.290   3.319  -9.852
   80    HA   ILE  10           HA       ILE  10  -2.542   2.791  -8.541
   81    HB   ILE  10           HB       ILE  10  -0.853   5.048  -8.945
   82   1HG1  ILE  10          2HG1      ILE  10  -3.158   4.449  -7.121
   83   2HG1  ILE  10          3HG1      ILE  10  -1.465   4.009  -6.889
   84   1HG2  ILE  10          1HG2      ILE  10  -2.234   6.982  -9.084
   85   2HG2  ILE  10          2HG2      ILE  10  -2.579   5.985 -10.499
   86   3HG2  ILE  10          3HG2      ILE  10  -3.720   6.013  -9.131
   87   1HD1  ILE  10          1HD1      ILE  10  -2.537   6.860  -6.826
   88   2HD1  ILE  10          2HD1      ILE  10  -2.055   5.882  -5.428
   89   3HD1  ILE  10          3HD1      ILE  10  -0.845   6.367  -6.625
   90    H    ALA  11           H        ALA  11  -4.725   3.473  -8.555
   91    HA   ALA  11           HA       ALA  11  -6.811   3.601  -9.370
   92   1HB   ALA  11          1HB       ALA  11  -7.291   5.121 -11.181
   93   2HB   ALA  11          2HB       ALA  11  -6.002   5.805 -10.177
   94   3HB   ALA  11          3HB       ALA  11  -5.616   5.071 -11.751
   95    H    CYS  12           H        CYS  12  -4.926   1.334 -10.310
   96    HA   CYS  12           HA       CYS  12  -6.716   0.269 -12.465
   97   1HB   CYS  12          2HB       CYS  12  -4.348   0.847 -13.086
   98   2HB   CYS  12          3HB       CYS  12  -3.798  -0.371 -11.929
   99    HG   CYS  12           HG       CYS  12  -5.103  -2.373 -13.036
  100    H    GLU  13           H        GLU  13  -6.526   0.089  -9.261
  101    HA   GLU  13           HA       GLU  13  -7.584  -2.594  -9.180
  102   1HB   GLU  13          2HB       GLU  13  -4.831  -2.517  -8.898
  103   2HB   GLU  13          3HB       GLU  13  -5.337  -2.370  -7.213
  104   1HG   GLU  13          2HG       GLU  13  -6.196  -4.548  -9.153
  105   2HG   GLU  13          3HG       GLU  13  -4.993  -4.701  -7.868
  106    H    ALA  14           H        ALA  14  -9.334  -1.199  -8.650
  107    HA   ALA  14           HA       ALA  14 -10.691   0.149  -7.389
  108   1HB   ALA  14          1HB       ALA  14 -11.222  -0.913  -5.240
  109   2HB   ALA  14          2HB       ALA  14 -10.956  -2.125  -6.505
  110   3HB   ALA  14          3HB       ALA  14  -9.695  -1.820  -5.297
  111    H    CYS  15           H        CYS  15  -8.207   1.448  -7.622
  112    HA   CYS  15           HA       CYS  15  -6.973   3.133  -6.886
  113   1HB   CYS  15          2HB       CYS  15  -9.178   3.480  -4.823
  114   2HB   CYS  15          3HB       CYS  15  -7.626   4.296  -4.618
  115    HG   CYS  15           HG       CYS  15  -9.617   4.374  -7.215
  116    H    ALA  16           H        ALA  16  -5.157   3.467  -5.655
  117    HA   ALA  16           HA       ALA  16  -3.870   1.206  -4.670
  118   1HB   ALA  16          1HB       ALA  16  -2.618   3.158  -5.233
  119   2HB   ALA  16          2HB       ALA  16  -3.389   4.125  -3.949
  120   3HB   ALA  16          3HB       ALA  16  -2.286   2.789  -3.541
  121    H    GLU  17           H        GLU  17  -6.081   3.339  -2.861
  122    HA   GLU  17           HA       GLU  17  -5.321   2.531  -0.296
  123   1HB   GLU  17          2HB       GLU  17  -7.384   3.286   0.526
  124   2HB   GLU  17          3HB       GLU  17  -6.869   4.418  -0.725
  125   1HG   GLU  17          2HG       GLU  17  -8.544   3.557  -2.263
  126   2HG   GLU  17          3HG       GLU  17  -8.920   2.194  -1.200
  127    H    ALA  18           H        ALA  18  -6.996   0.664  -2.761
  128    HA   ALA  18           HA       ALA  18  -8.131  -1.447  -1.388
  129   1HB   ALA  18          1HB       ALA  18  -7.332  -2.836  -3.271
  130   2HB   ALA  18          2HB       ALA  18  -7.944  -1.268  -3.836
  131   3HB   ALA  18          3HB       ALA  18  -6.199  -1.554  -3.751
  132    H    VAL  19           H        VAL  19  -4.568  -0.913  -1.953
  133    HA   VAL  19           HA       VAL  19  -3.910  -3.313  -0.522
  134    HB   VAL  19           HB       VAL  19  -2.379  -2.102  -2.161
  135   1HG1  VAL  19          1HG1      VAL  19  -1.375  -0.750   0.398
  136   2HG1  VAL  19          2HG1      VAL  19  -0.663  -0.675  -1.217
  137   3HG1  VAL  19          3HG1      VAL  19  -2.210   0.120  -0.906
  138   1HG2  VAL  19          1HG2      VAL  19  -1.880  -4.165  -0.911
  139   2HG2  VAL  19          2HG2      VAL  19  -0.462  -3.114  -0.934
  140   3HG2  VAL  19          3HG2      VAL  19  -1.434  -3.223   0.525
  141    H    THR  20           H        THR  20  -4.065   0.160   0.402
  142    HA   THR  20           HA       THR  20  -3.176   0.008   3.029
  143    HB   THR  20           HB       THR  20  -5.379   1.727   1.807
  144    HG1  THR  20           1HG      THR  20  -3.703   3.035   1.299
  145   1HG2  THR  20          1HG2      THR  20  -3.892   2.028   4.381
  146   2HG2  THR  20          2HG2      THR  20  -4.727   3.366   3.550
  147   3HG2  THR  20          3HG2      THR  20  -5.644   1.966   4.134
  148    H    LYS  21           H        LYS  21  -6.496  -0.551   1.798
  149    HA   LYS  21           HA       LYS  21  -7.699  -0.987   4.351
  150   1HB   LYS  21          2HB       LYS  21  -8.605  -2.144   1.699
  151   2HB   LYS  21          3HB       LYS  21  -9.595  -1.817   3.119
  152   1HG   LYS  21          2HG       LYS  21  -8.278   0.661   2.192
  153   2HG   LYS  21          3HG       LYS  21  -9.078  -0.164   0.863
  154   1HD   LYS  21          2HD       LYS  21 -10.560   1.396   1.723
  155   2HD   LYS  21          3HD       LYS  21 -11.202  -0.179   2.196
  156   1HE   LYS  21          2HE       LYS  21 -10.910   0.251   4.455
  157   2HE   LYS  21          3HE       LYS  21  -9.348   1.037   4.208
  158   1HZ   LYS  21          1HZ       LYS  21 -10.931   2.615   4.968
  159   2HZ   LYS  21          2HZ       LYS  21 -10.491   2.991   3.418
  160   3HZ   LYS  21          3HZ       LYS  21 -11.951   2.301   3.713
  161    H    ALA  22           H        ALA  22  -6.213  -3.175   1.909
  162    HA   ALA  22           HA       ALA  22  -6.793  -5.614   3.276
  163   1HB   ALA  22          1HB       ALA  22  -4.997  -6.574   1.930
  164   2HB   ALA  22          2HB       ALA  22  -6.027  -5.515   0.936
  165   3HB   ALA  22          3HB       ALA  22  -4.430  -4.957   1.481
  166    H    VAL  23           H        VAL  23  -3.889  -3.554   3.332
  167    HA   VAL  23           HA       VAL  23  -2.298  -5.028   5.120
  168    HB   VAL  23           HB       VAL  23  -2.422  -2.031   4.580
  169   1HG1  VAL  23          1HG1      VAL  23  -0.020  -2.010   5.188
  170   2HG1  VAL  23          2HG1      VAL  23  -1.043  -2.425   6.582
  171   3HG1  VAL  23          3HG1      VAL  23  -0.135  -3.691   5.714
  172   1HG2  VAL  23          1HG2      VAL  23  -1.091  -2.316   2.755
  173   2HG2  VAL  23          2HG2      VAL  23  -0.274  -3.752   3.390
  174   3HG2  VAL  23          3HG2      VAL  23  -1.870  -3.907   2.679
  175    H    GLN  24           H        GLN  24  -4.685  -2.423   5.683
  176    HA   GLN  24           HA       GLN  24  -4.439  -2.325   8.522
  177   1HB   GLN  24          2HB       GLN  24  -6.681  -1.573   6.629
  178   2HB   GLN  24          3HB       GLN  24  -6.710  -1.201   8.350
  179   1HG   GLN  24          2HG       GLN  24  -4.262  -0.339   6.804
  180   2HG   GLN  24          3HG       GLN  24  -5.767   0.515   6.508
  181   1HE2  GLN  24          1HE2      GLN  24  -3.034   0.600   8.375
  182   2HE2  GLN  24          2HE2      GLN  24  -3.656   1.604   9.670
  183    H    ASN  25           H        ASN  25  -5.748  -4.956   6.648
  184    HA   ASN  25           HA       ASN  25  -7.691  -5.784   8.669
  185   1HB   ASN  25          2HB       ASN  25  -6.129  -7.453   6.648
  186   2HB   ASN  25          3HB       ASN  25  -7.419  -8.035   7.692
  187   1HD2  ASN  25          1HD2      ASN  25  -7.213  -7.874   4.687
  188   2HD2  ASN  25          2HD2      ASN  25  -8.702  -7.055   4.230
  189    H    GLU  26           H        GLU  26  -4.343  -6.791   7.868
  190    HA   GLU  26           HA       GLU  26  -3.964  -8.213  10.373
  191   1HB   GLU  26          2HB       GLU  26  -2.017  -7.353   8.187
  192   2HB   GLU  26          3HB       GLU  26  -1.645  -8.470   9.509
  193   1HG   GLU  26          2HG       GLU  26  -3.882  -9.035   7.499
  194   2HG   GLU  26          3HG       GLU  26  -2.212  -9.531   7.245
  195    H    ASP  27           H        ASP  27  -2.374  -5.345   8.903
  196    HA   ASP  27           HA       ASP  27  -1.162  -4.658  11.486
  197   1HB   ASP  27          2HB       ASP  27   0.023  -4.718   9.194
  198   2HB   ASP  27          3HB       ASP  27  -0.815  -3.219   8.813
  199    H    ALA  28           H        ALA  28  -3.618  -4.449  12.032
  200    HA   ALA  28           HA       ALA  28  -5.180  -2.310  10.944
  201   1HB   ALA  28          1HB       ALA  28  -6.140  -4.319  12.037
  202   2HB   ALA  28          2HB       ALA  28  -5.466  -3.798  13.597
  203   3HB   ALA  28          3HB       ALA  28  -6.726  -2.827  12.800
  204    H    GLN  29           H        GLN  29  -2.834  -2.445  13.432
  205    HA   GLN  29           HA       GLN  29  -3.477   0.144  14.633
  206   1HB   GLN  29          2HB       GLN  29  -1.431  -0.351  15.951
  207   2HB   GLN  29          3HB       GLN  29  -2.710  -1.552  16.107
  208   1HG   GLN  29          2HG       GLN  29  -1.500  -3.137  14.722
  209   2HG   GLN  29          3HG       GLN  29  -0.337  -1.889  14.227
  210   1HE2  GLN  29          1HE2      GLN  29   1.366  -3.314  14.971
  211   2HE2  GLN  29          2HE2      GLN  29   1.686  -3.468  16.696
  212    H    ALA  30           H        ALA  30  -2.149  -0.558  11.627
  213    HA   ALA  30           HA       ALA  30   0.205   1.118  11.781
  214   1HB   ALA  30          1HB       ALA  30  -1.401   0.080   9.405
  215   2HB   ALA  30          2HB       ALA  30   0.179   0.863   9.298
  216   3HB   ALA  30          3HB       ALA  30   0.004  -0.686  10.140
  217    H    THR  31           H        THR  31   0.540   3.112  10.683
  218    HA   THR  31           HA       THR  31  -1.904   4.739  10.085
  219    HB   THR  31           HB       THR  31   0.890   5.553  10.936
  220    HG1  THR  31           1HG      THR  31  -0.684   4.786  12.500
  221   1HG2  THR  31          1HG2      THR  31  -1.506   7.233  10.061
  222   2HG2  THR  31          2HG2      THR  31  -0.130   7.875  10.982
  223   3HG2  THR  31          3HG2      THR  31   0.128   7.235   9.348
  224    H    VAL  32           H        VAL  32  -2.016   5.636   8.035
  225    HA   VAL  32           HA       VAL  32  -0.097   4.618   6.002
  226    HB   VAL  32           HB       VAL  32  -2.016   3.970   4.646
  227   1HG1  VAL  32          1HG1      VAL  32  -0.903   2.525   6.677
  228   2HG1  VAL  32          2HG1      VAL  32  -2.593   2.529   7.190
  229   3HG1  VAL  32          3HG1      VAL  32  -2.133   1.883   5.604
  230   1HG2  VAL  32          1HG2      VAL  32  -3.686   4.826   7.067
  231   2HG2  VAL  32          2HG2      VAL  32  -3.818   5.395   5.392
  232   3HG2  VAL  32          3HG2      VAL  32  -4.294   3.752   5.825
  233    H    GLN  33           H        GLN  33   0.380   6.162   4.368
  234    HA   GLN  33           HA       GLN  33  -1.461   8.479   4.032
  235   1HB   GLN  33          2HB       GLN  33   1.541   8.589   4.558
  236   2HB   GLN  33          3HB       GLN  33   0.554   9.946   3.989
  237   1HG   GLN  33          2HG       GLN  33  -0.827   9.803   6.063
  238   2HG   GLN  33          3HG       GLN  33   0.174   8.461   6.634
  239   1HE2  GLN  33          1HE2      GLN  33   0.221  11.960   5.925
  240   2HE2  GLN  33          2HE2      GLN  33   1.637  12.263   6.916
  241    H    VAL  34           H        VAL  34  -2.128   8.066   1.964
  242    HA   VAL  34           HA       VAL  34  -0.072   7.368  -0.075
  243    HB   VAL  34           HB       VAL  34  -1.630   5.540   0.312
  244   1HG1  VAL  34          1HG1      VAL  34  -3.652   6.826   1.026
  245   2HG1  VAL  34          2HG1      VAL  34  -3.885   7.332  -0.663
  246   3HG1  VAL  34          3HG1      VAL  34  -3.964   5.621  -0.230
  247   1HG2  VAL  34          1HG2      VAL  34  -2.220   5.152  -2.005
  248   2HG2  VAL  34          2HG2      VAL  34  -2.119   6.884  -2.380
  249   3HG2  VAL  34          3HG2      VAL  34  -0.656   5.983  -1.946
  250    H    ASP  35           H        ASP  35   0.282   8.820  -1.657
  251    HA   ASP  35           HA       ASP  35  -1.606  11.145  -1.837
  252   1HB   ASP  35          2HB       ASP  35   1.292  10.831  -2.374
  253   2HB   ASP  35          3HB       ASP  35   0.400  11.765  -3.566
  254    H    LEU  36           H        LEU  36  -3.255   9.882  -2.722
  255    HA   LEU  36           HA       LEU  36  -3.184   8.753  -5.361
  256   1HB   LEU  36          2HB       LEU  36  -5.290  10.092  -3.651
  257   2HB   LEU  36          3HB       LEU  36  -5.650   9.732  -5.340
  258    HG   LEU  36           HG       LEU  36  -4.539   7.554  -3.547
  259   1HD1  LEU  36          1HD1      LEU  36  -6.498   8.436  -2.354
  260   2HD1  LEU  36          2HD1      LEU  36  -7.471   8.339  -3.839
  261   3HD1  LEU  36          3HD1      LEU  36  -6.869   6.857  -3.068
  262   1HD2  LEU  36          1HD2      LEU  36  -6.422   7.508  -5.960
  263   2HD2  LEU  36          2HD2      LEU  36  -4.683   7.197  -6.047
  264   3HD2  LEU  36          3HD2      LEU  36  -5.729   6.096  -5.138
  265    H    THR  37           H        THR  37  -2.985  12.087  -4.183
  266    HA   THR  37           HA       THR  37  -3.268  13.679  -6.351
  267    HB   THR  37           HB       THR  37  -0.779  13.740  -4.619
  268    HG1  THR  37           1HG      THR  37  -1.839  13.875  -2.850
  269   1HG2  THR  37          1HG2      THR  37  -1.243  15.653  -6.131
  270   2HG2  THR  37          2HG2      THR  37  -2.825  15.881  -5.354
  271   3HG2  THR  37          3HG2      THR  37  -1.331  16.125  -4.424
  272    H    SER  38           H        SER  38  -0.790  11.154  -5.891
  273    HA   SER  38           HA       SER  38   0.262  11.649  -8.588
  274   1HB   SER  38          2HB       SER  38   2.041  11.803  -6.111
  275   2HB   SER  38          3HB       SER  38   2.584  11.845  -7.810
  276    HG   SER  38           HG       SER  38   0.736  13.672  -7.635
  277    H    LYS  39           H        LYS  39   2.459   9.822  -6.769
  278    HA   LYS  39           HA       LYS  39   1.083   7.284  -7.015
  279   1HB   LYS  39          2HB       LYS  39   2.618   6.413  -8.810
  280   2HB   LYS  39          3HB       LYS  39   1.377   7.554  -9.299
  281   1HG   LYS  39          2HG       LYS  39   3.202   9.397  -9.129
  282   2HG   LYS  39          3HG       LYS  39   4.371   8.079  -9.069
  283   1HD   LYS  39          2HD       LYS  39   2.226   8.213 -11.232
  284   2HD   LYS  39          3HD       LYS  39   3.624   9.279 -11.339
  285   1HE   LYS  39          2HE       LYS  39   5.164   7.569 -11.651
  286   2HE   LYS  39          3HE       LYS  39   4.152   6.349 -10.896
  287   1HZ   LYS  39          1HZ       LYS  39   2.721   6.384 -12.824
  288   2HZ   LYS  39          2HZ       LYS  39   3.599   7.596 -13.515
  289   3HZ   LYS  39          3HZ       LYS  39   4.269   6.114 -13.301
  290    H    LYS  40           H        LYS  40   2.045   8.377  -4.761
  291    HA   LYS  40           HA       LYS  40   4.263   6.533  -4.171
  292   1HB   LYS  40          2HB       LYS  40   5.412   8.095  -2.800
  293   2HB   LYS  40          3HB       LYS  40   5.179   8.837  -4.380
  294   1HG   LYS  40          2HG       LYS  40   4.602  10.608  -3.004
  295   2HG   LYS  40          3HG       LYS  40   3.044   9.907  -3.346
  296   1HD   LYS  40          2HD       LYS  40   2.670   9.743  -1.126
  297   2HD   LYS  40          3HD       LYS  40   3.904   8.509  -1.009
  298   1HE   LYS  40          2HE       LYS  40   4.424  11.510  -0.788
  299   2HE   LYS  40          3HE       LYS  40   4.181  10.418   0.582
  300   1HZ   LYS  40          1HZ       LYS  40   6.516  10.792   0.073
  301   2HZ   LYS  40          2HZ       LYS  40   6.074   9.208   0.027
  302   3HZ   LYS  40          3HZ       LYS  40   6.328  10.044  -1.384
  303    H    VAL  41           H        VAL  41   4.080   5.589  -2.130
  304    HA   VAL  41           HA       VAL  41   1.743   6.322  -0.498
  305    HB   VAL  41           HB       VAL  41   1.009   4.363  -1.766
  306   1HG1  VAL  41          1HG1      VAL  41   3.430   2.920  -0.623
  307   2HG1  VAL  41          2HG1      VAL  41   2.106   2.179  -1.539
  308   3HG1  VAL  41          3HG1      VAL  41   3.178   3.340  -2.337
  309   1HG2  VAL  41          1HG2      VAL  41   1.720   3.515   1.069
  310   2HG2  VAL  41          2HG2      VAL  41   0.421   4.654   0.683
  311   3HG2  VAL  41          3HG2      VAL  41   0.341   2.983   0.091
  312    H    THR  42           H        THR  42   2.196   6.264   1.695
  313    HA   THR  42           HA       THR  42   4.916   5.428   2.430
  314    HB   THR  42           HB       THR  42   3.544   8.092   3.011
  315    HG1  THR  42           1HG      THR  42   5.311   7.115   1.192
  316   1HG2  THR  42          1HG2      THR  42   4.765   7.451   5.012
  317   2HG2  THR  42          2HG2      THR  42   6.188   6.991   4.067
  318   3HG2  THR  42          3HG2      THR  42   5.690   8.693   4.154
  319    H    ILE  43           H        ILE  43   4.817   4.072   4.137
  320    HA   ILE  43           HA       ILE  43   2.262   3.957   5.715
  321    HB   ILE  43           HB       ILE  43   3.996   1.638   4.832
  322   1HG1  ILE  43          2HG1      ILE  43   2.767   2.356   2.913
  323   2HG1  ILE  43          3HG1      ILE  43   2.018   0.903   3.547
  324   1HG2  ILE  43          1HG2      ILE  43   2.144   0.242   5.792
  325   2HG2  ILE  43          2HG2      ILE  43   3.116   1.111   6.981
  326   3HG2  ILE  43          3HG2      ILE  43   1.502   1.715   6.555
  327   1HD1  ILE  43          1HD1      ILE  43   0.907   3.701   3.806
  328   2HD1  ILE  43          2HD1      ILE  43   0.268   2.338   2.881
  329   3HD1  ILE  43          3HD1      ILE  43   0.256   2.274   4.647
  330    H    THR  44           H        THR  44   2.442   3.912   7.847
  331    HA   THR  44           HA       THR  44   5.150   3.923   9.105
  332    HB   THR  44           HB       THR  44   2.680   5.588   9.687
  333    HG1  THR  44           1HG      THR  44   3.895   7.249   8.870
  334   1HG2  THR  44          1HG2      THR  44   5.450   5.703  10.970
  335   2HG2  THR  44          2HG2      THR  44   4.094   6.798  11.302
  336   3HG2  THR  44          3HG2      THR  44   3.986   5.093  11.770
  337    H    SER  45           H        SER  45   5.009   1.679   9.509
  338    HA   SER  45           HA       SER  45   3.661   1.178  12.022
  339   1HB   SER  45          2HB       SER  45   2.755  -0.977  11.427
  340   2HB   SER  45          3HB       SER  45   2.177   0.126  10.194
  341    HG   SER  45           HG       SER  45   3.010  -1.827   9.409
  342    H    ALA  46           H        ALA  46   4.614  -1.218  12.605
  343    HA   ALA  46           HA       ALA  46   7.530  -0.961  12.454
  344   1HB   ALA  46          1HB       ALA  46   7.512  -2.883  13.977
  345   2HB   ALA  46          2HB       ALA  46   6.453  -1.583  14.561
  346   3HB   ALA  46          3HB       ALA  46   5.749  -3.030  13.798
  347    H    LEU  47           H        LEU  47   4.960  -3.012  10.995
  348    HA   LEU  47           HA       LEU  47   7.118  -4.726   9.791
  349   1HB   LEU  47          2HB       LEU  47   5.700  -6.524   9.719
  350   2HB   LEU  47          3HB       LEU  47   5.592  -5.907  11.357
  351    HG   LEU  47           HG       LEU  47   3.485  -4.901   9.438
  352   1HD1  LEU  47          1HD1      LEU  47   3.492  -7.785  10.395
  353   2HD1  LEU  47          2HD1      LEU  47   2.189  -6.951   9.516
  354   3HD1  LEU  47          3HD1      LEU  47   3.738  -7.258   8.717
  355   1HD2  LEU  47          1HD2      LEU  47   3.402  -4.306  11.819
  356   2HD2  LEU  47          2HD2      LEU  47   2.026  -5.326  11.368
  357   3HD2  LEU  47          3HD2      LEU  47   3.384  -6.029  12.264
  358    H    GLY  48           H        GLY  48   5.515  -2.116   8.916
  359   1HA   GLY  48          2HA       GLY  48   3.722  -2.493   7.004
  360   2HA   GLY  48          3HA       GLY  48   4.924  -1.191   6.914
  361    H    GLU  49           H        GLU  49   7.248  -2.402   6.336
  362    HA   GLU  49           HA       GLU  49   7.104  -2.692   3.577
  363   1HB   GLU  49          2HB       GLU  49   9.091  -2.172   5.196
  364   2HB   GLU  49          3HB       GLU  49   9.345  -3.913   5.236
  365   1HG   GLU  49          2HG       GLU  49   9.535  -3.907   2.731
  366   2HG   GLU  49          3HG       GLU  49   9.274  -2.152   2.733
  367    H    GLU  50           H        GLU  50   7.531  -5.248   6.029
  368    HA   GLU  50           HA       GLU  50   7.622  -7.472   4.307
  369   1HB   GLU  50          2HB       GLU  50   8.066  -7.015   6.970
  370   2HB   GLU  50          3HB       GLU  50   6.465  -7.745   7.086
  371   1HG   GLU  50          2HG       GLU  50   7.355  -9.680   5.732
  372   2HG   GLU  50          3HG       GLU  50   8.945  -8.883   5.748
  373    H    GLN  51           H        GLN  51   4.930  -6.044   6.180
  374    HA   GLN  51           HA       GLN  51   2.930  -7.862   5.393
  375   1HB   GLN  51          2HB       GLN  51   3.016  -5.804   7.133
  376   2HB   GLN  51          3HB       GLN  51   2.222  -4.940   5.838
  377   1HG   GLN  51          2HG       GLN  51   1.309  -7.589   7.067
  378   2HG   GLN  51          3HG       GLN  51   0.659  -5.996   7.470
  379   1HE2  GLN  51          1HE2      GLN  51  -0.931  -8.205   6.487
  380   2HE2  GLN  51          2HE2      GLN  51  -1.597  -7.673   4.958
  381    H    LEU  52           H        LEU  52   3.642  -4.627   4.089
  382    HA   LEU  52           HA       LEU  52   1.893  -4.547   1.977
  383   1HB   LEU  52          2HB       LEU  52   4.664  -3.359   2.328
  384   2HB   LEU  52          3HB       LEU  52   3.637  -2.910   0.975
  385    HG   LEU  52           HG       LEU  52   2.589  -2.656   3.797
  386   1HD1  LEU  52          1HD1      LEU  52   3.559  -0.561   4.084
  387   2HD1  LEU  52          2HD1      LEU  52   4.884  -1.460   3.380
  388   3HD1  LEU  52          3HD1      LEU  52   3.952  -0.362   2.355
  389   1HD2  LEU  52          1HD2      LEU  52   1.062  -2.475   1.767
  390   2HD2  LEU  52          2HD2      LEU  52   1.092  -1.043   2.803
  391   3HD2  LEU  52          3HD2      LEU  52   1.988  -1.056   1.267
  392    H    ARG  53           H        ARG  53   5.255  -5.811   2.006
  393    HA   ARG  53           HA       ARG  53   5.638  -6.466  -0.626
  394   1HB   ARG  53          2HB       ARG  53   7.021  -7.032   1.626
  395   2HB   ARG  53          3HB       ARG  53   6.226  -8.585   1.459
  396   1HG   ARG  53          2HG       ARG  53   8.295  -8.822   0.417
  397   2HG   ARG  53          3HG       ARG  53   7.161  -8.651  -0.932
  398   1HD   ARG  53          2HD       ARG  53   7.848  -6.210  -1.128
  399   2HD   ARG  53          3HD       ARG  53   8.820  -6.391   0.321
  400    HE   ARG  53           HE       ARG  53  10.515  -7.286  -0.844
  401   1HH1  ARG  53          2HH2      ARG  53   7.617  -7.524  -2.820
  402   2HH1  ARG  53          1HH2      ARG  53   8.427  -8.026  -4.273
  403   1HH2  ARG  53          2HH1      ARG  53  11.648  -8.007  -2.725
  404   2HH2  ARG  53          1HH1      ARG  53  10.791  -8.334  -4.197
  405    H    THR  54           H        THR  54   3.743  -8.307   1.764
  406    HA   THR  54           HA       THR  54   2.887 -10.310  -0.179
  407    HB   THR  54           HB       THR  54   1.798  -9.822   2.621
  408    HG1  THR  54           1HG      THR  54   4.026 -10.131   2.731
  409   1HG2  THR  54          1HG2      THR  54   0.439 -11.353   1.230
  410   2HG2  THR  54          2HG2      THR  54   1.898 -12.264   0.782
  411   3HG2  THR  54          3HG2      THR  54   1.329 -12.267   2.461
  412    H    ALA  55           H        ALA  55   1.265  -7.603   1.600
  413    HA   ALA  55           HA       ALA  55  -1.280  -8.141   0.535
  414   1HB   ALA  55          1HB       ALA  55  -1.906  -5.899   1.305
  415   2HB   ALA  55          2HB       ALA  55  -0.985  -6.811   2.512
  416   3HB   ALA  55          3HB       ALA  55  -0.192  -5.514   1.582
  417    H    ILE  56           H        ILE  56   1.099  -5.699  -0.583
  418    HA   ILE  56           HA       ILE  56  -0.275  -4.718  -2.846
  419    HB   ILE  56           HB       ILE  56   2.706  -5.309  -2.594
  420   1HG1  ILE  56          2HG1      ILE  56   1.265  -2.646  -2.182
  421   2HG1  ILE  56          3HG1      ILE  56   1.703  -3.702  -0.832
  422   1HG2  ILE  56          1HG2      ILE  56   1.222  -3.352  -4.381
  423   2HG2  ILE  56          2HG2      ILE  56   2.981  -3.662  -4.376
  424   3HG2  ILE  56          3HG2      ILE  56   1.890  -4.893  -4.967
  425   1HD1  ILE  56          1HD1      ILE  56   3.647  -2.377  -2.756
  426   2HD1  ILE  56          2HD1      ILE  56   3.322  -1.958  -1.078
  427   3HD1  ILE  56          3HD1      ILE  56   4.088  -3.518  -1.462
  428    H    ALA  57           H        ALA  57   1.724  -7.702  -2.584
  429    HA   ALA  57           HA       ALA  57   1.370  -8.449  -5.338
  430   1HB   ALA  57          1HB       ALA  57   2.180 -10.681  -4.574
  431   2HB   ALA  57          2HB       ALA  57   3.229  -9.341  -4.060
  432   3HB   ALA  57          3HB       ALA  57   2.133 -10.113  -2.894
  433    H    SER  58           H        SER  58  -0.471  -9.116  -2.370
  434    HA   SER  58           HA       SER  58  -2.408 -10.895  -3.597
  435   1HB   SER  58          2HB       SER  58  -1.885 -10.881  -1.160
  436   2HB   SER  58          3HB       SER  58  -2.586  -9.251  -1.046
  437    HG   SER  58           HG       SER  58  -4.534 -10.109  -1.814
  438    H    ALA  59           H        ALA  59  -2.227  -8.886  -5.369
  439    HA   ALA  59           HA       ALA  59  -4.846  -7.871  -5.771
  440   1HB   ALA  59          1HB       ALA  59  -2.726  -5.880  -4.837
  441   2HB   ALA  59          2HB       ALA  59  -4.224  -5.429  -5.674
  442   3HB   ALA  59          3HB       ALA  59  -4.299  -6.189  -4.074
  443    H    GLY  60           H        GLY  60  -1.370  -7.069  -6.242
  444   1HA   GLY  60          2HA       GLY  60  -0.116  -7.875  -8.095
  445   2HA   GLY  60          3HA       GLY  60  -1.574  -7.994  -9.083
  446    H    HIS  61           H        HIS  61   0.317  -5.558  -7.262
  447    HA   HIS  61           HA       HIS  61  -0.202  -3.540  -9.419
  448   1HB   HIS  61          2HB       HIS  61   0.678  -3.294  -6.544
  449   2HB   HIS  61          3HB       HIS  61   0.805  -1.971  -7.712
  450    HD1  HIS  61           1HD      HIS  61  -1.520  -0.882  -8.579
  451    HD2  HIS  61           2HD      HIS  61  -1.570  -3.453  -5.251
  452    HE1  HIS  61           1HE      HIS  61  -3.583  -0.275  -7.231
  453    H    GLU  62           H        GLU  62   1.476  -2.730 -10.544
  454    HA   GLU  62           HA       GLU  62   4.003  -4.112 -10.698
  455   1HB   GLU  62          2HB       GLU  62   2.943  -1.624 -12.132
  456   2HB   GLU  62          3HB       GLU  62   4.326  -2.609 -12.621
  457   1HG   GLU  62          2HG       GLU  62   1.437  -3.625 -12.537
  458   2HG   GLU  62          3HG       GLU  62   2.298  -3.058 -13.970
  459    H    VAL  63           H        VAL  63   4.050  -3.248  -8.262
  460    HA   VAL  63           HA       VAL  63   5.049  -0.500  -7.946
  461    HB   VAL  63           HB       VAL  63   4.978  -2.778  -5.929
  462   1HG1  VAL  63          1HG1      VAL  63   6.438  -0.767  -5.330
  463   2HG1  VAL  63          2HG1      VAL  63   4.953   0.211  -5.390
  464   3HG1  VAL  63          3HG1      VAL  63   5.104  -1.105  -4.224
  465   1HG2  VAL  63          1HG2      VAL  63   2.861  -1.463  -5.175
  466   2HG2  VAL  63          2HG2      VAL  63   2.904  -0.717  -6.784
  467   3HG2  VAL  63          3HG2      VAL  63   2.756  -2.477  -6.623
  468    H    GLU  64           H        GLU  64   7.148   0.131  -7.719
  469    HA   GLU  64           HA       GLU  64   9.280  -1.785  -8.454
  470   1HB   GLU  64          2HB       GLU  64   8.885   0.498  -9.598
  471   2HB   GLU  64          3HB       GLU  64   9.442   1.231  -8.084
  472   1HG   GLU  64          2HG       GLU  64  11.621   0.091  -8.354
  473   2HG   GLU  64          3HG       GLU  64  11.028  -0.719  -9.815
  Start of MODEL   12
    1   1H    MET   1           H1       MET   1  11.272   5.652  10.756
    2   2H    MET   1           H2       MET   1  12.097   7.094  10.790
    3   3H    MET   1           H3       MET   1  10.427   7.037  10.760
    4    HA   MET   1           HA       MET   1  11.325   7.626   8.596
    5   1HB   MET   1          2HB       MET   1  12.459   4.826   8.953
    6   2HB   MET   1          3HB       MET   1  12.184   5.500   7.342
    7   1HG   MET   1          2HG       MET   1  13.744   7.217   7.606
    8   2HG   MET   1          3HG       MET   1  13.769   7.094   9.368
    9   1HE   MET   1          1HE       MET   1  16.365   7.407   7.552
   10   2HE   MET   1          2HE       MET   1  16.337   7.376   9.334
   11   3HE   MET   1          3HE       MET   1  17.440   6.304   8.442
   12    H    THR   2           H        THR   2  10.251   6.114   6.559
   13    HA   THR   2           HA       THR   2   7.762   4.896   7.523
   14    HB   THR   2           HB       THR   2   6.409   6.329   6.049
   15    HG1  THR   2           1HG      THR   2   8.799   7.854   5.824
   16   1HG2  THR   2          1HG2      THR   2   6.601   6.924   8.478
   17   2HG2  THR   2          2HG2      THR   2   7.882   8.082   8.063
   18   3HG2  THR   2          3HG2      THR   2   6.249   8.311   7.424
   19    H    ILE   3           H        ILE   3   6.765   3.659   5.780
   20    HA   ILE   3           HA       ILE   3   8.809   2.648   3.929
   21    HB   ILE   3           HB       ILE   3   5.979   1.681   4.380
   22   1HG1  ILE   3          2HG1      ILE   3   6.954   1.633   6.578
   23   2HG1  ILE   3          3HG1      ILE   3   6.850   0.006   5.929
   24   1HG2  ILE   3          1HG2      ILE   3   7.043   0.835   2.377
   25   2HG2  ILE   3          2HG2      ILE   3   8.482   0.343   3.284
   26   3HG2  ILE   3          3HG2      ILE   3   6.924  -0.458   3.573
   27   1HD1  ILE   3          1HD1      ILE   3   9.395   1.691   6.033
   28   2HD1  ILE   3          2HD1      ILE   3   8.958   0.368   7.125
   29   3HD1  ILE   3          3HD1      ILE   3   9.277   0.026   5.419
   30    H    GLN   4           H        GLN   4   8.974   4.471   2.583
   31    HA   GLN   4           HA       GLN   4   6.671   5.385   0.992
   32   1HB   GLN   4          2HB       GLN   4   9.449   6.290   1.493
   33   2HB   GLN   4          3HB       GLN   4   8.933   6.452  -0.190
   34   1HG   GLN   4          2HG       GLN   4   6.947   7.665   0.419
   35   2HG   GLN   4          3HG       GLN   4   7.305   7.486   2.142
   36   1HE2  GLN   4          1HE2      GLN   4   6.909   9.982   0.740
   37   2HE2  GLN   4          2HE2      GLN   4   8.434  10.864   0.816
   38    H    LEU   5           H        LEU   5   5.927   3.906  -0.447
   39    HA   LEU   5           HA       LEU   5   7.934   2.525  -2.208
   40   1HB   LEU   5          2HB       LEU   5   5.048   1.841  -1.666
   41   2HB   LEU   5          3HB       LEU   5   6.147   0.934  -2.697
   42    HG   LEU   5           HG       LEU   5   6.843   1.412   0.225
   43   1HD1  LEU   5          1HD1      LEU   5   5.019  -0.742  -0.870
   44   2HD1  LEU   5          2HD1      LEU   5   5.726  -0.718   0.762
   45   3HD1  LEU   5          3HD1      LEU   5   4.600   0.569   0.265
   46   1HD2  LEU   5          1HD2      LEU   5   8.062  -0.699  -0.043
   47   2HD2  LEU   5          2HD2      LEU   5   7.491  -0.844  -1.719
   48   3HD2  LEU   5          3HD2      LEU   5   8.588   0.478  -1.258
   49    H    THR   6           H        THR   6   7.680   2.575  -4.408
   50    HA   THR   6           HA       THR   6   6.151   4.891  -5.505
   51    HB   THR   6           HB       THR   6   8.548   3.367  -6.616
   52    HG1  THR   6           1HG      THR   6   8.985   4.626  -4.751
   53   1HG2  THR   6          1HG2      THR   6   7.201   4.418  -8.404
   54   2HG2  THR   6          2HG2      THR   6   7.181   5.953  -7.503
   55   3HG2  THR   6          3HG2      THR   6   8.708   5.315  -8.146
   56    H    VAL   7           H        VAL   7   4.182   4.155  -6.163
   57    HA   VAL   7           HA       VAL   7   3.959   1.478  -7.492
   58    HB   VAL   7           HB       VAL   7   2.951   1.290  -5.449
   59   1HG1  VAL   7          1HG1      VAL   7   1.501   3.911  -5.847
   60   2HG1  VAL   7          2HG1      VAL   7   1.198   2.743  -4.541
   61   3HG1  VAL   7          3HG1      VAL   7   2.758   3.559  -4.657
   62   1HG2  VAL   7          1HG2      VAL   7   1.683   0.461  -7.455
   63   2HG2  VAL   7          2HG2      VAL   7   0.744   0.669  -5.965
   64   3HG2  VAL   7          3HG2      VAL   7   0.614   1.848  -7.274
   65    HA   PRO   8           HA       PRO   8   3.226   4.927 -10.456
   66   1HB   PRO   8          2HB       PRO   8   3.836   3.592 -12.785
   67   2HB   PRO   8          3HB       PRO   8   5.046   4.340 -11.701
   68   1HG   PRO   8          2HG       PRO   8   4.176   1.441 -11.757
   69   2HG   PRO   8          3HG       PRO   8   5.842   2.087 -11.746
   70   1HD   PRO   8          2HD       PRO   8   4.666   1.249  -9.487
   71   2HD   PRO   8          3HD       PRO   8   5.668   2.722  -9.464
   72    H    THR   9           H        THR   9   1.990   1.650 -10.362
   73    HA   THR   9           HA       THR   9  -0.269   2.196 -12.134
   74    HB   THR   9           HB       THR   9   0.988   0.064 -12.168
   75    HG1  THR   9           1HG      THR   9  -1.735   0.022 -11.412
   76   1HG2  THR   9          1HG2      THR   9   1.638  -0.435  -9.968
   77   2HG2  THR   9          2HG2      THR   9   0.027  -0.136  -9.294
   78   3HG2  THR   9          3HG2      THR   9   0.291  -1.555 -10.298
   79    H    ILE  10           H        ILE  10   0.108   3.329  -8.993
   80    HA   ILE  10           HA       ILE  10  -2.225   2.564  -7.768
   81    HB   ILE  10           HB       ILE  10  -0.410   4.843  -7.686
   82   1HG1  ILE  10          2HG1      ILE  10  -2.397   3.619  -5.767
   83   2HG1  ILE  10          3HG1      ILE  10  -0.744   3.098  -5.993
   84   1HG2  ILE  10          1HG2      ILE  10  -1.851   6.597  -6.849
   85   2HG2  ILE  10          2HG2      ILE  10  -2.343   6.182  -8.489
   86   3HG2  ILE  10          3HG2      ILE  10  -3.290   5.592  -7.098
   87   1HD1  ILE  10          1HD1      ILE  10  -0.686   4.424  -4.021
   88   2HD1  ILE  10          2HD1      ILE  10  -0.043   5.502  -5.271
   89   3HD1  ILE  10          3HD1      ILE  10  -1.722   5.683  -4.721
   90    H    ALA  11           H        ALA  11  -4.333   3.435  -7.617
   91    HA   ALA  11           HA       ALA  11  -6.386   3.889  -8.455
   92   1HB   ALA  11          1HB       ALA  11  -4.900   6.057  -9.985
   93   2HB   ALA  11          2HB       ALA  11  -6.629   6.026  -9.591
   94   3HB   ALA  11          3HB       ALA  11  -5.433   6.157  -8.291
   95    H    CYS  12           H        CYS  12  -4.741   1.929  -9.938
   96    HA   CYS  12           HA       CYS  12  -5.523   2.115 -12.712
   97   1HB   CYS  12          2HB       CYS  12  -3.534   1.019 -12.281
   98   2HB   CYS  12          3HB       CYS  12  -4.206   0.055 -10.955
   99    HG   CYS  12           HG       CYS  12  -4.774  -1.836 -12.330
  100    H    GLU  13           H        GLU  13  -6.438  -0.531 -10.412
  101    HA   GLU  13           HA       GLU  13  -9.275  -0.300 -11.230
  102   1HB   GLU  13          2HB       GLU  13  -9.320  -2.625 -12.026
  103   2HB   GLU  13          3HB       GLU  13  -8.285  -1.596 -13.010
  104   1HG   GLU  13          2HG       GLU  13  -6.694  -3.166 -12.807
  105   2HG   GLU  13          3HG       GLU  13  -6.480  -2.671 -11.120
  106    H    ALA  14           H        ALA  14  -7.789   0.048  -8.757
  107    HA   ALA  14           HA       ALA  14  -9.350  -1.667  -6.971
  108   1HB   ALA  14          1HB       ALA  14  -6.299  -1.893  -7.008
  109   2HB   ALA  14          2HB       ALA  14  -7.386  -2.603  -5.798
  110   3HB   ALA  14          3HB       ALA  14  -7.444  -3.168  -7.477
  111    H    CYS  15           H        CYS  15  -6.536   0.526  -7.278
  112    HA   CYS  15           HA       CYS  15  -6.147   2.541  -6.480
  113   1HB   CYS  15          2HB       CYS  15  -8.862   2.723  -6.321
  114   2HB   CYS  15          3HB       CYS  15  -8.473   2.707  -4.585
  115    HG   CYS  15           HG       CYS  15  -7.812   4.739  -7.013
  116    H    ALA  16           H        ALA  16  -5.096   3.378  -4.611
  117    HA   ALA  16           HA       ALA  16  -3.831   1.386  -3.061
  118   1HB   ALA  16          1HB       ALA  16  -2.825   3.549  -3.463
  119   2HB   ALA  16          2HB       ALA  16  -4.072   4.357  -2.479
  120   3HB   ALA  16          3HB       ALA  16  -2.917   3.229  -1.721
  121    H    GLU  17           H        GLU  17  -6.812   3.142  -2.377
  122    HA   GLU  17           HA       GLU  17  -7.185   2.530   0.305
  123   1HB   GLU  17          2HB       GLU  17  -8.977   2.934  -2.065
  124   2HB   GLU  17          3HB       GLU  17  -9.695   2.105  -0.683
  125   1HG   GLU  17          2HG       GLU  17  -8.170   4.729  -0.385
  126   2HG   GLU  17          3HG       GLU  17  -9.927   4.617  -0.597
  127    H    ALA  18           H        ALA  18  -7.427   0.290  -2.487
  128    HA   ALA  18           HA       ALA  18  -8.570  -1.906  -1.090
  129   1HB   ALA  18          1HB       ALA  18  -7.615  -3.267  -2.895
  130   2HB   ALA  18          2HB       ALA  18  -8.356  -1.790  -3.543
  131   3HB   ALA  18          3HB       ALA  18  -6.590  -1.914  -3.412
  132    H    VAL  19           H        VAL  19  -5.083  -1.088  -1.693
  133    HA   VAL  19           HA       VAL  19  -4.246  -3.326  -0.118
  134    HB   VAL  19           HB       VAL  19  -2.871  -2.057  -1.879
  135   1HG1  VAL  19          1HG1      VAL  19  -1.863  -0.654   0.657
  136   2HG1  VAL  19          2HG1      VAL  19  -1.107  -0.627  -0.938
  137   3HG1  VAL  19          3HG1      VAL  19  -2.677   0.149  -0.706
  138   1HG2  VAL  19          1HG2      VAL  19  -2.295  -4.140  -0.496
  139   2HG2  VAL  19          2HG2      VAL  19  -0.938  -3.141  -0.970
  140   3HG2  VAL  19          3HG2      VAL  19  -1.541  -3.048   0.677
  141    H    THR  20           H        THR  20  -4.877   0.075   0.594
  142    HA   THR  20           HA       THR  20  -3.873   0.270   3.218
  143    HB   THR  20           HB       THR  20  -6.407   1.490   2.056
  144    HG1  THR  20           1HG      THR  20  -4.544   2.056   0.946
  145   1HG2  THR  20          1HG2      THR  20  -6.160   3.209   3.774
  146   2HG2  THR  20          2HG2      THR  20  -6.590   1.637   4.440
  147   3HG2  THR  20          3HG2      THR  20  -4.920   2.203   4.580
  148    H    LYS  21           H        LYS  21  -7.126  -0.860   2.143
  149    HA   LYS  21           HA       LYS  21  -8.090  -1.507   4.744
  150   1HB   LYS  21          2HB       LYS  21  -8.725  -2.654   1.993
  151   2HB   LYS  21          3HB       LYS  21  -9.683  -3.009   3.436
  152   1HG   LYS  21          2HG       LYS  21  -9.103  -0.139   2.670
  153   2HG   LYS  21          3HG       LYS  21 -10.347  -1.034   1.797
  154   1HD   LYS  21          2HD       LYS  21 -11.754  -1.177   3.666
  155   2HD   LYS  21          3HD       LYS  21 -10.418  -1.155   4.811
  156   1HE   LYS  21          2HE       LYS  21 -11.736   0.896   4.987
  157   2HE   LYS  21          3HE       LYS  21 -10.057   1.225   4.541
  158   1HZ   LYS  21          1HZ       LYS  21 -10.727   1.715   2.321
  159   2HZ   LYS  21          2HZ       LYS  21 -12.272   1.177   2.576
  160   3HZ   LYS  21          3HZ       LYS  21 -11.644   2.530   3.272
  161    H    ALA  22           H        ALA  22  -6.412  -3.476   2.316
  162    HA   ALA  22           HA       ALA  22  -6.500  -5.952   3.765
  163   1HB   ALA  22          1HB       ALA  22  -5.895  -5.815   1.384
  164   2HB   ALA  22          2HB       ALA  22  -4.388  -4.969   1.812
  165   3HB   ALA  22          3HB       ALA  22  -4.634  -6.650   2.327
  166    H    VAL  23           H        VAL  23  -3.898  -3.539   3.556
  167    HA   VAL  23           HA       VAL  23  -2.091  -4.783   5.344
  168    HB   VAL  23           HB       VAL  23  -2.404  -1.883   4.493
  169   1HG1  VAL  23          1HG1      VAL  23   0.011  -3.342   5.685
  170   2HG1  VAL  23          2HG1      VAL  23   0.035  -1.703   5.021
  171   3HG1  VAL  23          3HG1      VAL  23  -0.902  -2.041   6.492
  172   1HG2  VAL  23          1HG2      VAL  23  -0.331  -3.843   3.447
  173   2HG2  VAL  23          2HG2      VAL  23  -1.929  -3.791   2.721
  174   3HG2  VAL  23          3HG2      VAL  23  -0.932  -2.324   2.749
  175    H    GLN  24           H        GLN  24  -4.661  -2.270   5.878
  176    HA   GLN  24           HA       GLN  24  -4.192  -1.995   8.675
  177   1HB   GLN  24          2HB       GLN  24  -6.658  -1.658   6.945
  178   2HB   GLN  24          3HB       GLN  24  -6.635  -1.259   8.661
  179   1HG   GLN  24          2HG       GLN  24  -4.450  -0.111   6.895
  180   2HG   GLN  24          3HG       GLN  24  -6.064   0.555   6.781
  181   1HE2  GLN  24          1HE2      GLN  24  -3.188   1.126   8.213
  182   2HE2  GLN  24          2HE2      GLN  24  -3.736   1.886   9.692
  183    H    ASN  25           H        ASN  25  -5.998  -4.513   6.828
  184    HA   ASN  25           HA       ASN  25  -7.418  -5.509   9.108
  185   1HB   ASN  25          2HB       ASN  25  -6.488  -7.000   6.618
  186   2HB   ASN  25          3HB       ASN  25  -7.491  -7.693   7.881
  187   1HD2  ASN  25          1HD2      ASN  25  -8.219  -7.385   5.082
