*HEADER    RNA BINDING PROTEIN                     27-JAN-99   1B75              
*TITLE     SOLUTION STRUCTURE OF RIBOSOMAL PROTEIN L25 FROM                      
*TITLE    2 ESCHERICHIA COLI                                                     
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: 50S RIBOSOMAL PROTEIN L25;                                 
*COMPND   3 CHAIN: A                                                             
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI;                               
*SOURCE   3 STRAIN: MRE 600                                                      
*KEYWDS    RIBOSOMAL PROTEIN, RNA-BINDING PROTEIN                                
*EXPDTA    NMR, 10 STRUCTURES                                                    
*AUTHOR    M.STOLDT, J.WOEHNERT, M.GOERLACH, L.R.BROWN                           
*REVDAT   1   26-JAN-00 1B75    0                                                


  1 MET  
         HA      1 MET  QE      4.70                
         QB      2 PHE  QD      6.50                
         QB      2 PHE  QE      6.50                
         QB      2 PHE  HZ      6.38                
         QB     61 LEU  HA      6.38                
         QE     61 LEU  HA      4.70                
         QE     62 THR  HB      4.70                
         QE     71 LYS  QE      6.50                
  2 PHE  
         HA      3 THR  HN      2.70                
         HA     50 MET  QE      4.70                
         HB2     3 THR  HN      3.80                
         HB2    50 MET  QE      4.70                
         HB2    61 LEU  HA      4.50                
         HB2    61 LEU  QD1     6.84                
         HB2    61 LEU  QD2     6.84                
         HB3     3 THR  HN      3.80                
         HB3    50 MET  QE      4.70                
         HB3    61 LEU  HA      4.50                
         HB3    61 LEU  QD1     6.84                
         HB3    61 LEU  QD2     6.84                
         QB     50 MET  HA      4.38                
         QB     61 LEU  QQD     5.22                
         QB     62 THR  HN      5.38                
         QD      3 THR  HN      5.52                
         QD      4 ILE  QD1     6.85                
         QD     50 MET  HA      5.62                
         QD     50 MET  QB      6.50                
         QD     50 MET  HG2     5.62                
         QD     50 MET  HG3     5.62                
         QD     50 MET  QE      6.85                
         QD     56 PHE  HA      5.62                
         QD     56 PHE  QD      6.74                
         QD     61 LEU  HB2     5.62                
         QD     61 LEU  HB3     5.62                
         QD     61 LEU  HG      5.62                
         QD     61 LEU  QD1     6.85                
         QD     61 LEU  QD2     6.85                
         QD     61 LEU  QQD     5.89                
         QE      4 ILE  QD1     6.85                
         QE     50 MET  HA      5.62                
         QE     50 MET  QB      6.50                
         QE     55 GLU  QB      6.30                
         QE     55 GLU  HG2     5.62                
         QE     55 GLU  HG3     5.62                
         QE     55 GLU  QG      4.77                
         QE     56 PHE  HA      5.62                
         QE     56 PHE  HB2     5.62                
         QE     56 PHE  HB3     5.62                
         QE     56 PHE  QD      6.99                
         QE     61 LEU  HG      5.62                
         QE     61 LEU  QQD    6.42                
         HZ     55 GLU  QB      4.50                
         HZ     55 GLU  HG2     4.50                
         HZ     55 GLU  HG3     4.50                
         HZ     55 GLU  QG      4.65                
         HZ     56 PHE  QB      4.38                
  3 THR  
         HN      3 THR  HB      3.80                
         HN      4 ILE  HN      4.40                
         HN      4 ILE  QD1     4.00                
         HN     50 MET  QE      4.00                
         HA      4 ILE  HN      2.70                
         HA      4 ILE  HA      4.50                
         HA     62 THR  HN      4.50                
         HA     62 THR  HB      3.80                
         HA     62 THR  QG2     4.70                
         HB      4 ILE  HN      4.50                
         HB      4 ILE  HA      4.50                
         QG2     4 ILE  HN      4.50                
         QG2     4 ILE  HA      4.70                
         QG2     5 ASN  HA      4.70                
         QG2     5 ASN  QD2     4.57                
         QG2    64 VAL  HN      4.70                
  4 ILE  
         HN      4 ILE  HB      3.80                
         HN      4 ILE  QG1     4.38                
         HN      4 ILE  QD1     4.70                