  188   2HD2  ASN  25          2HD2      ASN  25  -9.666  -6.387   5.100
  189    H    GLU  26           H        GLU  26  -4.222  -6.476   7.765
  190    HA   GLU  26           HA       GLU  26  -3.657  -8.218  10.037
  191   1HB   GLU  26          2HB       GLU  26  -1.804  -7.069   7.907
  192   2HB   GLU  26          3HB       GLU  26  -1.400  -8.310   9.101
  193   1HG   GLU  26          2HG       GLU  26  -3.756  -9.300   7.928
  194   2HG   GLU  26          3HG       GLU  26  -2.903  -8.565   6.571
  195    H    ASP  27           H        ASP  27  -2.392  -5.060   8.993
  196    HA   ASP  27           HA       ASP  27  -1.072  -4.646  11.600
  197   1HB   ASP  27          2HB       ASP  27   0.177  -4.483   9.372
  198   2HB   ASP  27          3HB       ASP  27  -0.739  -3.030   9.021
  199    H    ALA  28           H        ALA  28  -3.351  -4.338  12.457
  200    HA   ALA  28           HA       ALA  28  -4.956  -2.119  11.517
  201   1HB   ALA  28          1HB       ALA  28  -6.409  -2.661  13.411
  202   2HB   ALA  28          2HB       ALA  28  -5.930  -4.143  12.561
  203   3HB   ALA  28          3HB       ALA  28  -5.157  -3.713  14.105
  204    H    GLN  29           H        GLN  29  -2.244  -2.248  13.553
  205    HA   GLN  29           HA       GLN  29  -2.945   0.188  15.055
  206   1HB   GLN  29          2HB       GLN  29  -0.804  -0.194  16.135
  207   2HB   GLN  29          3HB       GLN  29  -1.896  -1.564  16.290
  208   1HG   GLN  29          2HG       GLN  29  -0.604  -2.855  14.673
  209   2HG   GLN  29          3HG       GLN  29   0.349  -1.431  14.227
  210   1HE2  GLN  29          1HE2      GLN  29  -0.509  -3.348  17.192
  211   2HE2  GLN  29          2HE2      GLN  29   1.099  -3.214  17.885
  212    H    ALA  30           H        ALA  30  -1.677  -0.495  11.926
  213    HA   ALA  30           HA       ALA  30   0.341   1.618  11.985
  214   1HB   ALA  30          1HB       ALA  30   0.516   1.050   9.540
  215   2HB   ALA  30          2HB       ALA  30   0.782  -0.267  10.689
  216   3HB   ALA  30          3HB       ALA  30  -0.753  -0.165   9.786
  217    H    THR  31           H        THR  31   0.407   3.232  10.229
  218    HA   THR  31           HA       THR  31  -2.249   4.531   9.709
  219    HB   THR  31           HB       THR  31   0.424   5.749  10.470
  220    HG1  THR  31           1HG      THR  31  -1.013   4.849  12.118
  221   1HG2  THR  31          1HG2      THR  31  -2.184   7.148   9.745
  222   2HG2  THR  31          2HG2      THR  31  -0.753   7.928  10.440
  223   3HG2  THR  31          3HG2      THR  31  -0.664   7.226   8.823
  224    H    VAL  32           H        VAL  32  -2.454   5.380   7.605
  225    HA   VAL  32           HA       VAL  32  -0.272   4.713   5.676
  226    HB   VAL  32           HB       VAL  32  -1.990   4.342   4.028
  227   1HG1  VAL  32          1HG1      VAL  32  -1.184   2.506   5.684
  228   2HG1  VAL  32          2HG1      VAL  32  -2.771   2.655   6.439
  229   3HG1  VAL  32          3HG1      VAL  32  -2.640   2.175   4.733
  230   1HG2  VAL  32          1HG2      VAL  32  -4.137   4.539   6.186
  231   2HG2  VAL  32          2HG2      VAL  32  -3.786   5.871   5.073
  232   3HG2  VAL  32          3HG2      VAL  32  -4.323   4.346   4.432
  233    H    GLN  33           H        GLN  33   0.240   6.305   4.082
  234    HA   GLN  33           HA       GLN  33  -1.404   8.755   3.965
  235   1HB   GLN  33          2HB       GLN  33   1.572   8.631   4.648
  236   2HB   GLN  33          3HB       GLN  33   0.731  10.080   4.066
  237   1HG   GLN  33          2HG       GLN  33  -0.805   9.944   6.031
  238   2HG   GLN  33          3HG       GLN  33   0.117   8.563   6.647
  239   1HE2  GLN  33          1HE2      GLN  33   2.344   8.868   7.377
  240   2HE2  GLN  33          2HE2      GLN  33   2.849  10.492   7.818
  241    H    VAL  34           H        VAL  34  -2.066   7.965   1.929
  242    HA   VAL  34           HA       VAL  34   0.100   7.533  -0.072
  243    HB   VAL  34           HB       VAL  34  -1.111   5.560   0.098
  244   1HG1  VAL  34          1HG1      VAL  34  -3.685   7.142   0.028
  245   2HG1  VAL  34          2HG1      VAL  34  -3.577   5.391  -0.234
  246   3HG1  VAL  34          3HG1      VAL  34  -3.079   6.083   1.310
  247   1HG2  VAL  34          1HG2      VAL  34  -0.622   6.512  -2.194
  248   2HG2  VAL  34          2HG2      VAL  34  -1.872   5.283  -2.119
  249   3HG2  VAL  34          3HG2      VAL  34  -2.334   6.985  -2.289
  250    H    ASP  35           H        ASP  35   0.419   8.999  -1.607
  251    HA   ASP  35           HA       ASP  35  -1.477  11.277  -1.758
  252   1HB   ASP  35          2HB       ASP  35   1.163  10.766  -3.128
  253   2HB   ASP  35          3HB       ASP  35   0.199  12.230  -3.263
  254    H    LEU  36           H        LEU  36  -3.170   9.774  -2.531
  255    HA   LEU  36           HA       LEU  36  -3.188   8.467  -5.031
  256   1HB   LEU  36          2HB       LEU  36  -5.406  10.033  -3.631
  257   2HB   LEU  36          3HB       LEU  36  -5.614   9.165  -5.148
  258    HG   LEU  36           HG       LEU  36  -4.518   7.151  -3.692
  259   1HD1  LEU  36          1HD1      LEU  36  -5.576   7.108  -1.483
  260   2HD1  LEU  36          2HD1      LEU  36  -4.523   8.531  -1.591
  261   3HD1  LEU  36          3HD1      LEU  36  -6.276   8.718  -1.738
  262   1HD2  LEU  36          1HD2      LEU  36  -7.456   7.960  -3.770
  263   2HD2  LEU  36          2HD2      LEU  36  -6.569   7.110  -5.051
  264   3HD2  LEU  36          3HD2      LEU  36  -6.820   6.327  -3.471
  265    H    THR  37           H        THR  37  -3.192  11.928  -4.378
  266    HA   THR  37           HA       THR  37  -3.756  13.145  -6.750
  267    HB   THR  37           HB       THR  37  -1.310  13.605  -4.981
  268    HG1  THR  37           1HG      THR  37  -2.796  13.980  -3.536
  269   1HG2  THR  37          1HG2      THR  37  -2.895  15.491  -6.783
  270   2HG2  THR  37          2HG2      THR  37  -1.680  16.008  -5.593
  271   3HG2  THR  37          3HG2      THR  37  -1.193  15.011  -6.971
  272    H    SER  38           H        SER  38  -0.906  11.095  -6.075
  273    HA   SER  38           HA       SER  38  -0.109  11.288  -8.930
  274   1HB   SER  38          2HB       SER  38   1.816  11.454  -6.577
  275   2HB   SER  38          3HB       SER  38   2.225  11.479  -8.316
  276    HG   SER  38           HG       SER  38   0.650  13.370  -8.269
  277    H    LYS  39           H        LYS  39   2.117   9.447  -7.177
  278    HA   LYS  39           HA       LYS  39   0.564   6.985  -7.228
  279   1HB   LYS  39          2HB       LYS  39   1.677   5.989  -9.137
  280   2HB   LYS  39          3HB       LYS  39   0.784   7.419  -9.589
  281   1HG   LYS  39          2HG       LYS  39   3.102   8.672  -9.381
  282   2HG   LYS  39          3HG       LYS  39   3.774   7.034  -9.461
  283   1HD   LYS  39          2HD       LYS  39   2.201   6.741 -11.539
  284   2HD   LYS  39          3HD       LYS  39   1.990   8.495 -11.458
  285   1HE   LYS  39          2HE       LYS  39   4.486   8.774 -11.688
  286   2HE   LYS  39          3HE       LYS  39   4.659   7.013 -11.775
  287   1HZ   LYS  39          1HZ       LYS  39   3.310   7.053 -13.777
  288   2HZ   LYS  39          2HZ       LYS  39   3.218   8.694 -13.718
  289   3HZ   LYS  39          3HZ       LYS  39   4.669   7.960 -13.946
  290    H    LYS  40           H        LYS  40   1.702   8.020  -5.142
  291    HA   LYS  40           HA       LYS  40   4.100   6.383  -4.522
  292   1HB   LYS  40          2HB       LYS  40   5.043   8.355  -3.350
  293   2HB   LYS  40          3HB       LYS  40   4.847   8.635  -5.085
  294   1HG   LYS  40          2HG       LYS  40   2.516   9.671  -4.382
  295   2HG   LYS  40          3HG       LYS  40   3.226   9.784  -2.779
  296   1HD   LYS  40          2HD       LYS  40   4.526  10.874  -5.310
  297   2HD   LYS  40          3HD       LYS  40   3.274  11.781  -4.470
  298   1HE   LYS  40          2HE       LYS  40   5.760  10.818  -2.996
  299   2HE   LYS  40          3HE       LYS  40   5.753  12.336  -3.907
  300   1HZ   LYS  40          1HZ       LYS  40   3.972  13.136  -2.538
  301   2HZ   LYS  40          2HZ       LYS  40   3.826  11.749  -1.737
  302   3HZ   LYS  40          3HZ       LYS  40   5.191  12.643  -1.554
  303    H    VAL  41           H        VAL  41   3.956   5.451  -2.448
  304    HA   VAL  41           HA       VAL  41   1.594   6.220  -0.803
  305    HB   VAL  41           HB       VAL  41   1.016   4.256  -2.104
  306   1HG1  VAL  41          1HG1      VAL  41   3.299   3.286  -2.430
  307   2HG1  VAL  41          2HG1      VAL  41   3.292   2.802  -0.720
  308   3HG1  VAL  41          3HG1      VAL  41   2.115   2.108  -1.847
  309   1HG2  VAL  41          1HG2      VAL  41   1.311   2.848   0.454
  310   2HG2  VAL  41          2HG2      VAL  41   0.743   4.502   0.678
  311   3HG2  VAL  41          3HG2      VAL  41  -0.141   3.386  -0.389
  312    H    THR  42           H        THR  42   2.094   6.582   1.359
  313    HA   THR  42           HA       THR  42   4.810   5.735   2.249
  314    HB   THR  42           HB       THR  42   3.193   8.197   3.065
  315    HG1  THR  42           1HG      THR  42   4.037   8.426   1.029
  316   1HG2  THR  42          1HG2      THR  42   5.921   7.190   3.883
  317   2HG2  THR  42          2HG2      THR  42   5.312   8.829   4.198
  318   3HG2  THR  42          3HG2      THR  42   4.499   7.431   4.918
  319    H    ILE  43           H        ILE  43   4.423   3.945   3.499
  320    HA   ILE  43           HA       ILE  43   1.934   3.910   5.183
  321    HB   ILE  43           HB       ILE  43   3.790   1.681   4.352
  322   1HG1  ILE  43          2HG1      ILE  43   2.313   2.620   2.524
  323   2HG1  ILE  43          3HG1      ILE  43   2.149   0.917   2.877
  324   1HG2  ILE  43          1HG2      ILE  43   1.962   0.241   5.388
  325   2HG2  ILE  43          2HG2      ILE  43   2.936   1.179   6.525
  326   3HG2  ILE  43          3HG2      ILE  43   1.305   1.722   6.111
  327   1HD1  ILE  43          1HD1      ILE  43  -0.036   1.956   2.492
  328   2HD1  ILE  43          2HD1      ILE  43   0.073   1.318   4.132
  329   3HD1  ILE  43          3HD1      ILE  43   0.234   3.071   3.840
  330    H    THR  44           H        THR  44   2.137   4.302   7.329
  331    HA   THR  44           HA       THR  44   4.874   4.505   8.477
  332    HB   THR  44           HB       THR  44   2.231   5.643   9.401
  333    HG1  THR  44           1HG      THR  44   4.280   6.706   7.796
  334   1HG2  THR  44          1HG2      THR  44   3.880   5.422  11.221
  335   2HG2  THR  44          2HG2      THR  44   5.108   6.239  10.232
  336   3HG2  THR  44          3HG2      THR  44   3.669   7.125  10.777
  337    H    SER  45           H        SER  45   5.256   2.366   8.915
  338    HA   SER  45           HA       SER  45   3.933   1.165  11.224
  339   1HB   SER  45          2HB       SER  45   3.767  -1.049   9.995
  340   2HB   SER  45          3HB       SER  45   2.628   0.108   9.397
  341    HG   SER  45           HG       SER  45   5.190  -0.374   8.243
  342    H    ALA  46           H        ALA  46   5.269  -0.850  11.762
  343    HA   ALA  46           HA       ALA  46   8.085  -0.726  10.742
  344   1HB   ALA  46          1HB       ALA  46   6.944  -2.166  13.165
  345   2HB   ALA  46          2HB       ALA  46   8.638  -2.168  12.626
  346   3HB   ALA  46          3HB       ALA  46   7.889  -0.658  13.180
  347    H    LEU  47           H        LEU  47   5.195  -2.866  11.146
  348    HA   LEU  47           HA       LEU  47   6.764  -5.116  10.054
  349   1HB   LEU  47          2HB       LEU  47   5.106  -6.552  10.769
  350   2HB   LEU  47          3HB       LEU  47   5.246  -5.325  12.017
  351    HG   LEU  47           HG       LEU  47   3.211  -4.188  10.872
  352   1HD1  LEU  47          1HD1      LEU  47   3.241  -6.901   9.499
  353   2HD1  LEU  47          2HD1      LEU  47   1.691  -6.174   9.926
  354   3HD1  LEU  47          3HD1      LEU  47   2.769  -5.318   8.840
  355   1HD2  LEU  47          1HD2      LEU  47   3.132  -5.267  13.069
  356   2HD2  LEU  47          2HD2      LEU  47   1.649  -5.570  12.157
  357   3HD2  LEU  47          3HD2      LEU  47   2.876  -6.850  12.294
  358    H    GLY  48           H        GLY  48   4.398  -2.793   9.026
  359   1HA   GLY  48          2HA       GLY  48   3.208  -3.855   6.851
  360   2HA   GLY  48          3HA       GLY  48   3.696  -2.176   6.929
  361    H    GLU  49           H        GLU  49   6.686  -2.865   6.991
  362    HA   GLU  49           HA       GLU  49   7.271  -2.644   4.315
  363   1HB   GLU  49          2HB       GLU  49   8.812  -2.425   6.352
  364   2HB   GLU  49          3HB       GLU  49   8.943  -4.188   6.358
  365   1HG   GLU  49          2HG       GLU  49   9.748  -4.008   3.933
  366   2HG   GLU  49          3HG       GLU  49   9.792  -2.251   4.175
  367    H    GLU  50           H        GLU  50   7.282  -5.727   6.148
  368    HA   GLU  50           HA       GLU  50   7.580  -7.355   3.783
  369   1HB   GLU  50          2HB       GLU  50   8.037  -7.636   6.507
  370   2HB   GLU  50          3HB       GLU  50   6.555  -8.572   6.335
  371   1HG   GLU  50          2HG       GLU  50   8.811  -9.050   4.375
  372   2HG   GLU  50          3HG       GLU  50   9.029  -9.550   6.047
  373    H    GLN  51           H        GLN  51   4.872  -6.630   6.021
  374    HA   GLN  51           HA       GLN  51   3.013  -8.350   4.917
  375   1HB   GLN  51          2HB       GLN  51   2.974  -6.806   7.019
  376   2HB   GLN  51          3HB       GLN  51   2.193  -5.619   5.960
  377   1HG   GLN  51          2HG       GLN  51   1.261  -8.464   6.511
  378   2HG   GLN  51          3HG       GLN  51   0.611  -7.012   7.281
  379   1HE2  GLN  51          1HE2      GLN  51  -0.691  -9.081   5.513
  380   2HE2  GLN  51          2HE2      GLN  51  -1.405  -8.170   4.184
  381    H    LEU  52           H        LEU  52   3.613  -4.944   3.993
  382    HA   LEU  52           HA       LEU  52   1.761  -4.578   1.957
  383   1HB   LEU  52          2HB       LEU  52   4.619  -3.602   2.315
  384   2HB   LEU  52          3HB       LEU  52   3.612  -3.033   0.999
  385    HG   LEU  52           HG       LEU  52   2.567  -2.833   3.825
  386   1HD1  LEU  52          1HD1      LEU  52   3.596  -0.730   4.153
  387   2HD1  LEU  52          2HD1      LEU  52   4.902  -1.756   3.567
  388   3HD1  LEU  52          3HD1      LEU  52   4.133  -0.608   2.465
  389   1HD2  LEU  52          1HD2      LEU  52   1.174  -1.116   2.890
  390   2HD2  LEU  52          2HD2      LEU  52   2.104  -1.077   1.374
  391   3HD2  LEU  52          3HD2      LEU  52   1.104  -2.479   1.763
  392    H    ARG  53           H        ARG  53   4.950  -6.249   1.828
  393    HA   ARG  53           HA       ARG  53   5.091  -6.375  -1.007
  394   1HB   ARG  53          2HB       ARG  53   6.705  -7.239   1.089
  395   2HB   ARG  53          3HB       ARG  53   6.059  -8.768   0.509
  396   1HG   ARG  53          2HG       ARG  53   8.035  -8.456  -0.712
  397   2HG   ARG  53          3HG       ARG  53   6.782  -7.949  -1.856
  398   1HD   ARG  53          2HD       ARG  53   7.148  -5.555  -1.088
  399   2HD   ARG  53          3HD       ARG  53   8.463  -6.090  -0.066
  400    HE   ARG  53           HE       ARG  53   8.459  -5.595  -2.919
  401   1HH1  ARG  53          2HH2      ARG  53  10.000  -7.574  -0.461
  402   2HH1  ARG  53          1HH2      ARG  53  11.514  -7.751  -1.295
  403   1HH2  ARG  53          2HH1      ARG  53  10.465  -5.711  -4.043
  404   2HH2  ARG  53          1HH1      ARG  53  11.752  -6.698  -3.437
  405    H    THR  54           H        THR  54   3.714  -8.663   1.373
  406    HA   THR  54           HA       THR  54   2.647 -10.410  -0.615
  407    HB   THR  54           HB       THR  54   1.928 -10.114   2.330
  408    HG1  THR  54           1HG      THR  54   3.711 -11.332   2.647
  409   1HG2  THR  54          1HG2      THR  54   1.410 -12.554   2.140
  410   2HG2  THR  54          2HG2      THR  54   0.325 -11.579   1.132
  411   3HG2  THR  54          3HG2      THR  54   1.675 -12.465   0.386
  412    H    ALA  55           H        ALA  55   1.110  -7.852   1.392
  413    HA   ALA  55           HA       ALA  55  -1.554  -8.305   0.490
  414   1HB   ALA  55          1HB       ALA  55  -0.259  -5.784   1.606
  415   2HB   ALA  55          2HB       ALA  55  -2.005  -6.022   1.365
  416   3HB   ALA  55          3HB       ALA  55  -1.124  -7.050   2.501
  417    H    ILE  56           H        ILE  56   0.797  -5.764  -0.519
  418    HA   ILE  56           HA       ILE  56  -0.618  -4.805  -2.759
  419    HB   ILE  56           HB       ILE  56   2.401  -5.154  -2.548
  420   1HG1  ILE  56          2HG1      ILE  56   0.812  -2.592  -2.041
  421   2HG1  ILE  56          3HG1      ILE  56   1.277  -3.656  -0.709
  422   1HG2  ILE  56          1HG2      ILE  56   2.476  -3.428  -4.255
  423   2HG2  ILE  56          2HG2      ILE  56   1.473  -4.730  -4.862
  424   3HG2  ILE  56          3HG2      ILE  56   0.703  -3.265  -4.205
  425   1HD1  ILE  56          1HD1      ILE  56   2.852  -1.870  -0.883
  426   2HD1  ILE  56          2HD1      ILE  56   3.677  -3.357  -1.404
  427   3HD1  ILE  56          3HD1      ILE  56   3.135  -2.155  -2.597
  428    H    ALA  57           H        ALA  57   1.783  -7.583  -2.668
  429    HA   ALA  57           HA       ALA  57   1.476  -8.292  -5.356
  430   1HB   ALA  57          1HB       ALA  57   3.217  -9.251  -3.952
  431   2HB   ALA  57          2HB       ALA  57   2.001 -10.139  -2.998
  432   3HB   ALA  57          3HB       ALA  57   2.255 -10.530  -4.708
  433    H    SER  58           H        SER  58  -0.647  -9.153  -2.615
  434    HA   SER  58           HA       SER  58  -2.235 -11.071  -3.906
  435   1HB   SER  58          2HB       SER  58  -2.305 -10.354  -1.446
  436   2HB   SER  58          3HB       SER  58  -3.349  -9.014  -1.966
  437    HG   SER  58           HG       SER  58  -4.658 -10.731  -2.990
  438    H    ALA  59           H        ALA  59  -2.261  -7.535  -4.263
  439    HA   ALA  59           HA       ALA  59  -4.662  -7.617  -6.027
  440   1HB   ALA  59          1HB       ALA  59  -4.257  -5.159  -6.157
  441   2HB   ALA  59          2HB       ALA  59  -4.559  -5.753  -4.510
  442   3HB   ALA  59          3HB       ALA  59  -2.908  -5.363  -5.016
  443    H    GLY  60           H        GLY  60  -1.134  -7.203  -6.094
  444   1HA   GLY  60          2HA       GLY  60   0.311  -7.854  -7.787
  445   2HA   GLY  60          3HA       GLY  60  -1.048  -8.085  -8.895
  446    H    HIS  61           H        HIS  61   0.509  -5.415  -7.045
  447    HA   HIS  61           HA       HIS  61   0.111  -3.581  -9.351
  448   1HB   HIS  61          2HB       HIS  61   1.026  -3.075  -6.515
  449   2HB   HIS  61          3HB       HIS  61   0.906  -1.840  -7.753
  450    HD1  HIS  61           1HD      HIS  61  -1.578  -0.916  -8.264
  451    HD2  HIS  61           2HD      HIS  61  -1.197  -3.892  -5.320
  452    HE1  HIS  61           1HE      HIS  61  -3.706  -0.838  -6.868
  453    H    GLU  62           H        GLU  62   1.826  -2.638 -10.386
  454    HA   GLU  62           HA       GLU  62   4.336  -4.004 -10.539
  455   1HB   GLU  62          2HB       GLU  62   3.365  -1.426 -11.869
  456   2HB   GLU  62          3HB       GLU  62   4.675  -2.474 -12.421
  457   1HG   GLU  62          2HG       GLU  62   1.723  -3.312 -12.326
  458   2HG   GLU  62          3HG       GLU  62   2.577  -2.698 -13.736
  459    H    VAL  63           H        VAL  63   4.367  -3.214  -8.065
  460    HA   VAL  63           HA       VAL  63   5.614  -0.552  -7.707
  461    HB   VAL  63           HB       VAL  63   5.385  -2.748  -5.614
  462   1HG1  VAL  63          1HG1      VAL  63   6.800  -0.722  -5.075
  463   2HG1  VAL  63          2HG1      VAL  63   5.361   0.287  -5.336
  464   3HG1  VAL  63          3HG1      VAL  63   5.386  -0.913  -4.034
  465   1HG2  VAL  63          1HG2      VAL  63   3.312  -0.797  -6.632
  466   2HG2  VAL  63          2HG2      VAL  63   3.164  -2.542  -6.350
  467   3HG2  VAL  63          3HG2      VAL  63   3.246  -1.423  -4.975
  468    H    GLU  64           H        GLU  64   7.794  -0.195  -7.320
  469    HA   GLU  64           HA       GLU  64   9.697  -2.439  -7.744
  470   1HB   GLU  64          2HB       GLU  64   9.751  -0.020  -8.910
  471   2HB   GLU  64          3HB       GLU  64  10.477   0.447  -7.367
  472   1HG   GLU  64          2HG       GLU  64  12.319  -0.070  -8.728
  473   2HG   GLU  64          3HG       GLU  64  12.106  -1.569  -7.812
  Start of MODEL   13
    1   1H    MET   1           H1       MET   1   9.613   5.428  11.782
    2   2H    MET   1           H2       MET   1  11.267   5.592  11.904
    3   3H    MET   1           H3       MET   1  10.368   6.636  10.978
    4    HA   MET   1           HA       MET   1  11.341   5.123   9.464
    5   1HB   MET   1          2HB       MET   1  10.170   3.074  11.397
    6   2HB   MET   1          3HB       MET   1  10.664   2.658   9.753
    7   1HG   MET   1          2HG       MET   1  12.951   3.191  10.174
    8   2HG   MET   1          3HG       MET   1  12.582   3.955  11.727
    9   1HE   MET   1          1HE       MET   1  14.549   2.685  12.840
   10   2HE   MET   1          2HE       MET   1  14.724   0.915  12.812
   11   3HE   MET   1          3HE       MET   1  14.922   1.847  11.311
   12    H    THR   2           H        THR   2  10.043   4.756   7.559
   13    HA   THR   2           HA       THR   2   7.301   4.055   7.797
   14    HB   THR   2           HB       THR   2   7.265   6.599   8.177
   15    HG1  THR   2           1HG      THR   2   5.780   5.086   6.490
   16   1HG2  THR   2          1HG2      THR   2   7.482   8.065   6.260
   17   2HG2  THR   2          2HG2      THR   2   9.025   7.226   6.512
   18   3HG2  THR   2          3HG2      THR   2   7.936   6.723   5.203
   19    H    ILE   3           H        ILE   3   6.664   3.164   5.762
   20    HA   ILE   3           HA       ILE   3   8.980   2.544   4.028
   21    HB   ILE   3           HB       ILE   3   6.259   1.220   4.210
   22   1HG1  ILE   3          2HG1      ILE   3   7.135   1.052   6.436
   23   2HG1  ILE   3          3HG1      ILE   3   7.321  -0.485   5.622
   24   1HG2  ILE   3          1HG2      ILE   3   8.941   0.253   3.138
   25   2HG2  ILE   3          2HG2      ILE   3   7.418  -0.662   3.183
   26   3HG2  ILE   3          3HG2      ILE   3   7.550   0.784   2.181
   27   1HD1  ILE   3          1HD1      ILE   3   9.569   1.515   6.083
   28   2HD1  ILE   3          2HD1      ILE   3   9.276   0.017   6.975
   29   3HD1  ILE   3          3HD1      ILE   3   9.733  -0.056   5.267
   30    H    GLN   4           H        GLN   4   9.143   3.967   2.400
   31    HA   GLN   4           HA       GLN   4   6.748   5.017   1.007
   32   1HB   GLN   4          2HB       GLN   4   9.473   6.029   1.570
   33   2HB   GLN   4          3HB       GLN   4   9.022   6.187  -0.136
   34   1HG   GLN   4          2HG       GLN   4   6.976   7.303   0.397
   35   2HG   GLN   4          3HG       GLN   4   7.242   7.065   2.144
   36   1HE2  GLN   4          1HE2      GLN   4   6.693   9.500   1.718
   37   2HE2  GLN   4          2HE2      GLN   4   8.114  10.544   1.617
   38    H    LEU   5           H        LEU   5   6.050   3.637  -0.523
   39    HA   LEU   5           HA       LEU   5   8.089   2.311  -2.300
   40   1HB   LEU   5          2HB       LEU   5   5.210   1.454  -1.948
   41   2HB   LEU   5          3HB       LEU   5   6.518   0.622  -2.789
   42    HG   LEU   5           HG       LEU   5   6.307   1.064   0.221
   43   1HD1  LEU   5          1HD1      LEU   5   6.066  -1.450  -1.476
   44   2HD1  LEU   5          2HD1      LEU   5   6.004  -1.372   0.299
   45   3HD1  LEU   5          3HD1      LEU   5   4.735  -0.591  -0.667
   46   1HD2  LEU   5          1HD2      LEU   5   8.290  -0.519   0.278
   47   2HD2  LEU   5          2HD2      LEU   5   8.444  -0.309  -1.478
   48   3HD2  LEU   5          3HD2      LEU   5   8.655   1.077  -0.383
   49    H    THR   6           H        THR   6   7.679   2.264  -4.569
   50    HA   THR   6           HA       THR   6   6.087   4.612  -5.531
   51    HB   THR   6           HB       THR   6   8.463   3.161  -6.745
   52    HG1  THR   6           1HG      THR   6   8.314   4.957  -4.854
   53   1HG2  THR   6          1HG2      THR   6   8.470   5.074  -8.327
   54   2HG2  THR   6          2HG2      THR   6   6.982   4.129  -8.497
   55   3HG2  THR   6          3HG2      THR   6   6.958   5.677  -7.614
   56    H    VAL   7           H        VAL   7   4.128   3.931  -6.113
   57    HA   VAL   7           HA       VAL   7   3.735   1.274  -7.442
   58    HB   VAL   7           HB       VAL   7   2.723   1.212  -5.375
   59   1HG1  VAL   7          1HG1      VAL   7   1.059   2.805  -4.520
   60   2HG1  VAL   7          2HG1      VAL   7   2.670   3.509  -4.645
   61   3HG1  VAL   7          3HG1      VAL   7   1.445   3.915  -5.850
   62   1HG2  VAL   7          1HG2      VAL   7   0.461   0.756  -5.860
   63   2HG2  VAL   7          2HG2      VAL   7   0.441   1.856  -7.242
   64   3HG2  VAL   7          3HG2      VAL   7   1.395   0.376  -7.318
   65    HA   PRO   8           HA       PRO   8   3.262   4.699 -10.473
   66   1HB   PRO   8          2HB       PRO   8   3.723   3.261 -12.773
   67   2HB   PRO   8          3HB       PRO   8   5.014   3.912 -11.722
   68   1HG   PRO   8          2HG       PRO   8   3.890   1.102 -11.726
   69   2HG   PRO   8          3HG       PRO   8   5.604   1.603 -11.718
   70   1HD   PRO   8          2HD       PRO   8   4.307   0.901  -9.461
   71   2HD   PRO   8          3HD       PRO   8   5.514   2.209  -9.451
   72    H    THR   9           H        THR   9   1.852   1.440 -10.474
   73    HA   THR   9           HA       THR   9  -0.377   2.202 -12.162
   74    HB   THR   9           HB       THR   9   0.770  -0.024 -12.192
   75    HG1  THR   9           1HG      THR   9  -1.998   0.082 -11.597
   76   1HG2  THR   9          1HG2      THR   9  -0.722  -0.472  -9.579
   77   2HG2  THR   9          2HG2      THR   9   0.075  -1.695 -10.547
   78   3HG2  THR   9          3HG2      THR   9   1.050  -0.427  -9.780
   79    H    ILE  10           H        ILE  10   0.017   3.261  -9.019
   80    HA   ILE  10           HA       ILE  10  -2.326   2.652  -7.766
   81    HB   ILE  10           HB       ILE  10  -0.426   4.858  -7.782
   82   1HG1  ILE  10          2HG1      ILE  10  -2.496   3.842  -5.830
   83   2HG1  ILE  10          3HG1      ILE  10  -0.861   3.244  -5.997
   84   1HG2  ILE  10          1HG2      ILE  10  -1.811   6.725  -7.079
   85   2HG2  ILE  10          2HG2      ILE  10  -2.278   6.227  -8.706
   86   3HG2  ILE  10          3HG2      ILE  10  -3.283   5.765  -7.309
   87   1HD1  ILE  10          1HD1      ILE  10  -1.746   5.945  -4.900
   88   2HD1  ILE  10          2HD1      ILE  10  -0.803   4.680  -4.095
   89   3HD1  ILE  10          3HD1      ILE  10  -0.066   5.636  -5.388
   90    H    ALA  11           H        ALA  11  -4.426   3.506  -7.661
   91    HA   ALA  11           HA       ALA  11  -6.442   4.083  -8.456
   92   1HB   ALA  11          1HB       ALA  11  -6.630   6.188  -9.652
   93   2HB   ALA  11          2HB       ALA  11  -5.412   6.309  -8.372
   94   3HB   ALA  11          3HB       ALA  11  -4.907   6.149 -10.073
   95    H    CYS  12           H        CYS  12  -4.521   2.320 -10.320
   96    HA   CYS  12           HA       CYS  12  -5.476   2.228 -12.901
   97   1HB   CYS  12          2HB       CYS  12  -3.751   0.834 -12.216
   98   2HB   CYS  12          3HB       CYS  12  -4.658   0.157 -10.855
   99    HG   CYS  12           HG       CYS  12  -6.482  -1.064 -12.434
  100    H    GLU  13           H        GLU  13  -6.905   0.525 -10.119
  101    HA   GLU  13           HA       GLU  13  -9.617   1.130 -10.911
  102   1HB   GLU  13          2HB       GLU  13  -8.500  -1.582 -11.530
  103   2HB   GLU  13          3HB       GLU  13  -9.986  -1.601 -10.576
  104   1HG   GLU  13          2HG       GLU  13 -11.156  -0.247 -12.217
  105   2HG   GLU  13          3HG       GLU  13  -9.701  -0.150 -13.224
  106    H    ALA  14           H        ALA  14  -7.944  -1.419  -9.071
  107    HA   ALA  14           HA       ALA  14  -9.551  -1.501  -6.863
  108   1HB   ALA  14          1HB       ALA  14  -7.750  -3.109  -7.365
  109   2HB   ALA  14          2HB       ALA  14  -6.527  -1.900  -6.911
  110   3HB   ALA  14          3HB       ALA  14  -7.648  -2.536  -5.691
  111    H    CYS  15           H        CYS  15  -6.817   0.724  -7.339
  112    HA   CYS  15           HA       CYS  15  -6.151   2.583  -6.364
  113   1HB   CYS  15          2HB       CYS  15  -8.704   2.622  -4.680
  114   2HB   CYS  15          3HB       CYS  15  -7.496   3.899  -4.808
  115    HG   CYS  15           HG       CYS  15  -9.341   2.607  -7.198
  116    H    ALA  16           H        ALA  16  -4.939   3.221  -4.591
  117    HA   ALA  16           HA       ALA  16  -3.852   1.150  -2.999
  118   1HB   ALA  16          1HB       ALA  16  -2.616   3.165  -3.508
  119   2HB   ALA  16          2HB       ALA  16  -3.798   4.143  -2.590
  120   3HB   ALA  16          3HB       ALA  16  -2.745   2.973  -1.747
  121    H    GLU  17           H        GLU  17  -6.744   3.119  -2.342
  122    HA   GLU  17           HA       GLU  17  -6.976   2.562   0.392
  123   1HB   GLU  17          2HB       GLU  17  -8.994   3.005  -1.794
  124   2HB   GLU  17          3HB       GLU  17  -9.536   2.118  -0.374
  125   1HG   GLU  17          2HG       GLU  17  -8.491   4.007   1.053
  126   2HG   GLU  17          3HG       GLU  17  -8.478   4.943  -0.447
  127    H    ALA  18           H        ALA  18  -7.413   0.334  -2.407
  128    HA   ALA  18           HA       ALA  18  -8.540  -1.824  -0.965
  129   1HB   ALA  18          1HB       ALA  18  -6.633  -1.930  -3.343
  130   2HB   ALA  18          2HB       ALA  18  -7.720  -3.220  -2.789
  131   3HB   ALA  18          3HB       ALA  18  -8.394  -1.707  -3.427
  132    H    VAL  19           H        VAL  19  -5.045  -1.131  -1.685
  133    HA   VAL  19           HA       VAL  19  -4.214  -3.390  -0.155
  134    HB   VAL  19           HB       VAL  19  -2.803  -2.090  -1.892
  135   1HG1  VAL  19          1HG1      VAL  19  -2.651   0.095  -0.639
  136   2HG1  VAL  19          2HG1      VAL  19  -1.769  -0.752   0.657
  137   3HG1  VAL  19          3HG1      VAL  19  -1.088  -0.651  -0.973
  138   1HG2  VAL  19          1HG2      VAL  19  -0.753  -2.933  -0.439
  139   2HG2  VAL  19          2HG2      VAL  19  -1.974  -3.468   0.678
  140   3HG2  VAL  19          3HG2      VAL  19  -1.985  -4.106  -0.972
  141    H    THR  20           H        THR  20  -4.695   0.036   0.660
  142    HA   THR  20           HA       THR  20  -3.755   0.093   3.304
  143    HB   THR  20           HB       THR  20  -6.233   1.410   2.132
  144    HG1  THR  20           1HG      THR  20  -4.370   2.004   1.087
  145   1HG2  THR  20          1HG2      THR  20  -6.512   1.471   4.498
  146   2HG2  THR  20          2HG2      THR  20  -4.845   2.023   4.733
  147   3HG2  THR  20          3HG2      THR  20  -6.034   3.060   3.903
  148    H    LYS  21           H        LYS  21  -7.079  -0.854   2.200
  149    HA   LYS  21           HA       LYS  21  -7.942  -1.530   4.833
  150   1HB   LYS  21          2HB       LYS  21  -9.077  -2.762   2.314
  151   2HB   LYS  21          3HB       LYS  21  -9.895  -2.470   3.855
  152   1HG   LYS  21          2HG       LYS  21  -8.877   0.052   2.910
  153   2HG   LYS  21          3HG       LYS  21  -9.615  -0.792   1.535
  154   1HD   LYS  21          2HD       LYS  21 -11.761  -0.860   2.744
  155   2HD   LYS  21          3HD       LYS  21 -10.990  -0.058   4.147
  156   1HE   LYS  21          2HE       LYS  21 -10.202   1.795   2.601
  157   2HE   LYS  21          3HE       LYS  21 -11.052   1.020   1.261
  158   1HZ   LYS  21          1HZ       LYS  21 -12.096   2.853   2.107
  159   2HZ   LYS  21          2HZ       LYS  21 -13.106   1.556   2.330
  160   3HZ   LYS  21          3HZ       LYS  21 -12.304   2.233   3.625
  161    H    ALA  22           H        ALA  22  -6.443  -3.455   2.217
  162    HA   ALA  22           HA       ALA  22  -6.751  -5.998   3.395
  163   1HB   ALA  22          1HB       ALA  22  -4.487  -5.021   1.639
  164   2HB   ALA  22          2HB       ALA  22  -4.892  -6.707   2.016
  165   3HB   ALA  22          3HB       ALA  22  -6.040  -5.704   1.092
  166    H    VAL  23           H        VAL  23  -3.932  -3.805   3.491
  167    HA   VAL  23           HA       VAL  23  -2.309  -5.372   5.221
  168    HB   VAL  23           HB       VAL  23  -2.310  -2.418   4.489
  169   1HG1  VAL  23          1HG1      VAL  23  -0.088  -4.077   5.770
  170   2HG1  VAL  23          2HG1      VAL  23   0.094  -2.437   5.134
  171   3HG1  VAL  23          3HG1      VAL  23  -0.937  -2.718   6.556
  172   1HG2  VAL  23          1HG2      VAL  23  -0.668  -3.018   2.851
  173   2HG2  VAL  23          2HG2      VAL  23  -0.457  -4.644   3.533
  174   3HG2  VAL  23          3HG2      VAL  23  -1.946  -4.234   2.683
  175    H    GLN  24           H        GLN  24  -4.567  -2.632   5.848
  176    HA   GLN  24           HA       GLN  24  -4.215  -2.434   8.626
  177   1HB   GLN  24          2HB       GLN  24  -6.625  -1.992   6.852
  178   2HB   GLN  24          3HB       GLN  24  -6.617  -1.581   8.561
  179   1HG   GLN  24          2HG       GLN  24  -4.358  -0.511   6.859
  180   2HG   GLN  24          3HG       GLN  24  -5.963   0.181   6.653
  181   1HE2  GLN  24          1HE2      GLN  24  -3.185   0.919   8.073
  182   2HE2  GLN  24          2HE2      GLN  24  -3.777   1.726   9.515
  183    H    ASN  25           H        ASN  25  -5.705  -5.170   6.851
  184    HA   ASN  25           HA       ASN  25  -7.357  -6.036   9.051
  185   1HB   ASN  25          2HB       ASN  25  -5.796  -7.730   7.056
  186   2HB   ASN  25          3HB       ASN  25  -6.949  -8.342   8.232
  187   1HD2  ASN  25          1HD2      ASN  25  -6.642  -7.265   5.102
  188   2HD2  ASN  25          2HD2      ASN  25  -8.369  -7.116   4.730
  189    H    GLU  26           H        GLU  26  -3.870  -6.672   8.254
  190    HA   GLU  26           HA       GLU  26  -3.427  -8.088  10.772
  191   1HB   GLU  26          2HB       GLU  26  -1.651  -7.083   8.540
  192   2HB   GLU  26          3HB       GLU  26  -1.092  -8.094   9.888
  193   1HG   GLU  26          2HG       GLU  26  -3.407  -9.151   8.251
  194   2HG   GLU  26          3HG       GLU  26  -1.837  -9.042   7.454
  195    H    ASP  27           H        ASP  27  -2.257  -5.070   9.205
  196    HA   ASP  27           HA       ASP  27  -1.141  -4.171  11.760
  197   1HB   ASP  27          2HB       ASP  27  -0.146  -4.002   9.248
  198   2HB   ASP  27          3HB       ASP  27  -0.939  -2.469   9.267
  199    H    ALA  28           H        ALA  28  -3.501  -4.199  12.466
  200    HA   ALA  28           HA       ALA  28  -5.366  -2.254  11.478
  201   1HB   ALA  28          1HB       ALA  28  -5.251  -3.642  14.187
  202   2HB   ALA  28          2HB       ALA  28  -6.667  -2.829  13.480
  203   3HB   ALA  28          3HB       ALA  28  -6.006  -4.289  12.711
  204    H    GLN  29           H        GLN  29  -2.667  -1.974  13.547
  205    HA   GLN  29           HA       GLN  29  -3.455   0.641  14.680
  206   1HB   GLN  29          2HB       GLN  29  -1.294   0.319  15.893
  207   2HB   GLN  29          3HB       GLN  29  -2.519  -0.893  16.260
  208   1HG   GLN  29          2HG       GLN  29  -1.364  -2.600  15.156
  209   2HG   GLN  29          3HG       GLN  29  -0.551  -1.475  14.056
  210   1HE2  GLN  29          1HE2      GLN  29   1.563  -1.875  14.342
  211   2HE2  GLN  29          2HE2      GLN  29   2.384  -1.773  15.905
  212    H    ALA  30           H        ALA  30  -2.279  -0.240  11.667
  213    HA   ALA  30           HA       ALA  30   0.069   1.484  11.606
  214   1HB   ALA  30          1HB       ALA  30  -1.564   0.183   9.384
  215   2HB   ALA  30          2HB       ALA  30  -0.042   1.065   9.148
  216   3HB   ALA  30          3HB       ALA  30  -0.069  -0.412  10.107
  217    H    THR  31           H        THR  31   0.286   3.414  10.373
  218    HA   THR  31           HA       THR  31  -2.259   4.893   9.770
  219    HB   THR  31           HB       THR  31   0.484   5.985  10.465
  220    HG1  THR  31           1HG      THR  31  -0.795   5.003  12.187
  221   1HG2  THR  31          1HG2      THR  31  -0.812   7.497   8.963
  222   2HG2  THR  31          2HG2      THR  31  -2.199   7.391  10.074
  223   3HG2  THR  31          3HG2      THR  31  -0.688   8.157  10.603
  224    H    VAL  32           H        VAL  32  -2.454   5.567   7.636
  225    HA   VAL  32           HA       VAL  32  -0.257   4.817   5.752
  226    HB   VAL  32           HB       VAL  32  -1.949   4.425   4.092
  227   1HG1  VAL  32          1HG1      VAL  32  -2.651   2.317   4.847
  228   2HG1  VAL  32          2HG1      VAL  32  -1.248   2.647   5.867
  229   3HG1  VAL  32          3HG1      VAL  32  -2.876   2.864   6.524
  230   1HG2  VAL  32          1HG2      VAL  32  -4.051   4.985   6.244
  231   2HG2  VAL  32          2HG2      VAL  32  -3.718   6.012   4.833
  232   3HG2  VAL  32          3HG2      VAL  32  -4.346   4.388   4.603
  233    H    GLN  33           H        GLN  33   0.248   6.337   4.096
  234    HA   GLN  33           HA       GLN  33  -1.249   8.894   4.025
  235   1HB   GLN  33          2HB       GLN  33   1.752   8.609   4.529
  236   2HB   GLN  33          3HB       GLN  33   0.920  10.104   4.072
  237   1HG   GLN  33          2HG       GLN  33  -0.510   9.843   6.147
  238   2HG   GLN  33          3HG       GLN  33   0.551   8.509   6.643
  239   1HE2  GLN  33          1HE2      GLN  33   0.012  11.449   7.633
  240   2HE2  GLN  33          2HE2      GLN  33   1.649  12.039   7.864
  241    H    VAL  34           H        VAL  34  -1.982   7.654   2.083
  242    HA   VAL  34           HA       VAL  34   0.082   7.316   0.006
  243    HB   VAL  34           HB       VAL  34  -1.474   5.507   0.315
  244   1HG1  VAL  34          1HG1      VAL  34  -3.515   6.695   1.041
  245   2HG1  VAL  34          2HG1      VAL  34  -3.697   7.376  -0.588
  246   3HG1  VAL  34          3HG1      VAL  34  -3.814   5.629  -0.337
  247   1HG2  VAL  34          1HG2      VAL  34  -0.440   6.075  -1.913
  248   2HG2  VAL  34          2HG2      VAL  34  -1.948   5.191  -2.025
  249   3HG2  VAL  34          3HG2      VAL  34  -1.930   6.928  -2.349
  250    H    ASP  35           H        ASP  35   0.391   8.639  -1.694
  251    HA   ASP  35           HA       ASP  35  -1.283  11.112  -1.887
  252   1HB   ASP  35          2HB       ASP  35   1.522  10.352  -2.490
  253   2HB   ASP  35          3HB       ASP  35   0.752  11.486  -3.623
  254    H    LEU  36           H        LEU  36  -3.031   9.730  -2.671
  255    HA   LEU  36           HA       LEU  36  -3.036   8.486  -5.252
  256   1HB   LEU  36          2HB       LEU  36  -5.196   9.961  -3.707
  257   2HB   LEU  36          3HB       LEU  36  -5.501   9.100  -5.215
  258    HG   LEU  36           HG       LEU  36  -4.057   7.450  -3.222
  259   1HD1  LEU  36          1HD1      LEU  36  -6.037   7.059  -1.808
  260   2HD1  LEU  36          2HD1      LEU  36  -5.463   8.731  -1.667
  261   3HD1  LEU  36          3HD1      LEU  36  -6.903   8.368  -2.644
  262   1HD2  LEU  36          1HD2      LEU  36  -5.703   5.785  -3.940
  263   2HD2  LEU  36          2HD2      LEU  36  -6.633   7.028  -4.797
  264   3HD2  LEU  36          3HD2      LEU  36  -5.005   6.592  -5.361
  265    H    THR  37           H        THR  37  -2.902  11.879  -4.284
  266    HA   THR  37           HA       THR  37  -3.447  13.289  -6.572
  267    HB   THR  37           HB       THR  37  -1.045  13.616  -4.721
  268    HG1  THR  37           1HG      THR  37  -3.751  14.349  -4.266
  269   1HG2  THR  37          1HG2      THR  37  -2.859  15.665  -6.097
  270   2HG2  THR  37          2HG2      THR  37  -1.579  16.039  -4.923
  271   3HG2  THR  37          3HG2      THR  37  -1.159  15.336  -6.491
  272    H    SER  38           H        SER  38  -0.828  10.916  -6.140
  273    HA   SER  38           HA       SER  38  -0.146  11.315  -8.951
  274   1HB   SER  38          2HB       SER  38   1.999  11.503  -6.792
  275   2HB   SER  38          3HB       SER  38   2.271  11.421  -8.553
  276    HG   SER  38           HG       SER  38   0.535  13.350  -8.158
  277    H    LYS  39           H        LYS  39   2.168   9.442  -7.202
  278    HA   LYS  39           HA       LYS  39   0.611   6.998  -7.307
  279   1HB   LYS  39          2HB       LYS  39   1.752   5.966  -9.188
  280   2HB   LYS  39          3HB       LYS  39   0.851   7.384  -9.673
  281   1HG   LYS  39          2HG       LYS  39   3.143   8.655  -9.467
  282   2HG   LYS  39          3HG       LYS  39   3.842   7.018  -9.496
  283   1HD   LYS  39          2HD       LYS  39   2.345   6.618 -11.576
  284   2HD   LYS  39          3HD       LYS  39   2.043   8.351 -11.583
  285   1HE   LYS  39          2HE       LYS  39   4.770   6.959 -11.842
  286   2HE   LYS  39          3HE       LYS  39   3.842   7.660 -13.173
  287   1HZ   LYS  39          1HZ       LYS  39   4.981   9.161 -10.910
  288   2HZ   LYS  39          2HZ       LYS  39   5.558   9.135 -12.446
  289   3HZ   LYS  39          3HZ       LYS  39   4.094   9.815 -12.138
  290    H    LYS  40           H        LYS  40   1.870   8.094  -5.199
  291    HA   LYS  40           HA       LYS  40   4.072   6.163  -4.677
  292   1HB   LYS  40          2HB       LYS  40   5.307   7.875  -3.497
  293   2HB   LYS  40          3HB       LYS  40   4.979   8.426  -5.146
  294   1HG   LYS  40          2HG       LYS  40   2.842   9.548  -4.010
  295   2HG   LYS  40          3HG       LYS  40   3.799   9.368  -2.532
  296   1HD   LYS  40          2HD       LYS  40   5.676  10.585  -3.919
  297   2HD   LYS  40          3HD       LYS  40   4.341  10.936  -5.058
  298   1HE   LYS  40          2HE       LYS  40   3.051  11.913  -3.151
  299   2HE   LYS  40          3HE       LYS  40   4.423  11.669  -2.061
  300   1HZ   LYS  40          1HZ       LYS  40   4.251  13.872  -2.783
  301   2HZ   LYS  40          2HZ       LYS  40   5.601  13.264  -3.511
  302   3HZ   LYS  40          3HZ       LYS  40   4.202  13.479  -4.374
  303    H    VAL  41           H        VAL  41   4.000   5.256  -2.593
  304    HA   VAL  41           HA       VAL  41   1.612   5.961  -0.943
  305    HB   VAL  41           HB       VAL  41   1.189   3.882  -2.161
  306   1HG1  VAL  41          1HG1      VAL  41   2.489   1.842  -1.710
  307   2HG1  VAL  41          2HG1      VAL  41   3.493   3.063  -2.494
  308   3HG1  VAL  41          3HG1      VAL  41   3.653   2.773  -0.748
  309   1HG2  VAL  41          1HG2      VAL  41   0.572   2.489  -0.284
  310   2HG2  VAL  41          2HG2      VAL  41   1.732   3.306   0.776
  311   3HG2  VAL  41          3HG2      VAL  41   0.320   4.184   0.160
  312    H    THR  42           H        THR  42   1.950   5.889   1.352
  313    HA   THR  42           HA       THR  42   4.689   5.252   2.214
  314    HB   THR  42           HB       THR  42   3.216   7.845   2.843
  315    HG1  THR  42           1HG      THR  42   4.785   7.215   0.891
  316   1HG2  THR  42          1HG2      THR  42   5.802   6.708   3.965
  317   2HG2  THR  42          2HG2      THR  42   5.292   8.404   4.120
  318   3HG2  THR  42          3HG2      THR  42   4.328   7.122   4.866
  319    H    ILE  43           H        ILE  43   4.517   3.855   3.853
  320    HA   ILE  43           HA       ILE  43   1.954   3.677   5.420
  321    HB   ILE  43           HB       ILE  43   3.968   1.599   4.525
  322   1HG1  ILE  43          2HG1      ILE  43   2.379   2.294   2.749
  323   2HG1  ILE  43          3HG1      ILE  43   2.147   0.632   3.236
  324   1HG2  ILE  43          1HG2      ILE  43   1.643   1.239   6.424
  325   2HG2  ILE  43          2HG2      ILE  43   2.440  -0.095   5.546
  326   3HG2  ILE  43          3HG2      ILE  43   3.370   0.908   6.659
  327   1HD1  ILE  43          1HD1      ILE  43   0.362   2.939   4.048
  328   2HD1  ILE  43          2HD1      ILE  43   0.000   1.641   2.904
  329   3HD1  ILE  43          3HD1      ILE  43   0.195   1.255   4.616
  330    H    THR  44           H        THR  44   2.152   4.143   7.544
  331    HA   THR  44           HA       THR  44   4.879   4.211   8.755
  332    HB   THR  44           HB       THR  44   2.398   5.738   9.558
  333    HG1  THR  44           1HG      THR  44   4.489   6.439   7.793
  334   1HG2  THR  44          1HG2      THR  44   5.352   6.127  10.220
  335   2HG2  THR  44          2HG2      THR  44   4.010   7.159  10.760
  336   3HG2  THR  44          3HG2      THR  44   4.118   5.483  11.328
  337    H    SER  45           H        SER  45   4.984   2.115   9.444
  338    HA   SER  45           HA       SER  45   3.332   1.371  11.770
  339   1HB   SER  45          2HB       SER  45   3.275  -1.002  10.673
  340   2HB   SER  45          3HB       SER  45   2.125   0.200  10.111
  341    HG   SER  45           HG       SER  45   4.589  -0.456   8.850
  342    H    ALA  46           H        ALA  46   4.350  -0.710  12.714
  343    HA   ALA  46           HA       ALA  46   7.175  -0.339  13.161
  344   1HB   ALA  46          1HB       ALA  46   5.336  -2.694  13.785
  345   2HB   ALA  46          2HB       ALA  46   6.972  -2.448  14.431
  346   3HB   ALA  46          3HB       ALA  46   5.672  -1.314  14.857
  347    H    LEU  47           H        LEU  47   5.213  -2.492  11.140
  348    HA   LEU  47           HA       LEU  47   7.627  -3.551   9.723
  349   1HB   LEU  47          2HB       LEU  47   6.325  -5.336   8.968
  350   2HB   LEU  47          3HB       LEU  47   6.321  -5.340  10.714
  351    HG   LEU  47           HG       LEU  47   3.943  -4.171   9.194
  352   1HD1  LEU  47          1HD1      LEU  47   2.927  -6.361   9.213
  353   2HD1  LEU  47          2HD1      LEU  47   4.452  -6.443   8.308
  354   3HD1  LEU  47          3HD1      LEU  47   4.365  -7.085   9.956
  355   1HD2  LEU  47          1HD2      LEU  47   4.242  -5.495  11.928
  356   2HD2  LEU  47          2HD2      LEU  47   3.847  -3.789  11.619
  357   3HD2  LEU  47          3HD2      LEU  47   2.702  -5.049  11.171
  358    H    GLY  48           H        GLY  48   5.569  -4.115   7.545
  359   1HA   GLY  48          2HA       GLY  48   3.998  -2.439   6.479
  360   2HA   GLY  48          3HA       GLY  48   5.377  -1.334   6.422
  361    H    GLU  49           H        GLU  49   7.489  -2.481   5.523
  362    HA   GLU  49           HA       GLU  49   6.971  -2.914   2.822
  363   1HB   GLU  49          2HB       GLU  49   9.181  -2.226   3.961
  364   2HB   GLU  49          3HB       GLU  49   9.488  -3.956   4.181
  365   1HG   GLU  49          2HG       GLU  49   9.162  -4.272   1.714
  366   2HG   GLU  49          3HG       GLU  49   8.891  -2.524   1.555
  367    H    GLU  50           H        GLU  50   7.584  -5.301   5.339
  368    HA   GLU  50           HA       GLU  50   7.666  -7.675   3.825
  369   1HB   GLU  50          2HB       GLU  50   7.697  -6.880   6.589
  370   2HB   GLU  50          3HB       GLU  50   6.319  -7.952   6.459
  371   1HG   GLU  50          2HG       GLU  50   7.874  -9.616   5.317
  372   2HG   GLU  50          3HG       GLU  50   9.206  -8.504   5.726
  373    H    GLN  51           H        GLN  51   4.914  -6.232   5.583
  374    HA   GLN  51           HA       GLN  51   3.110  -8.164   4.604
  375   1HB   GLN  51          2HB       GLN  51   3.100  -6.419   6.656
  376   2HB   GLN  51          3HB       GLN  51   2.088  -5.474   5.568
  377   1HG   GLN  51          2HG       GLN  51   0.422  -7.194   5.543
  378   2HG   GLN  51          3HG       GLN  51   1.593  -8.434   6.049
  379   1HE2  GLN  51          1HE2      GLN  51   0.545  -5.243   7.420
  380   2HE2  GLN  51          2HE2      GLN  51   0.417  -5.893   9.041
  381    H    LEU  52           H        LEU  52   3.840  -4.831   3.568
  382    HA   LEU  52           HA       LEU  52   1.904  -4.588   1.582
  383   1HB   LEU  52          2HB       LEU  52   4.737  -3.530   1.827
  384   2HB   LEU  52          3HB       LEU  52   3.681  -3.021   0.515
  385    HG   LEU  52           HG       LEU  52   2.771  -2.771   3.390
  386   1HD1  LEU  52          1HD1      LEU  52   4.130  -0.500   1.903
  387   2HD1  LEU  52          2HD1      LEU  52   3.809  -0.695   3.647
  388   3HD1  LEU  52          3HD1      LEU  52   5.063  -1.640   2.879
  389   1HD2  LEU  52          1HD2      LEU  52   1.193  -1.217   2.539
  390   2HD2  LEU  52          2HD2      LEU  52   2.048  -1.048   0.991
  391   3HD2  LEU  52          3HD2      LEU  52   1.172  -2.535   1.375
  392    H    ARG  53           H        ARG  53   5.183  -6.111   1.456
  393    HA   ARG  53           HA       ARG  53   5.281  -6.729  -1.243
  394   1HB   ARG  53          2HB       ARG  53   6.699  -7.467   1.095
  395   2HB   ARG  53          3HB       ARG  53   6.086  -8.979   0.497
  396   1HG   ARG  53          2HG       ARG  53   8.252  -8.649  -0.404
  397   2HG   ARG  53          3HG       ARG  53   7.146  -8.375  -1.763
  398   1HD   ARG  53          2HD       ARG  53   7.391  -5.946  -1.515
  399   2HD   ARG  53          3HD       ARG  53   8.274  -6.151   0.015
  400    HE   ARG  53           HE       ARG  53   9.713  -7.550  -1.943
  401   1HH1  ARG  53          2HH2      ARG  53   8.886  -4.211  -1.141
  402   2HH1  ARG  53          1HH2      ARG  53  10.261  -3.507  -1.915
  403   1HH2  ARG  53          2HH1      ARG  53  11.599  -6.648  -2.938
  404   2HH2  ARG  53          1HH1      ARG  53  11.830  -4.927  -2.954
  405    H    THR  54           H        THR  54   3.813  -8.831   1.317
  406    HA   THR  54           HA       THR  54   2.728 -10.644  -0.607
  407    HB   THR  54           HB       THR  54   1.886 -10.205   2.291
  408    HG1  THR  54           1HG      THR  54   3.975 -11.748   1.148
  409   1HG2  THR  54          1HG2      THR  54   1.406 -12.645   2.206
  410   2HG2  THR  54          2HG2      THR  54   0.373 -11.739   1.088
  411   3HG2  THR  54          3HG2      THR  54   1.761 -12.658   0.465
  412    H    ALA  55           H        ALA  55   1.188  -8.067   1.324
  413    HA   ALA  55           HA       ALA  55  -1.478  -8.551   0.486
  414   1HB   ALA  55          1HB       ALA  55  -0.233  -5.977   1.531
  415   2HB   ALA  55          2HB       ALA  55  -1.969  -6.342   1.453
  416   3HB   ALA  55          3HB       ALA  55  -0.921  -7.279   2.528
  417    H    ILE  56           H        ILE  56   0.869  -6.033  -0.631
  418    HA   ILE  56           HA       ILE  56  -0.682  -5.153  -2.846
  419    HB   ILE  56           HB       ILE  56   2.358  -5.294  -2.728
  420   1HG1  ILE  56          2HG1      ILE  56   0.468  -2.950  -2.201
  421   2HG1  ILE  56          3HG1      ILE  56   1.243  -3.875  -0.900
  422   1HG2  ILE  56          1HG2      ILE  56   1.427  -5.059  -5.031
  423   2HG2  ILE  56          2HG2      ILE  56   0.454  -3.681  -4.457
  424   3HG2  ILE  56          3HG2      ILE  56   2.234  -3.609  -4.488
  425   1HD1  ILE  56          1HD1      ILE  56   2.515  -1.901  -1.195
  426   2HD1  ILE  56          2HD1      ILE  56   3.482  -3.210  -1.914
  427   3HD1  ILE  56          3HD1      ILE  56   2.573  -2.073  -2.938
  428    H    ALA  57           H        ALA  57   1.841  -7.834  -2.742
  429    HA   ALA  57           HA       ALA  57   1.573  -8.524  -5.433
  430   1HB   ALA  57          1HB       ALA  57   2.123 -10.376  -3.083
  431   2HB   ALA  57          2HB       ALA  57   2.374 -10.773  -4.791
  432   3HB   ALA  57          3HB       ALA  57   3.321  -9.476  -4.049
  433    H    SER  58           H        SER  58  -0.518  -9.513  -2.725
  434    HA   SER  58           HA       SER  58  -2.133 -11.393  -4.028
  435   1HB   SER  58          2HB       SER  58  -2.157 -10.629  -1.562
  436   2HB   SER  58          3HB       SER  58  -3.222  -9.314  -2.092
  437    HG   SER  58           HG       SER  58  -3.706 -12.088  -2.467
  438    H    ALA  59           H        ALA  59  -2.270  -7.825  -4.173
  439    HA   ALA  59           HA       ALA  59  -4.644  -7.807  -5.925
  440   1HB   ALA  59          1HB       ALA  59  -4.200  -5.348  -5.932
  441   2HB   ALA  59          2HB       ALA  59  -4.426  -6.031  -4.306
  442   3HB   ALA  59          3HB       ALA  59  -2.794  -5.640  -4.880
  443    H    GLY  60           H        GLY  60  -1.128  -7.495  -6.151
  444   1HA   GLY  60          2HA       GLY  60   0.251  -7.948  -7.932
  445   2HA   GLY  60          3HA       GLY  60  -1.152  -8.168  -8.982
  446    H    HIS  61           H        HIS  61   0.513  -5.542  -7.159
  447    HA   HIS  61           HA       HIS  61   0.170  -3.709  -9.504
  448   1HB   HIS  61          2HB       HIS  61   0.947  -3.155  -6.633
  449   2HB   HIS  61          3HB       HIS  61   0.907  -1.943  -7.904
  450    HD1  HIS  61           1HD      HIS  61  -1.216  -0.503  -7.623
  451    HD2  HIS  61           2HD      HIS  61  -1.562  -4.425  -6.196
  452    HE1  HIS  61           1HE      HIS  61  -3.486  -0.651  -6.481
  453    H    GLU  62           H        GLU  62   1.952  -2.876 -10.546
  454    HA   GLU  62           HA       GLU  62   4.487  -4.176 -10.414
  455   1HB   GLU  62          2HB       GLU  62   3.424  -1.762 -11.967
  456   2HB   GLU  62          3HB       GLU  62   5.003  -2.503 -12.231
  457   1HG   GLU  62          2HG       GLU  62   3.505  -3.320 -13.909
  458   2HG   GLU  62          3HG       GLU  62   3.944  -4.639 -12.814
  459    H    VAL  63           H        VAL  63   4.361  -3.310  -8.007
  460    HA   VAL  63           HA       VAL  63   5.302  -0.584  -7.626
  461    HB   VAL  63           HB       VAL  63   5.168  -2.856  -5.602
  462   1HG1  VAL  63          1HG1      VAL  63   6.534  -0.958  -4.774
  463   2HG1  VAL  63          2HG1      VAL  63   5.212   0.163  -5.169
  464   3HG1  VAL  63          3HG1      VAL  63   4.998  -1.076  -3.920
  465   1HG2  VAL  63          1HG2      VAL  63   3.013  -2.610  -6.457
  466   2HG2  VAL  63          2HG2      VAL  63   2.974  -1.532  -5.050
  467   3HG2  VAL  63          3HG2      VAL  63   3.159  -0.860  -6.673
  468    H    GLU  64           H        GLU  64   7.263   0.216  -7.092
  469    HA   GLU  64           HA       GLU  64   9.623  -1.602  -6.902
  470   1HB   GLU  64          2HB       GLU  64   9.467   1.345  -7.650
  471   2HB   GLU  64          3HB       GLU  64  10.948   0.399  -7.474
  472   1HG   GLU  64          2HG       GLU  64  10.368  -0.972  -9.405
  473   2HG   GLU  64          3HG       GLU  64   8.767  -0.226  -9.527
  Start of MODEL   14
    1   1H    MET   1           H1       MET   1   9.763   1.577   9.508
    2   2H    MET   1           H2       MET   1   9.833   1.662  11.162
    3   3H    MET   1           H3       MET   1   8.385   1.716  10.355
    4    HA   MET   1           HA       MET   1   9.030   3.909  11.126
    5   1HB   MET   1          2HB       MET   1  11.422   3.258   9.365
    6   2HB   MET   1          3HB       MET   1  10.918   4.934   9.570
    7   1HG   MET   1          2HG       MET   1  11.092   4.782  11.988
    8   2HG   MET   1          3HG       MET   1  11.677   3.113  11.864
    9   1HE   MET   1          1HE       MET   1  13.089   5.659  13.381
   10   2HE   MET   1          2HE       MET   1  13.685   3.980  13.457
   11   3HE   MET   1          3HE       MET   1  14.785   5.299  12.991
   12    H    THR   2           H        THR   2   9.264   5.786   8.984
   13    HA   THR   2           HA       THR   2   6.741   5.343   7.626
   14    HB   THR   2           HB       THR   2   7.299   7.638   6.794
   15    HG1  THR   2           1HG      THR   2   9.589   7.290   6.837
   16   1HG2  THR   2          1HG2      THR   2   6.194   7.328   9.040
   17   2HG2  THR   2          2HG2      THR   2   7.790   7.414   9.803
   18   3HG2  THR   2          3HG2      THR   2   7.156   8.805   8.908
   19    H    ILE   3           H        ILE   3   7.078   3.601   6.118
   20    HA   ILE   3           HA       ILE   3   9.433   3.652   4.352
   21    HB   ILE   3           HB       ILE   3   6.973   1.868   4.253
   22   1HG1  ILE   3          2HG1      ILE   3   7.806   1.559   6.472
   23   2HG1  ILE   3          3HG1      ILE   3   8.250   0.178   5.487
   24   1HG2  ILE   3          1HG2      ILE   3   8.349   1.847   2.234
   25   2HG2  ILE   3          2HG2      ILE   3   9.804   1.522   3.187
   26   3HG2  ILE   3          3HG2      ILE   3   8.504   0.312   3.100
   27   1HD1  ILE   3          1HD1      ILE   3  10.574   1.045   5.285
   28   2HD1  ILE   3          2HD1      ILE   3  10.130   2.448   6.287
   29   3HD1  ILE   3          3HD1      ILE   3  10.086   0.814   6.969
   30    H    GLN   4           H        GLN   4   9.414   4.761   2.443
   31    HA   GLN   4           HA       GLN   4   6.846   5.748   1.289
   32   1HB   GLN   4          2HB       GLN   4   9.693   6.726   1.248
   33   2HB   GLN   4          3HB       GLN   4   8.624   7.091  -0.116
   34   1HG   GLN   4          2HG       GLN   4   7.029   8.207   1.232
   35   2HG   GLN   4          3HG       GLN   4   7.748   7.609   2.729
   36   1HE2  GLN   4          1HE2      GLN   4   8.870   9.395  -0.228
   37   2HE2  GLN   4          2HE2      GLN   4   9.752  10.612   0.683
   38    H    LEU   5           H        LEU   5   6.057   4.262  -0.119
   39    HA   LEU   5           HA       LEU   5   7.940   2.957  -2.029
   40   1HB   LEU   5          2HB       LEU   5   5.045   2.192  -1.618
   41   2HB   LEU   5          3HB       LEU   5   6.346   1.330  -2.401
   42    HG   LEU   5           HG       LEU   5   7.487   1.221  -0.071
   43   1HD1  LEU   5          1HD1      LEU   5   6.007   2.762   1.267
   44   2HD1  LEU   5          2HD1      LEU   5   4.598   1.803   0.800
   45   3HD1  LEU   5          3HD1      LEU   5   5.863   1.119   1.837
   46   1HD2  LEU   5          1HD2      LEU   5   6.455  -0.680  -1.252
   47   2HD2  LEU   5          2HD2      LEU   5   6.143  -0.776   0.489
   48   3HD2  LEU   5          3HD2      LEU   5   4.864  -0.202  -0.612
   49    H    THR   6           H        THR   6   7.186   2.842  -4.268
   50    HA   THR   6           HA       THR   6   5.754   5.313  -5.175
   51    HB   THR   6           HB       THR   6   8.312   4.011  -6.209
   52    HG1  THR   6           1HG      THR   6   7.676   6.356  -4.783
   53   1HG2  THR   6          1HG2      THR   6   8.391   5.928  -7.784
   54   2HG2  THR   6          2HG2      THR   6   7.038   4.843  -8.126
   55   3HG2  THR   6          3HG2      THR   6   6.747   6.391  -7.291
   56    H    VAL   7           H        VAL   7   3.979   4.767  -6.330
   57    HA   VAL   7           HA       VAL   7   3.808   1.969  -7.348
   58    HB   VAL   7           HB       VAL   7   2.424   2.170  -5.503
   59   1HG1  VAL   7          1HG1      VAL   7   2.210   4.571  -5.182
   60   2HG1  VAL   7          2HG1      VAL   7   1.172   4.707  -6.619
   61   3HG1  VAL   7          3HG1      VAL   7   0.625   3.801  -5.203
   62   1HG2  VAL   7          1HG2      VAL   7   0.484   2.535  -7.792
   63   2HG2  VAL   7          2HG2      VAL   7   1.438   1.060  -7.571
   64   3HG2  VAL   7          3HG2      VAL   7   0.290   1.576  -6.323
   65    HA   PRO   8           HA       PRO   8   3.620   4.681 -11.053
   66   1HB   PRO   8          2HB       PRO   8   4.664   2.988 -12.908
   67   2HB   PRO   8          3HB       PRO   8   5.689   3.833 -11.710
   68   1HG   PRO   8          2HG       PRO   8   4.586   1.014 -11.521
   69   2HG   PRO   8          3HG       PRO   8   6.280   1.533 -11.296
   70   1HD   PRO   8          2HD       PRO   8   4.598   1.177  -9.208
   71   2HD   PRO   8          3HD       PRO   8   5.791   2.504  -9.201
   72    H    THR   9           H        THR   9   2.212   1.549 -10.332
   73    HA   THR   9           HA       THR   9   0.448   1.474 -12.599
   74    HB   THR   9           HB       THR   9   0.371   0.015 -10.067
   75    HG1  THR   9           1HG      THR   9   1.562  -0.651 -12.511
   76   1HG2  THR   9          1HG2      THR   9  -1.782  -0.171 -11.250
   77   2HG2  THR   9          2HG2      THR   9  -0.940  -0.533 -12.769
   78   3HG2  THR   9          3HG2      THR   9  -0.893  -1.696 -11.429
   79    H    ILE  10           H        ILE  10  -0.734   1.421  -9.198
   80    HA   ILE  10           HA       ILE  10  -2.610   2.077  -8.369
   81    HB   ILE  10           HB       ILE  10  -1.187   4.430  -9.185
   82   1HG1  ILE  10          2HG1      ILE  10  -3.242   3.816  -7.061
   83   2HG1  ILE  10          3HG1      ILE  10  -1.495   3.626  -6.958
   84   1HG2  ILE  10          1HG2      ILE  10  -4.163   4.993  -9.225
   85   2HG2  ILE  10          2HG2      ILE  10  -2.818   6.120  -9.474
   86   3HG2  ILE  10          3HG2      ILE  10  -3.154   4.886 -10.691
   87   1HD1  ILE  10          1HD1      ILE  10  -1.234   6.116  -7.234
   88   2HD1  ILE  10          2HD1      ILE  10  -3.005   6.269  -7.137
   89   3HD1  ILE  10          3HD1      ILE  10  -2.095   5.638  -5.757
   90    H    ALA  11           H        ALA  11  -4.885   2.880  -8.691
   91    HA   ALA  11           HA       ALA  11  -6.914   2.411  -9.605
   92   1HB   ALA  11          1HB       ALA  11  -7.308   3.669 -11.663
   93   2HB   ALA  11          2HB       ALA  11  -6.231   4.571 -10.585
   94   3HB   ALA  11          3HB       ALA  11  -5.565   3.719 -11.997
   95    H    CYS  12           H        CYS  12  -4.877   0.223 -10.085
   96    HA   CYS  12           HA       CYS  12  -5.748  -1.083 -12.572
   97   1HB   CYS  12          2HB       CYS  12  -3.501  -1.478 -11.981
   98   2HB   CYS  12          3HB       CYS  12  -3.905  -1.763 -10.276
   99    HG   CYS  12           HG       CYS  12  -3.208  -4.058 -11.151
  100    H    GLU  13           H        GLU  13  -5.990  -1.694  -9.082
  101    HA   GLU  13           HA       GLU  13  -8.553  -3.155  -9.453
  102   1HB   GLU  13          2HB       GLU  13  -6.566  -4.245  -8.198
  103   2HB   GLU  13          3HB       GLU  13  -6.850  -3.057  -6.929
  104   1HG   GLU  13          2HG       GLU  13  -9.402  -4.264  -7.602
  105   2HG   GLU  13          3HG       GLU  13  -8.211  -5.566  -7.513
  106    H    ALA  14           H        ALA  14  -8.981  -2.237  -6.463
  107    HA   ALA  14           HA       ALA  14 -10.437   0.179  -7.267
  108   1HB   ALA  14          1HB       ALA  14 -11.529  -0.065  -5.106
  109   2HB   ALA  14          2HB       ALA  14 -11.519  -1.617  -5.968
  110   3HB   ALA  14          3HB       ALA  14 -10.383  -1.335  -4.632
  111    H    CYS  15           H        CYS  15  -7.711   0.621  -7.425
  112    HA   CYS  15           HA       CYS  15  -6.371   2.319  -7.124
  113   1HB   CYS  15          2HB       CYS  15  -8.691   3.496  -6.310
  114   2HB   CYS  15          3HB       CYS  15  -7.765   3.594  -4.797
  115    HG   CYS  15           HG       CYS  15  -7.553   5.816  -6.120
  116    H    ALA  16           H        ALA  16  -4.818   3.177  -5.597
  117    HA   ALA  16           HA       ALA  16  -3.446   1.207  -4.160
  118   1HB   ALA  16          1HB       ALA  16  -2.178   3.028  -3.052
  119   2HB   ALA  16          2HB       ALA  16  -2.334   3.257  -4.796
  120   3HB   ALA  16          3HB       ALA  16  -3.348   4.212  -3.686
  121    H    GLU  17           H        GLU  17  -5.866   3.525  -2.801
  122    HA   GLU  17           HA       GLU  17  -5.836   2.896  -0.176
  123   1HB   GLU  17          2HB       GLU  17  -7.656   4.056  -2.047
  124   2HB   GLU  17          3HB       GLU  17  -8.597   2.862  -1.159
  125   1HG   GLU  17          2HG       GLU  17  -6.784   4.844   0.282
  126   2HG   GLU  17          3HG       GLU  17  -8.399   5.261  -0.270
  127    H    ALA  18           H        ALA  18  -7.029   0.695  -2.753
  128    HA   ALA  18           HA       ALA  18  -8.280  -1.260  -1.199
  129   1HB   ALA  18          1HB       ALA  18  -7.628  -2.831  -2.939
  130   2HB   ALA  18          2HB       ALA  18  -8.120  -1.292  -3.673
  131   3HB   ALA  18          3HB       ALA  18  -6.397  -1.716  -3.554
  132    H    VAL  19           H        VAL  19  -4.712  -0.814  -1.789
  133    HA   VAL  19           HA       VAL  19  -4.170  -3.197  -0.289
  134    HB   VAL  19           HB       VAL  19  -2.621  -2.163  -2.016
  135   1HG1  VAL  19          1HG1      VAL  19  -0.724  -0.872  -1.149
  136   2HG1  VAL  19          2HG1      VAL  19  -2.193   0.079  -0.944
  137   3HG1  VAL  19          3HG1      VAL  19  -1.467  -0.739   0.446
  138   1HG2  VAL  19          1HG2      VAL  19  -1.104  -3.651  -1.253
  139   2HG2  VAL  19          2HG2      VAL  19  -1.029  -3.002   0.392
  140   3HG2  VAL  19          3HG2      VAL  19  -2.310  -4.115  -0.087
  141    H    THR  20           H        THR  20  -4.332   0.257   0.422
  142    HA   THR  20           HA       THR  20  -3.270   0.246   3.063
  143    HB   THR  20           HB       THR  20  -5.501   1.945   1.864
  144    HG1  THR  20           1HG      THR  20  -3.452   2.125   0.892
  145   1HG2  THR  20          1HG2      THR  20  -4.024   2.236   4.469
  146   2HG2  THR  20          2HG2      THR  20  -4.921   3.546   3.653
  147   3HG2  THR  20          3HG2      THR  20  -5.777   2.108   4.222
  148    H    LYS  21           H        LYS  21  -6.706  -0.155   2.043
  149    HA   LYS  21           HA       LYS  21  -7.607  -0.808   4.671
  150   1HB   LYS  21          2HB       LYS  21  -8.898  -1.568   2.024
  151   2HB   LYS  21          3HB       LYS  21  -9.659  -1.496   3.629
  152   1HG   LYS  21          2HG       LYS  21  -8.609   1.010   3.554
  153   2HG   LYS  21          3HG       LYS  21  -8.757   0.749   1.825
  154   1HD   LYS  21          2HD       LYS  21 -11.001   0.460   3.866
  155   2HD   LYS  21          3HD       LYS  21 -10.697   1.901   2.873
  156   1HE   LYS  21          2HE       LYS  21 -11.161   0.753   0.823
  157   2HE   LYS  21          3HE       LYS  21 -11.192  -0.836   1.610
  158   1HZ   LYS  21          1HZ       LYS  21 -13.127   1.317   2.112
  159   2HZ   LYS  21          2HZ       LYS  21 -13.390  -0.004   1.165
  160   3HZ   LYS  21          3HZ       LYS  21 -13.151  -0.189   2.781
  161    H    ALA  22           H        ALA  22  -6.550  -2.891   1.965
  162    HA   ALA  22           HA       ALA  22  -7.093  -5.395   3.156
  163   1HB   ALA  22          1HB       ALA  22  -5.319  -6.313   1.800
  164   2HB   ALA  22          2HB       ALA  22  -6.311  -5.178   0.848
  165   3HB   ALA  22          3HB       ALA  22  -4.700  -4.693   1.440
  166    H    VAL  23           H        VAL  23  -4.021  -3.586   3.258
  167    HA   VAL  23           HA       VAL  23  -2.536  -5.240   4.954
  168    HB   VAL  23           HB       VAL  23  -2.433  -2.275   4.316
  169   1HG1  VAL  23          1HG1      VAL  23  -0.180  -2.139   5.081
  170   2HG1  VAL  23          2HG1      VAL  23  -1.143  -2.705   6.462
  171   3HG1  VAL  23          3HG1      VAL  23  -0.136  -3.840   5.520
  172   1HG2  VAL  23          1HG2      VAL  23  -2.028  -4.057   2.479
  173   2HG2  VAL  23          2HG2      VAL  23  -0.697  -2.931   2.777
  174   3HG2  VAL  23          3HG2      VAL  23  -0.635  -4.583   3.421
  175    H    GLN  24           H        GLN  24  -4.616  -2.408   5.729
  176    HA   GLN  24           HA       GLN  24  -4.287  -2.404   8.518
  177   1HB   GLN  24          2HB       GLN  24  -6.613  -1.645   6.740
  178   2HB   GLN  24          3HB       GLN  24  -6.606  -1.324   8.468
  179   1HG   GLN  24          2HG       GLN  24  -4.232  -0.401   6.824
  180   2HG   GLN  24          3HG       GLN  24  -5.751   0.474   6.692
  181   1HE2  GLN  24          1HE2      GLN  24  -2.890   0.802   8.124
  182   2HE2  GLN  24          2HE2      GLN  24  -3.383   1.543   9.636
  183    H    ASN  25           H        ASN  25  -5.815  -5.006   6.701
  184    HA   ASN  25           HA       ASN  25  -7.561  -5.819   8.905
  185   1HB   ASN  25          2HB       ASN  25  -6.290  -7.467   6.679
  186   2HB   ASN  25          3HB       ASN  25  -7.321  -8.117   7.948
  187   1HD2  ASN  25          1HD2      ASN  25  -7.286  -5.870   5.220
  188   2HD2  ASN  25          2HD2      ASN  25  -9.028  -5.882   4.958
  189    H    GLU  26           H        GLU  26  -4.249  -6.778   7.865
  190    HA   GLU  26           HA       GLU  26  -3.791  -8.222  10.362
  191   1HB   GLU  26          2HB       GLU  26  -1.743  -7.554   8.248
  192   2HB   GLU  26          3HB       GLU  26  -1.665  -8.787   9.497
  193   1HG   GLU  26          2HG       GLU  26  -3.669  -9.916   8.427
  194   2HG   GLU  26          3HG       GLU  26  -3.523  -8.784   7.071
  195    H    ASP  27           H        ASP  27  -2.169  -5.373   8.787
  196    HA   ASP  27           HA       ASP  27  -0.933  -4.756  11.396
  197   1HB   ASP  27          2HB       ASP  27   0.317  -4.716   9.142
  198   2HB   ASP  27          3HB       ASP  27  -0.482  -3.183   8.837
  199    H    ALA  28           H        ALA  28  -3.282  -4.519  12.060
  200    HA   ALA  28           HA       ALA  28  -4.895  -2.338  11.109
  201   1HB   ALA  28          1HB       ALA  28  -5.811  -4.380  12.195
  202   2HB   ALA  28          2HB       ALA  28  -5.056  -3.896  13.729
  203   3HB   ALA  28          3HB       ALA  28  -6.343  -2.900  13.017
  204    H    GLN  29           H        GLN  29  -2.254  -2.477  13.258
  205    HA   GLN  29           HA       GLN  29  -2.896   0.063  14.617
  206   1HB   GLN  29          2HB       GLN  29  -0.916  -0.464  15.932
  207   2HB   GLN  29          3HB       GLN  29  -2.132  -1.735  15.998
  208   1HG   GLN  29          2HG       GLN  29  -0.782  -3.131  14.455
  209   2HG   GLN  29          3HG       GLN  29   0.376  -1.810  14.251
  210   1HE2  GLN  29          1HE2      GLN  29  -1.228  -3.603  16.973
  211   2HE2  GLN  29          2HE2      GLN  29   0.253  -3.767  17.904
  212    H    ALA  30           H        ALA  30  -1.696  -0.671  11.568
  213    HA   ALA  30           HA       ALA  30   0.617   1.101  11.620
  214   1HB   ALA  30          1HB       ALA  30  -0.998  -0.071   9.315
  215   2HB   ALA  30          2HB       ALA  30   0.524   0.825   9.152
  216   3HB   ALA  30          3HB       ALA  30   0.503  -0.716  10.008
  217    H    THR  31           H        THR  31   0.765   3.073  10.416
  218    HA   THR  31           HA       THR  31  -1.815   4.561  10.014
  219    HB   THR  31           HB       THR  31   0.886   5.542  10.968
  220    HG1  THR  31           1HG      THR  31  -0.725   4.571  12.411
  221   1HG2  THR  31          1HG2      THR  31  -1.597   7.150  10.216
  222   2HG2  THR  31          2HG2      THR  31  -0.189   7.787  11.088
  223   3HG2  THR  31          3HG2      THR  31  -0.007   7.238   9.416
  224    H    VAL  32           H        VAL  32  -1.927   5.765   8.085
  225    HA   VAL  32           HA       VAL  32  -0.072   4.895   5.920
  226    HB   VAL  32           HB       VAL  32  -2.187   4.481   4.618
  227   1HG1  VAL  32          1HG1      VAL  32  -2.553   2.446   6.669
  228   2HG1  VAL  32          2HG1      VAL  32  -1.852   2.311   5.050
  229   3HG1  VAL  32          3HG1      VAL  32  -0.831   2.757   6.417
  230   1HG2  VAL  32          1HG2      VAL  32  -4.289   4.020   5.866
  231   2HG2  VAL  32          2HG2      VAL  32  -3.555   4.565   7.362
  232   3HG2  VAL  32          3HG2      VAL  32  -3.827   5.706   6.029
  233    H    GLN  33           H        GLN  33   0.350   6.556   4.388
  234    HA   GLN  33           HA       GLN  33  -1.718   8.641   4.054
  235   1HB   GLN  33          2HB       GLN  33   1.245   9.200   4.546
  236   2HB   GLN  33          3HB       GLN  33   0.060  10.353   3.923
  237   1HG   GLN  33          2HG       GLN  33  -1.288   9.954   6.068
  238   2HG   GLN  33          3HG       GLN  33   0.106   9.040   6.671
  239   1HE2  GLN  33          1HE2      GLN  33  -0.953  12.265   5.509
  240   2HE2  GLN  33          2HE2      GLN  33   0.294  13.144   6.376
  241    H    VAL  34           H        VAL  34  -2.263   8.329   1.940
  242    HA   VAL  34           HA       VAL  34  -0.125   7.576   0.010
  243    HB   VAL  34           HB       VAL  34  -1.490   5.672   0.436
  244   1HG1  VAL  34          1HG1      VAL  34  -3.531   6.593   1.328
  245   2HG1  VAL  34          2HG1      VAL  34  -3.941   7.328  -0.232
  246   3HG1  VAL  34          3HG1      VAL  34  -3.887   5.565  -0.064
  247   1HG2  VAL  34          1HG2      VAL  34  -0.711   6.230  -1.900
  248   2HG2  VAL  34          2HG2      VAL  34  -2.091   5.121  -1.795
  249   3HG2  VAL  34          3HG2      VAL  34  -2.335   6.818  -2.249
  250    H    ASP  35           H        ASP  35   0.182   8.916  -1.674
  251    HA   ASP  35           HA       ASP  35  -1.556  11.328  -1.674
  252   1HB   ASP  35          2HB       ASP  35   1.162  11.058  -1.410
  253   2HB   ASP  35          3HB       ASP  35   1.004  11.352  -3.150
  254    H    LEU  36           H        LEU  36  -3.202  10.123  -2.832
  255    HA   LEU  36           HA       LEU  36  -2.930   8.903  -5.360
  256   1HB   LEU  36          2HB       LEU  36  -5.289  10.385  -4.120
  257   2HB   LEU  36          3HB       LEU  36  -5.335   9.658  -5.725
  258    HG   LEU  36           HG       LEU  36  -4.654   7.442  -4.665
  259   1HD1  LEU  36          1HD1      LEU  36  -3.977   8.281  -2.429
  260   2HD1  LEU  36          2HD1      LEU  36  -5.616   8.892  -2.147
  261   3HD1  LEU  36          3HD1      LEU  36  -5.324   7.146  -2.301
  262   1HD2  LEU  36          1HD2      LEU  36  -6.912   7.938  -5.528
  263   2HD2  LEU  36          2HD2      LEU  36  -6.995   6.948  -4.059
  264   3HD2  LEU  36          3HD2      LEU  36  -7.350   8.687  -3.977
  265    H    THR  37           H        THR  37  -2.886  12.321  -4.546
  266    HA   THR  37           HA       THR  37  -3.052  13.816  -6.726
  267    HB   THR  37           HB       THR  37  -0.597  13.588  -4.937
  268    HG1  THR  37           1HG      THR  37  -1.788  14.134  -3.329
  269   1HG2  THR  37          1HG2      THR  37  -0.468  15.384  -6.650
  270   2HG2  THR  37          2HG2      THR  37  -2.032  16.024  -6.087
  271   3HG2  THR  37          3HG2      THR  37  -0.620  16.045  -5.009
  272    H    SER  38           H        SER  38  -0.393  11.403  -6.178
  273    HA   SER  38           HA       SER  38   0.100  11.402  -9.079
  274   1HB   SER  38          2HB       SER  38   2.376  11.804  -7.094
  275   2HB   SER  38          3HB       SER  38   2.509  11.607  -8.862
  276    HG   SER  38           HG       SER  38   1.280  13.585  -8.999
  277    H    LYS  39           H        LYS  39   2.570   9.801  -7.319
  278    HA   LYS  39           HA       LYS  39   1.059   7.277  -7.121
  279   1HB   LYS  39          2HB       LYS  39   2.717   6.302  -8.756
  280   2HB   LYS  39          3HB       LYS  39   1.445   7.321  -9.392
  281   1HG   LYS  39          2HG       LYS  39   3.206   7.907 -10.633
  282   2HG   LYS  39          3HG       LYS  39   3.236   9.220  -9.482
  283   1HD   LYS  39          2HD       LYS  39   5.244   8.490  -8.519
  284   2HD   LYS  39          3HD       LYS  39   4.852   6.793  -8.767
  285   1HE   LYS  39          2HE       LYS  39   6.739   7.281 -10.147
  286   2HE   LYS  39          3HE       LYS  39   5.336   6.849 -11.127
  287   1HZ   LYS  39          1HZ       LYS  39   5.012   9.204 -11.564
  288   2HZ   LYS  39          2HZ       LYS  39   6.354   9.580 -10.680
  289   3HZ   LYS  39          3HZ       LYS  39   6.493   8.693 -12.057
  290    H    LYS  40           H        LYS  40   1.825   8.341  -4.925
  291    HA   LYS  40           HA       LYS  40   4.363   7.051  -4.075
  292   1HB   LYS  40          2HB       LYS  40   5.009   9.130  -2.903
  293   2HB   LYS  40          3HB       LYS  40   4.916   9.349  -4.656
  294   1HG   LYS  40          2HG       LYS  40   2.395  10.066  -4.026
  295   2HG   LYS  40          3HG       LYS  40   3.144  10.461  -2.486
  296   1HD   LYS  40          2HD       LYS  40   4.117  11.485  -5.199
  297   2HD   LYS  40          3HD       LYS  40   2.852  12.288  -4.252
  298   1HE   LYS  40          2HE       LYS  40   4.380  12.581  -2.347
  299   2HE   LYS  40          3HE       LYS  40   5.695  11.813  -3.262
  300   1HZ   LYS  40          1HZ       LYS  40   5.783  14.214  -3.357
  301   2HZ   LYS  40          2HZ       LYS  40   5.504  13.615  -4.863
  302   3HZ   LYS  40          3HZ       LYS  40   4.274  14.294  -3.998
  303    H    VAL  41           H        VAL  41   4.241   6.176  -1.983
  304    HA   VAL  41           HA       VAL  41   1.845   6.788  -0.377
  305    HB   VAL  41           HB       VAL  41   1.092   4.966  -1.778
  306   1HG1  VAL  41          1HG1      VAL  41   3.469   3.376  -0.814
  307   2HG1  VAL  41          2HG1      VAL  41   2.152   2.770  -1.829
  308   3HG1  VAL  41          3HG1      VAL  41   3.259   3.991  -2.474
  309   1HG2  VAL  41          1HG2      VAL  41   0.419   3.408  -0.078
  310   2HG2  VAL  41          2HG2      VAL  41   1.848   3.758   0.909
  311   3HG2  VAL  41          3HG2      VAL  41   0.583   4.980   0.737
  312    H    THR  42           H        THR  42   2.240   6.820   1.757
  313    HA   THR  42           HA       THR  42   4.951   6.019   2.645
  314    HB   THR  42           HB       THR  42   3.195   8.336   3.545
  315    HG1  THR  42           1HG      THR  42   4.679   9.581   2.459
  316   1HG2  THR  42          1HG2      THR  42   5.263   9.049   4.771
  317   2HG2  THR  42          2HG2      THR  42   4.603   7.529   5.394
  318   3HG2  THR  42          3HG2      THR  42   6.028   7.505   4.334
  319    H    ILE  43           H        ILE  43   4.734   4.269   3.985
  320    HA   ILE  43           HA       ILE  43   2.234   3.976   5.621
  321    HB   ILE  43           HB       ILE  43   4.095   1.806   4.614
  322   1HG1  ILE  43          2HG1      ILE  43   2.894   2.736   2.711
  323   2HG1  ILE  43          3HG1      ILE  43   2.295   1.139   3.104
  324   1HG2  ILE  43          1HG2      ILE  43   2.154   0.340   5.411
  325   2HG2  ILE  43          2HG2      ILE  43   3.090   1.136   6.680
  326   3HG2  ILE  43          3HG2      ILE  43   1.506   1.774   6.224
  327   1HD1  ILE  43          1HD1      ILE  43   0.340   2.140   4.270
  328   2HD1  ILE  43          2HD1      ILE  43   0.883   3.754   3.756
  329   3HD1  ILE  43          3HD1      ILE  43   0.420   2.543   2.554
  330    H    THR  44           H        THR  44   2.505   4.219   7.731
  331    HA   THR  44           HA       THR  44   5.237   4.228   8.903
  332    HB   THR  44           HB       THR  44   2.589   5.369   9.784
  333    HG1  THR  44           1HG      THR  44   3.466   7.316   9.146
  334   1HG2  THR  44          1HG2      THR  44   5.395   5.760  10.928
  335   2HG2  THR  44          2HG2      THR  44   3.946   6.653  11.437
  336   3HG2  THR  44          3HG2      THR  44   4.054   4.911  11.730
  337    H    SER  45           H        SER  45   5.628   2.122   9.364
  338    HA   SER  45           HA       SER  45   4.008   0.780  11.430
  339   1HB   SER  45          2HB       SER  45   3.949  -1.331   9.983
  340   2HB   SER  45          3HB       SER  45   2.885  -0.073   9.446
  341    HG   SER  45           HG       SER  45   5.485  -0.637   8.419
  342    H    ALA  46           H        ALA  46   5.106  -1.413  11.857
  343    HA   ALA  46           HA       ALA  46   8.065  -1.348  11.428
  344   1HB   ALA  46          1HB       ALA  46   7.393  -1.642  13.765
  345   2HB   ALA  46          2HB       ALA  46   6.389  -3.043  13.320
  346   3HB   ALA  46          3HB       ALA  46   8.154  -3.110  13.118
  347    H    LEU  47           H        LEU  47   5.086  -3.385  11.045
  348    HA   LEU  47           HA       LEU  47   6.764  -5.386   9.605
  349   1HB   LEU  47          2HB       LEU  47   5.196  -7.032  10.139
  350   2HB   LEU  47          3HB       LEU  47   5.580  -6.114  11.587
  351    HG   LEU  47           HG       LEU  47   3.359  -4.805  11.091
  352   1HD1  LEU  47          1HD1      LEU  47   1.632  -6.393  10.062
  353   2HD1  LEU  47          2HD1      LEU  47   2.722  -5.697   8.877
  354   3HD1  LEU  47          3HD1      LEU  47   2.973  -7.360   9.437
  355   1HD2  LEU  47          1HD2      LEU  47   2.099  -6.485  12.364
  356   2HD2  LEU  47          2HD2      LEU  47   3.346  -7.702  12.006
  357   3HD2  LEU  47          3HD2      LEU  47   3.735  -6.285  13.009
  358    H    GLY  48           H        GLY  48   3.886  -3.323   9.171
  359   1HA   GLY  48          2HA       GLY  48   2.873  -3.833   6.827
  360   2HA   GLY  48          3HA       GLY  48   3.387  -2.200   7.223
  361    H    GLU  49           H        GLU  49   6.257  -2.635   7.134
  362    HA   GLU  49           HA       GLU  49   6.954  -2.131   4.538
  363   1HB   GLU  49          2HB       GLU  49   8.279  -1.940   6.668
  364   2HB   GLU  49          3HB       GLU  49   8.636  -3.660   6.590
  365   1HG   GLU  49          2HG       GLU  49   9.282  -1.827   4.243
  366   2HG   GLU  49          3HG       GLU  49  10.334  -1.883   5.665
  367    H    GLU  50           H        GLU  50   7.340  -5.426   6.002
  368    HA   GLU  50           HA       GLU  50   7.669  -6.668   3.412
  369   1HB   GLU  50          2HB       GLU  50   8.251  -7.403   6.054
  370   2HB   GLU  50          3HB       GLU  50   6.828  -8.391   5.697
  371   1HG   GLU  50          2HG       GLU  50   8.039  -9.021   3.510
  372   2HG   GLU  50          3HG       GLU  50   9.459  -8.219   4.219
  373    H    GLN  51           H        GLN  51   4.967  -6.348   5.745
  374    HA   GLN  51           HA       GLN  51   3.333  -8.257   4.584
  375   1HB   GLN  51          2HB       GLN  51   3.101  -6.887   6.801
  376   2HB   GLN  51          3HB       GLN  51   2.220  -5.726   5.799
  377   1HG   GLN  51          2HG       GLN  51   1.139  -8.263   5.122
  378   2HG   GLN  51          3HG       GLN  51   1.428  -8.360   6.861
  379   1HE2  GLN  51          1HE2      GLN  51  -1.204  -8.392   5.592
  380   2HE2  GLN  51          2HE2      GLN  51  -2.012  -6.902   6.019
  381    H    LEU  52           H        LEU  52   3.613  -4.781   3.793
  382    HA   LEU  52           HA       LEU  52   1.663  -4.417   1.865
  383   1HB   LEU  52          2HB       LEU  52   4.538  -3.455   2.113
  384   2HB   LEU  52          3HB       LEU  52   3.504  -2.880   0.815
  385    HG   LEU  52           HG       LEU  52   2.543  -2.641   3.668
  386   1HD1  LEU  52          1HD1      LEU  52   4.896  -1.652   3.403
  387   2HD1  LEU  52          2HD1      LEU  52   4.208  -0.549   2.203
  388   3HD1  LEU  52          3HD1      LEU  52   3.645  -0.515   3.891
  389   1HD2  LEU  52          1HD2      LEU  52   2.072  -0.854   1.251
  390   2HD2  LEU  52          2HD2      LEU  52   1.062  -2.250   1.627
  391   3HD2  LEU  52          3HD2      LEU  52   1.165  -0.909   2.782
  392    H    ARG  53           H        ARG  53   4.953  -5.844   1.531
  393    HA   ARG  53           HA       ARG  53   5.010  -6.005  -1.280
  394   1HB   ARG  53          2HB       ARG  53   6.754  -6.641   0.712
  395   2HB   ARG  53          3HB       ARG  53   6.175  -8.259   0.345
  396   1HG   ARG  53          2HG       ARG  53   8.080  -8.004  -0.945
  397   2HG   ARG  53          3HG       ARG  53   6.788  -7.732  -2.126
  398   1HD   ARG  53          2HD       ARG  53   7.169  -5.319  -2.056
  399   2HD   ARG  53          3HD       ARG  53   8.169  -5.453  -0.619
  400    HE   ARG  53           HE       ARG  53   9.916  -6.522  -1.825
  401   1HH1  ARG  53          2HH2      ARG  53   7.852  -4.387  -3.794
  402   2HH1  ARG  53          1HH2      ARG  53   8.543  -4.970  -5.294
  403   1HH2  ARG  53          2HH1      ARG  53  11.259  -6.489  -3.727
  404   2HH2  ARG  53          1HH1      ARG  53  10.756  -5.487  -5.061