         HN     62 THR  HN      4.40                
         HN     62 THR  HB      4.50                
         HN     62 THR  O       2.40                    
         HN     63 ILE  HA      3.80                
         HN     63 ILE  QG2     4.70                
         HN     63 ILE  QG1     4.38                
         HN     64 VAL  HN      4.40                
         HN     64 VAL  QQG     5.26                
         HA      5 ASN  HN      2.70                
         HA     50 MET  QE      4.70                
         HB     42 LEU  QQD     5.27                
         HB     62 THR  HA      4.50                
         HB     63 ILE  HN      4.50                
         HB     63 ILE  HA      4.50                
         HB     63 ILE  QG2     4.70                
         HB     63 ILE  QG1     4.68                
         HB     63 ILE  QD1     4.70                
         HB     64 VAL  HN      4.50                
         QG2     5 ASN  HN      4.70                
         QG2     5 ASN  HA      4.70                
         QG2     6 ALA  QB      4.70                
         QG2    42 LEU  HA      4.70                
         QG2    42 LEU  HG      4.70                
         QG2    50 MET  QE      4.70                
         QG2    63 ILE  QG2     4.00                
         QG2    63 ILE  QD1     4.70                
         QG2    64 VAL  HN      4.70                
         QG2    91 PHE  QD      6.85                
         QG2    91 PHE  QE      6.85                
         QG2    91 PHE  HZ      4.70                
         HG12    5 ASN  HN      4.50                
         HG12   50 MET  QE      4.70                
         HG13    5 ASN  HN      4.50                
         HG13   50 MET  QE      4.70                
         QG1    91 PHE  QD      6.50                
         QD1    50 MET  QE      4.70                
         QD1    56 PHE  QD      6.85                
         QD1    56 PHE  QE      5.15                
         QD1    61 LEU  QB      5.58                
         QD1    61 LEU  QQD     6.27                
         QD1    63 ILE  QD1     4.70                
         O      64 VAL  HN      2.40                    
  5 ASN  
         HN      5 ASN  QB      3.91                
         HA      6 ALA  HN      2.70                
         HA      6 ALA  QB      4.70                
         HA     63 ILE  QG2     5.30                
         HA     64 VAL  HN      4.50                
         HA     64 VAL  HB      3.80                
         HA     64 VAL  QG1     4.70                
         HA     64 VAL  QG2     4.70                
         HB2     6 ALA  HN      4.50                
         HB3     6 ALA  HN      4.50                
         QB     64 VAL  HN      6.38                
         HD21   64 VAL  QG1     6.82                
         HD21   64 VAL  QG2     6.82                
         HD22   64 VAL  QG1     6.82                
         HD22   64 VAL  QG2     6.82                
         QD2    64 VAL  HB      6.37                
         QD2    64 VAL  QQG     6.21                
  6 ALA  
         HN      7 GLU  HN      4.40                
         HN     42 LEU  QQD     6.27                
         HN     63 ILE  QG2     4.70                
         HN     64 VAL  HB      4.50                
         HN     64 VAL  QQG     5.5                
         HN     65 VAL  HA      4.50                
         HA     40 ILE  HB      4.50                
         HA     41 GLU  HN      4.50                
         HA     42 LEU  HA      4.50                
         HA     42 LEU  QQD     5.57                
         HA     43 ASP  HN      4.50                
         HA     63 ILE  QG2     4.70                
         QB      7 GLU  HN      4.00                
         QB      7 GLU  HA      4.70                
         QB     40 ILE  HA      4.70                
         QB     41 GLU  HA      4.70                
         QB     42 LEU  HA      4.70                
         QB     42 LEU  QQD     6.57                
         QB     63 ILE  QG2     5.00                
         QB     63 ILE  QD1     6.70                
         QB     64 VAL  HN      4.70                
         QB     65 VAL  HA      4.70                
  7 GLU  
         HN      7 GLU  QB      3.91                
         HN      7 GLU  QG      6.50                
         HN      8 VAL  HN      4.40                
         HN      8 VAL  QQG     5.5                
         HN     40 ILE  HA      4.50                
         HN     40 ILE  QG2     4.70                
         HN     40 ILE  QG1     6.38                
         HN     40 ILE  QD1     4.70                
         HN     41 GLU  HN      2.40                   
         HN     41 GLU  QB      6.38                
         HN     41 GLU  QG      6.50                