  405    H    THR  54           H        THR  54   3.832  -8.312   1.139
  406    HA   THR  54           HA       THR  54   2.898 -10.280  -0.764
  407    HB   THR  54           HB       THR  54   2.138  -9.908   2.167
  408    HG1  THR  54           1HG      THR  54   4.379 -10.148   1.866
  409   1HG2  THR  54          1HG2      THR  54   1.736 -12.355   2.072
  410   2HG2  THR  54          2HG2      THR  54   0.620 -11.480   1.007
  411   3HG2  THR  54          3HG2      THR  54   2.021 -12.337   0.320
  412    H    ALA  55           H        ALA  55   1.166  -7.826   1.215
  413    HA   ALA  55           HA       ALA  55  -1.451  -8.512   0.397
  414   1HB   ALA  55          1HB       ALA  55  -2.073  -6.309   1.302
  415   2HB   ALA  55          2HB       ALA  55  -0.933  -7.140   2.379
  416   3HB   ALA  55          3HB       ALA  55  -0.360  -5.826   1.330
  417    H    ILE  56           H        ILE  56   0.662  -5.864  -0.753
  418    HA   ILE  56           HA       ILE  56  -0.820  -4.989  -2.992
  419    HB   ILE  56           HB       ILE  56   2.190  -5.313  -2.757
  420   1HG1  ILE  56          2HG1      ILE  56   0.625  -2.726  -2.304
  421   2HG1  ILE  56          3HG1      ILE  56   1.081  -3.773  -0.967
  422   1HG2  ILE  56          1HG2      ILE  56   2.424  -4.038  -4.624
  423   2HG2  ILE  56          2HG2      ILE  56   0.961  -4.833  -5.120
  424   3HG2  ILE  56          3HG2      ILE  56   0.838  -3.217  -4.441
  425   1HD1  ILE  56          1HD1      ILE  56   2.686  -1.989  -1.212
  426   2HD1  ILE  56          2HD1      ILE  56   3.466  -3.548  -1.570
  427   3HD1  ILE  56          3HD1      ILE  56   3.019  -2.448  -2.881
  428    H    ALA  57           H        ALA  57   1.710  -7.651  -2.937
  429    HA   ALA  57           HA       ALA  57   1.344  -8.290  -5.640
  430   1HB   ALA  57          1HB       ALA  57   3.199  -9.178  -4.285
  431   2HB   ALA  57          2HB       ALA  57   2.069 -10.174  -3.342
  432   3HB   ALA  57          3HB       ALA  57   2.315 -10.501  -5.067
  433    H    SER  58           H        SER  58  -0.559  -9.379  -2.827
  434    HA   SER  58           HA       SER  58  -2.210 -11.257  -4.131
  435   1HB   SER  58          2HB       SER  58  -2.074 -10.553  -1.608
  436   2HB   SER  58          3HB       SER  58  -3.308  -9.355  -2.043
  437    HG   SER  58           HG       SER  58  -3.494 -12.158  -2.458
  438    H    ALA  59           H        ALA  59  -2.390  -7.682  -4.098
  439    HA   ALA  59           HA       ALA  59  -4.951  -7.563  -5.503
  440   1HB   ALA  59          1HB       ALA  59  -4.183  -5.779  -3.944
  441   2HB   ALA  59          2HB       ALA  59  -2.849  -5.402  -5.065
  442   3HB   ALA  59          3HB       ALA  59  -4.531  -5.170  -5.575
  443    H    GLY  60           H        GLY  60  -1.518  -7.028  -6.326
  444   1HA   GLY  60          2HA       GLY  60  -0.487  -7.505  -8.403
  445   2HA   GLY  60          3HA       GLY  60  -2.052  -7.533  -9.216
  446    H    HIS  61           H        HIS  61   0.243  -5.369  -7.537
  447    HA   HIS  61           HA       HIS  61  -0.305  -3.247  -9.592
  448   1HB   HIS  61          2HB       HIS  61   0.366  -2.867  -6.656
  449   2HB   HIS  61          3HB       HIS  61   0.226  -1.573  -7.847
  450    HD1  HIS  61           1HD      HIS  61  -2.435  -1.425  -8.897
  451    HD2  HIS  61           2HD      HIS  61  -1.683  -3.199  -5.164
  452    HE1  HIS  61           1HE      HIS  61  -4.617  -1.282  -7.557
  453    H    GLU  62           H        GLU  62   1.631  -2.377 -10.547
  454    HA   GLU  62           HA       GLU  62   4.038  -3.935 -10.011
  455   1HB   GLU  62          2HB       GLU  62   3.741  -1.643 -11.974
  456   2HB   GLU  62          3HB       GLU  62   4.880  -2.985 -11.997
  457   1HG   GLU  62          2HG       GLU  62   1.864  -3.230 -12.477
  458   2HG   GLU  62          3HG       GLU  62   3.145  -3.263 -13.687
  459    H    VAL  63           H        VAL  63   3.547  -2.602  -7.746
  460    HA   VAL  63           HA       VAL  63   5.339  -0.221  -7.593
  461    HB   VAL  63           HB       VAL  63   3.196   0.094  -6.567
  462   1HG1  VAL  63          1HG1      VAL  63   2.328  -1.253  -4.741
  463   2HG1  VAL  63          2HG1      VAL  63   2.395  -2.129  -6.268
  464   3HG1  VAL  63          3HG1      VAL  63   3.655  -2.413  -5.037
  465   1HG2  VAL  63          1HG2      VAL  63   3.799   0.635  -4.270
  466   2HG2  VAL  63          2HG2      VAL  63   5.047  -0.615  -4.237
  467   3HG2  VAL  63          3HG2      VAL  63   5.288   0.837  -5.205
  468    H    GLU  64           H        GLU  64   7.158  -0.350  -6.247
  469    HA   GLU  64           HA       GLU  64   7.989  -3.090  -5.577
  470   1HB   GLU  64          2HB       GLU  64   9.548  -0.554  -5.994
  471   2HB   GLU  64          3HB       GLU  64  10.182  -1.812  -4.925
  472   1HG   GLU  64          2HG       GLU  64   9.325  -2.394  -7.788
  473   2HG   GLU  64          3HG       GLU  64  10.991  -2.024  -7.302
  Start of MODEL   15
    1   1H    MET   1           H1       MET   1   8.093   3.445  12.095
    2   2H    MET   1           H2       MET   1   9.586   3.388  12.840
    3   3H    MET   1           H3       MET   1   9.006   4.797  12.182
    4    HA   MET   1           HA       MET   1  10.541   3.938  10.612
    5   1HB   MET   1          2HB       MET   1   8.789   1.441  10.793
    6   2HB   MET   1          3HB       MET   1  10.076   1.693   9.610
    7   1HG   MET   1          2HG       MET   1  11.757   1.732  11.390
    8   2HG   MET   1          3HG       MET   1  10.499   1.581  12.631
    9   1HE   MET   1          1HE       MET   1  11.741  -0.382  13.785
   10   2HE   MET   1          2HE       MET   1  12.290  -1.832  12.915
   11   3HE   MET   1          3HE       MET   1  13.035  -0.255  12.565
   12    H    THR   2           H        THR   2   9.949   4.376   8.314
   13    HA   THR   2           HA       THR   2   7.070   4.462   7.740
   14    HB   THR   2           HB       THR   2   7.789   6.724   8.620
   15    HG1  THR   2           1HG      THR   2   5.964   6.634   7.482
   16   1HG2  THR   2          1HG2      THR   2  10.023   6.852   7.471
   17   2HG2  THR   2          2HG2      THR   2   9.168   7.004   5.917
   18   3HG2  THR   2          3HG2      THR   2   8.965   8.244   7.161
   19    H    ILE   3           H        ILE   3   6.737   3.473   5.900
   20    HA   ILE   3           HA       ILE   3   9.054   2.698   4.190
   21    HB   ILE   3           HB       ILE   3   6.414   1.365   4.939
   22   1HG1  ILE   3          2HG1      ILE   3   7.886  -0.507   5.599
   23   2HG1  ILE   3          3HG1      ILE   3   9.320   0.452   5.240
   24   1HG2  ILE   3          1HG2      ILE   3   7.143  -0.500   3.447
   25   2HG2  ILE   3          2HG2      ILE   3   6.705   0.954   2.566
   26   3HG2  ILE   3          3HG2      ILE   3   8.424   0.544   2.809
   27   1HD1  ILE   3          1HD1      ILE   3   7.240   1.261   7.325
   28   2HD1  ILE   3          2HD1      ILE   3   8.613   0.195   7.681
   29   3HD1  ILE   3          3HD1      ILE   3   8.921   1.846   7.156
   30    H    GLN   4           H        GLN   4   9.094   4.268   2.612
   31    HA   GLN   4           HA       GLN   4   6.598   5.126   1.301
   32   1HB   GLN   4          2HB       GLN   4   8.190   6.876   2.059
   33   2HB   GLN   4          3HB       GLN   4   9.428   6.151   1.013
   34   1HG   GLN   4          2HG       GLN   4   7.351   6.465  -0.784
   35   2HG   GLN   4          3HG       GLN   4   7.044   7.809   0.303
   36   1HE2  GLN   4          1HE2      GLN   4   8.787   9.443   0.571
   37   2HE2  GLN   4          2HE2      GLN   4   9.961   9.619  -0.728
   38    H    LEU   5           H        LEU   5   6.041   3.941  -0.463
   39    HA   LEU   5           HA       LEU   5   8.133   2.767  -2.255
   40   1HB   LEU   5          2HB       LEU   5   5.597   1.691  -1.051
   41   2HB   LEU   5          3HB       LEU   5   5.918   1.294  -2.736
   42    HG   LEU   5           HG       LEU   5   7.904   0.166  -2.247
   43   1HD1  LEU   5          1HD1      LEU   5   9.108   1.414  -0.635
   44   2HD1  LEU   5          2HD1      LEU   5   7.780   1.323   0.550
   45   3HD1  LEU   5          3HD1      LEU   5   8.745  -0.114   0.153
   46   1HD2  LEU   5          1HD2      LEU   5   7.085  -1.593  -0.707
   47   2HD2  LEU   5          2HD2      LEU   5   5.935  -0.427  -0.012
   48   3HD2  LEU   5          3HD2      LEU   5   5.738  -0.982  -1.690
   49    H    THR   6           H        THR   6   7.305   2.480  -4.475
   50    HA   THR   6           HA       THR   6   5.780   4.874  -5.416
   51    HB   THR   6           HB       THR   6   8.200   3.415  -6.558
   52    HG1  THR   6           1HG      THR   6   7.815   5.570  -4.960
   53   1HG2  THR   6          1HG2      THR   6   6.549   5.716  -7.703
   54   2HG2  THR   6          2HG2      THR   6   8.161   5.233  -8.280
   55   3HG2  THR   6          3HG2      THR   6   6.803   4.113  -8.437
   56    H    VAL   7           H        VAL   7   3.911   4.341  -6.308
   57    HA   VAL   7           HA       VAL   7   3.466   1.580  -7.418
   58    HB   VAL   7           HB       VAL   7   2.359   1.701  -5.394
   59   1HG1  VAL   7          1HG1      VAL   7   2.322   4.076  -4.880
   60   2HG1  VAL   7          2HG1      VAL   7   1.123   4.362  -6.140
   61   3HG1  VAL   7          3HG1      VAL   7   0.716   3.372  -4.724
   62   1HG2  VAL   7          1HG2      VAL   7   1.108   0.752  -7.355
   63   2HG2  VAL   7          2HG2      VAL   7   0.114   1.245  -5.973
   64   3HG2  VAL   7          3HG2      VAL   7   0.193   2.255  -7.417
   65    HA   PRO   8           HA       PRO   8   3.139   4.800 -10.691
   66   1HB   PRO   8          2HB       PRO   8   3.840   3.267 -12.853
   67   2HB   PRO   8          3HB       PRO   8   5.021   4.011 -11.736
   68   1HG   PRO   8          2HG       PRO   8   3.985   1.168 -11.688
   69   2HG   PRO   8          3HG       PRO   8   5.678   1.723 -11.565
   70   1HD   PRO   8          2HD       PRO   8   4.203   1.084  -9.387
   71   2HD   PRO   8          3HD       PRO   8   5.382   2.416  -9.331
   72    H    THR   9           H        THR   9   1.817   1.536 -10.485
   73    HA   THR   9           HA       THR   9  -0.354   2.048 -12.355
   74    HB   THR   9           HB       THR   9   0.784  -0.106 -12.202
   75    HG1  THR   9           1HG      THR   9  -1.950  -0.018 -11.507
   76   1HG2  THR   9          1HG2      THR   9   0.123  -1.552 -10.191
   77   2HG2  THR   9          2HG2      THR   9   1.493  -0.442 -10.010
   78   3HG2  THR   9          3HG2      THR   9  -0.082  -0.027  -9.311
   79    H    ILE  10           H        ILE  10  -0.052   3.479  -9.357
   80    HA   ILE  10           HA       ILE  10  -2.329   2.866  -8.056
   81    HB   ILE  10           HB       ILE  10  -0.470   5.035  -8.067
   82   1HG1  ILE  10          2HG1      ILE  10  -2.774   4.215  -6.348
   83   2HG1  ILE  10          3HG1      ILE  10  -1.129   3.648  -6.193
   84   1HG2  ILE  10          1HG2      ILE  10  -3.275   6.197  -7.993
   85   2HG2  ILE  10          2HG2      ILE  10  -1.745   7.029  -7.687
   86   3HG2  ILE  10          3HG2      ILE  10  -2.093   6.444  -9.307
   87   1HD1  ILE  10          1HD1      ILE  10  -2.180   6.406  -5.501
   88   2HD1  ILE  10          2HD1      ILE  10  -1.423   5.215  -4.437
   89   3HD1  ILE  10          3HD1      ILE  10  -0.442   6.061  -5.648
   90    H    ALA  11           H        ALA  11  -4.479   3.417  -8.051
   91    HA   ALA  11           HA       ALA  11  -6.522   3.610  -8.978
   92   1HB   ALA  11          1HB       ALA  11  -7.023   5.633 -10.220
   93   2HB   ALA  11          2HB       ALA  11  -5.883   6.009  -8.916
   94   3HB   ALA  11          3HB       ALA  11  -5.311   5.888 -10.594
   95    H    CYS  12           H        CYS  12  -4.310   1.956 -10.521
   96    HA   CYS  12           HA       CYS  12  -6.094   1.415 -12.849
   97   1HB   CYS  12          2HB       CYS  12  -3.998   2.760 -13.448
   98   2HB   CYS  12          3HB       CYS  12  -3.057   1.333 -12.973
   99    HG   CYS  12           HG       CYS  12  -5.465   1.682 -15.190
  100    H    GLU  13           H        GLU  13  -6.664   0.163 -10.764
  101    HA   GLU  13           HA       GLU  13  -6.437  -2.527 -11.343
  102   1HB   GLU  13          2HB       GLU  13  -4.128  -2.180 -10.210
  103   2HB   GLU  13          3HB       GLU  13  -5.019  -1.977  -8.704
  104   1HG   GLU  13          2HG       GLU  13  -5.161  -4.427 -10.531
  105   2HG   GLU  13          3HG       GLU  13  -4.090  -4.271  -9.135
  106    H    ALA  14           H        ALA  14  -6.848  -2.395  -7.946
  107    HA   ALA  14           HA       ALA  14  -9.690  -1.539  -8.222
  108   1HB   ALA  14          1HB       ALA  14 -10.065  -3.045  -6.369
  109   2HB   ALA  14          2HB       ALA  14  -9.148  -3.888  -7.633
  110   3HB   ALA  14          3HB       ALA  14  -8.319  -3.308  -6.174
  111    H    CYS  15           H        CYS  15  -7.630   0.468  -7.883
  112    HA   CYS  15           HA       CYS  15  -7.432   2.449  -6.846
  113   1HB   CYS  15          2HB       CYS  15  -9.818   2.506  -6.391
  114   2HB   CYS  15          3HB       CYS  15  -9.609   1.593  -4.879
  115    HG   CYS  15           HG       CYS  15  -8.308   3.179  -3.570
  116    H    ALA  16           H        ALA  16  -6.033   3.316  -5.356
  117    HA   ALA  16           HA       ALA  16  -4.046   1.725  -4.318
  118   1HB   ALA  16          1HB       ALA  16  -4.078   4.282  -4.595
  119   2HB   ALA  16          2HB       ALA  16  -4.814   4.354  -2.989
  120   3HB   ALA  16          3HB       ALA  16  -3.206   3.631  -3.194
  121    H    GLU  17           H        GLU  17  -6.736   3.118  -2.392
  122    HA   GLU  17           HA       GLU  17  -6.306   2.098   0.013
  123   1HB   GLU  17          2HB       GLU  17  -8.727   2.955  -1.420
  124   2HB   GLU  17          3HB       GLU  17  -9.085   1.608  -0.351
  125   1HG   GLU  17          2HG       GLU  17  -7.719   2.972   1.436
  126   2HG   GLU  17          3HG       GLU  17  -8.058   4.343   0.381
  127    H    ALA  18           H        ALA  18  -7.129   0.010  -2.725
  128    HA   ALA  18           HA       ALA  18  -8.034  -2.307  -1.443
  129   1HB   ALA  18          1HB       ALA  18  -6.014  -2.055  -3.719
  130   2HB   ALA  18          2HB       ALA  18  -6.926  -3.515  -3.286
  131   3HB   ALA  18          3HB       ALA  18  -7.784  -2.085  -3.881
  132    H    VAL  19           H        VAL  19  -4.683  -0.982  -1.692
  133    HA   VAL  19           HA       VAL  19  -3.584  -3.271  -0.293
  134    HB   VAL  19           HB       VAL  19  -2.306  -1.670  -1.848
  135   1HG1  VAL  19          1HG1      VAL  19  -1.686  -0.267   0.792
  136   2HG1  VAL  19          2HG1      VAL  19  -0.936  -0.005  -0.788
  137   3HG1  VAL  19          3HG1      VAL  19  -2.623   0.479  -0.531
  138   1HG2  VAL  19          1HG2      VAL  19  -1.263  -2.764   0.790
  139   2HG2  VAL  19          2HG2      VAL  19  -1.338  -3.582  -0.779
  140   3HG2  VAL  19          3HG2      VAL  19  -0.235  -2.213  -0.534
  141    H    THR  20           H        THR  20  -4.510   0.061   0.642
  142    HA   THR  20           HA       THR  20  -3.678   0.143   3.286
  143    HB   THR  20           HB       THR  20  -6.214   1.282   2.042
  144    HG1  THR  20           1HG      THR  20  -3.599   2.332   2.387
  145   1HG2  THR  20          1HG2      THR  20  -6.072   3.029   3.776
  146   2HG2  THR  20          2HG2      THR  20  -6.528   1.443   4.386
  147   3HG2  THR  20          3HG2      THR  20  -4.878   2.025   4.645
  148    H    LYS  21           H        LYS  21  -6.818  -1.086   2.029
  149    HA   LYS  21           HA       LYS  21  -7.988  -1.642   4.552
  150   1HB   LYS  21          2HB       LYS  21  -8.358  -3.228   1.990
  151   2HB   LYS  21          3HB       LYS  21  -9.493  -3.123   3.334
  152   1HG   LYS  21          2HG       LYS  21  -8.828  -0.456   2.166
  153   2HG   LYS  21          3HG       LYS  21  -9.443  -1.618   0.986
  154   1HD   LYS  21          2HD       LYS  21 -11.394  -1.977   2.685
  155   2HD   LYS  21          3HD       LYS  21 -10.746  -0.530   3.491
  156   1HE   LYS  21          2HE       LYS  21 -10.805   0.232   0.787
  157   2HE   LYS  21          3HE       LYS  21 -12.217  -0.824   0.890
  158   1HZ   LYS  21          1HZ       LYS  21 -12.805   1.418   1.338
  159   2HZ   LYS  21          2HZ       LYS  21 -12.857   0.682   2.822
  160   3HZ   LYS  21          3HZ       LYS  21 -11.554   1.624   2.353
  161    H    ALA  22           H        ALA  22  -5.858  -3.587   2.439
  162    HA   ALA  22           HA       ALA  22  -6.111  -6.031   4.009
  163   1HB   ALA  22          1HB       ALA  22  -4.195  -6.770   2.620
  164   2HB   ALA  22          2HB       ALA  22  -5.516  -6.086   1.638
  165   3HB   ALA  22          3HB       ALA  22  -4.068  -5.118   1.975
  166    H    VAL  23           H        VAL  23  -3.707  -3.418   3.705
  167    HA   VAL  23           HA       VAL  23  -1.861  -4.468   5.577
  168    HB   VAL  23           HB       VAL  23  -2.298  -1.531   4.938
  169   1HG1  VAL  23          1HG1      VAL  23  -0.610  -2.038   6.744
  170   2HG1  VAL  23          2HG1      VAL  23   0.229  -3.116   5.593
  171   3HG1  VAL  23          3HG1      VAL  23   0.153  -1.384   5.273
  172   1HG2  VAL  23          1HG2      VAL  23  -0.161  -2.912   3.406
  173   2HG2  VAL  23          2HG2      VAL  23  -1.757  -3.431   2.943
  174   3HG2  VAL  23          3HG2      VAL  23  -1.340  -1.701   2.898
  175    H    GLN  24           H        GLN  24  -4.666  -2.311   6.008
  176    HA   GLN  24           HA       GLN  24  -4.298  -2.030   8.859
  177   1HB   GLN  24          2HB       GLN  24  -6.671  -1.626   7.016
  178   2HB   GLN  24          3HB       GLN  24  -6.663  -1.170   8.722
  179   1HG   GLN  24          2HG       GLN  24  -4.433  -0.151   6.908
  180   2HG   GLN  24          3HG       GLN  24  -6.017   0.572   6.824
  181   1HE2  GLN  24          1HE2      GLN  24  -3.067   0.989   8.211
  182   2HE2  GLN  24          2HE2      GLN  24  -3.564   1.830   9.671
  183    H    ASN  25           H        ASN  25  -5.755  -4.585   6.849
  184    HA   ASN  25           HA       ASN  25  -7.311  -5.730   9.019
  185   1HB   ASN  25          2HB       ASN  25  -6.146  -7.060   6.533
  186   2HB   ASN  25          3HB       ASN  25  -7.191  -7.842   7.709
  187   1HD2  ASN  25          1HD2      ASN  25  -7.741  -7.514   4.876
  188   2HD2  ASN  25          2HD2      ASN  25  -9.220  -6.567   4.796
  189    H    GLU  26           H        GLU  26  -4.067  -6.504   7.646
  190    HA   GLU  26           HA       GLU  26  -3.458  -8.369   9.780
  191   1HB   GLU  26          2HB       GLU  26  -1.791  -7.061   7.598
  192   2HB   GLU  26          3HB       GLU  26  -1.201  -8.347   8.664
  193   1HG   GLU  26          2HG       GLU  26  -3.776  -8.845   7.131
  194   2HG   GLU  26          3HG       GLU  26  -2.260  -8.908   6.259
  195    H    ASP  27           H        ASP  27  -2.094  -5.186   8.884
  196    HA   ASP  27           HA       ASP  27  -0.726  -4.967  11.511
  197   1HB   ASP  27          2HB       ASP  27   0.474  -4.836   9.257
  198   2HB   ASP  27          3HB       ASP  27  -0.333  -3.295   8.979
  199    H    ALA  28           H        ALA  28  -3.054  -4.661  12.303
  200    HA   ALA  28           HA       ALA  28  -4.655  -2.469  11.398
  201   1HB   ALA  28          1HB       ALA  28  -6.051  -2.943  13.365
  202   2HB   ALA  28          2HB       ALA  28  -5.573  -4.456  12.568
  203   3HB   ALA  28          3HB       ALA  28  -4.759  -3.945  14.067
  204    H    GLN  29           H        GLN  29  -2.157  -2.645  13.709
  205    HA   GLN  29           HA       GLN  29  -2.522  -0.026  14.921
  206   1HB   GLN  29          2HB       GLN  29  -0.168  -0.555  15.727
  207   2HB   GLN  29          3HB       GLN  29  -1.441  -1.656  16.248
  208   1HG   GLN  29          2HG       GLN  29  -0.563  -3.434  15.125
  209   2HG   GLN  29          3HG       GLN  29  -0.170  -2.459  13.706
  210   1HE2  GLN  29          1HE2      GLN  29   1.847  -2.901  13.201
  211   2HE2  GLN  29          2HE2      GLN  29   3.208  -2.797  14.342
  212    H    ALA  30           H        ALA  30  -1.756  -0.741  11.720
  213    HA   ALA  30           HA       ALA  30   0.519   1.034  11.401
  214   1HB   ALA  30          1HB       ALA  30   0.093   0.611   8.981
  215   2HB   ALA  30          2HB       ALA  30   0.103  -0.903   9.913
  216   3HB   ALA  30          3HB       ALA  30  -1.429  -0.178   9.388
  217    H    THR  31           H        THR  31   0.479   2.926   9.964
  218    HA   THR  31           HA       THR  31  -2.173   4.250   9.584
  219    HB   THR  31           HB       THR  31   0.432   5.430  10.625
  220    HG1  THR  31           1HG      THR  31  -1.480   4.405  11.885
  221   1HG2  THR  31          1HG2      THR  31  -0.445   7.037   8.988
  222   2HG2  THR  31          2HG2      THR  31  -2.079   6.888   9.684
  223   3HG2  THR  31          3HG2      THR  31  -0.763   7.615  10.629
  224    H    VAL  32           H        VAL  32  -2.343   5.345   7.598
  225    HA   VAL  32           HA       VAL  32  -0.183   4.755   5.637
  226    HB   VAL  32           HB       VAL  32  -1.749   4.201   3.995
  227   1HG1  VAL  32          1HG1      VAL  32  -2.884   2.777   6.426
  228   2HG1  VAL  32          2HG1      VAL  32  -2.604   2.147   4.789
  229   3HG1  VAL  32          3HG1      VAL  32  -1.235   2.477   5.858
  230   1HG2  VAL  32          1HG2      VAL  32  -4.184   4.186   4.310
  231   2HG2  VAL  32          2HG2      VAL  32  -4.008   4.922   5.915
  232   3HG2  VAL  32          3HG2      VAL  32  -3.561   5.813   4.442
  233    H    GLN  33           H        GLN  33   0.251   6.355   4.135
  234    HA   GLN  33           HA       GLN  33  -1.450   8.756   3.898
  235   1HB   GLN  33          2HB       GLN  33   1.458   8.690   4.796
  236   2HB   GLN  33          3HB       GLN  33   0.801  10.070   3.904
  237   1HG   GLN  33          2HG       GLN  33  -0.848  10.515   5.626
  238   2HG   GLN  33          3HG       GLN  33  -0.434   9.031   6.489
  239   1HE2  GLN  33          1HE2      GLN  33   1.123  12.102   5.380
  240   2HE2  GLN  33          2HE2      GLN  33   2.155  12.206   6.798
  241    H    VAL  34           H        VAL  34  -2.021   8.080   1.820
  242    HA   VAL  34           HA       VAL  34   0.205   7.546  -0.090
  243    HB   VAL  34           HB       VAL  34  -0.970   5.527   0.198
  244   1HG1  VAL  34          1HG1      VAL  34  -3.387   5.237  -0.219
  245   2HG1  VAL  34          2HG1      VAL  34  -3.048   6.172   1.241
  246   3HG1  VAL  34          3HG1      VAL  34  -3.591   6.995  -0.234
  247   1HG2  VAL  34          1HG2      VAL  34  -0.392   6.248  -2.144
  248   2HG2  VAL  34          2HG2      VAL  34  -1.708   5.069  -2.035
  249   3HG2  VAL  34          3HG2      VAL  34  -2.074   6.777  -2.347
  250    H    ASP  35           H        ASP  35   0.474   8.980  -1.688
  251    HA   ASP  35           HA       ASP  35  -1.539  11.168  -1.883
  252   1HB   ASP  35          2HB       ASP  35   1.195  10.816  -3.097
  253   2HB   ASP  35          3HB       ASP  35   0.152  12.212  -3.334
  254    H    LEU  36           H        LEU  36  -3.172   9.750  -2.828
  255    HA   LEU  36           HA       LEU  36  -2.881   8.542  -5.410
  256   1HB   LEU  36          2HB       LEU  36  -5.348   9.784  -4.115
  257   2HB   LEU  36          3HB       LEU  36  -5.327   8.942  -5.663
  258    HG   LEU  36           HG       LEU  36  -4.105   7.042  -4.137
  259   1HD1  LEU  36          1HD1      LEU  36  -5.348   6.818  -2.033
  260   2HD1  LEU  36          2HD1      LEU  36  -4.445   8.340  -2.031
  261   3HD1  LEU  36          3HD1      LEU  36  -6.193   8.350  -2.331
  262   1HD2  LEU  36          1HD2      LEU  36  -5.980   6.688  -5.679
  263   2HD2  LEU  36          2HD2      LEU  36  -6.316   5.922  -4.120
  264   3HD2  LEU  36          3HD2      LEU  36  -7.097   7.461  -4.532
  265    H    THR  37           H        THR  37  -2.996  11.922  -4.488
  266    HA   THR  37           HA       THR  37  -3.467  13.239  -6.858
  267    HB   THR  37           HB       THR  37  -1.207  13.793  -4.898
  268    HG1  THR  37           1HG      THR  37  -3.983  14.267  -4.531
  269   1HG2  THR  37          1HG2      THR  37  -3.148  15.637  -6.380
  270   2HG2  THR  37          2HG2      THR  37  -1.975  16.158  -5.151
  271   3HG2  THR  37          3HG2      THR  37  -1.405  15.475  -6.681
  272    H    SER  38           H        SER  38  -0.786  11.002  -6.202
  273    HA   SER  38           HA       SER  38   0.267  11.533  -8.881
  274   1HB   SER  38          2HB       SER  38   2.004  11.813  -6.390
  275   2HB   SER  38          3HB       SER  38   2.584  11.791  -8.079
  276    HG   SER  38           HG       SER  38   0.646  13.574  -7.955
  277    H    LYS  39           H        LYS  39   2.469   9.761  -6.944
  278    HA   LYS  39           HA       LYS  39   1.086   7.217  -7.241
  279   1HB   LYS  39          2HB       LYS  39   2.537   6.294  -8.968
  280   2HB   LYS  39          3HB       LYS  39   1.548   7.624  -9.547
  281   1HG   LYS  39          2HG       LYS  39   3.699   9.099  -9.146
  282   2HG   LYS  39          3HG       LYS  39   4.529   7.523  -9.087
  283   1HD   LYS  39          2HD       LYS  39   3.153   7.023 -11.275
  284   2HD   LYS  39          3HD       LYS  39   2.878   8.754 -11.349
  285   1HE   LYS  39          2HE       LYS  39   5.627   7.367 -11.280
  286   2HE   LYS  39          3HE       LYS  39   4.797   7.852 -12.761
  287   1HZ   LYS  39          1HZ       LYS  39   4.919  10.126 -12.055
  288   2HZ   LYS  39          2HZ       LYS  39   5.678   9.706 -10.652
  289   3HZ   LYS  39          3HZ       LYS  39   6.419   9.459 -12.099
  290    H    LYS  40           H        LYS  40   2.152   8.508  -5.085
  291    HA   LYS  40           HA       LYS  40   4.504   6.860  -4.289
  292   1HB   LYS  40          2HB       LYS  40   5.232   8.775  -2.911
  293   2HB   LYS  40          3HB       LYS  40   5.234   9.125  -4.645
  294   1HG   LYS  40          2HG       LYS  40   2.852  10.130  -4.217
  295   2HG   LYS  40          3HG       LYS  40   3.309  10.139  -2.513
  296   1HD   LYS  40          2HD       LYS  40   4.900  11.414  -4.774
  297   2HD   LYS  40          3HD       LYS  40   3.556  12.226  -3.946
  298   1HE   LYS  40          2HE       LYS  40   4.647  12.152  -1.802
  299   2HE   LYS  40          3HE       LYS  40   5.968  11.150  -2.419
  300   1HZ   LYS  40          1HZ       LYS  40   6.674  12.984  -3.757
  301   2HZ   LYS  40          2HZ       LYS  40   5.371  13.895  -3.309
  302   3HZ   LYS  40          3HZ       LYS  40   6.517  13.498  -2.201
  303    H    VAL  41           H        VAL  41   4.136   5.655  -2.503
  304    HA   VAL  41           HA       VAL  41   1.677   6.187  -0.896
  305    HB   VAL  41           HB       VAL  41   1.246   4.230  -2.203
  306   1HG1  VAL  41          1HG1      VAL  41   3.963   3.191  -1.322
  307   2HG1  VAL  41          2HG1      VAL  41   2.734   2.219  -2.151
  308   3HG1  VAL  41          3HG1      VAL  41   3.474   3.586  -2.982
  309   1HG2  VAL  41          1HG2      VAL  41   0.724   4.101   0.273
  310   2HG2  VAL  41          2HG2      VAL  41   0.951   2.528  -0.512
  311   3HG2  VAL  41          3HG2      VAL  41   2.249   3.220   0.476
  312    H    THR  42           H        THR  42   1.990   6.123   1.410
  313    HA   THR  42           HA       THR  42   4.634   5.184   2.341
  314    HB   THR  42           HB       THR  42   3.384   7.890   2.907
  315    HG1  THR  42           1HG      THR  42   5.052   7.045   1.124
  316   1HG2  THR  42          1HG2      THR  42   5.740   6.527   4.276
  317   2HG2  THR  42          2HG2      THR  42   5.333   8.253   4.398
  318   3HG2  THR  42          3HG2      THR  42   4.215   7.044   5.040
  319    H    ILE  43           H        ILE  43   4.361   3.663   3.789
  320    HA   ILE  43           HA       ILE  43   1.900   3.669   5.520
  321    HB   ILE  43           HB       ILE  43   3.612   1.469   4.393
  322   1HG1  ILE  43          2HG1      ILE  43   1.334   0.390   4.085
  323   2HG1  ILE  43          3HG1      ILE  43   0.583   1.822   4.773
  324   1HG2  ILE  43          1HG2      ILE  43   1.873   1.179   6.858
  325   2HG2  ILE  43          2HG2      ILE  43   2.557  -0.157   5.903
  326   3HG2  ILE  43          3HG2      ILE  43   3.636   0.934   6.756
  327   1HD1  ILE  43          1HD1      ILE  43   0.467   1.669   2.283
  328   2HD1  ILE  43          2HD1      ILE  43   1.233   3.154   2.847
  329   3HD1  ILE  43          3HD1      ILE  43   2.238   1.813   2.230
  330    H    THR  44           H        THR  44   2.286   4.132   7.580
  331    HA   THR  44           HA       THR  44   5.072   3.930   8.669
  332    HB   THR  44           HB       THR  44   2.774   5.734   9.501
  333    HG1  THR  44           1HG      THR  44   3.769   6.393   7.609
  334   1HG2  THR  44          1HG2      THR  44   5.649   5.661  10.508
  335   2HG2  THR  44          2HG2      THR  44   4.375   6.779  11.007
  336   3HG2  THR  44          3HG2      THR  44   4.246   5.060  11.421
  337    H    SER  45           H        SER  45   4.997   1.754   9.221
  338    HA   SER  45           HA       SER  45   3.394   1.219  11.617
  339   1HB   SER  45          2HB       SER  45   2.540  -0.838  10.868
  340   2HB   SER  45          3HB       SER  45   2.225   0.240   9.514
  341    HG   SER  45           HG       SER  45   3.232  -1.889   9.158
  342    H    ALA  46           H        ALA  46   4.212  -1.361  12.025
  343    HA   ALA  46           HA       ALA  46   7.095  -1.102  12.545
  344   1HB   ALA  46          1HB       ALA  46   6.794  -3.182  13.794
  345   2HB   ALA  46          2HB       ALA  46   5.602  -1.967  14.298
  346   3HB   ALA  46          3HB       ALA  46   5.115  -3.307  13.232
  347    H    LEU  47           H        LEU  47   4.862  -3.002  10.431
  348    HA   LEU  47           HA       LEU  47   7.280  -4.432   9.332
  349   1HB   LEU  47          2HB       LEU  47   6.045  -6.422   9.116
  350   2HB   LEU  47          3HB       LEU  47   6.001  -5.922  10.795
  351    HG   LEU  47           HG       LEU  47   3.681  -4.949   9.184
  352   1HD1  LEU  47          1HD1      LEU  47   3.987  -7.933   9.672
  353   2HD1  LEU  47          2HD1      LEU  47   2.546  -7.097   9.047
  354   3HD1  LEU  47          3HD1      LEU  47   4.035  -7.137   8.087
  355   1HD2  LEU  47          1HD2      LEU  47   2.421  -5.781  11.129
  356   2HD2  LEU  47          2HD2      LEU  47   3.891  -6.522  11.786
  357   3HD2  LEU  47          3HD2      LEU  47   3.770  -4.753  11.646
  358    H    GLY  48           H        GLY  48   5.976  -1.978   8.401
  359   1HA   GLY  48          2HA       GLY  48   4.038  -2.121   6.569
  360   2HA   GLY  48          3HA       GLY  48   5.409  -1.009   6.399
  361    H    GLU  49           H        GLU  49   7.512  -2.547   5.726
  362    HA   GLU  49           HA       GLU  49   7.118  -2.919   2.979
  363   1HB   GLU  49          2HB       GLU  49   9.231  -2.406   4.369
  364   2HB   GLU  49          3HB       GLU  49   9.378  -4.150   4.606
  365   1HG   GLU  49          2HG       GLU  49   9.394  -4.432   2.102
  366   2HG   GLU  49          3HG       GLU  49   9.271  -2.668   1.932
  367    H    GLU  50           H        GLU  50   7.404  -5.342   5.584
  368    HA   GLU  50           HA       GLU  50   7.222  -7.688   3.952
  369   1HB   GLU  50          2HB       GLU  50   7.245  -7.040   6.841
  370   2HB   GLU  50          3HB       GLU  50   6.080  -8.307   6.468
  371   1HG   GLU  50          2HG       GLU  50   7.815  -9.596   5.277
  372   2HG   GLU  50          3HG       GLU  50   9.019  -8.361   5.707
  373    H    GLN  51           H        GLN  51   4.784  -5.923   5.905
  374    HA   GLN  51           HA       GLN  51   2.592  -7.503   5.253
  375   1HB   GLN  51          2HB       GLN  51   2.917  -5.423   6.915
  376   2HB   GLN  51          3HB       GLN  51   2.290  -4.489   5.572
  377   1HG   GLN  51          2HG       GLN  51   1.007  -6.844   7.003
  378   2HG   GLN  51          3HG       GLN  51   0.444  -5.164   6.994
  379   1HE2  GLN  51          1HE2      GLN  51  -0.449  -8.094   5.813
  380   2HE2  GLN  51          2HE2      GLN  51  -1.123  -7.594   4.278
  381    H    LEU  52           H        LEU  52   3.599  -4.399   3.737
  382    HA   LEU  52           HA       LEU  52   1.804  -4.338   1.653
  383   1HB   LEU  52          2HB       LEU  52   4.655  -3.334   1.943
  384   2HB   LEU  52          3HB       LEU  52   3.696  -2.960   0.523
  385    HG   LEU  52           HG       LEU  52   2.702  -2.332   3.322
  386   1HD1  LEU  52          1HD1      LEU  52   4.875  -1.224   2.879
  387   2HD1  LEU  52          2HD1      LEU  52   4.201  -0.529   1.383
  388   3HD1  LEU  52          3HD1      LEU  52   3.527  -0.080   2.952
  389   1HD2  LEU  52          1HD2      LEU  52   1.245  -0.745   2.131
  390   2HD2  LEU  52          2HD2      LEU  52   1.967  -1.192   0.579
  391   3HD2  LEU  52          3HD2      LEU  52   0.995  -2.362   1.486
  392    H    ARG  53           H        ARG  53   4.991  -6.026   1.718
  393    HA   ARG  53           HA       ARG  53   5.110  -6.929  -0.879
  394   1HB   ARG  53          2HB       ARG  53   6.374  -7.583   1.536
  395   2HB   ARG  53          3HB       ARG  53   5.530  -9.064   1.164
  396   1HG   ARG  53          2HG       ARG  53   7.670  -9.273   0.215
  397   2HG   ARG  53          3HG       ARG  53   6.627  -8.915  -1.174
  398   1HD   ARG  53          2HD       ARG  53   7.343  -6.487  -1.021
  399   2HD   ARG  53          3HD       ARG  53   8.232  -6.860   0.442
  400    HE   ARG  53           HE       ARG  53   9.982  -7.664  -0.716
  401   1HH1  ARG  53          2HH2      ARG  53   7.236  -7.462  -2.902
  402   2HH1  ARG  53          1HH2      ARG  53   8.134  -7.782  -4.354
  403   1HH2  ARG  53          2HH1      ARG  53  11.221  -8.173  -2.597
  404   2HH2  ARG  53          1HH1      ARG  53  10.469  -8.235  -4.159
  405    H    THR  54           H        THR  54   3.187  -8.432   1.768
  406    HA   THR  54           HA       THR  54   1.971 -10.352  -0.001
  407    HB   THR  54           HB       THR  54   1.169  -9.466   2.808
  408    HG1  THR  54           1HG      THR  54   2.896 -11.500   1.842
  409   1HG2  THR  54          1HG2      THR  54   0.184 -11.749   2.937
  410   2HG2  THR  54          2HG2      THR  54  -0.641 -10.740   1.739
  411   3HG2  THR  54          3HG2      THR  54   0.512 -11.986   1.207
  412    H    ALA  55           H        ALA  55   0.710  -7.364   1.615
  413    HA   ALA  55           HA       ALA  55  -1.920  -7.603   0.570
  414   1HB   ALA  55          1HB       ALA  55  -0.344  -5.196   1.543
  415   2HB   ALA  55          2HB       ALA  55  -2.050  -5.130   1.075
  416   3HB   ALA  55          3HB       ALA  55  -1.549  -6.167   2.422
  417    H    ILE  56           H        ILE  56   0.740  -5.492  -0.572
  418    HA   ILE  56           HA       ILE  56  -0.458  -4.516  -2.925
  419    HB   ILE  56           HB       ILE  56   2.457  -5.272  -2.501
  420   1HG1  ILE  56          2HG1      ILE  56   1.050  -2.574  -2.350
  421   2HG1  ILE  56          3HG1      ILE  56   1.549  -3.526  -0.937
  422   1HG2  ILE  56          1HG2      ILE  56   2.971  -3.896  -4.415
  423   2HG2  ILE  56          2HG2      ILE  56   1.830  -5.089  -4.951
  424   3HG2  ILE  56          3HG2      ILE  56   1.251  -3.453  -4.563
  425   1HD1  ILE  56          1HD1      ILE  56   3.191  -1.797  -1.363
  426   2HD1  ILE  56          2HD1      ILE  56   3.919  -3.389  -1.713
  427   3HD1  ILE  56          3HD1      ILE  56   3.393  -2.323  -3.022
  428    H    ALA  57           H        ALA  57   1.335  -7.653  -2.526
  429    HA   ALA  57           HA       ALA  57   0.996  -8.403  -5.267
  430   1HB   ALA  57          1HB       ALA  57   1.399 -10.153  -2.803
  431   2HB   ALA  57          2HB       ALA  57   1.578 -10.670  -4.491
  432   3HB   ALA  57          3HB       ALA  57   2.677  -9.449  -3.821
  433    H    SER  58           H        SER  58  -1.004  -8.924  -2.371
  434    HA   SER  58           HA       SER  58  -2.880 -10.723  -3.464
  435   1HB   SER  58          2HB       SER  58  -2.584 -10.040  -1.024
  436   2HB   SER  58          3HB       SER  58  -3.505  -8.570  -1.398
  437    HG   SER  58           HG       SER  58  -4.419 -11.230  -1.809
  438    H    ALA  59           H        ALA  59  -2.876  -7.123  -3.427
  439    HA   ALA  59           HA       ALA  59  -5.272  -6.856  -5.048
  440   1HB   ALA  59          1HB       ALA  59  -2.923  -4.950  -4.651
  441   2HB   ALA  59          2HB       ALA  59  -4.473  -4.551  -5.420
  442   3HB   ALA  59          3HB       ALA  59  -4.424  -4.995  -3.702
  443    H    GLY  60           H        GLY  60  -1.802  -6.645  -5.812
  444   1HA   GLY  60          2HA       GLY  60  -0.751  -7.745  -7.630
  445   2HA   GLY  60          3HA       GLY  60  -2.247  -7.691  -8.569
  446    H    HIS  61           H        HIS  61  -0.112  -5.341  -6.838
  447    HA   HIS  61           HA       HIS  61  -0.259  -3.538  -9.234
  448   1HB   HIS  61          2HB       HIS  61   0.186  -2.942  -6.310
  449   2HB   HIS  61          3HB       HIS  61   0.527  -1.782  -7.585
  450    HD1  HIS  61           1HD      HIS  61  -1.831  -1.195  -9.151
  451    HD2  HIS  61           2HD      HIS  61  -1.934  -2.326  -5.105
  452    HE1  HIS  61           1HE      HIS  61  -3.768   0.062  -8.088
  453    H    GLU  62           H        GLU  62   1.618  -2.776 -10.129
  454    HA   GLU  62           HA       GLU  62   4.064  -4.283  -9.751
  455   1HB   GLU  62          2HB       GLU  62   3.354  -1.983 -11.637
  456   2HB   GLU  62          3HB       GLU  62   4.739  -3.074 -11.777
  457   1HG   GLU  62          2HG       GLU  62   1.816  -3.959 -11.980
  458   2HG   GLU  62          3HG       GLU  62   2.886  -3.621 -13.340
  459    H    VAL  63           H        VAL  63   3.862  -3.172  -7.476
  460    HA   VAL  63           HA       VAL  63   4.895  -0.429  -7.337
  461    HB   VAL  63           HB       VAL  63   4.561  -2.445  -5.091
  462   1HG1  VAL  63          1HG1      VAL  63   5.921  -0.505  -4.412
  463   2HG1  VAL  63          2HG1      VAL  63   4.679   0.598  -5.046
  464   3HG1  VAL  63          3HG1      VAL  63   4.331  -0.418  -3.657
  465   1HG2  VAL  63          1HG2      VAL  63   2.349  -1.161  -4.750
  466   2HG2  VAL  63          2HG2      VAL  63   2.645  -0.454  -6.347
  467   3HG2  VAL  63          3HG2      VAL  63   2.417  -2.196  -6.183
  468    H    GLU  64           H        GLU  64   6.922   0.272  -6.585
  469    HA   GLU  64           HA       GLU  64   9.022  -1.750  -6.045
  470   1HB   GLU  64          2HB       GLU  64   9.333   0.791  -7.710
  471   2HB   GLU  64          3HB       GLU  64  10.649  -0.238  -7.125
  472   1HG   GLU  64          2HG       GLU  64   9.748  -2.144  -8.450
  473   2HG   GLU  64          3HG       GLU  64   8.464  -1.098  -9.078
  Start of MODEL   16
    1   1H    MET   1           H1       MET   1   8.948   5.185  11.630
    2   2H    MET   1           H2       MET   1  10.464   5.787  11.898
    3   3H    MET   1           H3       MET   1   9.475   6.485  10.767
    4    HA   MET   1           HA       MET   1  11.127   5.155   9.697
    5   1HB   MET   1          2HB       MET   1  11.044   3.603  11.874
    6   2HB   MET   1          3HB       MET   1   9.897   2.667  10.924
    7   1HG   MET   1          2HG       MET   1  12.772   3.386  10.225
    8   2HG   MET   1          3HG       MET   1  12.153   1.804  10.705
    9   1HE   MET   1          1HE       MET   1  13.493   0.729   8.743
   10   2HE   MET   1          2HE       MET   1  13.346   1.239   7.046
   11   3HE   MET   1          3HE       MET   1  14.079   2.335   8.241
   12    H    THR   2           H        THR   2   9.782   6.084   8.014
   13    HA   THR   2           HA       THR   2   7.099   4.853   7.651
   14    HB   THR   2           HB       THR   2   7.259   7.301   8.132
   15    HG1  THR   2           1HG      THR   2   5.443   6.524   7.245
   16   1HG2  THR   2          1HG2      THR   2   8.229   7.540   5.252
   17   2HG2  THR   2          2HG2      THR   2   7.812   8.847   6.366
   18   3HG2  THR   2          3HG2      THR   2   9.247   7.853   6.676
   19    H    ILE   3           H        ILE   3   6.729   3.611   5.910
   20    HA   ILE   3           HA       ILE   3   8.974   3.077   4.078
   21    HB   ILE   3           HB       ILE   3   6.305   1.661   4.404
   22   1HG1  ILE   3          2HG1      ILE   3   7.330   1.541   6.575
   23   2HG1  ILE   3          3HG1      ILE   3   7.491  -0.011   5.768
   24   1HG2  ILE   3          1HG2      ILE   3   8.945   0.795   3.156
   25   2HG2  ILE   3          2HG2      ILE   3   7.515  -0.235   3.381
   26   3HG2  ILE   3          3HG2      ILE   3   7.436   1.169   2.313
   27   1HD1  ILE   3          1HD1      ILE   3   9.533   0.559   6.962
   28   2HD1  ILE   3          2HD1      ILE   3   9.873   0.517   5.227
   29   3HD1  ILE   3          3HD1      ILE   3   9.698   2.074   6.068
   30    H    GLN   4           H        GLN   4   8.995   4.739   2.616
   31    HA   GLN   4           HA       GLN   4   6.554   5.549   1.156
   32   1HB   GLN   4          2HB       GLN   4   9.293   6.658   1.543
   33   2HB   GLN   4          3HB       GLN   4   8.631   6.830  -0.088
   34   1HG   GLN   4          2HG       GLN   4   6.614   7.885   0.737
   35   2HG   GLN   4          3HG       GLN   4   7.131   7.655   2.411
   36   1HE2  GLN   4          1HE2      GLN   4   8.046   9.258  -0.681
   37   2HE2  GLN   4          2HE2      GLN   4   8.884  10.594   0.092
   38    H    LEU   5           H        LEU   5   5.892   4.206  -0.412
   39    HA   LEU   5           HA       LEU   5   7.916   2.999  -2.260
   40   1HB   LEU   5          2HB       LEU   5   5.058   2.156  -1.728
   41   2HB   LEU   5          3HB       LEU   5   6.242   1.294  -2.712
   42    HG   LEU   5           HG       LEU   5   6.565   1.787   0.295
   43   1HD1  LEU   5          1HD1      LEU   5   5.866  -0.533   0.584
   44   2HD1  LEU   5          2HD1      LEU   5   4.583   0.507  -0.076
   45   3HD1  LEU   5          3HD1      LEU   5   5.449  -0.629  -1.145
   46   1HD2  LEU   5          1HD2      LEU   5   8.680   1.356  -0.888
   47   2HD2  LEU   5          2HD2      LEU   5   8.236  -0.029   0.122
   48   3HD2  LEU   5          3HD2      LEU   5   7.982  -0.102  -1.636
   49    H    THR   6           H        THR   6   7.380   2.993  -4.495
   50    HA   THR   6           HA       THR   6   5.698   5.296  -5.400
   51    HB   THR   6           HB       THR   6   8.041   3.865  -6.731
   52    HG1  THR   6           1HG      THR   6   8.512   5.305  -4.971
   53   1HG2  THR   6          1HG2      THR   6   6.359   6.251  -7.628
   54   2HG2  THR   6          2HG2      THR   6   7.875   5.719  -8.388
   55   3HG2  THR   6          3HG2      THR   6   6.456   4.663  -8.426
   56    H    VAL   7           H        VAL   7   3.815   4.649  -6.393
   57    HA   VAL   7           HA       VAL   7   3.607   1.787  -7.212
   58    HB   VAL   7           HB       VAL   7   2.473   1.945  -5.190
   59   1HG1  VAL   7          1HG1      VAL   7   2.304   4.308  -4.778
   60   2HG1  VAL   7          2HG1      VAL   7   1.113   4.500  -6.072
   61   3HG1  VAL   7          3HG1      VAL   7   0.715   3.566  -4.618
   62   1HG2  VAL   7          1HG2      VAL   7   0.282   2.213  -7.248
   63   2HG2  VAL   7          2HG2      VAL   7   1.241   0.753  -6.942
   64   3HG2  VAL   7          3HG2      VAL   7   0.196   1.411  -5.676
   65    HA   PRO   8           HA       PRO   8   3.010   4.553 -10.765
   66   1HB   PRO   8          2HB       PRO   8   3.538   2.806 -12.802
   67   2HB   PRO   8          3HB       PRO   8   4.819   3.532 -11.786
   68   1HG   PRO   8          2HG       PRO   8   3.571   0.793 -11.501
   69   2HG   PRO   8          3HG       PRO   8   5.301   1.224 -11.450
   70   1HD   PRO   8          2HD       PRO   8   3.751   0.870  -9.221
   71   2HD   PRO   8          3HD       PRO   8   5.139   1.981  -9.245
   72    H    THR   9           H        THR   9   1.628   1.403 -10.162
   73    HA   THR   9           HA       THR   9  -0.588   1.616 -11.965
   74    HB   THR   9           HB       THR   9   0.657  -0.382 -11.585
   75    HG1  THR   9           1HG      THR   9  -0.884  -1.760 -11.442
   76   1HG2  THR   9          1HG2      THR   9  -0.069   0.083  -8.690
   77   2HG2  THR   9          2HG2      THR   9   0.134  -1.544  -9.327
   78   3HG2  THR   9          3HG2      THR   9   1.489  -0.420  -9.405
   79    H    ILE  10           H        ILE  10  -0.210   3.375  -9.119
   80    HA   ILE  10           HA       ILE  10  -2.661   3.064  -7.891
   81    HB   ILE  10           HB       ILE  10  -0.646   5.169  -8.110
   82   1HG1  ILE  10          2HG1      ILE  10  -2.825   4.423  -6.150
   83   2HG1  ILE  10          3HG1      ILE  10  -1.175   3.831  -6.157
   84   1HG2  ILE  10          1HG2      ILE  10  -2.344   6.528  -9.260
   85   2HG2  ILE  10          2HG2      ILE  10  -3.499   6.225  -7.933
   86   3HG2  ILE  10          3HG2      ILE  10  -2.015   7.137  -7.647
   87   1HD1  ILE  10          1HD1      ILE  10  -0.426   6.253  -5.723
   88   2HD1  ILE  10          2HD1      ILE  10  -2.141   6.638  -5.455
   89   3HD1  ILE  10          3HD1      ILE  10  -1.317   5.476  -4.410
   90    H    ALA  11           H        ALA  11  -4.714   3.739  -8.184
   91    HA   ALA  11           HA       ALA  11  -6.637   3.950  -9.321
   92   1HB   ALA  11          1HB       ALA  11  -5.884   6.308  -9.237
   93   2HB   ALA  11          2HB       ALA  11  -5.141   6.118 -10.842
   94   3HB   ALA  11          3HB       ALA  11  -6.899   5.969 -10.651
   95    H    CYS  12           H        CYS  12  -4.385   2.166 -10.602
   96    HA   CYS  12           HA       CYS  12  -5.628   1.963 -13.312
   97   1HB   CYS  12          2HB       CYS  12  -3.157   2.370 -13.127
   98   2HB   CYS  12          3HB       CYS  12  -3.008   0.784 -12.337
   99    HG   CYS  12           HG       CYS  12  -4.414   1.484 -15.229
  100    H    GLU  13           H        GLU  13  -4.520  -0.024 -10.528
  101    HA   GLU  13           HA       GLU  13  -5.937  -2.353 -11.606
  102   1HB   GLU  13          2HB       GLU  13  -3.623  -2.070 -10.149
  103   2HB   GLU  13          3HB       GLU  13  -4.756  -2.607  -8.890
  104   1HG   GLU  13          2HG       GLU  13  -4.216  -4.001 -11.524
  105   2HG   GLU  13          3HG       GLU  13  -3.611  -4.471  -9.932
  106    H    ALA  14           H        ALA  14  -6.030  -1.292  -8.175
  107    HA   ALA  14           HA       ALA  14  -8.952  -0.755  -8.390
  108   1HB   ALA  14          1HB       ALA  14  -7.679  -2.689  -6.409
  109   2HB   ALA  14          2HB       ALA  14  -9.399  -2.249  -6.504
  110   3HB   ALA  14          3HB       ALA  14  -8.644  -3.160  -7.825
  111    H    CYS  15           H        CYS  15  -6.459   0.861  -7.949
  112    HA   CYS  15           HA       CYS  15  -5.855   2.690  -6.797
  113   1HB   CYS  15          2HB       CYS  15  -8.445   2.438  -5.200
  114   2HB   CYS  15          3HB       CYS  15  -7.297   3.773  -5.119
  115    HG   CYS  15           HG       CYS  15  -9.364   4.492  -6.471
  116    H    ALA  16           H        ALA  16  -4.382   3.086  -5.192
  117    HA   ALA  16           HA       ALA  16  -3.512   0.862  -3.632
  118   1HB   ALA  16          1HB       ALA  16  -1.961   2.575  -2.619
  119   2HB   ALA  16          2HB       ALA  16  -1.927   2.466  -4.391
  120   3HB   ALA  16          3HB       ALA  16  -2.805   3.798  -3.610
  121    H    GLU  17           H        GLU  17  -5.985   3.270  -2.905
  122    HA   GLU  17           HA       GLU  17  -5.863   2.963  -0.089
  123   1HB   GLU  17          2HB       GLU  17  -8.077   3.791   0.019
  124   2HB   GLU  17          3HB       GLU  17  -7.138   4.701  -1.153
  125   1HG   GLU  17          2HG       GLU  17  -9.012   4.483  -2.416
  126   2HG   GLU  17          3HG       GLU  17  -8.320   2.910  -2.849
  127    H    ALA  18           H        ALA  18  -6.940   0.738  -2.650
  128    HA   ALA  18           HA       ALA  18  -8.262  -1.177  -1.049
  129   1HB   ALA  18          1HB       ALA  18  -8.192  -1.210  -3.525
  130   2HB   ALA  18          2HB       ALA  18  -6.476  -1.664  -3.475
  131   3HB   ALA  18          3HB       ALA  18  -7.698  -2.759  -2.814
  132    H    VAL  19           H        VAL  19  -4.749  -1.071  -2.011
  133    HA   VAL  19           HA       VAL  19  -4.056  -3.275  -0.405
  134    HB   VAL  19           HB       VAL  19  -2.588  -2.169  -2.184
  135   1HG1  VAL  19          1HG1      VAL  19  -0.700  -0.859  -1.313
  136   2HG1  VAL  19          2HG1      VAL  19  -2.181   0.064  -1.113
  137   3HG1  VAL  19          3HG1      VAL  19  -1.441  -0.748   0.284
  138   1HG2  VAL  19          1HG2      VAL  19  -1.494  -3.239   0.463
  139   2HG2  VAL  19          2HG2      VAL  19  -2.091  -4.219  -0.891
  140   3HG2  VAL  19          3HG2      VAL  19  -0.640  -3.228  -1.076
  141    H    THR  20           H        THR  20  -4.262   0.179   0.316
  142    HA   THR  20           HA       THR  20  -3.185   0.221   2.903
  143    HB   THR  20           HB       THR  20  -5.586   1.832   1.933
  144    HG1  THR  20           1HG      THR  20  -3.788   2.078   0.543
  145   1HG2  THR  20          1HG2      THR  20  -4.748   3.512   3.512
  146   2HG2  THR  20          2HG2      THR  20  -5.329   2.041   4.320
  147   3HG2  THR  20          3HG2      THR  20  -3.583   2.306   4.105
  148    H    LYS  21           H        LYS  21  -6.650  -0.471   2.019
  149    HA   LYS  21           HA       LYS  21  -7.309  -0.976   4.780
  150   1HB   LYS  21          2HB       LYS  21  -9.023  -2.241   2.688
  151   2HB   LYS  21          3HB       LYS  21  -9.444  -1.418   4.194
  152   1HG   LYS  21          2HG       LYS  21  -8.387   0.690   2.839
  153   2HG   LYS  21          3HG       LYS  21  -8.843  -0.380   1.485
  154   1HD   LYS  21          2HD       LYS  21 -11.213  -0.365   2.536
  155   2HD   LYS  21          3HD       LYS  21 -10.603   0.993   3.528
  156   1HE   LYS  21          2HE       LYS  21  -9.655   1.899   1.224
  157   2HE   LYS  21          3HE       LYS  21 -10.752   0.721   0.488
  158   1HZ   LYS  21          1HZ       LYS  21 -11.546   2.918   0.559
  159   2HZ   LYS  21          2HZ       LYS  21 -12.578   1.942   1.408
  160   3HZ   LYS  21          3HZ       LYS  21 -11.546   2.984   2.198
  161    H    ALA  22           H        ALA  22  -6.267  -3.072   2.088
  162    HA   ALA  22           HA       ALA  22  -6.703  -5.586   3.337
  163   1HB   ALA  22          1HB       ALA  22  -4.426  -4.790   1.482
  164   2HB   ALA  22          2HB       ALA  22  -4.984  -6.435   1.830
  165   3HB   ALA  22          3HB       ALA  22  -6.048  -5.303   0.962
  166    H    VAL  23           H        VAL  23  -3.779  -3.517   3.335
  167    HA   VAL  23           HA       VAL  23  -2.166  -5.082   5.039
  168    HB   VAL  23           HB       VAL  23  -2.266  -2.076   4.559
  169   1HG1  VAL  23          1HG1      VAL  23   0.156  -2.106   5.199
  170   2HG1  VAL  23          2HG1      VAL  23  -0.919  -2.447   6.569
  171   3HG1  VAL  23          3HG1      VAL  23  -0.037  -3.770   5.768
  172   1HG2  VAL  23          1HG2      VAL  23  -0.887  -2.367   2.768
  173   2HG2  VAL  23          2HG2      VAL  23  -0.153  -3.866   3.383
  174   3HG2  VAL  23          3HG2      VAL  23  -1.747  -3.907   2.641
  175    H    GLN  24           H        GLN  24  -4.472  -2.429   5.764
  176    HA   GLN  24           HA       GLN  24  -4.136  -2.447   8.587
  177   1HB   GLN  24          2HB       GLN  24  -6.512  -1.703   6.870
  178   2HB   GLN  24          3HB       GLN  24  -6.427  -1.386   8.597
  179   1HG   GLN  24          2HG       GLN  24  -4.112  -0.400   6.924
  180   2HG   GLN  24          3HG       GLN  24  -5.662   0.405   6.728
  181   1HE2  GLN  24          1HE2      GLN  24  -2.827   0.516   8.523
  182   2HE2  GLN  24          2HE2      GLN  24  -3.456   1.536   9.803
  183    H    ASN  25           H        ASN  25  -5.561  -5.010   6.659
  184    HA   ASN  25           HA       ASN  25  -7.378  -5.994   8.685
  185   1HB   ASN  25          2HB       ASN  25  -5.728  -7.607   6.681
  186   2HB   ASN  25          3HB       ASN  25  -7.078  -8.189   7.643
  187   1HD2  ASN  25          1HD2      ASN  25  -8.563  -5.488   7.132
  188   2HD2  ASN  25          2HD2      ASN  25  -9.197  -5.746   5.521
  189    H    GLU  26           H        GLU  26  -3.926  -6.728   7.978
  190    HA   GLU  26           HA       GLU  26  -3.577  -8.186  10.495
  191   1HB   GLU  26          2HB       GLU  26  -1.628  -7.193   8.363
  192   2HB   GLU  26          3HB       GLU  26  -1.188  -8.208   9.743
  193   1HG   GLU  26          2HG       GLU  26  -3.340  -9.145   7.798
  194   2HG   GLU  26          3HG       GLU  26  -1.630  -9.292   7.408
  195    H    ASP  27           H        ASP  27  -2.329  -5.165   9.015
  196    HA   ASP  27           HA       ASP  27  -1.001  -4.454  11.483
  197   1HB   ASP  27          2HB       ASP  27  -0.096  -4.394   9.055
  198   2HB   ASP  27          3HB       ASP  27  -1.091  -2.960   8.817
  199    H    ALA  28           H        ALA  28  -3.394  -4.377  12.317
  200    HA   ALA  28           HA       ALA  28  -5.191  -2.397  11.316
  201   1HB   ALA  28          1HB       ALA  28  -5.901  -4.490  12.428
  202   2HB   ALA  28          2HB       ALA  28  -5.225  -3.906  13.967
  203   3HB   ALA  28          3HB       ALA  28  -6.603  -3.066  13.221
  204    H    GLN  29           H        GLN  29  -2.596  -2.148  13.491
  205    HA   GLN  29           HA       GLN  29  -3.601   0.333  14.769
  206   1HB   GLN  29          2HB       GLN  29  -1.725  -0.039  16.286
  207   2HB   GLN  29          3HB       GLN  29  -2.873  -1.371  16.275
  208   1HG   GLN  29          2HG       GLN  29  -1.313  -2.747  14.955
  209   2HG   GLN  29          3HG       GLN  29  -0.218  -1.367  14.761
  210   1HE2  GLN  29          1HE2      GLN  29  -1.918  -3.113  17.461
  211   2HE2  GLN  29          2HE2      GLN  29  -0.504  -3.129  18.501
  212    H    ALA  30           H        ALA  30  -2.007  -0.370  11.896
  213    HA   ALA  30           HA       ALA  30   0.206   1.519  12.249
  214   1HB   ALA  30          1HB       ALA  30  -0.789  -0.168   9.934
  215   2HB   ALA  30          2HB       ALA  30   0.509   1.031   9.761
  216   3HB   ALA  30          3HB       ALA  30   0.692  -0.281  10.927
  217    H    THR  31           H        THR  31   0.599   3.226  10.664
  218    HA   THR  31           HA       THR  31  -1.865   4.859  10.165
  219    HB   THR  31           HB       THR  31   0.973   5.670  10.860
  220    HG1  THR  31           1HG      THR  31  -0.535   4.914  12.510
  221   1HG2  THR  31          1HG2      THR  31   0.039   7.321   9.270
  222   2HG2  THR  31          2HG2      THR  31  -1.457   7.407  10.231
  223   3HG2  THR  31          3HG2      THR  31   0.075   7.988  10.909
  224    H    VAL  32           H        VAL  32  -2.096   5.721   8.128
  225    HA   VAL  32           HA       VAL  32  -0.287   4.692   5.995
  226    HB   VAL  32           HB       VAL  32  -2.354   4.089   4.785
  227   1HG1  VAL  32          1HG1      VAL  32  -1.162   2.312   5.930
  228   2HG1  VAL  32          2HG1      VAL  32  -1.911   2.711   7.483
  229   3HG1  VAL  32          3HG1      VAL  32  -2.890   2.036   6.191
  230   1HG2  VAL  32          1HG2      VAL  32  -4.028   5.501   5.937
  231   2HG2  VAL  32          2HG2      VAL  32  -4.484   3.802   6.019
  232   3HG2  VAL  32          3HG2      VAL  32  -3.793   4.581   7.440
  233    H    GLN  33           H        GLN  33   0.070   6.183   4.300
  234    HA   GLN  33           HA       GLN  33  -1.792   8.466   3.979
  235   1HB   GLN  33          2HB       GLN  33   1.140   8.556   4.738
  236   2HB   GLN  33          3HB       GLN  33   0.528   9.758   3.599
  237   1HG   GLN  33          2HG       GLN  33  -0.642   9.269   6.370
  238   2HG   GLN  33          3HG       GLN  33   0.508  10.543   5.956
  239   1HE2  GLN  33          1HE2      GLN  33  -2.621  10.332   6.682
  240   2HE2  GLN  33          2HE2      GLN  33  -3.265  11.530   5.572
  241    H    VAL  34           H        VAL  34  -2.509   7.998   1.960
  242    HA   VAL  34           HA       VAL  34  -0.500   7.112  -0.055
  243    HB   VAL  34           HB       VAL  34  -2.042   5.360   0.511
  244   1HG1  VAL  34          1HG1      VAL  34  -4.302   7.086  -0.550
  245   2HG1  VAL  34          2HG1      VAL  34  -4.386   5.391  -0.054
  246   3HG1  VAL  34          3HG1      VAL  34  -4.062   6.644   1.156
  247   1HG2  VAL  34          1HG2      VAL  34  -2.671   6.407  -2.272
  248   2HG2  VAL  34          2HG2      VAL  34  -1.089   5.747  -1.819
  249   3HG2  VAL  34          3HG2      VAL  34  -2.537   4.733  -1.683
  250    H    ASP  35           H        ASP  35  -0.003   8.591  -1.538
  251    HA   ASP  35           HA       ASP  35  -1.569  11.087  -1.410
  252   1HB   ASP  35          2HB       ASP  35   0.927  10.936  -1.049
  253   2HB   ASP  35          3HB       ASP  35   1.039  10.475  -2.758
  254    H    LEU  36           H        LEU  36  -3.322   9.923  -2.508
  255    HA   LEU  36           HA       LEU  36  -3.303   8.838  -5.071
  256   1HB   LEU  36          2HB       LEU  36  -5.506  10.520  -3.822
  257   2HB   LEU  36          3HB       LEU  36  -5.682   9.468  -5.225
  258    HG   LEU  36           HG       LEU  36  -4.502   7.853  -3.170
  259   1HD1  LEU  36          1HD1      LEU  36  -6.266   7.995  -1.426
  260   2HD1  LEU  36          2HD1      LEU  36  -5.354   9.514  -1.528
  261   3HD1  LEU  36          3HD1      LEU  36  -6.973   9.399  -2.243
  262   1HD2  LEU  36          1HD2      LEU  36  -6.578   6.562  -3.417
  263   2HD2  LEU  36          2HD2      LEU  36  -7.345   7.920  -4.268
  264   3HD2  LEU  36          3HD2      LEU  36  -5.966   7.070  -5.003
  265    H    THR  37           H        THR  37  -3.037  12.250  -4.229
  266    HA   THR  37           HA       THR  37  -3.410  13.708  -6.456
  267    HB   THR  37           HB       THR  37  -0.827  13.709  -4.864
  268    HG1  THR  37           1HG      THR  37  -1.887  13.904  -3.132
  269   1HG2  THR  37          1HG2      THR  37  -1.133  16.144  -4.856
  270   2HG2  THR  37          2HG2      THR  37  -1.071  15.523  -6.515
  271   3HG2  THR  37          3HG2      THR  37  -2.633  15.979  -5.794
  272    H    SER  38           H        SER  38  -0.896  11.164  -6.069
  273    HA   SER  38           HA       SER  38  -0.278  11.470  -8.942
  274   1HB   SER  38          2HB       SER  38   1.894  11.723  -6.830
  275   2HB   SER  38          3HB       SER  38   2.137  11.608  -8.593
  276    HG   SER  38           HG       SER  38   0.378  13.508  -8.241
  277    H    LYS  39           H        LYS  39   1.995   9.639  -7.003
  278    HA   LYS  39           HA       LYS  39   0.656   7.107  -7.545
  279   1HB   LYS  39          2HB       LYS  39   2.269   6.370  -9.260
  280   2HB   LYS  39          3HB       LYS  39   1.213   7.674  -9.780
  281   1HG   LYS  39          2HG       LYS  39   3.246   9.238  -9.074
  282   2HG   LYS  39          3HG       LYS  39   4.182   7.750  -9.213
  283   1HD   LYS  39          2HD       LYS  39   2.397   9.023 -11.354
  284   2HD   LYS  39          3HD       LYS  39   4.165   9.132 -11.284
  285   1HE   LYS  39          2HE       LYS  39   4.305   6.634 -11.515
  286   2HE   LYS  39          3HE       LYS  39   2.533   6.569 -11.665
  287   1HZ   LYS  39          1HZ       LYS  39   3.631   6.516 -13.782
  288   2HZ   LYS  39          2HZ       LYS  39   2.669   7.838 -13.650
  289   3HZ   LYS  39          3HZ       LYS  39   4.306   7.993 -13.526
  290    H    LYS  40           H        LYS  40   1.528   8.145  -5.162
  291    HA   LYS  40           HA       LYS  40   3.871   6.474  -4.440
  292   1HB   LYS  40          2HB       LYS  40   4.834   8.412  -3.242
  293   2HB   LYS  40          3HB       LYS  40   4.704   8.676  -4.984
  294   1HG   LYS  40          2HG       LYS  40   2.362   9.787  -4.334
  295   2HG   LYS  40          3HG       LYS  40   3.100   9.911  -2.735
  296   1HD   LYS  40          2HD       LYS  40   4.547  10.893  -5.209
  297   2HD   LYS  40          3HD       LYS  40   3.183  11.821  -4.598
  298   1HE   LYS  40          2HE       LYS  40   5.277  11.004  -2.587
  299   2HE   LYS  40          3HE       LYS  40   5.712  12.275  -3.738
  300   1HZ   LYS  40          1HZ       LYS  40   4.615  13.031  -1.598
  301   2HZ   LYS  40          2HZ       LYS  40   3.975  13.620  -2.998
  302   3HZ   LYS  40          3HZ       LYS  40   3.187  12.482  -2.242
  303    H    VAL  41           H        VAL  41   3.868   5.733  -2.283
  304    HA   VAL  41           HA       VAL  41   1.482   6.351  -0.651
  305    HB   VAL  41           HB       VAL  41   0.830   4.484  -2.078
  306   1HG1  VAL  41          1HG1      VAL  41   3.111   3.520  -2.525
  307   2HG1  VAL  41          2HG1      VAL  41   3.093   2.863  -0.870
  308   3HG1  VAL  41          3HG1      VAL  41   1.892   2.327  -2.058
  309   1HG2  VAL  41          1HG2      VAL  41   0.083   4.596   0.325
  310   2HG2  VAL  41          2HG2      VAL  41   0.089   2.958  -0.355
  311   3HG2  VAL  41          3HG2      VAL  41   1.385   3.471   0.740
  312    H    THR  42           H        THR  42   1.833   6.236   1.550
  313    HA   THR  42           HA       THR  42   4.625   5.682   2.414
  314    HB   THR  42           HB       THR  42   2.785   8.019   3.098
  315    HG1  THR  42           1HG      THR  42   3.731   8.103   1.039
  316   1HG2  THR  42          1HG2      THR  42   4.125   7.526   5.026
  317   2HG2  THR  42          2HG2      THR  42   5.588   7.319   4.038
  318   3HG2  THR  42          3HG2      THR  42   4.845   8.925   4.211
  319    H    ILE  43           H        ILE  43   4.485   3.999   3.833
  320    HA   ILE  43           HA       ILE  43   2.025   3.741   5.549
  321    HB   ILE  43           HB       ILE  43   3.901   1.604   4.521
  322   1HG1  ILE  43          2HG1      ILE  43   2.524   2.561   2.680
  323   2HG1  ILE  43          3HG1      ILE  43   2.135   0.891   3.031
  324   1HG2  ILE  43          1HG2      ILE  43   2.113   0.047   5.367
  325   2HG2  ILE  43          2HG2      ILE  43   2.992   0.917   6.630
  326   3HG2  ILE  43          3HG2      ILE  43   1.358   1.435   6.180
  327   1HD1  ILE  43          1HD1      ILE  43   0.462   3.245   3.977
  328   2HD1  ILE  43          2HD1      ILE  43   0.130   2.212   2.581
  329   3HD1  ILE  43          3HD1      ILE  43   0.104   1.511   4.199
  330    H    THR  44           H        THR  44   2.372   4.215   7.621
  331    HA   THR  44           HA       THR  44   5.128   4.023   8.754
  332    HB   THR  44           HB       THR  44   2.684   5.612   9.541
  333    HG1  THR  44           1HG      THR  44   3.972   7.313   8.936
  334   1HG2  THR  44          1HG2      THR  44   3.872   4.928  11.601
  335   2HG2  THR  44          2HG2      THR  44   5.423   5.421  10.883
  336   3HG2  THR  44          3HG2      THR  44   4.183   6.636  11.265
  337    H    SER  45           H        SER  45   5.329   1.959   9.326
  338    HA   SER  45           HA       SER  45   3.774   0.943  11.575
  339   1HB   SER  45          2HB       SER  45   3.373  -1.244  10.509
  340   2HB   SER  45          3HB       SER  45   2.642  -0.009   9.485
  341    HG   SER  45           HG       SER  45   4.418  -0.066   8.152
  342    H    ALA  46           H        ALA  46   5.052  -1.414  11.924
  343    HA   ALA  46           HA       ALA  46   7.976  -0.846  11.796
  344   1HB   ALA  46          1HB       ALA  46   6.428  -3.026  13.241
  345   2HB   ALA  46          2HB       ALA  46   8.179  -2.735  13.324
  346   3HB   ALA  46          3HB       ALA  46   7.051  -1.523  13.963
  347    H    LEU  47           H        LEU  47   5.470  -2.956  10.442
  348    HA   LEU  47           HA       LEU  47   7.546  -4.681   9.139
  349   1HB   LEU  47          2HB       LEU  47   5.710  -6.423   9.184
  350   2HB   LEU  47          3HB       LEU  47   6.509  -6.022  10.694
  351    HG   LEU  47           HG       LEU  47   4.635  -4.797  11.528
  352   1HD1  LEU  47          1HD1      LEU  47   3.725  -3.659   9.540
  353   2HD1  LEU  47          2HD1      LEU  47   3.279  -5.222   8.832
  354   3HD1  LEU  47          3HD1      LEU  47   2.479  -4.654  10.295
  355   1HD2  LEU  47          1HD2      LEU  47   4.600  -7.273  11.696
  356   2HD2  LEU  47          2HD2      LEU  47   2.964  -6.593  11.617
  357   3HD2  LEU  47          3HD2      LEU  47   3.674  -7.356  10.182
  358    H    GLY  48           H        GLY  48   5.780  -2.155   8.308
  359   1HA   GLY  48          2HA       GLY  48   3.927  -2.621   6.489
  360   2HA   GLY  48          3HA       GLY  48   5.112  -1.315   6.300
  361    H    GLU  49           H        GLU  49   7.378  -2.271   5.500
  362    HA   GLU  49           HA       GLU  49   7.157  -2.783   2.829
  363   1HB   GLU  49          2HB       GLU  49   9.155  -2.106   4.237
  364   2HB   GLU  49          3HB       GLU  49   9.399  -3.808   4.630
  365   1HG   GLU  49          2HG       GLU  49   9.620  -4.295   2.172
  366   2HG   GLU  49          3HG       GLU  49   9.385  -2.568   1.835
  367    H    GLU  50           H        GLU  50   7.722  -5.275   5.336
  368    HA   GLU  50           HA       GLU  50   7.707  -7.528   3.628
  369   1HB   GLU  50          2HB       GLU  50   8.324  -7.024   6.272
  370   2HB   GLU  50          3HB       GLU  50   6.776  -7.842   6.476
  371   1HG   GLU  50          2HG       GLU  50   7.677  -9.720   5.060
  372   2HG   GLU  50          3HG       GLU  50   9.225  -8.847   4.978
  373    H    GLN  51           H        GLN  51   5.136  -6.192   5.755
  374    HA   GLN  51           HA       GLN  51   3.180  -8.096   5.109
  375   1HB   GLN  51          2HB       GLN  51   3.362  -6.236   6.939
  376   2HB   GLN  51          3HB       GLN  51   2.502  -5.203   5.803
  377   1HG   GLN  51          2HG       GLN  51   1.640  -7.894   6.956
  378   2HG   GLN  51          3HG       GLN  51   0.972  -6.312   7.386
  379   1HE2  GLN  51          1HE2      GLN  51  -0.146  -8.931   5.999
  380   2HE2  GLN  51          2HE2      GLN  51  -1.029  -8.257   4.647
  381    H    LEU  52           H        LEU  52   3.604  -4.804   3.813
  382    HA   LEU  52           HA       LEU  52   1.784  -4.703   1.753
  383   1HB   LEU  52          2HB       LEU  52   4.610  -3.613   1.961
  384   2HB   LEU  52          3HB       LEU  52   3.522  -3.164   0.663
  385    HG   LEU  52           HG       LEU  52   2.621  -2.809   3.520
  386   1HD1  LEU  52          1HD1      LEU  52   4.921  -1.646   2.965
  387   2HD1  LEU  52          2HD1      LEU  52   3.936  -0.559   1.985
  388   3HD1  LEU  52          3HD1      LEU  52   3.627  -0.724   3.725
  389   1HD2  LEU  52          1HD2      LEU  52   1.017  -2.622   1.556
  390   2HD2  LEU  52          2HD2      LEU  52   1.151  -1.154   2.543
  391   3HD2  LEU  52          3HD2      LEU  52   1.969  -1.259   0.969
  392    H    ARG  53           H        ARG  53   5.132  -6.088   1.588
  393    HA   ARG  53           HA       ARG  53   5.181  -6.786  -1.068
  394   1HB   ARG  53          2HB       ARG  53   6.716  -7.425   1.172
  395   2HB   ARG  53          3HB       ARG  53   6.032  -8.981   0.773
  396   1HG   ARG  53          2HG       ARG  53   8.094  -8.865  -0.391
  397   2HG   ARG  53          3HG       ARG  53   6.887  -8.513  -1.648
  398   1HD   ARG  53          2HD       ARG  53   7.236  -6.053  -1.153
  399   2HD   ARG  53          3HD       ARG  53   8.532  -6.488  -0.026
  400    HE   ARG  53           HE       ARG  53   9.318  -7.693  -2.365
  401   1HH1  ARG  53          2HH2      ARG  53   8.473  -4.337  -1.432
  402   2HH1  ARG  53          1HH2      ARG  53   9.106  -3.681  -2.938
  403   1HH2  ARG  53          2HH1      ARG  53  10.432  -6.620  -4.222
  404   2HH2  ARG  53          1HH1      ARG  53  10.180  -4.872  -4.344
  405    H    THR  54           H        THR  54   3.652  -8.747   1.525
  406    HA   THR  54           HA       THR  54   2.508 -10.607  -0.367
  407    HB   THR  54           HB       THR  54   1.703 -10.122   2.531
  408    HG1  THR  54           1HG      THR  54   3.833 -11.558   1.350
  409   1HG2  THR  54          1HG2      THR  54   1.160 -12.547   2.442
  410   2HG2  THR  54          2HG2      THR  54   0.171 -11.625   1.295
  411   3HG2  THR  54          3HG2      THR  54   1.554 -12.578   0.711
  412    H    ALA  55           H        ALA  55   1.082  -7.901   1.568
  413    HA   ALA  55           HA       ALA  55  -1.583  -8.387   0.743
  414   1HB   ALA  55          1HB       ALA  55  -1.088  -7.070   2.700
  415   2HB   ALA  55          2HB       ALA  55  -0.294  -5.814   1.723
  416   3HB   ALA  55          3HB       ALA  55  -2.043  -6.097   1.570
  417    H    ILE  56           H        ILE  56   0.747  -5.969  -0.504
  418    HA   ILE  56           HA       ILE  56  -0.651  -4.966  -2.735
  419    HB   ILE  56           HB       ILE  56   2.271  -5.799  -2.609
  420   1HG1  ILE  56          2HG1      ILE  56   1.195  -2.958  -2.315
  421   2HG1  ILE  56          3HG1      ILE  56   1.526  -3.962  -0.909
  422   1HG2  ILE  56          1HG2      ILE  56   1.171  -5.374  -4.962
  423   2HG2  ILE  56          2HG2      ILE  56   1.076  -3.703  -4.403
  424   3HG2  ILE  56          3HG2      ILE  56   2.646  -4.565  -4.536
  425   1HD1  ILE  56          1HD1      ILE  56   3.599  -3.223  -3.021
  426   2HD1  ILE  56          2HD1      ILE  56   3.398  -2.451  -1.456
  427   3HD1  ILE  56          3HD1      ILE  56   3.888  -4.160  -1.553
  428    H    ALA  57           H        ALA  57   1.494  -7.907  -2.687
  429    HA   ALA  57           HA       ALA  57   0.936  -8.644  -5.333
  430   1HB   ALA  57          1HB       ALA  57   1.673 -10.446  -2.989
  431   2HB   ALA  57          2HB       ALA  57   1.804 -10.862  -4.708
  432   3HB   ALA  57          3HB       ALA  57   2.803  -9.561  -4.036
  433    H    SER  58           H        SER  58  -0.847  -9.426  -2.359
  434    HA   SER  58           HA       SER  58  -2.626 -11.327  -3.453
  435   1HB   SER  58          2HB       SER  58  -2.296 -10.752  -0.997
  436   2HB   SER  58          3HB       SER  58  -3.339  -9.340  -1.269
  437    HG   SER  58           HG       SER  58  -4.857 -10.970  -2.189
  438    H    ALA  59           H        ALA  59  -2.568  -7.817  -3.858
  439    HA   ALA  59           HA       ALA  59  -5.228  -7.830  -5.207
  440   1HB   ALA  59          1HB       ALA  59  -4.797  -5.430  -5.525
  441   2HB   ALA  59          2HB       ALA  59  -4.734  -5.893  -3.812
  442   3HB   ALA  59          3HB       ALA  59  -3.231  -5.583  -4.703
  443    H    GLY  60           H        GLY  60  -1.842  -6.938  -5.888
  444   1HA   GLY  60          2HA       GLY  60  -0.588  -8.035  -7.624
  445   2HA   GLY  60          3HA       GLY  60  -2.029  -8.100  -8.644
  446    H    HIS  61           H        HIS  61  -0.237  -5.565  -6.805
  447    HA   HIS  61           HA       HIS  61  -0.543  -3.693  -9.114
  448   1HB   HIS  61          2HB       HIS  61  -0.165  -3.359  -6.136
  449   2HB   HIS  61          3HB       HIS  61   0.265  -2.056  -7.219
  450    HD1  HIS  61           1HD      HIS  61  -1.867  -1.040  -8.756
  451    HD2  HIS  61           2HD      HIS  61  -2.511  -3.192  -5.196
  452    HE1  HIS  61           1HE      HIS  61  -4.008  -0.129  -7.734
  453    H    GLU  62           H        GLU  62   1.240  -2.923 -10.170
  454    HA   GLU  62           HA       GLU  62   3.791  -4.192  -9.871
  455   1HB   GLU  62          2HB       GLU  62   2.848  -1.897 -11.675
  456   2HB   GLU  62          3HB       GLU  62   4.296  -2.886 -11.870
  457   1HG   GLU  62          2HG       GLU  62   2.843  -3.830 -13.384
  458   2HG   GLU  62          3HG       GLU  62   2.724  -4.906 -11.987
  459    H    VAL  63           H        VAL  63   3.461  -2.897  -7.523
  460    HA   VAL  63           HA       VAL  63   5.187  -0.465  -7.580
  461    HB   VAL  63           HB       VAL  63   3.247  -0.124  -6.381
  462   1HG1  VAL  63          1HG1      VAL  63   2.189  -2.135  -6.167
  463   2HG1  VAL  63          2HG1      VAL  63   3.538  -2.812  -5.217
  464   3HG1  VAL  63          3HG1      VAL  63   2.441  -1.586  -4.509
  465   1HG2  VAL  63          1HG2      VAL  63   5.412   0.438  -5.068
  466   2HG2  VAL  63          2HG2      VAL  63   3.942   0.291  -4.092
  467   3HG2  VAL  63          3HG2      VAL  63   5.117  -1.038  -4.143
  468    H    GLU  64           H        GLU  64   7.204  -0.510  -6.836
  469    HA   GLU  64           HA       GLU  64   8.492  -3.048  -6.800
  470   1HB   GLU  64          2HB       GLU  64   9.482  -0.203  -6.370
  471   2HB   GLU  64          3HB       GLU  64  10.544  -1.611  -6.405
  472   1HG   GLU  64          2HG       GLU  64  10.589  -0.657  -8.593
  473   2HG   GLU  64          3HG       GLU  64   9.715  -2.188  -8.690
  Start of MODEL   17
    1   1H    MET   1           H1       MET   1  11.787   7.165   7.586
    2   2H    MET   1           H2       MET   1  13.371   6.865   7.951
    3   3H    MET   1           H3       MET   1  12.553   5.900   6.886
    4    HA   MET   1           HA       MET   1  12.806   4.778   8.954
    5   1HB   MET   1          2HB       MET   1  11.450   7.291   9.998
    6   2HB   MET   1          3HB       MET   1  11.179   5.730  10.782
    7   1HG   MET   1          2HG       MET   1  13.618   5.414  11.051
    8   2HG   MET   1          3HG       MET   1  13.882   7.063  10.451
    9   1HE   MET   1          1HE       MET   1  14.598   7.109  14.364
   10   2HE   MET   1          2HE       MET   1  14.861   5.733  13.269
   11   3HE   MET   1          3HE       MET   1  15.310   7.381  12.755
   12    H    THR   2           H        THR   2   9.697   6.610   8.422
   13    HA   THR   2           HA       THR   2   8.025   4.322   8.326
   14    HB   THR   2           HB       THR   2   6.581   6.038   7.059
   15    HG1  THR   2           1HG      THR   2   8.313   7.265   6.182
   16   1HG2  THR   2          1HG2      THR   2   6.279   7.452   9.048
   17   2HG2  THR   2          2HG2      THR   2   6.616   5.781   9.568
   18   3HG2  THR   2          3HG2      THR   2   7.880   7.015   9.660
   19    H    ILE   3           H        ILE   3   6.986   3.454   6.368
   20    HA   ILE   3           HA       ILE   3   9.099   2.709   4.461
   21    HB   ILE   3           HB       ILE   3   6.266   1.747   5.048
   22   1HG1  ILE   3          2HG1      ILE   3   7.393  -0.352   5.631
   23   2HG1  ILE   3          3HG1      ILE   3   8.979   0.384   5.395
   24   1HG2  ILE   3          1HG2      ILE   3   6.562   1.461   2.695
   25   2HG2  ILE   3          2HG2      ILE   3   8.217   0.820   2.916
   26   3HG2  ILE   3          3HG2      ILE   3   6.811  -0.116   3.444
   27   1HD1  ILE   3          1HD1      ILE   3   6.920   1.335   7.447
   28   2HD1  ILE   3          2HD1      ILE   3   8.158   0.110   7.783
   29   3HD1  ILE   3          3HD1      ILE   3   8.657   1.752   7.378
   30    H    GLN   4           H        GLN   4   9.057   3.284   2.272
   31    HA   GLN   4           HA       GLN   4   6.824   4.912   1.198
   32   1HB   GLN   4          2HB       GLN   4   9.658   5.757   1.677
   33   2HB   GLN   4          3HB       GLN   4   8.992   6.156   0.087
   34   1HG   GLN   4          2HG       GLN   4   7.193   7.397   0.981
   35   2HG   GLN   4          3HG       GLN   4   7.457   6.753   2.605
   36   1HE2  GLN   4          1HE2      GLN   4   8.999   8.812   0.076
   37   2HE2  GLN   4          2HE2      GLN   4   9.833   9.834   1.233
   38    H    LEU   5           H        LEU   5   6.127   3.816  -0.532
   39    HA   LEU   5           HA       LEU   5   8.180   2.629  -2.389
   40   1HB   LEU   5          2HB       LEU   5   5.421   1.539  -1.695
   41   2HB   LEU   5          3HB       LEU   5   6.365   1.062  -3.093
   42    HG   LEU   5           HG       LEU   5   6.544  -0.606  -1.494
   43   1HD1  LEU   5          1HD1      LEU   5   9.202   0.880  -1.452
   44   2HD1  LEU   5          2HD1      LEU   5   8.947  -0.861  -1.257
   45   3HD1  LEU   5          3HD1      LEU   5   8.595  -0.090  -2.813
   46   1HD2  LEU   5          1HD2      LEU   5   7.791   1.244   0.539
   47   2HD2  LEU   5          2HD2      LEU   5   6.071   0.773   0.531
   48   3HD2  LEU   5          3HD2      LEU   5   7.345  -0.455   0.721
   49    H    THR   6           H        THR   6   7.463   2.448  -4.608
   50    HA   THR   6           HA       THR   6   5.887   4.814  -5.507
   51    HB   THR   6           HB       THR   6   8.257   3.374  -6.764
   52    HG1  THR   6           1HG      THR   6   8.738   4.742  -5.021
   53   1HG2  THR   6          1HG2      THR   6   6.772   4.202  -8.533
   54   2HG2  THR   6          2HG2      THR   6   6.602   5.769  -7.705
   55   3HG2  THR   6          3HG2      THR   6   8.168   5.283  -8.392
   56    H    VAL   7           H        VAL   7   4.010   4.245  -6.418
   57    HA   VAL   7           HA       VAL   7   3.635   1.474  -7.488
   58    HB   VAL   7           HB       VAL   7   2.566   1.514  -5.461
   59   1HG1  VAL   7          1HG1      VAL   7   0.899   3.142  -4.715
   60   2HG1  VAL   7          2HG1      VAL   7   2.511   3.839  -4.844
   61   3HG1  VAL   7          3HG1      VAL   7   1.308   4.187  -6.095
   62   1HG2  VAL   7          1HG2      VAL   7   0.305   1.041  -6.005
   63   2HG2  VAL   7          2HG2      VAL   7   0.346   2.092  -7.427
   64   3HG2  VAL   7          3HG2      VAL   7   1.287   0.605  -7.412
   65    HA   PRO   8           HA       PRO   8   3.137   4.653 -10.740
   66   1HB   PRO   8          2HB       PRO   8   3.838   3.169 -12.941
   67   2HB   PRO   8          3HB       PRO   8   5.042   3.842 -11.799
   68   1HG   PRO   8          2HG       PRO   8   3.903   1.039 -11.834
   69   2HG   PRO   8          3HG       PRO   8   5.616   1.526 -11.710
   70   1HD   PRO   8          2HD       PRO   8   4.106   0.887  -9.539
   71   2HD   PRO   8          3HD       PRO   8   5.367   2.142  -9.446
   72    H    THR   9           H        THR   9   1.746   1.522 -10.428
   73    HA   THR   9           HA       THR   9  -0.397   1.863 -12.358
   74    HB   THR   9           HB       THR   9   0.945  -0.162 -12.060
   75    HG1  THR   9           1HG      THR   9  -0.531  -1.634 -12.019
   76   1HG2  THR   9          1HG2      THR   9   1.625  -0.335  -9.826
   77   2HG2  THR   9          2HG2      THR   9   0.001   0.055  -9.195
   78   3HG2  THR   9          3HG2      THR   9   0.324  -1.513  -9.907
   79    H    ILE  10           H        ILE  10  -0.051   3.276  -9.282
   80    HA   ILE  10           HA       ILE  10  -2.347   2.676  -7.987
   81    HB   ILE  10           HB       ILE  10  -0.428   4.815  -7.958
   82   1HG1  ILE  10          2HG1      ILE  10  -2.646   3.918  -6.143
   83   2HG1  ILE  10          3HG1      ILE  10  -0.999   3.335  -6.129
   84   1HG2  ILE  10          1HG2      ILE  10  -2.099   6.307  -9.018
   85   2HG2  ILE  10          2HG2      ILE  10  -3.225   5.965  -7.676
   86   3HG2  ILE  10          3HG2      ILE  10  -1.686   6.780  -7.377
   87   1HD1  ILE  10          1HD1      ILE  10  -1.093   4.808  -4.296
   88   2HD1  ILE  10          2HD1      ILE  10  -0.284   5.762  -5.549
   89   3HD1  ILE  10          3HD1      ILE  10  -2.003   6.039  -5.187
   90    H    ALA  11           H        ALA  11  -4.480   3.351  -7.933
   91    HA   ALA  11           HA       ALA  11  -6.512   3.720  -8.836
   92   1HB   ALA  11          1HB       ALA  11  -5.693   6.058  -8.711
   93   2HB   ALA  11          2HB       ALA  11  -5.154   5.949 -10.400
   94   3HB   ALA  11          3HB       ALA  11  -6.874   5.807 -10.007
   95    H    CYS  12           H        CYS  12  -4.412   1.977 -10.497
   96    HA   CYS  12           HA       CYS  12  -6.296   1.652 -12.803
   97   1HB   CYS  12          2HB       CYS  12  -4.098   2.666 -13.435
   98   2HB   CYS  12          3HB       CYS  12  -3.288   1.194 -12.854
   99    HG   CYS  12           HG       CYS  12  -4.535  -0.459 -14.391
  100    H    GLU  13           H        GLU  13  -6.797   0.517 -10.420
  101    HA   GLU  13           HA       GLU  13  -7.067  -2.208 -11.154
  102   1HB   GLU  13          2HB       GLU  13  -4.740  -2.220 -10.170
  103   2HB   GLU  13          3HB       GLU  13  -5.425  -1.768  -8.613
  104   1HG   GLU  13          2HG       GLU  13  -6.223  -4.279 -10.175
  105   2HG   GLU  13          3HG       GLU  13  -4.882  -4.232  -9.028
  106    H    ALA  14           H        ALA  14  -7.272  -1.859  -7.711
  107    HA   ALA  14           HA       ALA  14 -10.022  -0.678  -7.904
  108   1HB   ALA  14          1HB       ALA  14  -9.901  -3.080  -7.361
  109   2HB   ALA  14          2HB       ALA  14  -8.859  -2.717  -5.976
  110   3HB   ALA  14          3HB       ALA  14 -10.534  -2.125  -6.005
  111    H    CYS  15           H        CYS  15  -7.565   0.890  -7.644
  112    HA   CYS  15           HA       CYS  15  -6.878   2.739  -6.637
  113   1HB   CYS  15          2HB       CYS  15  -9.459   2.506  -5.034
  114   2HB   CYS  15          3HB       CYS  15  -8.225   3.704  -4.651
  115    HG   CYS  15           HG       CYS  15 -10.067   4.836  -6.008
  116    H    ALA  16           H        ALA  16  -5.573   3.426  -4.988
  117    HA   ALA  16           HA       ALA  16  -4.134   1.544  -3.508
  118   1HB   ALA  16          1HB       ALA  16  -3.293   3.387  -2.176
  119   2HB   ALA  16          2HB       ALA  16  -3.324   3.822  -3.900
  120   3HB   ALA  16          3HB       ALA  16  -4.559   4.475  -2.792
  121    H    GLU  17           H        GLU  17  -7.224   3.031  -2.585
  122    HA   GLU  17           HA       GLU  17  -7.289   2.304   0.121
  123   1HB   GLU  17          2HB       GLU  17  -9.457   2.427  -1.988
  124   2HB   GLU  17          3HB       GLU  17  -9.772   1.800  -0.376
  125   1HG   GLU  17          2HG       GLU  17  -8.340   4.212   0.111
  126   2HG   GLU  17          3HG       GLU  17  -9.458   4.589  -1.197
  127    H    ALA  18           H        ALA  18  -7.617   0.163  -2.756
  128    HA   ALA  18           HA       ALA  18  -8.415  -2.186  -1.429
  129   1HB   ALA  18          1HB       ALA  18  -7.397  -3.369  -3.315
  130   2HB   ALA  18          2HB       ALA  18  -8.281  -1.937  -3.871
  131   3HB   ALA  18          3HB       ALA  18  -6.507  -1.914  -3.795
  132    H    VAL  19           H        VAL  19  -5.036  -1.004  -2.076
  133    HA   VAL  19           HA       VAL  19  -3.919  -3.164  -0.572
  134    HB   VAL  19           HB       VAL  19  -2.675  -1.592  -2.252
  135   1HG1  VAL  19          1HG1      VAL  19  -1.862  -0.310   0.417
  136   2HG1  VAL  19          2HG1      VAL  19  -1.098  -0.073  -1.156
  137   3HG1  VAL  19          3HG1      VAL  19  -2.735   0.537  -0.884
  138   1HG2  VAL  19          1HG2      VAL  19  -1.833  -3.635  -1.131
  139   2HG2  VAL  19          2HG2      VAL  19  -0.580  -2.385  -1.221
  140   3HG2  VAL  19          3HG2      VAL  19  -1.418  -2.680   0.305
  141    H    THR  20           H        THR  20  -4.930   0.131   0.278
  142    HA   THR  20           HA       THR  20  -3.887   0.316   2.872
  143    HB   THR  20           HB       THR  20  -6.588   1.339   1.906
  144    HG1  THR  20           1HG      THR  20  -4.850   2.080   0.634
  145   1HG2  THR  20          1HG2      THR  20  -6.599   1.485   4.269
  146   2HG2  THR  20          2HG2      THR  20  -4.937   2.078   4.302
  147   3HG2  THR  20          3HG2      THR  20  -6.238   3.092   3.626
  148    H    LYS  21           H        LYS  21  -7.118  -1.067   1.926
  149    HA   LYS  21           HA       LYS  21  -7.729  -1.759   4.653
  150   1HB   LYS  21          2HB       LYS  21  -8.906  -3.076   2.175
  151   2HB   LYS  21          3HB       LYS  21  -9.572  -3.019   3.821
  152   1HG   LYS  21          2HG       LYS  21  -9.224  -0.385   3.453
  153   2HG   LYS  21          3HG       LYS  21  -9.358  -0.871   1.750
  154   1HD   LYS  21          2HD       LYS  21 -11.548  -1.973   2.274
  155   2HD   LYS  21          3HD       LYS  21 -11.465  -1.295   3.908
  156   1HE   LYS  21          2HE       LYS  21 -11.464   0.260   1.264
  157   2HE   LYS  21          3HE       LYS  21 -12.834   0.146   2.375
  158   1HZ   LYS  21          1HZ       LYS  21 -10.238   1.352   3.102
  159   2HZ   LYS  21          2HZ       LYS  21 -11.374   2.208   2.455
  160   3HZ   LYS  21          3HZ       LYS  21 -11.662   1.497   3.933
  161    H    ALA  22           H        ALA  22  -6.088  -3.532   2.040
  162    HA   ALA  22           HA       ALA  22  -5.976  -6.067   3.399
  163   1HB   ALA  22          1HB       ALA  22  -4.071  -6.524   1.921
  164   2HB   ALA  22          2HB       ALA  22  -5.423  -5.792   1.018
  165   3HB   ALA  22          3HB       ALA  22  -4.012  -4.807   1.465
  166    H    VAL  23           H        VAL  23  -3.640  -3.356   3.262
  167    HA   VAL  23           HA       VAL  23  -1.709  -4.416   5.034
  168    HB   VAL  23           HB       VAL  23  -2.413  -1.523   4.440
  169   1HG1  VAL  23          1HG1      VAL  23  -0.039  -1.092   5.100
  170   2HG1  VAL  23          2HG1      VAL  23  -0.961  -1.724   6.482
  171   3HG1  VAL  23          3HG1      VAL  23   0.137  -2.791   5.561
  172   1HG2  VAL  23          1HG2      VAL  23  -0.128  -3.197   3.299
  173   2HG2  VAL  23          2HG2      VAL  23  -1.663  -2.992   2.466
  174   3HG2  VAL  23          3HG2      VAL  23  -0.662  -1.577   2.798
  175    H    GLN  24           H        GLN  24  -4.480  -2.255   5.667
  176    HA   GLN  24           HA       GLN  24  -4.018  -2.296   8.521
  177   1HB   GLN  24          2HB       GLN  24  -6.412  -1.301   6.933
  178   2HB   GLN  24          3HB       GLN  24  -6.133  -1.065   8.669
  179   1HG   GLN  24          2HG       GLN  24  -3.842  -0.083   8.021
  180   2HG   GLN  24          3HG       GLN  24  -4.442   0.023   6.380
  181   1HE2  GLN  24          1HE2      GLN  24  -4.023   1.937   9.080
  182   2HE2  GLN  24          2HE2      GLN  24  -5.333   3.047   8.725
  183    H    ASN  25           H        ASN  25  -5.589  -4.674   6.500
  184    HA   ASN  25           HA       ASN  25  -7.274  -5.712   8.638
  185   1HB   ASN  25          2HB       ASN  25  -6.060  -7.014   6.166
  186   2HB   ASN  25          3HB       ASN  25  -6.979  -7.908   7.371
  187   1HD2  ASN  25          1HD2      ASN  25  -7.909  -8.004   4.844
  188   2HD2  ASN  25          2HD2      ASN  25  -9.386  -7.058   4.729
  189    H    GLU  26           H        GLU  26  -4.020  -6.647   7.428
  190    HA   GLU  26           HA       GLU  26  -3.485  -8.309   9.750
  191   1HB   GLU  26          2HB       GLU  26  -1.688  -7.261   7.533
  192   2HB   GLU  26          3HB       GLU  26  -1.248  -8.516   8.709
  193   1HG   GLU  26          2HG       GLU  26  -3.496  -8.710   6.635
  194   2HG   GLU  26          3HG       GLU  26  -1.916  -9.490   6.545
  195    H    ASP  27           H        ASP  27  -1.945  -5.299   8.533
  196    HA   ASP  27           HA       ASP  27  -0.628  -4.874  11.123
  197   1HB   ASP  27          2HB       ASP  27   0.537  -4.613   8.871
  198   2HB   ASP  27          3HB       ASP  27  -0.423  -3.163   8.587
  199    H    ALA  28           H        ALA  28  -2.996  -4.798  11.877
  200    HA   ALA  28           HA       ALA  28  -4.693  -2.585  11.182
  201   1HB   ALA  28          1HB       ALA  28  -6.075  -3.367  13.070
  202   2HB   ALA  28          2HB       ALA  28  -5.534  -4.737  12.078
  203   3HB   ALA  28          3HB       ALA  28  -4.741  -4.401  13.635
  204    H    GLN  29           H        GLN  29  -2.007  -2.795  13.217
  205    HA   GLN  29           HA       GLN  29  -2.682  -0.450  14.863
  206   1HB   GLN  29          2HB       GLN  29  -0.487  -0.978  15.891
  207   2HB   GLN  29          3HB       GLN  29  -1.682  -2.266  16.017
  208   1HG   GLN  29          2HG       GLN  29  -0.556  -3.587  14.316
  209   2HG   GLN  29          3HG       GLN  29   0.494  -2.220  13.894
  210   1HE2  GLN  29          1HE2      GLN  29   2.377  -3.477  14.292
  211   2HE2  GLN  29          2HE2      GLN  29   2.862  -3.893  15.933
  212    H    ALA  30           H        ALA  30  -1.838  -0.694  11.677
  213    HA   ALA  30           HA       ALA  30   0.343   1.283  11.712
  214   1HB   ALA  30          1HB       ALA  30   0.412   0.852   9.308
  215   2HB   ALA  30          2HB       ALA  30   0.405  -0.659  10.236
  216   3HB   ALA  30          3HB       ALA  30  -1.067  -0.118   9.409
  217    H    THR  31           H        THR  31   0.335   3.189  10.573
  218    HA   THR  31           HA       THR  31  -2.328   4.354   9.798
  219    HB   THR  31           HB       THR  31   0.260   5.734  10.569
  220    HG1  THR  31           1HG      THR  31  -1.091   4.766  12.234
  221   1HG2  THR  31          1HG2      THR  31  -1.121   7.810  10.489
  222   2HG2  THR  31          2HG2      THR  31  -0.925   7.086   8.887
  223   3HG2  THR  31          3HG2      THR  31  -2.455   6.883   9.775
  224    H    VAL  32           H        VAL  32  -2.494   5.132   7.686
  225    HA   VAL  32           HA       VAL  32  -0.320   4.342   5.815
  226    HB   VAL  32           HB       VAL  32  -2.015   4.029   4.146
  227   1HG1  VAL  32          1HG1      VAL  32  -3.112   2.564   6.554
  228   2HG1  VAL  32          2HG1      VAL  32  -2.806   1.962   4.911
  229   3HG1  VAL  32          3HG1      VAL  32  -1.463   2.252   6.021
  230   1HG2  VAL  32          1HG2      VAL  32  -4.095   4.752   6.272
  231   2HG2  VAL  32          2HG2      VAL  32  -3.664   5.761   4.876
  232   3HG2  VAL  32          3HG2      VAL  32  -4.418   4.202   4.624
  233    H    GLN  33           H        GLN  33   0.115   5.838   3.996
  234    HA   GLN  33           HA       GLN  33  -1.258   8.435   3.988
  235   1HB   GLN  33          2HB       GLN  33   1.343   7.955   5.276
  236   2HB   GLN  33          3HB       GLN  33   1.521   9.080   3.934
  237   1HG   GLN  33          2HG       GLN  33  -0.589   9.445   6.084
  238   2HG   GLN  33          3HG       GLN  33   1.044  10.121   6.163
  239   1HE2  GLN  33          1HE2      GLN  33  -0.638  12.098   6.282
  240   2HE2  GLN  33          2HE2      GLN  33  -0.860  12.874   4.721
  241    H    VAL  34           H        VAL  34  -2.043   7.749   1.960
  242    HA   VAL  34           HA       VAL  34   0.034   7.256  -0.117
  243    HB   VAL  34           HB       VAL  34  -1.328   5.302   0.324
  244   1HG1  VAL  34          1HG1      VAL  34  -3.466   6.357   1.014
  245   2HG1  VAL  34          2HG1      VAL  34  -3.735   6.869  -0.665
  246   3HG1  VAL  34          3HG1      VAL  34  -3.665   5.148  -0.263
  247   1HG2  VAL  34          1HG2      VAL  34  -0.378   5.962  -1.958
  248   2HG2  VAL  34          2HG2      VAL  34  -1.681   4.788  -1.967
  249   3HG2  VAL  34          3HG2      VAL  34  -2.015   6.481  -2.398
  250    H    ASP  35           H        ASP  35   0.227   8.610  -1.744
  251    HA   ASP  35           HA       ASP  35  -1.675  10.899  -1.902
  252   1HB   ASP  35          2HB       ASP  35   1.153  10.478  -2.924
  253   2HB   ASP  35          3HB       ASP  35   0.145  11.884  -3.280
  254    H    LEU  36           H        LEU  36  -3.326   9.563  -2.898
  255    HA   LEU  36           HA       LEU  36  -3.034   8.333  -5.465
  256   1HB   LEU  36          2HB       LEU  36  -5.476   9.728  -4.288
  257   2HB   LEU  36          3HB       LEU  36  -5.445   8.728  -5.739
  258    HG   LEU  36           HG       LEU  36  -4.250   7.058  -3.841
  259   1HD1  LEU  36          1HD1      LEU  36  -5.833   7.040  -1.945
  260   2HD1  LEU  36          2HD1      LEU  36  -4.971   8.588  -2.009
  261   3HD1  LEU  36          3HD1      LEU  36  -6.646   8.478  -2.585
  262   1HD2  LEU  36          1HD2      LEU  36  -5.839   6.384  -5.591
  263   2HD2  LEU  36          2HD2      LEU  36  -6.372   5.794  -4.008
  264   3HD2  LEU  36          3HD2      LEU  36  -7.159   7.208  -4.735
  265    H    THR  37           H        THR  37  -3.141  11.730  -4.506
  266    HA   THR  37           HA       THR  37  -3.444  13.176  -6.774
  267    HB   THR  37           HB       THR  37  -1.074  13.427  -4.881
  268    HG1  THR  37           1HG      THR  37  -2.512  14.217  -3.354
  269   1HG2  THR  37          1HG2      THR  37  -2.982  15.494  -6.070
  270   2HG2  THR  37          2HG2      THR  37  -1.632  15.837  -4.965
  271   3HG2  THR  37          3HG2      THR  37  -1.306  15.205  -6.585
  272    H    SER  38           H        SER  38  -0.850  10.820  -6.129
  273    HA   SER  38           HA       SER  38   0.225  11.265  -8.830
  274   1HB   SER  38          2HB       SER  38   1.952  11.517  -6.330
  275   2HB   SER  38          3HB       SER  38   2.529  11.519  -8.020
  276    HG   SER  38           HG       SER  38   0.628  13.299  -7.942
  277    H    LYS  39           H        LYS  39   2.415   9.486  -6.933
  278    HA   LYS  39           HA       LYS  39   1.103   6.912  -7.394
  279   1HB   LYS  39          2HB       LYS  39   2.787   6.260  -9.151
  280   2HB   LYS  39          3HB       LYS  39   1.536   7.393  -9.629
  281   1HG   LYS  39          2HG       LYS  39   3.296   9.270  -9.178
  282   2HG   LYS  39          3HG       LYS  39   4.493   7.977  -9.169
  283   1HD   LYS  39          2HD       LYS  39   2.454   8.390 -11.410
  284   2HD   LYS  39          3HD       LYS  39   3.953   9.313 -11.364
  285   1HE   LYS  39          2HE       LYS  39   5.292   7.570 -11.948
  286   2HE   LYS  39          3HE       LYS  39   4.350   6.379 -11.072
  287   1HZ   LYS  39          1HZ       LYS  39   4.216   6.078 -13.456
  288   2HZ   LYS  39          2HZ       LYS  39   2.727   6.396 -12.840
  289   3HZ   LYS  39          3HZ       LYS  39   3.557   7.569 -13.652
  290    H    LYS  40           H        LYS  40   2.267   8.224  -5.097
  291    HA   LYS  40           HA       LYS  40   4.351   6.207  -4.472
  292   1HB   LYS  40          2HB       LYS  40   5.528   7.725  -3.092
  293   2HB   LYS  40          3HB       LYS  40   5.326   8.486  -4.662
  294   1HG   LYS  40          2HG       LYS  40   4.938  10.202  -3.165
  295   2HG   LYS  40          3HG       LYS  40   3.317   9.754  -3.659
  296   1HD   LYS  40          2HD       LYS  40   2.717   9.135  -1.560
  297   2HD   LYS  40          3HD       LYS  40   4.223   8.252  -1.253
  298   1HE   LYS  40          2HE       LYS  40   5.381  10.252  -0.587
  299   2HE   LYS  40          3HE       LYS  40   4.050  11.283  -1.158
  300   1HZ   LYS  40          1HZ       LYS  40   3.807   9.374   1.087
  301   2HZ   LYS  40          2HZ       LYS  40   3.960  11.017   1.203
  302   3HZ   LYS  40          3HZ       LYS  40   2.641  10.407   0.457
  303    H    VAL  41           H        VAL  41   4.226   5.399  -2.313
  304    HA   VAL  41           HA       VAL  41   1.763   6.056  -0.809
  305    HB   VAL  41           HB       VAL  41   1.158   4.067  -2.040
  306   1HG1  VAL  41          1HG1      VAL  41   3.661   2.731  -0.945
  307   2HG1  VAL  41          2HG1      VAL  41   2.390   1.954  -1.902
  308   3HG1  VAL  41          3HG1      VAL  41   3.408   3.194  -2.642
  309   1HG2  VAL  41          1HG2      VAL  41   0.599   2.590  -0.224
  310   2HG2  VAL  41          2HG2      VAL  41   1.958   3.164   0.759
  311   3HG2  VAL  41          3HG2      VAL  41   0.593   4.238   0.432
  312    H    THR  42           H        THR  42   2.129   6.128   1.437
  313    HA   THR  42           HA       THR  42   4.823   5.374   2.310
  314    HB   THR  42           HB       THR  42   3.127   7.765   3.188
  315    HG1  THR  42           1HG      THR  42   5.225   7.455   1.387
  316   1HG2  THR  42          1HG2      THR  42   5.900   6.942   4.078
  317   2HG2  THR  42          2HG2      THR  42   5.150   8.520   4.385
  318   3HG2  THR  42          3HG2      THR  42   4.431   7.048   5.051
  319    H    ILE  43           H        ILE  43   4.704   4.126   4.174
  320    HA   ILE  43           HA       ILE  43   2.068   3.816   5.563
  321    HB   ILE  43           HB       ILE  43   3.970   1.595   4.760
  322   1HG1  ILE  43          2HG1      ILE  43   2.551   2.200   2.889
  323   2HG1  ILE  43          3HG1      ILE  43   2.090   0.639   3.580
  324   1HG2  ILE  43          1HG2      ILE  43   1.487   1.447   6.508
  325   2HG2  ILE  43          2HG2      ILE  43   2.337   0.051   5.805
  326   3HG2  ILE  43          3HG2      ILE  43   3.160   1.082   6.978
  327   1HD1  ILE  43          1HD1      ILE  43   0.528   3.193   3.998
  328   2HD1  ILE  43          2HD1      ILE  43   0.127   1.857   2.918
  329   3HD1  ILE  43          3HD1      ILE  43   0.151   1.583   4.661
  330    H    THR  44           H        THR  44   2.172   4.024   7.698
  331    HA   THR  44           HA       THR  44   4.839   4.301   9.000
  332    HB   THR  44           HB       THR  44   2.124   5.494   9.604
  333    HG1  THR  44           1HG      THR  44   4.448   6.553   8.422
  334   1HG2  THR  44          1HG2      THR  44   3.322   6.943  11.206
  335   2HG2  THR  44          2HG2      THR  44   3.422   5.242  11.683
  336   3HG2  THR  44          3HG2      THR  44   4.819   6.035  10.932
  337    H    SER  45           H        SER  45   5.114   2.094   9.442
  338    HA   SER  45           HA       SER  45   3.910   1.389  11.946
  339   1HB   SER  45          2HB       SER  45   3.193  -0.860  11.348
  340   2HB   SER  45          3HB       SER  45   2.420   0.247  10.237
  341    HG   SER  45           HG       SER  45   3.293  -1.520   9.214
  342    H    ALA  46           H        ALA  46   5.105  -1.054  12.256
  343    HA   ALA  46           HA       ALA  46   8.003  -0.578  11.794
  344   1HB   ALA  46          1HB       ALA  46   6.558  -2.655  13.482
  345   2HB   ALA  46          2HB       ALA  46   8.317  -2.421  13.367
  346   3HB   ALA  46          3HB       ALA  46   7.300  -1.147  14.070
  347    H    LEU  47           H        LEU  47   5.319  -2.814  10.912
  348    HA   LEU  47           HA       LEU  47   7.309  -4.544   9.492
  349   1HB   LEU  47          2HB       LEU  47   5.873  -6.321   9.661
  350   2HB   LEU  47          3HB       LEU  47   5.888  -5.583  11.253
  351    HG   LEU  47           HG       LEU  47   3.688  -4.488   9.615
  352   1HD1  LEU  47          1HD1      LEU  47   2.353  -6.503   9.397
  353   2HD1  LEU  47          2HD1      LEU  47   3.852  -6.690   8.467
  354   3HD1  LEU  47          3HD1      LEU  47   3.677  -7.501  10.035
  355   1HD2  LEU  47          1HD2      LEU  47   3.724  -6.113  12.187
  356   2HD2  LEU  47          2HD2      LEU  47   3.751  -4.336  12.055
  357   3HD2  LEU  47          3HD2      LEU  47   2.328  -5.249  11.518
  358    H    GLY  48           H        GLY  48   5.524  -1.942   8.728
  359   1HA   GLY  48          2HA       GLY  48   3.723  -2.330   6.859
  360   2HA   GLY  48          3HA       GLY  48   4.925  -1.031   6.733
  361    H    GLU  49           H        GLU  49   7.243  -2.434   6.170
  362    HA   GLU  49           HA       GLU  49   7.033  -2.708   3.376
  363   1HB   GLU  49          2HB       GLU  49   9.037  -2.176   4.986
  364   2HB   GLU  49          3HB       GLU  49   9.283  -3.923   5.017
  365   1HG   GLU  49          2HG       GLU  49   9.477  -3.898   2.517
  366   2HG   GLU  49          3HG       GLU  49   9.194  -2.146   2.526
  367    H    GLU  50           H        GLU  50   7.204  -5.165   5.949
  368    HA   GLU  50           HA       GLU  50   7.256  -7.499   4.212
  369   1HB   GLU  50          2HB       GLU  50   6.702  -7.026   7.173
  370   2HB   GLU  50          3HB       GLU  50   6.326  -8.572   6.417
  371   1HG   GLU  50          2HG       GLU  50   8.634  -8.869   5.703
  372   2HG   GLU  50          3HG       GLU  50   9.085  -7.298   6.401
  373    H    GLN  51           H        GLN  51   4.696  -5.756   6.104
  374    HA   GLN  51           HA       GLN  51   2.746  -7.579   5.318
  375   1HB   GLN  51          2HB       GLN  51   2.751  -5.389   7.024
  376   2HB   GLN  51          3HB       GLN  51   1.831  -4.751   5.697
  377   1HG   GLN  51          2HG       GLN  51   1.235  -7.113   7.494
  378   2HG   GLN  51          3HG       GLN  51   0.172  -5.766   7.063
  379   1HE2  GLN  51          1HE2      GLN  51  -0.539  -5.776   4.661
  380   2HE2  GLN  51          2HE2      GLN  51  -0.965  -7.360   4.034
  381    H    LEU  52           H        LEU  52   3.464  -4.303   3.960
  382    HA   LEU  52           HA       LEU  52   1.831  -4.212   1.814
  383   1HB   LEU  52          2HB       LEU  52   4.705  -3.337   2.240
  384   2HB   LEU  52          3HB       LEU  52   3.909  -3.010   0.715
  385    HG   LEU  52           HG       LEU  52   2.683  -2.116   3.333
  386   1HD1  LEU  52          1HD1      LEU  52   3.829   0.141   2.415
  387   2HD1  LEU  52          2HD1      LEU  52   4.699  -1.034   3.422
  388   3HD1  LEU  52          3HD1      LEU  52   4.932  -1.008   1.664
  389   1HD2  LEU  52          1HD2      LEU  52   1.474  -0.552   1.844
  390   2HD2  LEU  52          2HD2      LEU  52   2.405  -1.108   0.450
  391   3HD2  LEU  52          3HD2      LEU  52   1.241  -2.188   1.239
  392    H    ARG  53           H        ARG  53   5.015  -5.911   1.940
  393    HA   ARG  53           HA       ARG  53   5.229  -6.747  -0.663
  394   1HB   ARG  53          2HB       ARG  53   6.555  -7.401   1.616
  395   2HB   ARG  53          3HB       ARG  53   5.600  -8.867   1.453
  396   1HG   ARG  53          2HG       ARG  53   7.560  -9.381   0.320
  397   2HG   ARG  53          3HG       ARG  53   6.481  -8.921  -1.007
  398   1HD   ARG  53          2HD       ARG  53   7.514  -6.554  -0.856
  399   2HD   ARG  53          3HD       ARG  53   8.558  -7.168   0.407
  400    HE   ARG  53           HE       ARG  53   9.890  -8.243  -1.083
  401   1HH1  ARG  53          2HH2      ARG  53   6.954  -7.240  -2.749
  402   2HH1  ARG  53          1HH2      ARG  53   7.584  -7.447  -4.354
  403   1HH2  ARG  53          2HH1      ARG  53  10.745  -8.632  -3.194
  404   2HH2  ARG  53          1HH1      ARG  53   9.787  -8.311  -4.602
  405    H    THR  54           H        THR  54   3.268  -8.394   1.856
  406    HA   THR  54           HA       THR  54   2.031 -10.225  -0.009
  407    HB   THR  54           HB       THR  54   1.236  -9.456   2.839
  408    HG1  THR  54           1HG      THR  54   3.021 -11.402   1.803
  409   1HG2  THR  54          1HG2      THR  54   0.653 -11.945   1.161
  410   2HG2  THR  54          2HG2      THR  54   0.293 -11.748   2.891
  411   3HG2  THR  54          3HG2      THR  54  -0.536 -10.736   1.697
  412    H    ALA  55           H        ALA  55   0.951  -7.261   1.669
  413    HA   ALA  55           HA       ALA  55  -1.737  -7.302   0.933
  414   1HB   ALA  55          1HB       ALA  55  -1.834  -5.287   2.002
  415   2HB   ALA  55          2HB       ALA  55  -0.185  -5.680   2.498
  416   3HB   ALA  55          3HB       ALA  55  -0.444  -4.607   1.140
  417    H    ILE  56           H        ILE  56   0.858  -5.340  -0.514
  418    HA   ILE  56           HA       ILE  56  -0.428  -4.388  -2.829
  419    HB   ILE  56           HB       ILE  56   2.459  -5.296  -2.528
  420   1HG1  ILE  56          2HG1      ILE  56   1.390  -2.446  -2.406
  421   2HG1  ILE  56          3HG1      ILE  56   1.643  -3.415  -0.950
  422   1HG2  ILE  56          1HG2      ILE  56   1.160  -3.430  -4.524
  423   2HG2  ILE  56          2HG2      ILE  56   2.884  -3.890  -4.496
  424   3HG2  ILE  56          3HG2      ILE  56   1.685  -5.078  -4.931
  425   1HD1  ILE  56          1HD1      ILE  56   3.810  -2.694  -2.964
  426   2HD1  ILE  56          2HD1      ILE  56   3.578  -1.981  -1.374
  427   3HD1  ILE  56          3HD1      ILE  56   4.032  -3.695  -1.524
  428    H    ALA  57           H        ALA  57   1.438  -7.487  -2.477
  429    HA   ALA  57           HA       ALA  57   0.964  -8.366  -5.110
  430   1HB   ALA  57          1HB       ALA  57   2.653  -9.374  -3.646
  431   2HB   ALA  57          2HB       ALA  57   1.382 -10.039  -2.596
  432   3HB   ALA  57          3HB       ALA  57   1.543 -10.610  -4.268
  433    H    SER  58           H        SER  58  -1.067  -8.678  -2.218
  434    HA   SER  58           HA       SER  58  -2.987 -10.483  -3.162
  435   1HB   SER  58          2HB       SER  58  -2.690  -9.277  -0.824
  436   2HB   SER  58          3HB       SER  58  -3.809  -8.083  -1.507
  437    HG   SER  58           HG       SER  58  -4.249 -10.881  -1.260
  438    H    ALA  59           H        ALA  59  -2.704  -6.956  -3.738
  439    HA   ALA  59           HA       ALA  59  -5.140  -6.851  -5.392
  440   1HB   ALA  59          1HB       ALA  59  -4.446  -4.883  -4.104
  441   2HB   ALA  59          2HB       ALA  59  -2.901  -4.823  -4.984
  442   3HB   ALA  59          3HB       ALA  59  -4.428  -4.548  -5.847
  443    H    GLY  60           H        GLY  60  -1.614  -6.759  -5.875
  444   1HA   GLY  60          2HA       GLY  60  -0.409  -7.805  -7.598
  445   2HA   GLY  60          3HA       GLY  60  -1.865  -7.927  -8.593
  446    H    HIS  61           H        HIS  61   0.169  -5.409  -7.029
  447    HA   HIS  61           HA       HIS  61  -0.122  -3.650  -9.439
  448   1HB   HIS  61          2HB       HIS  61   0.351  -3.114  -6.497
  449   2HB   HIS  61          3HB       HIS  61   0.703  -1.899  -7.705
  450    HD1  HIS  61           1HD      HIS  61  -1.753  -1.499  -9.382
  451    HD2  HIS  61           2HD      HIS  61  -1.668  -2.274  -5.246
  452    HE1  HIS  61           1HE      HIS  61  -3.697  -0.227  -8.353
  453    H    GLU  62           H        GLU  62   1.756  -2.829 -10.392
  454    HA   GLU  62           HA       GLU  62   4.214  -4.272  -9.972
  455   1HB   GLU  62          2HB       GLU  62   3.748  -1.893 -11.817
  456   2HB   GLU  62          3HB       GLU  62   4.927  -3.197 -11.955
  457   1HG   GLU  62          2HG       GLU  62   3.398  -3.993 -13.454
  458   2HG   GLU  62          3HG       GLU  62   2.637  -4.674 -12.012
  459    H    VAL  63           H        VAL  63   3.956  -3.207  -7.670
  460    HA   VAL  63           HA       VAL  63   5.025  -0.502  -7.398
  461    HB   VAL  63           HB       VAL  63   4.690  -2.630  -5.244
  462   1HG1  VAL  63          1HG1      VAL  63   6.072  -0.749  -4.493
  463   2HG1  VAL  63          2HG1      VAL  63   4.860   0.410  -5.084
  464   3HG1  VAL  63          3HG1      VAL  63   4.486  -0.653  -3.727
  465   1HG2  VAL  63          1HG2      VAL  63   2.501  -1.356  -4.818
  466   2HG2  VAL  63          2HG2      VAL  63   2.774  -0.589  -6.395
  467   3HG2  VAL  63          3HG2      VAL  63   2.547  -2.337  -6.293
  468    H    GLU  64           H        GLU  64   7.076   0.182  -6.785
  469    HA   GLU  64           HA       GLU  64   9.141  -1.755  -6.033
  470   1HB   GLU  64          2HB       GLU  64   9.537   0.322  -8.227
  471   2HB   GLU  64          3HB       GLU  64  10.800  -0.645  -7.466
  472   1HG   GLU  64          2HG       GLU  64   8.789  -2.465  -8.508
  473   2HG   GLU  64          3HG       GLU  64   9.211  -1.302  -9.763
  Start of MODEL   18
    1   1H    MET   1           H1       MET   1  12.573   4.999   8.074
    2   2H    MET   1           H2       MET   1  12.986   4.388   9.558
    3   3H    MET   1           H3       MET   1  11.528   4.033   8.855
    4    HA   MET   1           HA       MET   1  11.243   5.700  10.598
    5   1HB   MET   1          2HB       MET   1  13.163   7.213   8.777
    6   2HB   MET   1          3HB       MET   1  12.125   8.006   9.969
    7   1HG   MET   1          2HG       MET   1  13.222   6.902  11.806
    8   2HG   MET   1          3HG       MET   1  14.118   5.837  10.717
    9   1HE   MET   1          1HE       MET   1  13.629   9.798  10.363
   10   2HE   MET   1          2HE       MET   1  13.808   9.502  12.114
   11   3HE   MET   1          3HE       MET   1  15.100  10.321  11.208
   12    H    THR   2           H        THR   2   9.259   4.963   9.603
   13    HA   THR   2           HA       THR   2   7.574   4.784   8.197
   14    HB   THR   2           HB       THR   2   7.816   7.464   7.939
   15    HG1  THR   2           1HG      THR   2   5.873   6.378   7.758
   16   1HG2  THR   2          1HG2      THR   2   8.056   6.513   5.046
   17   2HG2  THR   2          2HG2      THR   2   7.910   8.169   5.655
   18   3HG2  THR   2          3HG2      THR   2   9.408   7.273   5.881
   19    H    ILE   3           H        ILE   3   7.190   3.908   5.969
   20    HA   ILE   3           HA       ILE   3   9.672   3.209   4.481
   21    HB   ILE   3           HB       ILE   3   7.029   1.703   4.511
   22   1HG1  ILE   3          2HG1      ILE   3   7.794   1.509   6.804
   23   2HG1  ILE   3          3HG1      ILE   3   7.915  -0.006   5.932
   24   1HG2  ILE   3          1HG2      ILE   3   8.320  -0.061   3.472
   25   2HG2  ILE   3          2HG2      ILE   3   8.547   1.455   2.585
   26   3HG2  ILE   3          3HG2      ILE   3   9.825   0.881   3.652
   27   1HD1  ILE   3          1HD1      ILE   3  10.353   0.233   5.729
   28   2HD1  ILE   3          2HD1      ILE   3  10.283   1.836   6.486
   29   3HD1  ILE   3          3HD1      ILE   3   9.852   0.392   7.416
   30    H    GLN   4           H        GLN   4   9.572   4.146   2.368
   31    HA   GLN   4           HA       GLN   4   6.928   5.169   1.474
   32   1HB   GLN   4          2HB       GLN   4   8.709   6.910   1.953
   33   2HB   GLN   4          3HB       GLN   4   9.641   6.206   0.614
   34   1HG   GLN   4          2HG       GLN   4   7.643   6.571  -0.883
   35   2HG   GLN   4          3HG       GLN   4   6.782   7.274   0.497
   36   1HE2  GLN   4          1HE2      GLN   4  10.003   7.698  -1.106
   37   2HE2  GLN   4          2HE2      GLN   4   9.919   9.447  -1.129
   38    H    LEU   5           H        LEU   5   6.144   4.267  -0.331
   39    HA   LEU   5           HA       LEU   5   7.963   2.617  -2.086
   40   1HB   LEU   5          2HB       LEU   5   5.042   2.060  -1.417
   41   2HB   LEU   5          3HB       LEU   5   6.009   1.222  -2.611
   42    HG   LEU   5           HG       LEU   5   5.780  -0.182  -0.768
   43   1HD1  LEU   5          1HD1      LEU   5   8.605   0.932  -0.597
   44   2HD1  LEU   5          2HD1      LEU   5   8.063  -0.706  -0.192
   45   3HD1  LEU   5          3HD1      LEU   5   8.002  -0.149  -1.874
   46   1HD2  LEU   5          1HD2      LEU   5   6.934   1.903   1.110
   47   2HD2  LEU   5          2HD2      LEU   5   5.221   1.476   0.977
   48   3HD2  LEU   5          3HD2      LEU   5   6.411   0.268   1.507
   49    H    THR   6           H        THR   6   7.331   2.559  -4.382
   50    HA   THR   6           HA       THR   6   5.844   5.026  -5.184
   51    HB   THR   6           HB       THR   6   8.019   3.429  -6.576
   52    HG1  THR   6           1HG      THR   6   9.307   4.953  -5.831
   53   1HG2  THR   6          1HG2      THR   6   6.519   4.462  -8.237
   54   2HG2  THR   6          2HG2      THR   6   6.573   6.007  -7.359
   55   3HG2  THR   6          3HG2      THR   6   8.033   5.374  -8.150
   56    H    VAL   7           H        VAL   7   3.939   4.713  -6.157
   57    HA   VAL   7           HA       VAL   7   3.221   1.997  -7.181
   58    HB   VAL   7           HB       VAL   7   2.031   2.352  -5.194
   59   1HG1  VAL   7          1HG1      VAL   7   0.864   4.954  -6.255
   60   2HG1  VAL   7          2HG1      VAL   7   0.457   4.120  -4.753
   61   3HG1  VAL   7          3HG1      VAL   7   2.071   4.807  -4.959
   62   1HG2  VAL   7          1HG2      VAL   7  -0.229   2.048  -5.967
   63   2HG2  VAL   7          2HG2      VAL   7   0.156   2.787  -7.530
   64   3HG2  VAL   7          3HG2      VAL   7   0.896   1.240  -7.071
   65    HA   PRO   8           HA       PRO   8   3.411   5.037 -10.538
   66   1HB   PRO   8          2HB       PRO   8   4.406   3.486 -12.553
   67   2HB   PRO   8          3HB       PRO   8   5.428   4.139 -11.236
   68   1HG   PRO   8          2HG       PRO   8   4.180   1.381 -11.397
   69   2HG   PRO   8          3HG       PRO   8   5.878   1.793 -11.029
   70   1HD   PRO   8          2HD       PRO   8   4.067   1.305  -9.067
   71   2HD   PRO   8          3HD       PRO   8   5.330   2.555  -8.878
   72    H    THR   9           H        THR   9   1.920   1.817 -10.527
   73    HA   THR   9           HA       THR   9   0.421   2.407 -12.920
   74    HB   THR   9           HB       THR   9   1.331   0.128 -12.009
   75    HG1  THR   9           1HG      THR   9  -1.068   0.416 -13.457
   76   1HG2  THR   9          1HG2      THR   9  -1.572  -0.077 -11.130
   77   2HG2  THR   9          2HG2      THR   9  -0.389  -1.378 -11.223
   78   3HG2  THR   9          3HG2      THR   9  -0.176  -0.092 -10.018
   79    H    ILE  10           H        ILE  10  -0.498   2.072  -9.418
   80    HA   ILE  10           HA       ILE  10  -2.362   2.372  -8.360
   81    HB   ILE  10           HB       ILE  10  -1.572   4.803  -9.569
   82   1HG1  ILE  10          2HG1      ILE  10  -3.339   4.112  -7.233
   83   2HG1  ILE  10          3HG1      ILE  10  -1.613   4.379  -7.192
   84   1HG2  ILE  10          1HG2      ILE  10  -4.593   4.840  -9.396
   85   2HG2  ILE  10          2HG2      ILE  10  -3.495   6.101  -9.977
   86   3HG2  ILE  10          3HG2      ILE  10  -3.720   4.634 -10.935
   87   1HD1  ILE  10          1HD1      ILE  10  -1.962   6.753  -7.966
   88   2HD1  ILE  10          2HD1      ILE  10  -3.696   6.523  -7.609
   89   3HD1  ILE  10          3HD1      ILE  10  -2.479   6.350  -6.326
   90    H    ALA  11           H        ALA  11  -4.862   2.899  -8.525
   91    HA   ALA  11           HA       ALA  11  -6.868   1.978  -9.078
   92   1HB   ALA  11          1HB       ALA  11  -6.616   3.890 -10.604
   93   2HB   ALA  11          2HB       ALA  11  -5.936   2.810 -11.845
   94   3HB   ALA  11          3HB       ALA  11  -7.618   2.609 -11.307
   95    H    CYS  12           H        CYS  12  -4.713   0.022  -9.040
   96    HA   CYS  12           HA       CYS  12  -4.948  -1.831 -11.204
   97   1HB   CYS  12          2HB       CYS  12  -2.913  -1.845 -10.019
   98   2HB   CYS  12          3HB       CYS  12  -3.741  -1.768  -8.461
   99    HG   CYS  12           HG       CYS  12  -3.525  -4.295 -10.583
  100    H    GLU  13           H        GLU  13  -6.104  -1.998  -7.789
  101    HA   GLU  13           HA       GLU  13  -7.937  -4.212  -8.426
  102   1HB   GLU  13          2HB       GLU  13  -6.596  -3.846  -6.224
  103   2HB   GLU  13          3HB       GLU  13  -7.752  -2.554  -5.881
  104   1HG   GLU  13          2HG       GLU  13  -8.782  -4.302  -4.800
  105   2HG   GLU  13          3HG       GLU  13  -9.528  -4.522  -6.388
  106    H    ALA  14           H        ALA  14  -7.850  -0.812  -7.752
  107    HA   ALA  14           HA       ALA  14 -10.255   0.088  -8.899
  108   1HB   ALA  14          1HB       ALA  14 -11.554   0.571  -6.806
  109   2HB   ALA  14          2HB       ALA  14 -11.454  -1.163  -7.142
  110   3HB   ALA  14          3HB       ALA  14 -10.421  -0.444  -5.888
  111    H    CYS  15           H        CYS  15  -7.894   0.385  -6.176
  112    HA   CYS  15           HA       CYS  15  -6.942   2.944  -6.922
  113   1HB   CYS  15          2HB       CYS  15  -9.145   3.751  -6.050
  114   2HB   CYS  15          3HB       CYS  15  -8.864   2.856  -4.539
  115    HG   CYS  15           HG       CYS  15  -8.486   5.418  -4.174
  116    H    ALA  16           H        ALA  16  -5.172   3.462  -5.520
  117    HA   ALA  16           HA       ALA  16  -3.678   1.407  -4.364
  118   1HB   ALA  16          1HB       ALA  16  -2.741   3.597  -4.934
  119   2HB   ALA  16          2HB       ALA  16  -3.683   4.345  -3.626
  120   3HB   ALA  16          3HB       ALA  16  -2.400   3.180  -3.245
  121    H    GLU  17           H        GLU  17  -6.160   3.472  -2.769
  122    HA   GLU  17           HA       GLU  17  -5.811   2.705  -0.148
  123   1HB   GLU  17          2HB       GLU  17  -7.932   3.888  -1.737
  124   2HB   GLU  17          3HB       GLU  17  -8.649   2.725  -0.634
  125   1HG   GLU  17          2HG       GLU  17  -6.627   4.609   0.555
  126   2HG   GLU  17          3HG       GLU  17  -8.152   5.289   0.014
  127    H    ALA  18           H        ALA  18  -7.020   0.622  -2.755
  128    HA   ALA  18           HA       ALA  18  -8.188  -1.473  -1.315
  129   1HB   ALA  18          1HB       ALA  18  -7.335  -2.913  -3.117
  130   2HB   ALA  18          2HB       ALA  18  -7.967  -1.385  -3.771
  131   3HB   ALA  18          3HB       ALA  18  -6.213  -1.637  -3.636
  132    H    VAL  19           H        VAL  19  -4.659  -0.759  -1.766
  133    HA   VAL  19           HA       VAL  19  -3.873  -3.108  -0.320
  134    HB   VAL  19           HB       VAL  19  -2.430  -1.720  -1.943
  135   1HG1  VAL  19          1HG1      VAL  19  -0.854  -0.187  -0.970
  136   2HG1  VAL  19          2HG1      VAL  19  -2.444   0.452  -0.568
  137   3HG1  VAL  19          3HG1      VAL  19  -1.501  -0.414   0.658
  138   1HG2  VAL  19          1HG2      VAL  19  -1.614  -3.730  -0.989
  139   2HG2  VAL  19          2HG2      VAL  19  -0.422  -2.529  -0.420
  140   3HG2  VAL  19          3HG2      VAL  19  -1.671  -3.091   0.653
  141    H    THR  20           H        THR  20  -4.454   0.298   0.584
  142    HA   THR  20           HA       THR  20  -3.471   0.215   3.264
  143    HB   THR  20           HB       THR  20  -5.691   1.831   1.956
  144    HG1  THR  20           1HG      THR  20  -3.517   2.222   1.361
  145   1HG2  THR  20          1HG2      THR  20  -5.675   3.294   3.884
  146   2HG2  THR  20          2HG2      THR  20  -6.310   1.714   4.293
  147   3HG2  THR  20          3HG2      THR  20  -4.653   2.131   4.783
  148    H    LYS  21           H        LYS  21  -6.755  -0.378   1.980
  149    HA   LYS  21           HA       LYS  21  -7.951  -1.045   4.457
  150   1HB   LYS  21          2HB       LYS  21  -8.703  -2.120   1.724
  151   2HB   LYS  21          3HB       LYS  21  -9.777  -1.973   3.115
  152   1HG   LYS  21          2HG       LYS  21  -8.511   0.583   2.104
  153   2HG   LYS  21          3HG       LYS  21  -9.633  -0.224   1.034
  154   1HD   LYS  21          2HD       LYS  21 -10.753   1.453   2.218
  155   2HD   LYS  21          3HD       LYS  21 -11.373  -0.099   2.826
  156   1HE   LYS  21          2HE       LYS  21 -10.085   0.141   4.883
  157   2HE   LYS  21          3HE       LYS  21  -9.118   1.466   4.194
  158   1HZ   LYS  21          1HZ       LYS  21 -11.995   1.659   4.740
  159   2HZ   LYS  21          2HZ       LYS  21 -10.796   2.266   5.692
  160   3HZ   LYS  21          3HZ       LYS  21 -10.999   2.850   4.166
  161    H    ALA  22           H        ALA  22  -6.354  -3.101   1.974
  162    HA   ALA  22           HA       ALA  22  -6.896  -5.594   3.212
  163   1HB   ALA  22          1HB       ALA  22  -6.120  -5.396   0.903
  164   2HB   ALA  22          2HB       ALA  22  -4.549  -4.781   1.469
  165   3HB   ALA  22          3HB       ALA  22  -5.041  -6.440   1.863
  166    H    VAL  23           H        VAL  23  -3.922  -3.606   3.315
  167    HA   VAL  23           HA       VAL  23  -2.419  -5.263   5.036
  168    HB   VAL  23           HB       VAL  23  -2.300  -2.278   4.464
  169   1HG1  VAL  23          1HG1      VAL  23  -0.986  -2.687   6.518
  170   2HG1  VAL  23          2HG1      VAL  23  -0.210  -4.102   5.755
  171   3HG1  VAL  23          3HG1      VAL  23   0.116  -2.474   5.142
  172   1HG2  VAL  23          1HG2      VAL  23  -0.741  -2.787   2.798
  173   2HG2  VAL  23          2HG2      VAL  23  -0.414  -4.412   3.415
  174   3HG2  VAL  23          3HG2      VAL  23  -1.934  -4.083   2.588
  175    H    GLN  24           H        GLN  24  -4.560  -2.446   5.741
  176    HA   GLN  24           HA       GLN  24  -4.214  -2.371   8.533
  177   1HB   GLN  24          2HB       GLN  24  -6.560  -1.707   6.742
  178   2HB   GLN  24          3HB       GLN  24  -6.564  -1.362   8.467
  179   1HG   GLN  24          2HG       GLN  24  -4.211  -0.399   6.811
  180   2HG   GLN  24          3HG       GLN  24  -5.751   0.433   6.670
  181   1HE2  GLN  24          1HE2      GLN  24  -2.920   0.949   8.037
  182   2HE2  GLN  24          2HE2      GLN  24  -3.411   1.678   9.554
  183    H    ASN  25           H        ASN  25  -5.840  -4.934   6.663
  184    HA   ASN  25           HA       ASN  25  -7.549  -5.829   8.813
  185   1HB   ASN  25          2HB       ASN  25  -6.094  -7.482   6.701
  186   2HB   ASN  25          3HB       ASN  25  -7.324  -8.076   7.805
  187   1HD2  ASN  25          1HD2      ASN  25  -7.076  -7.486   4.714
  188   2HD2  ASN  25          2HD2      ASN  25  -8.693  -6.871   4.378
  189    H    GLU  26           H        GLU  26  -4.156  -6.576   7.911
  190    HA   GLU  26           HA       GLU  26  -3.689  -8.161  10.332
  191   1HB   GLU  26          2HB       GLU  26  -1.716  -7.102   8.249
  192   2HB   GLU  26          3HB       GLU  26  -1.408  -8.285   9.524
  193   1HG   GLU  26          2HG       GLU  26  -3.639  -9.346   8.162
  194   2HG   GLU  26          3HG       GLU  26  -2.649  -8.647   6.877
  195    H    ASP  27           H        ASP  27  -2.367  -5.124   8.971
  196    HA   ASP  27           HA       ASP  27  -1.151  -4.477  11.539
  197   1HB   ASP  27          2HB       ASP  27  -0.093  -4.414   9.158
  198   2HB   ASP  27          3HB       ASP  27  -0.969  -2.902   8.941
  199    H    ALA  28           H        ALA  28  -3.567  -4.326  12.221
  200    HA   ALA  28           HA       ALA  28  -5.197  -2.139  11.336
  201   1HB   ALA  28          1HB       ALA  28  -6.090  -4.161  12.442
  202   2HB   ALA  28          2HB       ALA  28  -5.290  -3.690  13.960
  203   3HB   ALA  28          3HB       ALA  28  -6.590  -2.682  13.288
  204    H    GLN  29           H        GLN  29  -2.489  -2.250  13.419
  205    HA   GLN  29           HA       GLN  29  -3.138   0.307  14.774
  206   1HB   GLN  29          2HB       GLN  29  -1.453  -0.379  16.335
  207   2HB   GLN  29          3HB       GLN  29  -2.628  -1.660  16.143
  208   1HG   GLN  29          2HG       GLN  29  -1.057  -3.140  15.511
  209   2HG   GLN  29          3HG       GLN  29  -0.447  -2.092  14.231
  210   1HE2  GLN  29          1HE2      GLN  29   0.721   0.011  15.316
  211   2HE2  GLN  29          2HE2      GLN  29   1.987  -0.476  16.446
  212    H    ALA  30           H        ALA  30  -2.057  -0.125  11.830
  213    HA   ALA  30           HA       ALA  30   0.400   1.568  12.094
  214   1HB   ALA  30          1HB       ALA  30   0.875  -0.300  10.821
  215   2HB   ALA  30          2HB       ALA  30  -0.651  -0.236   9.896
  216   3HB   ALA  30          3HB       ALA  30   0.618   0.975   9.628
  217    H    THR  31           H        THR  31   0.689   3.257  10.483
  218    HA   THR  31           HA       THR  31  -1.873   4.702   9.877
  219    HB   THR  31           HB       THR  31   0.819   5.870  10.663
  220    HG1  THR  31           1HG      THR  31  -0.480   4.825  12.332
  221   1HG2  THR  31          1HG2      THR  31  -0.448   7.381   9.155
  222   2HG2  THR  31          2HG2      THR  31  -1.893   7.189  10.176
  223   3HG2  THR  31          3HG2      THR  31  -0.450   7.999  10.814
  224    H    VAL  32           H        VAL  32  -2.086   5.408   7.803
  225    HA   VAL  32           HA       VAL  32   0.126   4.859   5.878
  226    HB   VAL  32           HB       VAL  32  -1.623   4.486   4.227
  227   1HG1  VAL  32          1HG1      VAL  32  -2.291   2.295   4.933
  228   2HG1  VAL  32          2HG1      VAL  32  -0.711   2.601   5.675
  229   3HG1  VAL  32          3HG1      VAL  32  -2.179   2.725   6.652
  230   1HG2  VAL  32          1HG2      VAL  32  -3.675   4.606   6.490
  231   2HG2  VAL  32          2HG2      VAL  32  -3.441   5.911   5.306
  232   3HG2  VAL  32          3HG2      VAL  32  -3.949   4.330   4.762
  233    H    GLN  33           H        GLN  33   0.443   6.421   4.209
  234    HA   GLN  33           HA       GLN  33  -1.386   8.715   4.021
  235   1HB   GLN  33          2HB       GLN  33   1.539   8.842   4.806
  236   2HB   GLN  33          3HB       GLN  33   0.931  10.064   3.687
  237   1HG   GLN  33          2HG       GLN  33  -0.228   9.502   6.447
  238   2HG   GLN  33          3HG       GLN  33   0.864  10.825   6.032
  239   1HE2  GLN  33          1HE2      GLN  33  -1.738  11.269   7.161
  240   2HE2  GLN  33          2HE2      GLN  33  -2.677  12.096   5.929
  241    H    VAL  34           H        VAL  34  -2.051   8.486   1.944
  242    HA   VAL  34           HA       VAL  34  -0.089   7.533  -0.094
  243    HB   VAL  34           HB       VAL  34  -1.726   5.808   0.644
  244   1HG1  VAL  34          1HG1      VAL  34  -4.027   5.869   0.037
  245   2HG1  VAL  34          2HG1      VAL  34  -3.695   7.264   1.071
  246   3HG1  VAL  34          3HG1      VAL  34  -3.885   7.474  -0.684
  247   1HG2  VAL  34          1HG2      VAL  34  -0.792   5.415  -1.441
  248   2HG2  VAL  34          2HG2      VAL  34  -2.518   5.322  -1.769
  249   3HG2  VAL  34          3HG2      VAL  34  -1.587   6.773  -2.217
  250    H    ASP  35           H        ASP  35   0.234   8.918  -1.765
  251    HA   ASP  35           HA       ASP  35  -1.708  11.181  -2.112
  252   1HB   ASP  35          2HB       ASP  35   1.219  10.834  -2.755
  253   2HB   ASP  35          3HB       ASP  35   0.225  11.939  -3.699
  254    H    LEU  36           H        LEU  36  -3.318   9.743  -3.141
  255    HA   LEU  36           HA       LEU  36  -2.848   8.657  -5.722
  256   1HB   LEU  36          2HB       LEU  36  -5.354  10.141  -4.889
  257   2HB   LEU  36          3HB       LEU  36  -5.164   8.853  -6.068
  258    HG   LEU  36           HG       LEU  36  -6.025   7.597  -4.505
  259   1HD1  LEU  36          1HD1      LEU  36  -3.796   6.638  -4.555
  260   2HD1  LEU  36          2HD1      LEU  36  -3.406   7.538  -3.070
  261   3HD1  LEU  36          3HD1      LEU  36  -4.691   6.340  -3.054
  262   1HD2  LEU  36          1HD2      LEU  36  -6.182   8.045  -2.098
  263   2HD2  LEU  36          2HD2      LEU  36  -5.039   9.390  -2.247
  264   3HD2  LEU  36          3HD2      LEU  36  -6.629   9.479  -3.032
  265    H    THR  37           H        THR  37  -2.971  11.951  -4.479
  266    HA   THR  37           HA       THR  37  -3.172  13.631  -6.577
  267    HB   THR  37           HB       THR  37  -0.755  13.912  -4.818
  268    HG1  THR  37           1HG      THR  37  -1.704  13.663  -2.960
  269   1HG2  THR  37          1HG2      THR  37  -1.804  16.090  -4.337
  270   2HG2  THR  37          2HG2      THR  37  -1.723  15.798  -6.086
  271   3HG2  THR  37          3HG2      THR  37  -3.264  15.600  -5.222
  272    H    SER  38           H        SER  38  -0.616  11.198  -6.062
  273    HA   SER  38           HA       SER  38   0.456  11.800  -8.724
  274   1HB   SER  38          2HB       SER  38   2.187  11.975  -6.218
  275   2HB   SER  38          3HB       SER  38   2.789  11.964  -7.898
  276    HG   SER  38           HG       SER  38   0.878  13.796  -7.732
  277    H    LYS  39           H        LYS  39   2.572   9.942  -6.740
  278    HA   LYS  39           HA       LYS  39   1.319   7.384  -7.416
  279   1HB   LYS  39          2HB       LYS  39   3.095   6.772  -9.038
  280   2HB   LYS  39          3HB       LYS  39   2.039   8.064  -9.597
  281   1HG   LYS  39          2HG       LYS  39   3.926   9.674  -8.680
  282   2HG   LYS  39          3HG       LYS  39   4.942   8.235  -8.725
  283   1HD   LYS  39          2HD       LYS  39   3.329   9.386 -11.063
  284   2HD   LYS  39          3HD       LYS  39   5.037   9.737 -10.752
  285   1HE   LYS  39          2HE       LYS  39   5.588   7.314 -11.000
  286   2HE   LYS  39          3HE       LYS  39   3.877   6.978 -11.338
  287   1HZ   LYS  39          1HZ       LYS  39   4.004   8.271 -13.296
  288   2HZ   LYS  39          2HZ       LYS  39   5.569   8.705 -13.002
  289   3HZ   LYS  39          3HZ       LYS  39   5.190   7.139 -13.326
  290    H    LYS  40           H        LYS  40   2.264   8.643  -4.973
  291    HA   LYS  40           HA       LYS  40   4.461   6.774  -4.242
  292   1HB   LYS  40          2HB       LYS  40   5.549   8.414  -2.919
  293   2HB   LYS  40          3HB       LYS  40   5.328   9.083  -4.530
  294   1HG   LYS  40          2HG       LYS  40   4.792  10.879  -3.190
  295   2HG   LYS  40          3HG       LYS  40   3.214  10.250  -3.584
  296   1HD   LYS  40          2HD       LYS  40   2.715   9.824  -1.405
  297   2HD   LYS  40          3HD       LYS  40   4.231   8.986  -1.100
  298   1HE   LYS  40          2HE       LYS  40   3.853  12.016  -1.128
  299   2HE   LYS  40          3HE       LYS  40   3.840  11.001   0.314
  300   1HZ   LYS  40          1HZ       LYS  40   5.991  11.988  -0.038
  301   2HZ   LYS  40          2HZ       LYS  40   6.145  10.362  -0.179
  302   3HZ   LYS  40          3HZ       LYS  40   6.135  11.290  -1.516
  303    H    VAL  41           H        VAL  41   4.304   5.907  -2.159
  304    HA   VAL  41           HA       VAL  41   2.012   6.777  -0.515
  305    HB   VAL  41           HB       VAL  41   1.253   4.818  -1.803
  306   1HG1  VAL  41          1HG1      VAL  41   2.179   2.601  -1.453
  307   2HG1  VAL  41          2HG1      VAL  41   3.401   3.670  -2.163
  308   3HG1  VAL  41          3HG1      VAL  41   3.462   3.269  -0.422
  309   1HG2  VAL  41          1HG2      VAL  41   0.522   5.252   0.598
  310   2HG2  VAL  41          2HG2      VAL  41   0.401   3.557   0.092
  311   3HG2  VAL  41          3HG2      VAL  41   1.744   4.092   1.119
  312    H    THR  42           H        THR  42   2.379   6.659   1.660
  313    HA   THR  42           HA       THR  42   5.111   5.936   2.546
  314    HB   THR  42           HB       THR  42   3.292   8.271   3.347
  315    HG1  THR  42           1HG      THR  42   4.991   9.506   2.474
  316   1HG2  THR  42          1HG2      THR  42   5.249   9.019   4.715
  317   2HG2  THR  42          2HG2      THR  42   4.569   7.492   5.290
  318   3HG2  THR  42          3HG2      THR  42   6.057   7.485   4.322
  319    H    ILE  43           H        ILE  43   4.973   4.390   4.112
  320    HA   ILE  43           HA       ILE  43   2.404   3.985   5.595
  321    HB   ILE  43           HB       ILE  43   4.345   1.867   4.624
  322   1HG1  ILE  43          2HG1      ILE  43   3.084   2.866   2.712
  323   2HG1  ILE  43          3HG1      ILE  43   2.730   1.181   2.987
  324   1HG2  ILE  43          1HG2      ILE  43   2.469   0.318   5.345
  325   2HG2  ILE  43          2HG2      ILE  43   3.290   1.164   6.664
  326   3HG2  ILE  43          3HG2      ILE  43   1.697   1.714   6.120
  327   1HD1  ILE  43          1HD1      ILE  43   0.607   1.688   4.046
  328   2HD1  ILE  43          2HD1      ILE  43   0.913   3.440   3.886
  329   3HD1  ILE  43          3HD1      ILE  43   0.703   2.423   2.451
  330    H    THR  44           H        THR  44   2.649   4.313   7.700
  331    HA   THR  44           HA       THR  44   5.343   4.081   8.966
  332    HB   THR  44           HB       THR  44   2.853   5.612   9.757
  333    HG1  THR  44           1HG      THR  44   4.103   7.365   9.213
  334   1HG2  THR  44          1HG2      THR  44   4.299   6.587  11.534
  335   2HG2  THR  44          2HG2      THR  44   4.069   4.849  11.778
  336   3HG2  THR  44          3HG2      THR  44   5.596   5.456  11.095
  337    H    SER  45           H        SER  45   5.506   1.989   9.501
  338    HA   SER  45           HA       SER  45   3.741   0.863  11.523
  339   1HB   SER  45          2HB       SER  45   3.428  -1.232  10.316
  340   2HB   SER  45          3HB       SER  45   2.745   0.053   9.319
  341    HG   SER  45           HG       SER  45   4.665   0.070   8.108
  342    H    ALA  46           H        ALA  46   4.877  -1.517  11.883
  343    HA   ALA  46           HA       ALA  46   7.795  -1.412  11.295
  344   1HB   ALA  46          1HB       ALA  46   8.288  -2.341  13.506
  345   2HB   ALA  46          2HB       ALA  46   7.476  -0.772  13.670
  346   3HB   ALA  46          3HB       ALA  46   6.566  -2.277  13.945
  347    H    LEU  47           H        LEU  47   5.454  -2.658   9.986
  348    HA   LEU  47           HA       LEU  47   6.592  -5.286   9.618
  349   1HB   LEU  47          2HB       LEU  47   4.862  -6.677  10.335
  350   2HB   LEU  47          3HB       LEU  47   5.179  -5.545  11.643
  351    HG   LEU  47           HG       LEU  47   3.157  -4.186  10.701
  352   1HD1  LEU  47          1HD1      LEU  47   1.401  -5.958   9.853
  353   2HD1  LEU  47          2HD1      LEU  47   2.512  -5.306   8.664
  354   3HD1  LEU  47          3HD1      LEU  47   2.798  -6.915   9.365
  355   1HD2  LEU  47          1HD2      LEU  47   1.638  -5.501  12.097
  356   2HD2  LEU  47          2HD2      LEU  47   2.782  -6.865  12.068
  357   3HD2  LEU  47          3HD2      LEU  47   3.225  -5.330  12.863
  358    H    GLY  48           H        GLY  48   3.901  -3.012   8.881
  359   1HA   GLY  48          2HA       GLY  48   2.912  -3.707   6.545
  360   2HA   GLY  48          3HA       GLY  48   3.474  -2.073   6.862
  361    H    GLU  49           H        GLU  49   6.328  -2.610   6.932
  362    HA   GLU  49           HA       GLU  49   7.119  -2.311   4.343
  363   1HB   GLU  49          2HB       GLU  49   8.428  -2.153   6.545
  364   2HB   GLU  49          3HB       GLU  49   8.722  -3.884   6.438
  365   1HG   GLU  49          2HG       GLU  49   9.483  -1.962   4.194
  366   2HG   GLU  49          3HG       GLU  49  10.528  -2.255   5.591
  367    H    GLU  50           H        GLU  50   7.312  -5.542   5.943
  368    HA   GLU  50           HA       GLU  50   7.548  -6.868   3.347
  369   1HB   GLU  50          2HB       GLU  50   7.843  -7.682   6.166
  370   2HB   GLU  50          3HB       GLU  50   6.835  -8.812   5.265
  371   1HG   GLU  50          2HG       GLU  50   8.619  -8.859   3.458
  372   2HG   GLU  50          3HG       GLU  50   9.659  -7.944   4.568
  373    H    GLN  51           H        GLN  51   4.933  -6.369   5.758
  374    HA   GLN  51           HA       GLN  51   3.168  -8.219   4.679
  375   1HB   GLN  51          2HB       GLN  51   3.079  -6.638   6.800
  376   2HB   GLN  51          3HB       GLN  51   2.054  -5.634   5.764
  377   1HG   GLN  51          2HG       GLN  51   1.635  -8.580   6.463
  378   2HG   GLN  51          3HG       GLN  51   0.796  -7.223   7.220
  379   1HE2  GLN  51          1HE2      GLN  51  -0.448  -9.454   5.796
  380   2HE2  GLN  51          2HE2      GLN  51  -1.248  -8.786   4.377
  381    H    LEU  52           H        LEU  52   3.592  -4.800   3.714
  382    HA   LEU  52           HA       LEU  52   1.681  -4.485   1.709
  383   1HB   LEU  52          2HB       LEU  52   4.561  -3.548   1.938
  384   2HB   LEU  52          3HB       LEU  52   3.499  -2.992   0.651
  385    HG   LEU  52           HG       LEU  52   2.613  -2.667   3.520
  386   1HD1  LEU  52          1HD1      LEU  52   5.001  -1.733   3.127
  387   2HD1  LEU  52          2HD1      LEU  52   4.247  -0.604   1.995
  388   3HD1  LEU  52          3HD1      LEU  52   3.791  -0.606   3.718
  389   1HD2  LEU  52          1HD2      LEU  52   1.053  -2.276   1.577
  390   2HD2  LEU  52          2HD2      LEU  52   1.306  -0.853   2.606
  391   3HD2  LEU  52          3HD2      LEU  52   2.119  -0.979   1.030
  392    H    ARG  53           H        ARG  53   4.924  -6.065   1.548
  393    HA   ARG  53           HA       ARG  53   4.999  -6.233  -1.275
  394   1HB   ARG  53          2HB       ARG  53   6.785  -6.869   0.663
  395   2HB   ARG  53          3HB       ARG  53   6.145  -8.484   0.375
  396   1HG   ARG  53          2HG       ARG  53   7.966  -8.338  -1.101
  397   2HG   ARG  53          3HG       ARG  53   6.592  -7.976  -2.159
  398   1HD   ARG  53          2HD       ARG  53   7.087  -5.456  -1.611
  399   2HD   ARG  53          3HD       ARG  53   8.522  -6.035  -0.800
  400    HE   ARG  53           HE       ARG  53   9.578  -6.478  -2.779
  401   1HH1  ARG  53          2HH2      ARG  53   6.189  -5.829  -3.489
  402   2HH1  ARG  53          1HH2      ARG  53   6.462  -5.279  -5.119
  403   1HH2  ARG  53          2HH1      ARG  53   9.969  -5.831  -4.976
  404   2HH2  ARG  53          1HH1      ARG  53   8.653  -5.324  -5.981
  405    H    THR  54           H        THR  54   3.632  -8.392   1.171
  406    HA   THR  54           HA       THR  54   2.679 -10.346  -0.755
  407    HB   THR  54           HB       THR  54   1.907  -9.947   2.171
  408    HG1  THR  54           1HG      THR  54   4.137 -10.308   1.858
  409   1HG2  THR  54          1HG2      THR  54   1.361 -12.365   2.058
  410   2HG2  THR  54          2HG2      THR  54   0.312 -11.421   0.985
  411   3HG2  THR  54          3HG2      THR  54   1.666 -12.357   0.309
  412    H    ALA  55           H        ALA  55   1.017  -7.863   1.281
  413    HA   ALA  55           HA       ALA  55  -1.583  -8.389   0.348
  414   1HB   ALA  55          1HB       ALA  55  -2.123  -6.129   1.235
  415   2HB   ALA  55          2HB       ALA  55  -1.192  -7.132   2.360
  416   3HB   ALA  55          3HB       ALA  55  -0.382  -5.829   1.456
  417    H    ILE  56           H        ILE  56   0.693  -5.829  -0.749
  418    HA   ILE  56           HA       ILE  56  -0.737  -4.834  -2.956
  419    HB   ILE  56           HB       ILE  56   2.255  -5.429  -2.760
  420   1HG1  ILE  56          2HG1      ILE  56   1.305  -3.686  -1.133
  421   2HG1  ILE  56          3HG1      ILE  56   2.618  -3.178  -2.186
  422   1HG2  ILE  56          1HG2      ILE  56   0.610  -3.981  -4.812
  423   2HG2  ILE  56          2HG2      ILE  56   2.364  -3.689  -4.629
  424   3HG2  ILE  56          3HG2      ILE  56   1.781  -5.287  -5.091
  425   1HD1  ILE  56          1HD1      ILE  56  -0.320  -2.575  -2.741
  426   2HD1  ILE  56          2HD1      ILE  56   0.862  -1.458  -2.009
  427   3HD1  ILE  56          3HD1      ILE  56   1.052  -1.999  -3.668
  428    H    ALA  57           H        ALA  57   1.540  -7.665  -2.958
  429    HA   ALA  57           HA       ALA  57   1.146  -8.262  -5.665
  430   1HB   ALA  57          1HB       ALA  57   3.004  -9.173  -4.344
  431   2HB   ALA  57          2HB       ALA  57   1.875 -10.166  -3.393
  432   3HB   ALA  57          3HB       ALA  57   2.095 -10.480  -5.125
  433    H    SER  58           H        SER  58  -0.811  -9.219  -2.868
  434    HA   SER  58           HA       SER  58  -2.462 -11.168  -3.959
  435   1HB   SER  58          2HB       SER  58  -2.516 -10.024  -1.618
  436   2HB   SER  58          3HB       SER  58  -3.639  -8.869  -2.372
  437    HG   SER  58           HG       SER  58  -4.802 -10.562  -1.478
  438    H    ALA  59           H        ALA  59  -2.687  -7.620  -4.467
  439    HA   ALA  59           HA       ALA  59  -4.948  -7.925  -6.374
  440   1HB   ALA  59          1HB       ALA  59  -3.486  -5.515  -5.249
  441   2HB   ALA  59          2HB       ALA  59  -4.797  -5.440  -6.450
  442   3HB   ALA  59          3HB       ALA  59  -5.107  -6.093  -4.828
  443    H    GLY  60           H        GLY  60  -1.508  -7.066  -6.274
  444   1HA   GLY  60          2HA       GLY  60   0.085  -7.522  -7.905
  445   2HA   GLY  60          3HA       GLY  60  -1.177  -7.805  -9.107
  446    H    HIS  61           H        HIS  61  -0.037  -5.101  -7.011
  447    HA   HIS  61           HA       HIS  61  -0.378  -3.175  -9.261
  448   1HB   HIS  61          2HB       HIS  61   0.738  -2.641  -6.493
  449   2HB   HIS  61          3HB       HIS  61   0.363  -1.469  -7.743
  450    HD1  HIS  61           1HD      HIS  61  -1.672  -0.135  -7.054
  451    HD2  HIS  61           2HD      HIS  61  -1.775  -4.147  -5.818
  452    HE1  HIS  61           1HE      HIS  61  -3.845  -0.437  -5.749
  453    H    GLU  62           H        GLU  62   1.421  -2.271 -10.304
  454    HA   GLU  62           HA       GLU  62   3.893  -3.796 -10.295
  455   1HB   GLU  62          2HB       GLU  62   3.115  -1.275 -11.824
  456   2HB   GLU  62          3HB       GLU  62   4.439  -2.371 -12.208
  457   1HG   GLU  62          2HG       GLU  62   1.510  -3.277 -12.255
  458   2HG   GLU  62          3HG       GLU  62   2.356  -2.584 -13.635
  459    H    VAL  63           H        VAL  63   3.820  -2.950  -7.877
  460    HA   VAL  63           HA       VAL  63   4.832  -0.240  -7.464
  461    HB   VAL  63           HB       VAL  63   4.151  -2.557  -5.652
  462   1HG1  VAL  63          1HG1      VAL  63   4.546  -1.061  -3.704
  463   2HG1  VAL  63          2HG1      VAL  63   6.055  -1.505  -4.506
  464   3HG1  VAL  63          3HG1      VAL  63   5.353   0.104  -4.768
  465   1HG2  VAL  63          1HG2      VAL  63   3.138   0.310  -5.826
  466   2HG2  VAL  63          2HG2      VAL  63   2.404  -1.022  -6.729
  467   3HG2  VAL  63          3HG2      VAL  63   2.391  -1.016  -4.952
  468    H    GLU  64           H        GLU  64   6.792   0.452  -6.847
  469    HA   GLU  64           HA       GLU  64   9.063  -1.451  -6.809
  470   1HB   GLU  64          2HB       GLU  64   8.662   0.089  -8.958
  471   2HB   GLU  64          3HB       GLU  64   9.330   1.350  -7.912
  472   1HG   GLU  64          2HG       GLU  64  11.377  -0.068  -7.623
  473   2HG   GLU  64          3HG       GLU  64  10.651  -1.301  -8.674
  Start of MODEL   19
    1   1H    MET   1           H1       MET   1  10.897   7.955   6.756
    2   2H    MET   1           H2       MET   1  12.449   8.234   7.258
    3   3H    MET   1           H3       MET   1  12.032   6.792   6.561
    4    HA   MET   1           HA       MET   1  12.273   6.498   8.902
    5   1HB   MET   1          2HB       MET   1  10.161   8.700   8.970
    6   2HB   MET   1          3HB       MET   1  10.355   7.530  10.282
    7   1HG   MET   1          2HG       MET   1  12.695   8.203  10.589
    8   2HG   MET   1          3HG       MET   1  12.511   9.446   9.334
    9   1HE   MET   1          1HE       MET   1  13.530   9.866  12.404
   10   2HE   MET   1          2HE       MET   1  13.490  11.166  11.182
   11   3HE   MET   1          3HE       MET   1  12.724  11.408  12.770
   12    H    THR   2           H        THR   2   8.881   7.269   7.965
   13    HA   THR   2           HA       THR   2   7.783   4.672   8.347
   14    HB   THR   2           HB       THR   2   5.968   5.865   6.962
   15    HG1  THR   2           1HG      THR   2   7.397   7.228   5.780
   16   1HG2  THR   2          1HG2      THR   2   5.530   7.569   8.696
   17   2HG2  THR   2          2HG2      THR   2   6.104   6.065   9.452
   18   3HG2  THR   2          3HG2      THR   2   7.184   7.458   9.296
   19    H    ILE   3           H        ILE   3   6.853   3.391   6.467
   20    HA   ILE   3           HA       ILE   3   9.073   2.808   4.606
   21    HB   ILE   3           HB       ILE   3   6.446   1.416   5.299
   22   1HG1  ILE   3          2HG1      ILE   3   7.935  -0.405   6.093
   23   2HG1  ILE   3          3HG1      ILE   3   9.351   0.613   5.819
   24   1HG2  ILE   3          1HG2      ILE   3   6.948   0.982   2.952
   25   2HG2  ILE   3          2HG2      ILE   3   8.625   0.558   3.349
   26   3HG2  ILE   3          3HG2      ILE   3   7.277  -0.459   3.898
   27   1HD1  ILE   3          1HD1      ILE   3   8.714   2.062   7.651
   28   2HD1  ILE   3          2HD1      ILE   3   7.080   1.345   7.721
   29   3HD1  ILE   3          3HD1      ILE   3   8.502   0.404   8.207
   30    H    GLN   4           H        GLN   4   9.075   4.048   2.725
   31    HA   GLN   4           HA       GLN   4   6.473   5.012   1.670
   32   1HB   GLN   4          2HB       GLN   4   7.943   6.717   2.690
   33   2HB   GLN   4          3HB       GLN   4   9.201   6.331   1.499
   34   1HG   GLN   4          2HG       GLN   4   7.767   7.040  -0.325
   35   2HG   GLN   4          3HG       GLN   4   6.370   7.180   0.754
   36   1HE2  GLN   4          1HE2      GLN   4   6.082   9.046   2.024
   37   2HE2  GLN   4          2HE2      GLN   4   7.176  10.421   1.909
   38    H    LEU   5           H        LEU   5   5.917   4.423  -0.322
   39    HA   LEU   5           HA       LEU   5   7.896   2.977  -2.053
   40   1HB   LEU   5          2HB       LEU   5   4.982   2.209  -1.874
   41   2HB   LEU   5          3HB       LEU   5   6.326   1.317  -2.548
   42    HG   LEU   5           HG       LEU   5   5.475   0.235  -0.634
   43   1HD1  LEU   5          1HD1      LEU   5   8.196   1.405   0.057
   44   2HD1  LEU   5          2HD1      LEU   5   7.498  -0.101   0.680
   45   3HD1  LEU   5          3HD1      LEU   5   7.887   0.049  -1.043
   46   1HD2  LEU   5          1HD2      LEU   5   5.180   1.078   1.519
   47   2HD2  LEU   5          2HD2      LEU   5   6.260   2.425   1.266
   48   3HD2  LEU   5          3HD2      LEU   5   4.656   2.421   0.517
   49    H    THR   6           H        THR   6   7.093   2.723  -4.299
   50    HA   THR   6           HA       THR   6   5.561   5.074  -5.301
   51    HB   THR   6           HB       THR   6   8.105   3.725  -6.253
   52    HG1  THR   6           1HG      THR   6   8.964   5.663  -5.762
   53   1HG2  THR   6          1HG2      THR   6   8.095   5.436  -8.095
   54   2HG2  THR   6          2HG2      THR   6   6.873   4.180  -8.289
   55   3HG2  THR   6          3HG2      THR   6   6.398   5.794  -7.703
   56    H    VAL   7           H        VAL   7   3.688   4.391  -6.123
   57    HA   VAL   7           HA       VAL   7   3.404   1.685  -7.428
   58    HB   VAL   7           HB       VAL   7   2.151   1.670  -5.513
   59   1HG1  VAL   7          1HG1      VAL   7   1.007   4.408  -6.154
   60   2HG1  VAL   7          2HG1      VAL   7   0.403   3.312  -4.898
   61   3HG1  VAL   7          3HG1      VAL   7   2.039   3.961  -4.784
   62   1HG2  VAL   7          1HG2      VAL   7   1.033   0.899  -7.646
   63   2HG2  VAL   7          2HG2      VAL   7   0.007   1.180  -6.226
   64   3HG2  VAL   7          3HG2      VAL   7   0.059   2.380  -7.515
   65    HA   PRO   8           HA       PRO   8   3.098   4.834 -10.753
   66   1HB   PRO   8          2HB       PRO   8   3.955   3.276 -12.827
   67   2HB   PRO   8          3HB       PRO   8   5.063   4.103 -11.696
   68   1HG   PRO   8          2HG       PRO   8   4.152   1.221 -11.590
   69   2HG   PRO   8          3HG       PRO   8   5.812   1.856 -11.434
   70   1HD   PRO   8          2HD       PRO   8   4.313   1.225  -9.284
   71   2HD   PRO   8          3HD       PRO   8   5.418   2.620  -9.246
   72    H    THR   9           H        THR   9   1.971   1.495 -10.509
   73    HA   THR   9           HA       THR   9  -0.241   2.052 -12.377
   74    HB   THR   9           HB       THR   9   1.235   0.079 -12.558
   75    HG1  THR   9           1HG      THR   9  -1.551  -0.259 -12.158
   76   1HG2  THR   9          1HG2      THR   9   0.747  -1.895 -11.298
   77   2HG2  THR   9          2HG2      THR   9   1.493  -0.645 -10.258
   78   3HG2  THR   9          3HG2      THR   9  -0.244  -1.014 -10.139
   79    H    ILE  10           H        ILE  10  -0.220   3.339  -9.600
   80    HA   ILE  10           HA       ILE  10  -2.315   2.666  -8.123
   81    HB   ILE  10           HB       ILE  10  -0.988   5.055  -8.923
   82   1HG1  ILE  10          2HG1      ILE  10  -3.074   4.443  -6.857
   83   2HG1  ILE  10          3HG1      ILE  10  -1.328   4.266  -6.710
   84   1HG2  ILE  10          1HG2      ILE  10  -2.888   5.517 -10.473
   85   2HG2  ILE  10          2HG2      ILE  10  -3.971   5.579  -9.059
   86   3HG2  ILE  10          3HG2      ILE  10  -2.642   6.746  -9.227
   87   1HD1  ILE  10          1HD1      ILE  10  -1.962   6.269  -5.511
   88   2HD1  ILE  10          2HD1      ILE  10  -1.098   6.771  -6.977
   89   3HD1  ILE  10          3HD1      ILE  10  -2.872   6.892  -6.896
   90    H    ALA  11           H        ALA  11  -4.615   3.044  -8.114
   91    HA   ALA  11           HA       ALA  11  -6.731   2.958  -8.882
   92   1HB   ALA  11          1HB       ALA  11  -5.784   3.772 -11.631
   93   2HB   ALA  11          2HB       ALA  11  -7.419   3.830 -10.961
   94   3HB   ALA  11          3HB       ALA  11  -6.160   4.876 -10.286
   95    H    CYS  12           H        CYS  12  -4.321   1.004 -10.367
   96    HA   CYS  12           HA       CYS  12  -5.544  -0.771 -11.976
   97   1HB   CYS  12          2HB       CYS  12  -3.268  -0.972 -11.481
   98   2HB   CYS  12          3HB       CYS  12  -3.558  -1.159  -9.744
   99    HG   CYS  12           HG       CYS  12  -4.513  -3.221 -12.145
  100    H    GLU  13           H        GLU  13  -5.724  -1.110  -8.364
  101    HA   GLU  13           HA       GLU  13  -8.113  -2.879  -8.732
  102   1HB   GLU  13          2HB       GLU  13  -5.804  -2.975  -6.786
  103   2HB   GLU  13          3HB       GLU  13  -7.415  -3.387  -6.192
  104   1HG   GLU  13          2HG       GLU  13  -6.179  -4.686  -8.650
  105   2HG   GLU  13          3HG       GLU  13  -6.167  -5.381  -7.021
  106    H    ALA  14           H        ALA  14  -8.721  -0.544  -9.243
  107    HA   ALA  14           HA       ALA  14 -10.371   0.915  -8.793
  108   1HB   ALA  14          1HB       ALA  14 -11.581   1.032  -6.727
  109   2HB   ALA  14          2HB       ALA  14 -11.330  -0.678  -7.127
  110   3HB   ALA  14          3HB       ALA  14 -10.360   0.100  -5.856
  111    H    CYS  15           H        CYS  15  -7.743   0.756  -6.399
  112    HA   CYS  15           HA       CYS  15  -6.622   3.283  -6.784
  113   1HB   CYS  15          2HB       CYS  15  -9.062   3.392  -5.048
  114   2HB   CYS  15          3HB       CYS  15  -7.582   4.058  -4.335
  115    HG   CYS  15           HG       CYS  15  -8.862   4.841  -7.247
  116    H    ALA  16           H        ALA  16  -4.909   3.624  -5.414
  117    HA   ALA  16           HA       ALA  16  -3.635   1.365  -4.311
  118   1HB   ALA  16          1HB       ALA  16  -2.348   3.297  -4.885
  119   2HB   ALA  16          2HB       ALA  16  -3.253   4.328  -3.750
  120   3HB   ALA  16          3HB       ALA  16  -2.170   3.050  -3.146
  121    H    GLU  17           H        GLU  17  -5.998   3.586  -2.805
  122    HA   GLU  17           HA       GLU  17  -5.562   2.953  -0.167
  123   1HB   GLU  17          2HB       GLU  17  -7.721   3.624   0.373
  124   2HB   GLU  17          3HB       GLU  17  -7.189   4.641  -0.960
  125   1HG   GLU  17          2HG       GLU  17  -8.625   3.357  -2.516
  126   2HG   GLU  17          3HG       GLU  17  -9.078   2.248  -1.223
  127    H    ALA  18           H        ALA  18  -6.928   0.867  -2.675
  128    HA   ALA  18           HA       ALA  18  -8.104  -1.196  -1.205
  129   1HB   ALA  18          1HB       ALA  18  -8.058  -1.045  -3.656
  130   2HB   ALA  18          2HB       ALA  18  -6.316  -1.375  -3.671
  131   3HB   ALA  18          3HB       ALA  18  -7.450  -2.619  -3.104
  132    H    VAL  19           H        VAL  19  -4.561  -0.708  -1.927
  133    HA   VAL  19           HA       VAL  19  -3.887  -3.168  -0.586
  134    HB   VAL  19           HB       VAL  19  -2.382  -1.941  -2.255
  135   1HG1  VAL  19          1HG1      VAL  19  -0.596  -0.588  -1.312
  136   2HG1  VAL  19          2HG1      VAL  19  -2.110   0.241  -0.948
  137   3HG1  VAL  19          3HG1      VAL  19  -1.275  -0.685   0.316
  138   1HG2  VAL  19          1HG2      VAL  19  -1.371  -3.136   0.376
  139   2HG2  VAL  19          2HG2      VAL  19  -1.896  -4.049  -1.051
  140   3HG2  VAL  19          3HG2      VAL  19  -0.448  -3.041  -1.110
  141    H    THR  20           H        THR  20  -4.127   0.235   0.349
  142    HA   THR  20           HA       THR  20  -3.083   0.062   2.992
  143    HB   THR  20           HB       THR  20  -4.955   1.906   1.567
  144    HG1  THR  20           1HG      THR  20  -2.678   2.083   1.554
  145   1HG2  THR  20          1HG2      THR  20  -6.195   1.840   3.581
  146   2HG2  THR  20          2HG2      THR  20  -4.722   1.851   4.563
  147   3HG2  THR  20          3HG2      THR  20  -5.185   3.287   3.607
  148    H    LYS  21           H        LYS  21  -6.505  -0.446   1.879
  149    HA   LYS  21           HA       LYS  21  -7.401  -1.048   4.516
  150   1HB   LYS  21          2HB       LYS  21  -8.727  -2.317   2.119
  151   2HB   LYS  21          3HB       LYS  21  -9.424  -1.750   3.643
  152   1HG   LYS  21          2HG       LYS  21  -8.373   0.598   2.682
  153   2HG   LYS  21          3HG       LYS  21  -8.685  -0.290   1.170
  154   1HD   LYS  21          2HD       LYS  21 -11.086  -0.566   1.957
  155   2HD   LYS  21          3HD       LYS  21 -10.678   0.544   3.296
  156   1HE   LYS  21          2HE       LYS  21  -9.721   2.131   1.460
  157   2HE   LYS  21          3HE       LYS  21 -10.486   1.066   0.277
  158   1HZ   LYS  21          1HZ       LYS  21 -12.611   1.652   1.246
  159   2HZ   LYS  21          2HZ       LYS  21 -11.858   2.668   2.328
  160   3HZ   LYS  21          3HZ       LYS  21 -11.730   2.941   0.709
  161    H    ALA  22           H        ALA  22  -6.126  -3.156   1.919
  162    HA   ALA  22           HA       ALA  22  -6.517  -5.640   3.239
  163   1HB   ALA  22          1HB       ALA  22  -5.872  -5.471   0.888
  164   2HB   ALA  22          2HB       ALA  22  -4.291  -4.806   1.356
  165   3HB   ALA  22          3HB       ALA  22  -4.713  -6.473   1.795
  166    H    VAL  23           H        VAL  23  -3.634  -3.538   3.216
  167    HA   VAL  23           HA       VAL  23  -1.986  -4.981   4.995
  168    HB   VAL  23           HB       VAL  23  -2.244  -2.009   4.325
  169   1HG1  VAL  23          1HG1      VAL  23  -0.029  -1.583   5.062
  170   2HG1  VAL  23          2HG1      VAL  23  -0.874  -2.305   6.448
  171   3HG1  VAL  23          3HG1      VAL  23   0.262  -3.265   5.457
  172   1HG2  VAL  23          1HG2      VAL  23  -0.540  -2.343   2.715
  173   2HG2  VAL  23          2HG2      VAL  23  -0.103  -3.946   3.349
  174   3HG2  VAL  23          3HG2      VAL  23  -1.617  -3.727   2.491
  175    H    GLN  24           H        GLN  24  -4.403  -2.396   5.642
  176    HA   GLN  24           HA       GLN  24  -3.975  -2.454   8.486
  177   1HB   GLN  24          2HB       GLN  24  -6.334  -1.369   6.896
  178   2HB   GLN  24          3HB       GLN  24  -6.083  -1.188   8.637
  179   1HG   GLN  24          2HG       GLN  24  -3.723  -0.232   7.952
  180   2HG   GLN  24          3HG       GLN  24  -4.499   0.074   6.406
  181   1HE2  GLN  24          1HE2      GLN  24  -3.708   1.729   9.158
  182   2HE2  GLN  24          2HE2      GLN  24  -5.048   2.836   9.123
  183    H    ASN  25           H        ASN  25  -5.546  -4.860   6.529
  184    HA   ASN  25           HA       ASN  25  -7.454  -5.709   8.529
  185   1HB   ASN  25          2HB       ASN  25  -5.887  -7.393   6.520
  186   2HB   ASN  25          3HB       ASN  25  -7.192  -7.968   7.545
  187   1HD2  ASN  25          1HD2      ASN  25  -7.069  -7.952   4.609
  188   2HD2  ASN  25          2HD2      ASN  25  -8.509  -7.067   4.121
  189    H    GLU  26           H        GLU  26  -4.045  -6.756   7.843
  190    HA   GLU  26           HA       GLU  26  -3.890  -8.210  10.364
  191   1HB   GLU  26          2HB       GLU  26  -1.869  -7.582   8.205
  192   2HB   GLU  26          3HB       GLU  26  -1.645  -8.713   9.562
  193   1HG   GLU  26          2HG       GLU  26  -4.029  -9.575   8.354
  194   2HG   GLU  26          3HG       GLU  26  -3.108  -8.987   6.973
  195    H    ASP  27           H        ASP  27  -2.256  -5.377   8.843
  196    HA   ASP  27           HA       ASP  27  -0.945  -4.730  11.367
  197   1HB   ASP  27          2HB       ASP  27   0.054  -4.620   8.971
  198   2HB   ASP  27          3HB       ASP  27  -0.808  -3.103   8.780
  199    H    ALA  28           H        ALA  28  -3.398  -4.593  12.090
  200    HA   ALA  28           HA       ALA  28  -4.971  -2.363  11.189
  201   1HB   ALA  28          1HB       ALA  28  -6.575  -3.065  12.801
  202   2HB   ALA  28          2HB       ALA  28  -5.802  -4.551  12.225
  203   3HB   ALA  28          3HB       ALA  28  -5.350  -3.871  13.804
  204    H    GLN  29           H        GLN  29  -2.492  -2.678  13.522
  205    HA   GLN  29           HA       GLN  29  -3.095  -0.258  15.023
  206   1HB   GLN  29          2HB       GLN  29  -0.947  -0.723  16.078
  207   2HB   GLN  29          3HB       GLN  29  -2.034  -2.108  16.125
  208   1HG   GLN  29          2HG       GLN  29  -0.737  -3.211  14.320
  209   2HG   GLN  29          3HG       GLN  29   0.280  -1.774  14.156
  210   1HE2  GLN  29          1HE2      GLN  29  -0.799  -4.194  16.631
  211   2HE2  GLN  29          2HE2      GLN  29   0.741  -4.202  17.474
  212    H    ALA  30           H        ALA  30  -1.701  -0.857  11.884
  213    HA   ALA  30           HA       ALA  30   0.257   1.300  12.079
  214   1HB   ALA  30          1HB       ALA  30   0.846  -0.567  10.799
  215   2HB   ALA  30          2HB       ALA  30  -0.625  -0.490   9.791
  216   3HB   ALA  30          3HB       ALA  30   0.596   0.776   9.660
  217    H    THR  31           H        THR  31   0.373   3.027  10.622
  218    HA   THR  31           HA       THR  31  -2.268   4.274   9.934
  219    HB   THR  31           HB       THR  31   0.367   5.425  10.879
  220    HG1  THR  31           1HG      THR  31  -1.216   4.521  12.362
  221   1HG2  THR  31          1HG2      THR  31  -2.121   6.922   9.939
  222   2HG2  THR  31          2HG2      THR  31  -0.776   7.643  10.844
  223   3HG2  THR  31          3HG2      THR  31  -0.492   7.014   9.216
  224    H    VAL  32           H        VAL  32  -2.236   5.599   7.982
  225    HA   VAL  32           HA       VAL  32  -0.360   4.648   5.901
  226    HB   VAL  32           HB       VAL  32  -2.334   4.072   4.521
  227   1HG1  VAL  32          1HG1      VAL  32  -2.381   2.508   7.136
  228   2HG1  VAL  32          2HG1      VAL  32  -2.703   1.918   5.500
  229   3HG1  VAL  32          3HG1      VAL  32  -1.065   2.385   5.956
  230   1HG2  VAL  32          1HG2      VAL  32  -4.116   5.390   5.515
  231   2HG2  VAL  32          2HG2      VAL  32  -4.537   3.694   5.757
  232   3HG2  VAL  32          3HG2      VAL  32  -3.906   4.616   7.100
  233    H    GLN  33           H        GLN  33  -0.007   6.235   4.268
  234    HA   GLN  33           HA       GLN  33  -1.846   8.536   4.052
  235   1HB   GLN  33          2HB       GLN  33   1.038   8.583   4.984
  236   2HB   GLN  33          3HB       GLN  33   0.499   9.874   3.911
  237   1HG   GLN  33          2HG       GLN  33  -0.937   9.237   6.519
  238   2HG   GLN  33          3HG       GLN  33   0.417  10.360   6.379
  239   1HE2  GLN  33          1HE2      GLN  33  -1.020  12.091   7.123
  240   2HE2  GLN  33          2HE2      GLN  33  -2.113  12.818   5.960
  241    H    VAL  34           H        VAL  34  -2.331   8.523   1.882
  242    HA   VAL  34           HA       VAL  34  -0.179   7.774  -0.038
  243    HB   VAL  34           HB       VAL  34  -1.618   5.870   0.248
  244   1HG1  VAL  34          1HG1      VAL  34  -3.977   5.836  -0.340
  245   2HG1  VAL  34          2HG1      VAL  34  -3.693   6.872   1.066
  246   3HG1  VAL  34          3HG1      VAL  34  -3.978   7.596  -0.529
  247   1HG2  VAL  34          1HG2      VAL  34  -0.727   6.521  -2.031
  248   2HG2  VAL  34          2HG2      VAL  34  -2.145   5.459  -2.034
  249   3HG2  VAL  34          3HG2      VAL  34  -2.328   7.187  -2.398
  250    H    ASP  35           H        ASP  35   0.162   9.186  -1.697
  251    HA   ASP  35           HA       ASP  35  -1.542  11.613  -1.821
  252   1HB   ASP  35          2HB       ASP  35   0.899  10.694  -3.324
  253   2HB   ASP  35          3HB       ASP  35   0.019  12.158  -3.734
  254    H    LEU  36           H        LEU  36  -3.532  10.695  -2.623
  255    HA   LEU  36           HA       LEU  36  -3.607   9.353  -5.242
  256   1HB   LEU  36          2HB       LEU  36  -5.844  10.741  -3.715
  257   2HB   LEU  36          3HB       LEU  36  -5.981   9.820  -5.212
  258    HG   LEU  36           HG       LEU  36  -4.664   8.015  -3.536
  259   1HD1  LEU  36          1HD1      LEU  36  -6.064   7.957  -1.488
  260   2HD1  LEU  36          2HD1      LEU  36  -5.117   9.460  -1.568
  261   3HD1  LEU  36          3HD1      LEU  36  -6.848   9.470  -1.967
  262   1HD2  LEU  36          1HD2      LEU  36  -7.650   8.290  -4.080
  263   2HD2  LEU  36          2HD2      LEU  36  -6.457   7.502  -5.135
  264   3HD2  LEU  36          3HD2      LEU  36  -6.817   6.817  -3.540
  265    H    THR  37           H        THR  37  -1.997  10.871  -5.950
  266    HA   THR  37           HA       THR  37  -3.161  13.131  -7.478
  267    HB   THR  37           HB       THR  37  -0.822  13.464  -5.544
  268    HG1  THR  37           1HG      THR  37  -3.511  13.807  -5.306
  269   1HG2  THR  37          1HG2      THR  37  -2.148  15.466  -7.419
  270   2HG2  THR  37          2HG2      THR  37  -0.950  15.855  -6.166
  271   3HG2  THR  37          3HG2      THR  37  -0.486  14.847  -7.546
  272    H    SER  38           H        SER  38  -0.167  11.292  -6.648
  273    HA   SER  38           HA       SER  38   0.399  11.111  -9.569
  274   1HB   SER  38          2HB       SER  38   2.489  11.676  -7.432
  275   2HB   SER  38          3HB       SER  38   2.752  11.419  -9.179
  276    HG   SER  38           HG       SER  38   2.622  13.616  -8.847
  277    H    LYS  39           H        LYS  39   2.637   9.639  -7.301
  278    HA   LYS  39           HA       LYS  39   1.333   7.028  -7.472
  279   1HB   LYS  39          2HB       LYS  39   3.041   6.083  -8.945
  280   2HB   LYS  39          3HB       LYS  39   2.018   7.273  -9.748
  281   1HG   LYS  39          2HG       LYS  39   4.064   8.916  -9.202
  282   2HG   LYS  39          3HG       LYS  39   4.939   7.382  -9.020
  283   1HD   LYS  39          2HD       LYS  39   3.692   6.841 -11.347
  284   2HD   LYS  39          3HD       LYS  39   3.602   8.584 -11.470
  285   1HE   LYS  39          2HE       LYS  39   6.135   6.871 -11.106
  286   2HE   LYS  39          3HE       LYS  39   5.570   7.543 -12.640
  287   1HZ   LYS  39          1HZ       LYS  39   7.295   8.870 -11.686
  288   2HZ   LYS  39          2HZ       LYS  39   5.904   9.741 -11.751
  289   3HZ   LYS  39          3HZ       LYS  39   6.431   9.126 -10.312
  290    H    LYS  40           H        LYS  40   1.903   8.117  -5.156
  291    HA   LYS  40           HA       LYS  40   4.411   6.882  -4.174
  292   1HB   LYS  40          2HB       LYS  40   5.028   9.027  -3.097
  293   2HB   LYS  40          3HB       LYS  40   4.979   9.159  -4.862
  294   1HG   LYS  40          2HG       LYS  40   2.472   9.896  -4.441
  295   2HG   LYS  40          3HG       LYS  40   3.030  10.249  -2.810
  296   1HD   LYS  40          2HD       LYS  40   4.301  11.361  -5.368
  297   2HD   LYS  40          3HD       LYS  40   2.846  12.031  -4.623
  298   1HE   LYS  40          2HE       LYS  40   4.387  12.012  -2.408
  299   2HE   LYS  40          3HE       LYS  40   5.681  12.156  -3.610
  300   1HZ   LYS  40          1HZ       LYS  40   3.288  13.817  -3.215
  301   2HZ   LYS  40          2HZ       LYS  40   4.825  14.301  -2.883
  302   3HZ   LYS  40          3HZ       LYS  40   4.357  14.099  -4.457
  303    H    VAL  41           H        VAL  41   4.130   6.027  -2.124
  304    HA   VAL  41           HA       VAL  41   1.735   6.797  -0.560
  305    HB   VAL  41           HB       VAL  41   0.943   4.983  -1.942
  306   1HG1  VAL  41          1HG1      VAL  41   3.267   3.323  -0.945
  307   2HG1  VAL  41          2HG1      VAL  41   1.943   2.756  -1.974
  308   3HG1  VAL  41          3HG1      VAL  41   3.098   3.943  -2.597
  309   1HG2  VAL  41          1HG2      VAL  41   0.177   3.463  -0.258
  310   2HG2  VAL  41          2HG2      VAL  41   1.591   3.755   0.769
  311   3HG2  VAL  41          3HG2      VAL  41   0.384   5.029   0.555
  312    H    THR  42           H        THR  42   1.937   6.463   1.681
  313    HA   THR  42           HA       THR  42   4.628   5.679   2.625
  314    HB   THR  42           HB       THR  42   2.925   8.006   3.624
  315    HG1  THR  42           1HG      THR  42   3.753   8.448   1.600
  316   1HG2  THR  42          1HG2      THR  42   4.413   7.067   5.355
  317   2HG2  THR  42          2HG2      THR  42   5.790   7.149   4.230
  318   3HG2  THR  42          3HG2      THR  42   5.017   8.641   4.810
  319    H    ILE  43           H        ILE  43   4.495   4.159   4.133
  320    HA   ILE  43           HA       ILE  43   1.929   3.575   5.545
  321    HB   ILE  43           HB       ILE  43   4.121   1.784   4.443
  322   1HG1  ILE  43          2HG1      ILE  43   2.500   2.576   2.755
  323   2HG1  ILE  43          3HG1      ILE  43   2.433   0.850   3.021
  324   1HG2  ILE  43          1HG2      ILE  43   2.727  -0.123   5.270
  325   2HG2  ILE  43          2HG2      ILE  43   3.520   0.812   6.541
  326   3HG2  ILE  43          3HG2      ILE  43   1.787   1.039   6.240
  327   1HD1  ILE  43          1HD1      ILE  43   0.388   1.108   4.403
  328   2HD1  ILE  43          2HD1      ILE  43   0.415   2.861   4.071
  329   3HD1  ILE  43          3HD1      ILE  43   0.200   1.706   2.752
  330    H    THR  44           H        THR  44   2.041   3.995   7.663
  331    HA   THR  44           HA       THR  44   4.690   4.283   8.972
  332    HB   THR  44           HB       THR  44   1.897   5.267   9.528
  333    HG1  THR  44           1HG      THR  44   2.792   7.262   8.997
  334   1HG2  THR  44          1HG2      THR  44   4.474   5.864  11.065
  335   2HG2  THR  44          2HG2      THR  44   2.923   6.693  11.305
  336   3HG2  THR  44          3HG2      THR  44   3.075   4.975  11.693
  337    H    SER  45           H        SER  45   5.091   2.076   9.245
  338    HA   SER  45           HA       SER  45   3.788   0.929  11.575
  339   1HB   SER  45          2HB       SER  45   3.356  -1.236  10.617
  340   2HB   SER  45          3HB       SER  45   2.587  -0.090   9.535
  341    HG   SER  45           HG       SER  45   3.718  -1.619   8.435
  342    H    ALA  46           H        ALA  46   5.137  -1.305  11.863
  343    HA   ALA  46           HA       ALA  46   8.033  -0.686  11.513
  344   1HB   ALA  46          1HB       ALA  46   7.310  -1.383  13.749
  345   2HB   ALA  46          2HB       ALA  46   6.637  -2.888  13.081
  346   3HB   ALA  46          3HB       ALA  46   8.387  -2.583  13.008
  347    H    LEU  47           H        LEU  47   5.467  -3.053  10.582
  348    HA   LEU  47           HA       LEU  47   7.553  -4.660   9.194
  349   1HB   LEU  47          2HB       LEU  47   6.228  -6.493   9.393
  350   2HB   LEU  47          3HB       LEU  47   6.076  -5.694  10.947
  351    HG   LEU  47           HG       LEU  47   3.913  -4.871   9.078
  352   1HD1  LEU  47          1HD1      LEU  47   2.791  -7.077   9.074
  353   2HD1  LEU  47          2HD1      LEU  47   4.284  -7.112   8.125
  354   3HD1  LEU  47          3HD1      LEU  47   4.237  -7.831   9.751
  355   1HD2  LEU  47          1HD2      LEU  47   3.783  -4.528  11.514
  356   2HD2  LEU  47          2HD2      LEU  47   2.456  -5.529  10.895
  357   3HD2  LEU  47          3HD2      LEU  47   3.809  -6.293  11.757
  358    H    GLY  48           H        GLY  48   6.094  -2.111   8.204
  359   1HA   GLY  48          2HA       GLY  48   4.138  -2.442   6.419
  360   2HA   GLY  48          3HA       GLY  48   5.449  -1.272   6.176
  361    H    GLU  49           H        GLU  49   7.610  -2.679   5.519
  362    HA   GLU  49           HA       GLU  49   7.296  -3.266   2.836
  363   1HB   GLU  49          2HB       GLU  49   9.407  -2.816   4.283
  364   2HB   GLU  49          3HB       GLU  49   9.444  -4.563   4.546
  365   1HG   GLU  49          2HG       GLU  49   9.453  -4.851   2.017
  366   2HG   GLU  49          3HG       GLU  49   9.531  -3.085   1.869
  367    H    GLU  50           H        GLU  50   7.236  -5.582   5.587
  368    HA   GLU  50           HA       GLU  50   7.090  -7.911   3.887
  369   1HB   GLU  50          2HB       GLU  50   7.412  -7.441   6.726
  370   2HB   GLU  50          3HB       GLU  50   5.955  -8.397   6.512
  371   1HG   GLU  50          2HG       GLU  50   7.512  -9.822   4.858
  372   2HG   GLU  50          3HG       GLU  50   8.793  -9.115   5.863
  373    H    GLN  51           H        GLN  51   4.676  -6.038   5.857
  374    HA   GLN  51           HA       GLN  51   2.498  -7.662   5.315
  375   1HB   GLN  51          2HB       GLN  51   2.813  -5.752   7.018
  376   2HB   GLN  51          3HB       GLN  51   2.598  -4.612   5.698
  377   1HG   GLN  51          2HG       GLN  51   0.539  -4.919   6.863
  378   2HG   GLN  51          3HG       GLN  51   0.395  -5.612   5.230
  379   1HE2  GLN  51          1HE2      GLN  51   0.880  -6.452   8.700
  380   2HE2  GLN  51          2HE2      GLN  51   0.288  -8.098   8.529
  381    H    LEU  52           H        LEU  52   3.679  -4.744   3.663
  382    HA   LEU  52           HA       LEU  52   1.834  -4.598   1.575
  383   1HB   LEU  52          2HB       LEU  52   4.765  -3.826   1.764
  384   2HB   LEU  52          3HB       LEU  52   3.759  -3.363   0.398
  385    HG   LEU  52           HG       LEU  52   2.943  -2.626   3.230
  386   1HD1  LEU  52          1HD1      LEU  52   5.278  -1.828   2.701
  387   2HD1  LEU  52          2HD1      LEU  52   4.632  -1.042   1.262
  388   3HD1  LEU  52          3HD1      LEU  52   4.128  -0.511   2.893
  389   1HD2  LEU  52          1HD2      LEU  52   2.351  -1.223   0.601
  390   2HD2  LEU  52          2HD2      LEU  52   1.294  -2.486   1.253
  391   3HD2  LEU  52          3HD2      LEU  52   1.558  -1.005   2.173
  392    H    ARG  53           H        ARG  53   4.975  -6.379   1.764
  393    HA   ARG  53           HA       ARG  53   5.175  -7.339  -0.769
  394   1HB   ARG  53          2HB       ARG  53   6.393  -7.984   1.596
  395   2HB   ARG  53          3HB       ARG  53   5.422  -9.428   1.395
  396   1HG   ARG  53          2HG       ARG  53   7.458  -9.945   0.437
  397   2HG   ARG  53          3HG       ARG  53   6.445  -9.603  -0.969
  398   1HD   ARG  53          2HD       ARG  53   7.444  -7.437  -1.291
  399   2HD   ARG  53          3HD       ARG  53   8.165  -7.402   0.306
  400    HE   ARG  53           HE       ARG  53   9.235  -8.586  -2.101
  401   1HH1  ARG  53          2HH2      ARG  53   9.237  -8.843   1.412
  402   2HH1  ARG  53          1HH2      ARG  53  10.790  -9.602   1.539
  403   1HH2  ARG  53          2HH1      ARG  53  11.295  -9.638  -1.999
  404   2HH2  ARG  53          1HH1      ARG  53  11.976 -10.091  -0.470
  405    H    THR  54           H        THR  54   3.201  -8.997   1.754
  406    HA   THR  54           HA       THR  54   1.967 -10.764  -0.141
  407    HB   THR  54           HB       THR  54   1.048 -10.023   2.667
  408    HG1  THR  54           1HG      THR  54   2.425 -11.687   3.280
  409   1HG2  THR  54          1HG2      THR  54   0.151 -12.352   2.639
  410   2HG2  THR  54          2HG2      THR  54  -0.611 -11.361   1.385
  411   3HG2  THR  54          3HG2      THR  54   0.658 -12.524   0.946
  412    H    ALA  55           H        ALA  55   0.773  -7.809   1.571
  413    HA   ALA  55           HA       ALA  55  -1.863  -7.983   0.573
  414   1HB   ALA  55          1HB       ALA  55  -0.314  -5.522   1.449
  415   2HB   ALA  55          2HB       ALA  55  -2.079  -5.656   1.290
  416   3HB   ALA  55          3HB       ALA  55  -1.222  -6.620   2.511
  417    H    ILE  56           H        ILE  56   0.798  -5.870  -0.579
  418    HA   ILE  56           HA       ILE  56  -0.392  -4.818  -2.903
  419    HB   ILE  56           HB       ILE  56   2.492  -5.758  -2.638
  420   1HG1  ILE  56          2HG1      ILE  56   1.610  -3.947  -0.909
  421   2HG1  ILE  56          3HG1      ILE  56   3.165  -3.805  -1.724
  422   1HG2  ILE  56          1HG2      ILE  56   1.924  -5.371  -4.961
  423   2HG2  ILE  56          2HG2      ILE  56   1.113  -3.855  -4.528
  424   3HG2  ILE  56          3HG2      ILE  56   2.889  -4.007  -4.398
  425   1HD1  ILE  56          1HD1      ILE  56   2.466  -2.107  -3.138
  426   2HD1  ILE  56          2HD1      ILE  56   0.734  -2.383  -2.846
  427   3HD1  ILE  56          3HD1      ILE  56   1.766  -1.689  -1.581
  428    H    ALA  57           H        ALA  57   1.499  -7.915  -2.593
  429    HA   ALA  57           HA       ALA  57   1.181  -8.640  -5.303
  430   1HB   ALA  57          1HB       ALA  57   1.823 -10.906  -4.569
  431   2HB   ALA  57          2HB       ALA  57   2.857  -9.661  -3.845
  432   3HB   ALA  57          3HB       ALA  57   1.581 -10.435  -2.874
  433    H    SER  58           H        SER  58  -0.939  -9.240  -2.513
  434    HA   SER  58           HA       SER  58  -2.708 -11.098  -3.623
  435   1HB   SER  58          2HB       SER  58  -2.624 -10.097  -1.233
  436   2HB   SER  58          3HB       SER  58  -3.624  -8.781  -1.874
  437    HG   SER  58           HG       SER  58  -4.252 -11.553  -1.938
  438    H    ALA  59           H        ALA  59  -2.651  -7.544  -3.986
  439    HA   ALA  59           HA       ALA  59  -4.955  -7.478  -5.813
  440   1HB   ALA  59          1HB       ALA  59  -4.122  -5.077  -6.103
  441   2HB   ALA  59          2HB       ALA  59  -4.626  -5.543  -4.464
  442   3HB   ALA  59          3HB       ALA  59  -2.905  -5.451  -4.873
  443    H    GLY  60           H        GLY  60  -1.412  -7.196  -6.047
  444   1HA   GLY  60          2HA       GLY  60  -0.040  -7.997  -7.761
  445   2HA   GLY  60          3HA       GLY  60  -1.427  -8.164  -8.843
  446    H    HIS  61           H        HIS  61   0.327  -5.584  -7.031
  447    HA   HIS  61           HA       HIS  61   0.090  -3.771  -9.410
  448   1HB   HIS  61          2HB       HIS  61   0.731  -3.152  -6.533
  449   2HB   HIS  61          3HB       HIS  61   0.735  -1.971  -7.843
  450    HD1  HIS  61           1HD      HIS  61  -1.654  -0.981  -8.525
  451    HD2  HIS  61           2HD      HIS  61  -1.479  -3.742  -5.364
  452    HE1  HIS  61           1HE      HIS  61  -3.781  -0.665  -7.160
  453    H    GLU  62           H        GLU  62   1.915  -2.700 -10.094
  454    HA   GLU  62           HA       GLU  62   4.480  -4.097  -9.949
  455   1HB   GLU  62          2HB       GLU  62   3.497  -1.755 -11.654
  456   2HB   GLU  62          3HB       GLU  62   4.966  -2.698 -11.913
  457   1HG   GLU  62          2HG       GLU  62   2.117  -3.810 -12.092
  458   2HG   GLU  62          3HG       GLU  62   3.126  -3.325 -13.454
  459    H    VAL  63           H        VAL  63   4.239  -3.079  -7.560
  460    HA   VAL  63           HA       VAL  63   4.973  -0.237  -7.409
  461    HB   VAL  63           HB       VAL  63   4.686  -2.288  -5.184
  462   1HG1  VAL  63          1HG1      VAL  63   5.921  -0.230  -4.474
  463   2HG1  VAL  63          2HG1      VAL  63   4.546   0.750  -5.032
  464   3HG1  VAL  63          3HG1      VAL  63   4.346  -0.394  -3.700
  465   1HG2  VAL  63          1HG2      VAL  63   2.625  -2.214  -6.267
  466   2HG2  VAL  63          2HG2      VAL  63   2.399  -0.999  -4.999
  467   3HG2  VAL  63          3HG2      VAL  63   2.733  -0.489  -6.656
  468    H    GLU  64           H        GLU  64   6.892   0.664  -6.744
  469    HA   GLU  64           HA       GLU  64   9.265  -1.107  -6.349
  470   1HB   GLU  64          2HB       GLU  64   9.133   1.802  -7.248
  471   2HB   GLU  64          3HB       GLU  64  10.596   0.849  -6.971
  472   1HG   GLU  64          2HG       GLU  64   9.984  -0.655  -8.839
  473   2HG   GLU  64          3HG       GLU  64   8.501   0.276  -9.120
  Start of MODEL   20
    1   1H    MET   1           H1       MET   1   8.907   0.617   8.046
    2   2H    MET   1           H2       MET   1   8.969  -0.087   9.544
    3   3H    MET   1           H3       MET   1   7.636   0.731   9.119
    4    HA   MET   1           HA       MET   1   8.559   2.244  10.436
    5   1HB   MET   1          2HB       MET   1  10.987   2.829  10.369
    6   2HB   MET   1          3HB       MET   1  10.540   1.256  11.024
    7   1HG   MET   1          2HG       MET   1  11.175   0.200   8.825
    8   2HG   MET   1          3HG       MET   1  11.828   1.770   8.322
    9   1HE   MET   1          1HE       MET   1  13.955   0.136   7.812
   10   2HE   MET   1          2HE       MET   1  14.849  -0.713   9.097
   11   3HE   MET   1          3HE       MET   1  13.222  -1.263   8.640
   12    H    THR   2           H        THR   2   7.059   3.355   9.079
   13    HA   THR   2           HA       THR   2   6.364   4.803   7.465
   14    HB   THR   2           HB       THR   2   7.128   6.017   9.420
   15    HG1  THR   2           1HG      THR   2   5.922   7.069   8.030
   16   1HG2  THR   2          1HG2      THR   2   9.544   5.857   9.334
   17   2HG2  THR   2          2HG2      THR   2   9.596   6.789   7.824
   18   3HG2  THR   2          3HG2      THR   2   9.012   7.546   9.306
   19    H    ILE   3           H        ILE   3   6.912   3.189   5.775
   20    HA   ILE   3           HA       ILE   3   9.302   3.865   4.166
   21    HB   ILE   3           HB       ILE   3   7.245   1.663   3.784
   22   1HG1  ILE   3          2HG1      ILE   3   8.285   1.356   5.986
   23   2HG1  ILE   3          3HG1      ILE   3   8.755   0.110   4.839
   24   1HG2  ILE   3          1HG2      ILE   3   8.518   2.157   1.786
   25   2HG2  ILE   3          2HG2      ILE   3  10.046   2.099   2.671
   26   3HG2  ILE   3          3HG2      ILE   3   9.079   0.618   2.460
   27   1HD1  ILE   3          1HD1      ILE   3  10.642   0.878   6.250
   28   2HD1  ILE   3          2HD1      ILE   3  10.958   1.116   4.530
   29   3HD1  ILE   3          3HD1      ILE   3  10.513   2.500   5.550
   30    H    GLN   4           H        GLN   4   9.165   5.158   2.430
   31    HA   GLN   4           HA       GLN   4   6.569   5.852   1.163
   32   1HB   GLN   4          2HB       GLN   4   9.347   7.042   1.121
   33   2HB   GLN   4          3HB       GLN   4   8.163   7.419  -0.142
   34   1HG   GLN   4          2HG       GLN   4   6.608   8.344   1.385
   35   2HG   GLN   4          3HG       GLN   4   7.462   7.687   2.781
   36   1HE2  GLN   4          1HE2      GLN   4   8.182   9.811  -0.075
   37   2HE2  GLN   4          2HE2      GLN   4   9.082  10.989   0.870
   38    H    LEU   5           H        LEU   5   6.014   4.196  -0.187
   39    HA   LEU   5           HA       LEU   5   8.010   3.273  -2.244
   40   1HB   LEU   5          2HB       LEU   5   5.269   2.135  -1.584
   41   2HB   LEU   5          3HB       LEU   5   6.443   1.473  -2.719
   42    HG   LEU   5           HG       LEU   5   6.714   1.631   0.311
   43   1HD1  LEU   5          1HD1      LEU   5   5.233  -0.133  -0.569
   44   2HD1  LEU   5          2HD1      LEU   5   6.543  -0.718  -1.618
   45   3HD1  LEU   5          3HD1      LEU   5   6.708  -0.818   0.148
   46   1HD2  LEU   5          1HD2      LEU   5   8.855   0.342  -0.076
   47   2HD2  LEU   5          2HD2      LEU   5   8.714   0.713  -1.805
   48   3HD2  LEU   5          3HD2      LEU   5   8.927   2.023  -0.620
   49    H    THR   6           H        THR   6   6.957   2.974  -4.464
   50    HA   THR   6           HA       THR   6   4.960   5.072  -5.038
   51    HB   THR   6           HB       THR   6   7.793   5.149  -5.886
   52    HG1  THR   6           1HG      THR   6   5.613   6.961  -5.926
   53   1HG2  THR   6          1HG2      THR   6   7.269   6.252  -8.061
   54   2HG2  THR   6          2HG2      THR   6   7.024   4.506  -8.087
   55   3HG2  THR   6          3HG2      THR   6   5.624   5.598  -7.986
   56    H    VAL   7           H        VAL   7   3.328   4.188  -5.900
   57    HA   VAL   7           HA       VAL   7   3.583   1.600  -7.315
   58    HB   VAL   7           HB       VAL   7   2.256   1.330  -5.475
   59   1HG1  VAL   7          1HG1      VAL   7   0.294   2.743  -4.868
   60   2HG1  VAL   7          2HG1      VAL   7   1.866   3.491  -4.612
   61   3HG1  VAL   7          3HG1      VAL   7   0.894   3.968  -6.012
   62   1HG2  VAL   7          1HG2      VAL   7   1.279   0.430  -7.559
   63   2HG2  VAL   7          2HG2      VAL   7   0.144   0.672  -6.220
   64   3HG2  VAL   7          3HG2      VAL   7   0.165   1.816  -7.569
   65    HA   PRO   8           HA       PRO   8   2.897   4.584 -10.641
   66   1HB   PRO   8          2HB       PRO   8   3.794   3.142 -12.783
   67   2HB   PRO   8          3HB       PRO   8   4.915   3.864 -11.586
   68   1HG   PRO   8          2HG       PRO   8   3.890   1.013 -11.657
   69   2HG   PRO   8          3HG       PRO   8   5.578   1.563 -11.480
   70   1HD   PRO   8          2HD       PRO   8   4.027   0.892  -9.348
   71   2HD   PRO   8          3HD       PRO   8   5.239   2.199  -9.255
   72    H    THR   9           H        THR   9   1.806   1.272 -10.336
   73    HA   THR   9           HA       THR   9  -0.307   1.570 -12.298
   74    HB   THR   9           HB       THR   9   1.009  -0.492 -11.976
   75    HG1  THR   9           1HG      THR   9  -0.794  -1.827 -12.188
   76   1HG2  THR   9          1HG2      THR   9  -0.042  -1.931 -10.050
   77   2HG2  THR   9          2HG2      THR   9   1.340  -0.851  -9.702
   78   3HG2  THR   9          3HG2      THR   9  -0.314  -0.399  -9.261
   79    H    ILE  10           H        ILE  10  -0.189   3.185  -9.409
   80    HA   ILE  10           HA       ILE  10  -2.495   2.625  -8.143
   81    HB   ILE  10           HB       ILE  10  -0.828   4.952  -8.551
   82   1HG1  ILE  10          2HG1      ILE  10  -2.969   4.200  -6.561
   83   2HG1  ILE  10          3HG1      ILE  10  -1.280   3.730  -6.487
   84   1HG2  ILE  10          1HG2      ILE  10  -2.700   5.858  -9.901
   85   2HG2  ILE  10          2HG2      ILE  10  -3.775   5.663  -8.493
   86   3HG2  ILE  10          3HG2      ILE  10  -2.395   6.789  -8.431
   87   1HD1  ILE  10          1HD1      ILE  10  -2.346   6.574  -6.173
   88   2HD1  ILE  10          2HD1      ILE  10  -1.656   5.547  -4.910
   89   3HD1  ILE  10          3HD1      ILE  10  -0.624   6.122  -6.225
   90    H    ALA  11           H        ALA  11  -4.671   3.125  -8.268
   91    HA   ALA  11           HA       ALA  11  -6.722   3.272  -9.155
   92   1HB   ALA  11          1HB       ALA  11  -5.965   5.465 -10.033
   93   2HB   ALA  11          2HB       ALA  11  -5.531   4.681 -11.569
   94   3HB   ALA  11          3HB       ALA  11  -7.210   4.685 -11.022
   95    H    CYS  12           H        CYS  12  -4.337   1.330 -10.549
   96    HA   CYS  12           HA       CYS  12  -5.688   0.225 -12.766
   97   1HB   CYS  12          2HB       CYS  12  -3.367  -0.141 -12.420
   98   2HB   CYS  12          3HB       CYS  12  -3.644  -0.813 -10.794
   99    HG   CYS  12           HG       CYS  12  -4.732  -2.036 -13.665
  100    H    GLU  13           H        GLU  13  -5.487  -1.066  -9.407
  101    HA   GLU  13           HA       GLU  13  -7.519  -3.081 -10.064
  102   1HB   GLU  13          2HB       GLU  13  -5.377  -3.569  -8.888
  103   2HB   GLU  13          3HB       GLU  13  -5.941  -2.695  -7.472
  104   1HG   GLU  13          2HG       GLU  13  -7.364  -5.088  -8.757
  105   2HG   GLU  13          3HG       GLU  13  -6.222  -5.204  -7.417
  106    H    ALA  14           H        ALA  14  -7.576  -1.715  -6.813
  107    HA   ALA  14           HA       ALA  14  -9.818   0.138  -7.560
  108   1HB   ALA  14          1HB       ALA  14 -10.624  -1.985  -6.586
  109   2HB   ALA  14          2HB       ALA  14  -9.624  -1.713  -5.151
  110   3HB   ALA  14          3HB       ALA  14 -10.954  -0.597  -5.528
  111    H    CYS  15           H        CYS  15  -7.197   1.026  -7.478
  112    HA   CYS  15           HA       CYS  15  -6.103   2.847  -6.812
  113   1HB   CYS  15          2HB       CYS  15  -8.070   3.268  -4.517
  114   2HB   CYS  15          3HB       CYS  15  -6.799   4.361  -5.060
  115    HG   CYS  15           HG       CYS  15  -9.394   3.274  -6.738
  116    H    ALA  16           H        ALA  16  -4.556   3.392  -5.181
  117    HA   ALA  16           HA       ALA  16  -3.373   1.198  -3.768
  118   1HB   ALA  16          1HB       ALA  16  -2.062   3.136  -4.370
  119   2HB   ALA  16          2HB       ALA  16  -3.092   4.182  -3.361
  120   3HB   ALA  16          3HB       ALA  16  -2.044   2.940  -2.609
  121    H    GLU  17           H        GLU  17  -5.982   3.436  -2.822
  122    HA   GLU  17           HA       GLU  17  -6.122   2.842  -0.123
  123   1HB   GLU  17          2HB       GLU  17  -8.060   3.633  -2.206
  124   2HB   GLU  17          3HB       GLU  17  -8.783   2.723  -0.884
  125   1HG   GLU  17          2HG       GLU  17  -6.905   5.068  -0.365
  126   2HG   GLU  17          3HG       GLU  17  -8.644   5.265  -0.600
  127    H    ALA  18           H        ALA  18  -6.927   0.658  -2.880
  128    HA   ALA  18           HA       ALA  18  -8.091  -1.462  -1.487
  129   1HB   ALA  18          1HB       ALA  18  -7.733  -1.331  -3.961
  130   2HB   ALA  18          2HB       ALA  18  -6.020  -1.711  -3.713
  131   3HB   ALA  18          3HB       ALA  18  -7.262  -2.886  -3.258
  132    H    VAL  19           H        VAL  19  -4.540  -0.883  -2.015
  133    HA   VAL  19           HA       VAL  19  -3.874  -3.179  -0.429
  134    HB   VAL  19           HB       VAL  19  -2.331  -2.027  -2.140
  135   1HG1  VAL  19          1HG1      VAL  19  -2.086   0.212  -1.027
  136   2HG1  VAL  19          2HG1      VAL  19  -1.359  -0.593   0.383
  137   3HG1  VAL  19          3HG1      VAL  19  -0.564  -0.651  -1.196
  138   1HG2  VAL  19          1HG2      VAL  19  -1.762  -3.406   0.480
  139   2HG2  VAL  19          2HG2      VAL  19  -1.578  -3.991  -1.173
  140   3HG2  VAL  19          3HG2      VAL  19  -0.402  -2.856  -0.457
  141    H    THR  20           H        THR  20  -4.230   0.279   0.223
  142    HA   THR  20           HA       THR  20  -3.248   0.451   2.837
  143    HB   THR  20           HB       THR  20  -5.733   1.885   1.785
  144    HG1  THR  20           1HG      THR  20  -4.006   2.222   0.348
  145   1HG2  THR  20          1HG2      THR  20  -5.004   3.686   3.258
  146   2HG2  THR  20          2HG2      THR  20  -5.426   2.219   4.161
  147   3HG2  THR  20          3HG2      THR  20  -3.717   2.624   3.871
  148    H    LYS  21           H        LYS  21  -6.646  -0.265   1.878
  149    HA   LYS  21           HA       LYS  21  -7.483  -0.794   4.568
  150   1HB   LYS  21          2HB       LYS  21  -8.837  -1.615   1.970
  151   2HB   LYS  21          3HB       LYS  21  -9.566  -1.518   3.588
  152   1HG   LYS  21          2HG       LYS  21  -8.358   0.979   3.342
  153   2HG   LYS  21          3HG       LYS  21  -8.804   0.650   1.684
  154   1HD   LYS  21          2HD       LYS  21 -10.813   0.420   3.954
  155   2HD   LYS  21          3HD       LYS  21 -10.355   1.981   3.238
  156   1HE   LYS  21          2HE       LYS  21 -10.990   1.208   0.990
  157   2HE   LYS  21          3HE       LYS  21 -11.507  -0.357   1.648
  158   1HZ   LYS  21          1HZ       LYS  21 -13.160   0.826   2.936
  159   2HZ   LYS  21          2HZ       LYS  21 -12.632   2.277   2.358
  160   3HZ   LYS  21          3HZ       LYS  21 -13.333   1.192   1.339
  161    H    ALA  22           H        ALA  22  -6.343  -2.886   1.922
  162    HA   ALA  22           HA       ALA  22  -6.859  -5.384   3.162
  163   1HB   ALA  22          1HB       ALA  22  -5.100  -6.291   1.779
  164   2HB   ALA  22          2HB       ALA  22  -6.046  -5.119   0.828
  165   3HB   ALA  22          3HB       ALA  22  -4.443  -4.674   1.467
  166    H    VAL  23           H        VAL  23  -3.906  -3.374   3.296
  167    HA   VAL  23           HA       VAL  23  -2.426  -5.030   5.048
  168    HB   VAL  23           HB       VAL  23  -2.266  -2.075   4.360
  169   1HG1  VAL  23          1HG1      VAL  23  -0.967  -2.440   6.455
  170   2HG1  VAL  23          2HG1      VAL  23  -0.129  -3.811   5.682
  171   3HG1  VAL  23          3HG1      VAL  23   0.104  -2.173   5.062
  172   1HG2  VAL  23          1HG2      VAL  23  -1.910  -4.006   2.587
  173   2HG2  VAL  23          2HG2      VAL  23  -0.739  -2.684   2.700
  174   3HG2  VAL  23          3HG2      VAL  23  -0.385  -4.271   3.422
  175    H    GLN  24           H        GLN  24  -4.555  -2.186   5.651
  176    HA   GLN  24           HA       GLN  24  -4.289  -2.091   8.459
  177   1HB   GLN  24          2HB       GLN  24  -6.594  -1.452   6.609
  178   2HB   GLN  24          3HB       GLN  24  -6.645  -1.104   8.334
  179   1HG   GLN  24          2HG       GLN  24  -4.242  -0.119   6.780
  180   2HG   GLN  24          3HG       GLN  24  -5.778   0.691   6.543
  181   1HE2  GLN  24          1HE2      GLN  24  -3.008   0.757   8.418
  182   2HE2  GLN  24          2HE2      GLN  24  -3.654   1.714   9.735
  183    H    ASN  25           H        ASN  25  -5.813  -4.709   6.587
  184    HA   ASN  25           HA       ASN  25  -7.627  -5.559   8.650
  185   1HB   ASN  25          2HB       ASN  25  -6.041  -7.259   6.674
  186   2HB   ASN  25          3HB       ASN  25  -7.322  -7.840   7.727
  187   1HD2  ASN  25          1HD2      ASN  25  -7.003  -7.527   4.672
  188   2HD2  ASN  25          2HD2      ASN  25  -8.578  -6.874   4.224
  189    H    GLU  26           H        GLU  26  -4.206  -6.526   7.978
  190    HA   GLU  26           HA       GLU  26  -3.960  -7.981  10.503
  191   1HB   GLU  26          2HB       GLU  26  -1.967  -7.053   8.395
  192   2HB   GLU  26          3HB       GLU  26  -1.544  -8.056   9.782
  193   1HG   GLU  26          2HG       GLU  26  -3.681  -8.946   7.792
  194   2HG   GLU  26          3HG       GLU  26  -1.956  -9.220   7.518
  195    H    ASP  27           H        ASP  27  -2.590  -5.021   9.033
  196    HA   ASP  27           HA       ASP  27  -1.268  -4.360  11.533
  197   1HB   ASP  27          2HB       ASP  27  -0.442  -4.278   8.996
  198   2HB   ASP  27          3HB       ASP  27  -1.147  -2.669   9.011
  199    H    ALA  28           H        ALA  28  -3.647  -4.224  12.327
  200    HA   ALA  28           HA       ALA  28  -5.391  -2.141  11.456
  201   1HB   ALA  28          1HB       ALA  28  -5.342  -3.698  14.081
  202   2HB   ALA  28          2HB       ALA  28  -6.713  -2.755  13.457
  203   3HB   ALA  28          3HB       ALA  28  -6.158  -4.196  12.582
  204    H    GLN  29           H        GLN  29  -2.784  -2.190  13.684
  205    HA   GLN  29           HA       GLN  29  -3.488   0.354  14.994
  206   1HB   GLN  29          2HB       GLN  29  -1.493  -0.155  16.328
  207   2HB   GLN  29          3HB       GLN  29  -2.719  -1.417  16.409
  208   1HG   GLN  29          2HG       GLN  29  -1.399  -2.864  14.945
  209   2HG   GLN  29          3HG       GLN  29  -0.250  -1.551  14.622
  210   1HE2  GLN  29          1HE2      GLN  29   1.247  -3.378  15.347
  211   2HE2  GLN  29          2HE2      GLN  29   1.559  -3.475  17.076
  212    H    ALA  30           H        ALA  30  -2.137  -0.333  11.988
  213    HA   ALA  30           HA       ALA  30   0.163   1.491  12.250
  214   1HB   ALA  30          1HB       ALA  30   0.481  -0.473  10.976
  215   2HB   ALA  30          2HB       ALA  30  -0.913  -0.127   9.917
  216   3HB   ALA  30          3HB       ALA  30   0.525   0.907   9.868
  217    H    THR  31           H        THR  31   0.533   3.140  10.613
  218    HA   THR  31           HA       THR  31  -1.918   4.762  10.071
  219    HB   THR  31           HB       THR  31   0.930   5.585  10.710
  220    HG1  THR  31           1HG      THR  31  -0.018   6.264  12.652
  221   1HG2  THR  31          1HG2      THR  31  -1.587   7.264  10.255
  222   2HG2  THR  31          2HG2      THR  31  -0.046   7.890  10.874
  223   3HG2  THR  31          3HG2      THR  31  -0.137   7.258   9.225
  224    H    VAL  32           H        VAL  32  -2.114   5.650   8.042
  225    HA   VAL  32           HA       VAL  32  -0.278   4.669   5.906
  226    HB   VAL  32           HB       VAL  32  -2.350   4.194   4.638
  227   1HG1  VAL  32          1HG1      VAL  32  -2.987   2.098   5.918
  228   2HG1  VAL  32          2HG1      VAL  32  -1.240   2.320   5.758
  229   3HG1  VAL  32          3HG1      VAL  32  -2.051   2.685   7.288
  230   1HG2  VAL  32          1HG2      VAL  32  -4.514   3.948   5.812
  231   2HG2  VAL  32          2HG2      VAL  32  -3.819   4.594   7.294
  232   3HG2  VAL  32          3HG2      VAL  32  -3.981   5.625   5.853
  233    H    GLN  33           H        GLN  33   0.157   6.203   4.311
  234    HA   GLN  33           HA       GLN  33  -1.522   8.649   4.152
  235   1HB   GLN  33          2HB       GLN  33   1.310   8.405   5.128
  236   2HB   GLN  33          3HB       GLN  33   0.998   9.714   3.982
  237   1HG   GLN  33          2HG       GLN  33  -0.578   9.298   6.554
  238   2HG   GLN  33          3HG       GLN  33   0.841  10.340   6.392
  239   1HE2  GLN  33          1HE2      GLN  33  -1.039  11.850   7.239
  240   2HE2  GLN  33          2HE2      GLN  33  -1.858  12.724   5.954
  241    H    VAL  34           H        VAL  34  -2.273   8.044   2.140
  242    HA   VAL  34           HA       VAL  34  -0.233   7.437   0.068
  243    HB   VAL  34           HB       VAL  34  -1.709   5.602   0.534
  244   1HG1  VAL  34          1HG1      VAL  34  -3.784   6.744   1.219
  245   2HG1  VAL  34          2HG1      VAL  34  -4.036   7.277  -0.457
  246   3HG1  VAL  34          3HG1      VAL  34  -4.043   5.554  -0.065
  247   1HG2  VAL  34          1HG2      VAL  34  -2.017   5.030  -1.676
  248   2HG2  VAL  34          2HG2      VAL  34  -2.415   6.682  -2.206
  249   3HG2  VAL  34          3HG2      VAL  34  -0.748   6.249  -1.791
  250    H    ASP  35           H        ASP  35   0.217   8.999  -1.329
  251    HA   ASP  35           HA       ASP  35  -1.540  11.378  -1.237
  252   1HB   ASP  35          2HB       ASP  35   0.976  11.441  -0.815
  253   2HB   ASP  35          3HB       ASP  35   1.151  11.078  -2.536
  254    H    LEU  36           H        LEU  36  -3.178  10.164  -2.436
  255    HA   LEU  36           HA       LEU  36  -2.928   9.077  -4.998
  256   1HB   LEU  36          2HB       LEU  36  -5.298  10.574  -3.818
  257   2HB   LEU  36          3HB       LEU  36  -5.342   9.618  -5.299
  258    HG   LEU  36           HG       LEU  36  -4.175   7.922  -3.315
  259   1HD1  LEU  36          1HD1      LEU  36  -5.170   9.378  -1.587
  260   2HD1  LEU  36          2HD1      LEU  36  -6.753   9.269  -2.384
  261   3HD1  LEU  36          3HD1      LEU  36  -6.023   7.824  -1.661
  262   1HD2  LEU  36          1HD2      LEU  36  -5.498   7.215  -5.278
  263   2HD2  LEU  36          2HD2      LEU  36  -6.175   6.558  -3.775
  264   3HD2  LEU  36          3HD2      LEU  36  -6.955   7.944  -4.565
  265    H    THR  37           H        THR  37  -2.898  12.488  -4.149
  266    HA   THR  37           HA       THR  37  -3.115  13.967  -6.365
  267    HB   THR  37           HB       THR  37  -0.668  13.859  -4.568
  268    HG1  THR  37           1HG      THR  37  -1.896  14.249  -2.946
  269   1HG2  THR  37          1HG2      THR  37  -0.637  15.692  -6.233
  270   2HG2  THR  37          2HG2      THR  37  -2.231  16.238  -5.657
  271   3HG2  THR  37          3HG2      THR  37  -0.822  16.302  -4.578
  272    H    SER  38           H        SER  38  -0.623  11.402  -5.891
  273    HA   SER  38           HA       SER  38  -0.026  11.603  -8.761
  274   1HB   SER  38          2HB       SER  38   2.194  11.925  -6.698
  275   2HB   SER  38          3HB       SER  38   2.402  11.739  -8.460
  276    HG   SER  38           HG       SER  38   0.682  13.681  -8.144
  277    H    LYS  39           H        LYS  39   2.306   9.878  -6.838
  278    HA   LYS  39           HA       LYS  39   0.988   7.294  -7.228
  279   1HB   LYS  39          2HB       LYS  39   2.632   6.527  -8.913
  280   2HB   LYS  39          3HB       LYS  39   1.539   7.779  -9.492
  281   1HG   LYS  39          2HG       LYS  39   3.481   9.450  -8.866
  282   2HG   LYS  39          3HG       LYS  39   4.502   8.017  -8.867
  283   1HD   LYS  39          2HD       LYS  39   2.703   8.927 -11.172
  284   2HD   LYS  39          3HD       LYS  39   4.405   9.385 -11.001
  285   1HE   LYS  39          2HE       LYS  39   5.059   6.963 -11.065
  286   2HE   LYS  39          3HE       LYS  39   3.352   6.548 -11.313
  287   1HZ   LYS  39          1HZ       LYS  39   4.584   6.595 -13.360
  288   2HZ   LYS  39          2HZ       LYS  39   3.380   7.710 -13.371
  289   3HZ   LYS  39          3HZ       LYS  39   4.945   8.186 -13.159
  290    H    LYS  40           H        LYS  40   1.779   8.391  -4.871
  291    HA   LYS  40           HA       LYS  40   4.212   6.875  -4.100
  292   1HB   LYS  40          2HB       LYS  40   4.999   8.835  -2.858
  293   2HB   LYS  40          3HB       LYS  40   4.842   9.195  -4.588
  294   1HG   LYS  40          2HG       LYS  40   2.442  10.036  -3.984
  295   2HG   LYS  40          3HG       LYS  40   2.985   9.983  -2.314
  296   1HD   LYS  40          2HD       LYS  40   4.561  11.506  -4.422
  297   2HD   LYS  40          3HD       LYS  40   2.979  12.087  -3.924
  298   1HE   LYS  40          2HE       LYS  40   4.114  11.644  -1.441
  299   2HE   LYS  40          3HE       LYS  40   5.541  12.104  -2.376
  300   1HZ   LYS  40          1HZ       LYS  40   4.379  13.987  -1.348
  301   2HZ   LYS  40          2HZ       LYS  40   4.307  14.126  -2.995
  302   3HZ   LYS  40          3HZ       LYS  40   3.006  13.608  -2.165
  303    H    VAL  41           H        VAL  41   4.111   6.027  -1.979
  304    HA   VAL  41           HA       VAL  41   1.638   6.492  -0.448
  305    HB   VAL  41           HB       VAL  41   1.020   4.727  -1.988
  306   1HG1  VAL  41          1HG1      VAL  41   2.115   2.563  -2.072
  307   2HG1  VAL  41          2HG1      VAL  41   3.281   3.816  -2.522
  308   3HG1  VAL  41          3HG1      VAL  41   3.331   3.089  -0.899
  309   1HG2  VAL  41          1HG2      VAL  41   0.285   3.065  -0.394
  310   2HG2  VAL  41          2HG2      VAL  41   1.578   3.493   0.738
  311   3HG2  VAL  41          3HG2      VAL  41   0.272   4.641   0.424
  312    H    THR  42           H        THR  42   2.024   6.543   1.679
  313    HA   THR  42           HA       THR  42   4.739   5.796   2.594
  314    HB   THR  42           HB       THR  42   2.891   7.942   3.677
  315    HG1  THR  42           1HG      THR  42   3.583   8.465   1.639
  316   1HG2  THR  42          1HG2      THR  42   5.803   7.254   4.245
  317   2HG2  THR  42          2HG2      THR  42   4.983   8.729   4.794
  318   3HG2  THR  42          3HG2      THR  42   4.445   7.144   5.375
  319    H    ILE  43           H        ILE  43   4.606   3.995   3.841
  320    HA   ILE  43           HA       ILE  43   2.105   3.467   5.435
  321    HB   ILE  43           HB       ILE  43   4.123   1.593   4.195
  322   1HG1  ILE  43          2HG1      ILE  43   2.363   2.611   2.693
  323   2HG1  ILE  43          3HG1      ILE  43   2.360   0.864   2.775
  324   1HG2  ILE  43          1HG2      ILE  43   3.574   0.612   6.306
  325   2HG2  ILE  43          2HG2      ILE  43   1.860   1.030   6.150
  326   3HG2  ILE  43          3HG2      ILE  43   2.574  -0.218   5.109
  327   1HD1  ILE  43          1HD1      ILE  43   0.092   1.723   2.770
  328   2HD1  ILE  43          2HD1      ILE  43   0.409   0.925   4.314
  329   3HD1  ILE  43          3HD1      ILE  43   0.409   2.705   4.203
  330    H    THR  44           H        THR  44   2.327   4.021   7.486
  331    HA   THR  44           HA       THR  44   4.985   3.839   8.811
  332    HB   THR  44           HB       THR  44   2.588   5.594   9.334
  333    HG1  THR  44           1HG      THR  44   3.861   6.194   7.604
  334   1HG2  THR  44          1HG2      THR  44   5.258   5.383  10.812
  335   2HG2  THR  44          2HG2      THR  44   4.058   6.674  11.035
  336   3HG2  THR  44          3HG2      THR  44   3.659   5.012  11.490
  337    H    SER  45           H        SER  45   4.820   1.667   8.970
  338    HA   SER  45           HA       SER  45   3.483   0.820  11.472
  339   1HB   SER  45          2HB       SER  45   3.332  -1.467  10.475
  340   2HB   SER  45          3HB       SER  45   2.374  -0.346   9.530
  341    HG   SER  45           HG       SER  45   3.580  -1.495   8.147
  342    H    ALA  46           H        ALA  46   4.835  -1.306  12.051
  343    HA   ALA  46           HA       ALA  46   7.735  -0.831  11.842
  344   1HB   ALA  46          1HB       ALA  46   6.793  -1.855  13.871
  345   2HB   ALA  46          2HB       ALA  46   6.135  -3.199  12.917
  346   3HB   ALA  46          3HB       ALA  46   7.891  -2.975  13.040
  347    H    LEU  47           H        LEU  47   5.333  -3.191  10.706
  348    HA   LEU  47           HA       LEU  47   7.413  -4.709   9.240
  349   1HB   LEU  47          2HB       LEU  47   5.774  -6.569   9.395
  350   2HB   LEU  47          3HB       LEU  47   6.368  -5.925  10.914
  351    HG   LEU  47           HG       LEU  47   4.161  -4.675  11.208
  352   1HD1  LEU  47          1HD1      LEU  47   3.252  -6.532   8.994
  353   2HD1  LEU  47          2HD1      LEU  47   2.221  -5.464   9.955
  354   3HD1  LEU  47          3HD1      LEU  47   3.363  -4.757   8.809
  355   1HD2  LEU  47          1HD2      LEU  47   4.066  -7.694  10.997
  356   2HD2  LEU  47          2HD2      LEU  47   4.665  -6.750  12.381
  357   3HD2  LEU  47          3HD2      LEU  47   2.956  -6.655  11.918
  358    H    GLY  48           H        GLY  48   5.752  -2.275   8.247
  359   1HA   GLY  48          2HA       GLY  48   3.936  -2.797   6.354
  360   2HA   GLY  48          3HA       GLY  48   5.141  -1.504   6.196
  361    H    GLU  49           H        GLU  49   7.461  -2.630   5.605
  362    HA   GLU  49           HA       GLU  49   7.307  -3.039   2.905
  363   1HB   GLU  49          2HB       GLU  49   9.272  -2.617   4.626
  364   2HB   GLU  49          3HB       GLU  49   9.578  -4.341   4.433
  365   1HG   GLU  49          2HG       GLU  49   9.332  -2.441   2.042
  366   2HG   GLU  49          3HG       GLU  49  10.831  -2.611   2.953
  367    H    GLU  50           H        GLU  50   7.878  -5.712   5.231
  368    HA   GLU  50           HA       GLU  50   7.532  -7.905   3.496
  369   1HB   GLU  50          2HB       GLU  50   7.045  -7.486   6.480
  370   2HB   GLU  50          3HB       GLU  50   6.784  -9.046   5.708
  371   1HG   GLU  50          2HG       GLU  50   9.102  -9.150   4.961
  372   2HG   GLU  50          3HG       GLU  50   9.431  -7.541   5.634
  373    H    GLN  51           H        GLN  51   5.097  -6.341   5.638
  374    HA   GLN  51           HA       GLN  51   3.072  -8.180   4.989
  375   1HB   GLN  51          2HB       GLN  51   3.377  -6.296   6.843
  376   2HB   GLN  51          3HB       GLN  51   2.316  -5.358   5.814
  377   1HG   GLN  51          2HG       GLN  51   1.671  -8.209   6.784
  378   2HG   GLN  51          3HG       GLN  51   1.297  -6.769   7.721
  379   1HE2  GLN  51          1HE2      GLN  51   0.667  -8.090   4.368
  380   2HE2  GLN  51          2HE2      GLN  51  -0.989  -7.510   4.416
  381    H    LEU  52           H        LEU  52   3.667  -4.929   3.697
  382    HA   LEU  52           HA       LEU  52   1.780  -4.719   1.657
  383   1HB   LEU  52          2HB       LEU  52   4.686  -3.827   1.831
  384   2HB   LEU  52          3HB       LEU  52   3.613  -3.323   0.547
  385    HG   LEU  52           HG       LEU  52   2.903  -2.814   3.447
  386   1HD1  LEU  52          1HD1      LEU  52   4.397  -0.927   1.574
  387   2HD1  LEU  52          2HD1      LEU  52   3.974  -0.651   3.277
  388   3HD1  LEU  52          3HD1      LEU  52   5.173  -1.869   2.854
  389   1HD2  LEU  52          1HD2      LEU  52   1.177  -2.614   1.543
  390   2HD2  LEU  52          2HD2      LEU  52   1.404  -1.176   2.542
  391   3HD2  LEU  52          3HD2      LEU  52   2.143  -1.269   0.927
  392    H    ARG  53           H        ARG  53   5.117  -6.131   1.504
  393    HA   ARG  53           HA       ARG  53   5.180  -6.808  -1.136
  394   1HB   ARG  53          2HB       ARG  53   6.741  -7.422   1.063
  395   2HB   ARG  53          3HB       ARG  53   6.077  -8.996   0.703
  396   1HG   ARG  53          2HG       ARG  53   8.162  -8.786  -0.407
  397   2HG   ARG  53          3HG       ARG  53   6.937  -8.694  -1.685
  398   1HD   ARG  53          2HD       ARG  53   7.249  -6.218  -1.815
  399   2HD   ARG  53          3HD       ARG  53   8.128  -6.239  -0.301
  400    HE   ARG  53           HE       ARG  53  10.039  -6.642  -1.324
  401   1HH1  ARG  53          2HH2      ARG  53   7.459  -7.553  -3.520
  402   2HH1  ARG  53          1HH2      ARG  53   8.467  -7.805  -4.915
  403   1HH2  ARG  53          2HH1      ARG  53  11.456  -7.001  -3.138
  404   2HH2  ARG  53          1HH1      ARG  53  10.816  -7.484  -4.677
  405    H    THR  54           H        THR  54   3.696  -8.838   1.439
  406    HA   THR  54           HA       THR  54   2.590 -10.739  -0.413
  407    HB   THR  54           HB       THR  54   1.738 -10.142   2.450
  408    HG1  THR  54           1HG      THR  54   3.854 -11.696   1.384
  409   1HG2  THR  54          1HG2      THR  54   1.606 -12.671   0.733
  410   2HG2  THR  54          2HG2      THR  54   1.208 -12.572   2.461
  411   3HG2  THR  54          3HG2      THR  54   0.221 -11.700   1.276
  412    H    ALA  55           H        ALA  55   1.112  -7.964   1.371
  413    HA   ALA  55           HA       ALA  55  -1.550  -8.493   0.492
  414   1HB   ALA  55          1HB       ALA  55  -0.317  -5.851   1.385
  415   2HB   ALA  55          2HB       ALA  55  -2.054  -6.214   1.267
  416   3HB   ALA  55          3HB       ALA  55  -1.046  -7.084   2.431
  417    H    ILE  56           H        ILE  56   0.734  -5.998  -0.623
  418    HA   ILE  56           HA       ILE  56  -0.510  -5.105  -2.969
  419    HB   ILE  56           HB       ILE  56   2.464  -5.639  -2.545
  420   1HG1  ILE  56          2HG1      ILE  56   0.813  -3.085  -2.214
  421   2HG1  ILE  56          3HG1      ILE  56   1.482  -4.022  -0.864
  422   1HG2  ILE  56          1HG2      ILE  56   2.859  -4.190  -4.336
  423   2HG2  ILE  56          2HG2      ILE  56   1.654  -5.277  -4.979
  424   3HG2  ILE  56          3HG2      ILE  56   1.148  -3.669  -4.403
  425   1HD1  ILE  56          1HD1      ILE  56   2.887  -2.118  -1.241
  426   2HD1  ILE  56          2HD1      ILE  56   3.787  -3.552  -1.796
  427   3HD1  ILE  56          3HD1      ILE  56   3.025  -2.443  -2.957
  428    H    ALA  57           H        ALA  57   1.759  -7.979  -2.686
  429    HA   ALA  57           HA       ALA  57   1.473  -8.711  -5.390
  430   1HB   ALA  57          1HB       ALA  57   2.250 -10.949  -4.686
  431   2HB   ALA  57          2HB       ALA  57   3.229  -9.642  -4.005
  432   3HB   ALA  57          3HB       ALA  57   2.036 -10.488  -2.987
  433    H    SER  58           H        SER  58  -0.580  -9.565  -2.604
  434    HA   SER  58           HA       SER  58  -2.179 -11.530  -3.804
  435   1HB   SER  58          2HB       SER  58  -2.152 -10.699  -1.358
  436   2HB   SER  58          3HB       SER  58  -3.272  -9.431  -1.890
  437    HG   SER  58           HG       SER  58  -3.673 -12.230  -2.169
  438    H    ALA  59           H        ALA  59  -2.526  -7.966  -3.888
  439    HA   ALA  59           HA       ALA  59  -4.852  -8.050  -5.675
  440   1HB   ALA  59          1HB       ALA  59  -3.051  -5.809  -4.700
  441   2HB   ALA  59          2HB       ALA  59  -4.467  -5.575  -5.757
  442   3HB   ALA  59          3HB       ALA  59  -4.673  -6.232  -4.122
  443    H    GLY  60           H        GLY  60  -1.355  -7.622  -6.005
  444   1HA   GLY  60          2HA       GLY  60  -0.032  -8.208  -7.798
  445   2HA   GLY  60          3HA       GLY  60  -1.454  -8.381  -8.830
  446    H    HIS  61           H        HIS  61   0.208  -5.743  -6.991
  447    HA   HIS  61           HA       HIS  61  -0.210  -3.926  -9.306
  448   1HB   HIS  61          2HB       HIS  61   0.586  -3.432  -6.442
  449   2HB   HIS  61          3HB       HIS  61   0.704  -2.187  -7.668
  450    HD1  HIS  61           1HD      HIS  61  -1.316  -0.598  -7.562
  451    HD2  HIS  61           2HD      HIS  61  -2.110  -4.509  -6.265
  452    HE1  HIS  61           1HE      HIS  61  -3.694  -0.581  -6.681
  453    H    GLU  62           H        GLU  62   1.465  -3.014 -10.429
  454    HA   GLU  62           HA       GLU  62   4.017  -4.336 -10.526
  455   1HB   GLU  62          2HB       GLU  62   3.012  -1.901 -12.070
  456   2HB   GLU  62          3HB       GLU  62   4.269  -3.036 -12.563
  457   1HG   GLU  62          2HG       GLU  62   1.306  -3.786 -12.291
  458   2HG   GLU  62          3HG       GLU  62   2.073  -3.210 -13.764
  459    H    VAL  63           H        VAL  63   4.056  -3.267  -8.128
  460    HA   VAL  63           HA       VAL  63   5.449  -0.624  -8.227
  461    HB   VAL  63           HB       VAL  63   3.433  -0.542  -7.088
  462   1HG1  VAL  63          1HG1      VAL  63   2.843  -1.905  -5.138
  463   2HG1  VAL  63          2HG1      VAL  63   2.813  -2.748  -6.672
  464   3HG1  VAL  63          3HG1      VAL  63   4.196  -3.001  -5.571
  465   1HG2  VAL  63          1HG2      VAL  63   5.444   0.506  -5.867
  466   2HG2  VAL  63          2HG2      VAL  63   4.066   0.144  -4.818
  467   3HG2  VAL  63          3HG2      VAL  63   5.469  -0.927  -4.831
  468    H    GLU  64           H        GLU  64   7.246  -0.175  -7.083
  469    HA   GLU  64           HA       GLU  64   8.882  -2.352  -5.891
  470   1HB   GLU  64          2HB       GLU  64   9.568   0.416  -6.968
  471   2HB   GLU  64          3HB       GLU  64  10.677  -0.567  -6.014
  472   1HG   GLU  64          2HG       GLU  64   9.511  -1.738  -8.562
  473   2HG   GLU  64          3HG       GLU  64  10.829  -0.562  -8.645