         HN     42 LEU  QQD     6.27                
         HN     65 VAL  QQG     5.5                
         HA      8 VAL  HN      2.70                
         HA      8 VAL  HA      4.50                
         HA      8 VAL  QQG     5.5                
         HA     41 GLU  HN      4.50                
         HA     65 VAL  HA      4.50                
         HA     66 ASP  HA      4.50                
         HB2     8 VAL  HN      4.50                
         HB3     8 VAL  HN      4.50                
         QB     66 ASP  HA      6.38                
         QG      8 VAL  HN      6.50                
         QG     65 VAL  HA      6.50                
         QG     65 VAL  QQG     7.06                
         O      41 GLU  HN      2.40                    
  8 VAL  
         HN      8 VAL  HB      3.80                
         HN      8 VAL  QQG     3.92                
         HN      9 ARG  HN      4.40                
         HN     41 GLU  QG      6.50                
         HN     65 VAL  QQG     5.5                
         HA      9 ARG  HN      2.70                
         HA     40 ILE  HA      3.80                
         HA     40 ILE  QG2     4.70                
         HA     41 GLU  HN      4.50                
         HB      9 ARG  HN      4.50                
         HB     40 ILE  HA      4.50                
         HB     40 ILE  QG2     4.70                
         QG1    66 ASP  HB2     6.82                
         QG1    66 ASP  HB3     6.82                
         QG2    66 ASP  HB2     6.82                
         QG2    66 ASP  HB3     6.82                
         QQG     9 ARG  HN      5.56                
         QQG    10 LYS  HN      5.5                
         QQG    40 ILE  HA      5.5                
         QQG    66 ASP  HN      5.5                
         QQG    66 ASP  QB      6.21                
  9 ARG  
         HN      9 ARG  HB2     3.80                
         HN      9 ARG  HB3     3.80                
         HN      9 ARG  QG      6.38                
         HN     10 LYS  HN      4.40                
         HN     39 ALA  QB      6.20                
         HN     40 ILE  HA      3.80                
         HN     40 ILE  HB      5.60                
         HN     40 ILE  QG2     4.70                
         HN     41 GLU  HN      4.40                
         HA      9 ARG  HD2     4.50                
         HA      9 ARG  HD3     4.50                
         HA     10 LYS  HN      2.70                
         HA     40 ILE  HA      4.50                
         HA     41 GLU  QG      6.50                
         HB2    40 ILE  HA      4.50                
         HB3    40 ILE  HA      4.50                
         QB     40 ILE  HN      6.38                
         QB     41 GLU  HN      6.38                
         QG     10 LYS  HN      6.38                
         QG     11 GLU  HN      6.38                
         QG     41 GLU  HN      6.38                
         HD2    20 LEU  QD1     6.45                
         HD2    20 LEU  QD2     6.45                
         HD2    27 PRO  HA      4.50                
         HD2    41 GLU  QG      6.50                
         HD3    20 LEU  QD1     6.45                
         HD3    20 LEU  QD2     6.45                
         HD3    27 PRO  HA      4.50                
         HD3    41 GLU  QG      6.50                
         QD     20 LEU  QQD     5.92                
         QD     41 GLU  HA      6.38                
 10 LYS  
         HN     10 LYS  QG      6.50                
         HN     41 GLU  HB2     4.50                
         HN     41 GLU  HB3     4.50                
         HN     41 GLU  QB      4.65                
         HN     41 GLU  QG      6.50                
         QB     11 GLU  QG      6.50                
         QG     11 GLU  HN      6.50                
         QE     11 GLU  QG      6.50                
 11 GLU  
         HN     11 GLU  QG      6.50                
         QB     25 LYS  QB      6.25                
         QG     16 ALA  QB      6.50                
 12 GLN  
         HN     12 GLN  QB      3.91                
 15 GLY  
         QA     16 ALA  QB      6.58                
 16 ALA  
         QB     17 SER  HA      4.70                
 17 SER  
         HA     18 ARG  QB      6.38                
         HA     20 LEU  HB2     4.50                
         HA     20 LEU  HB3     4.50                
         HA     20 LEU  QD1     4.70                
         HA     20 LEU  QD2     4.70                
         QB     18 ARG  HA      6.38                
         QB     20 LEU  QQD     6.15                
 19 ARG  
         HN     19 ARG  QG      6.38                
         QG     20 LEU  HN      4.68                
 20 LEU  
         HN     20 LEU  HG      4.50                
         HN     20 LEU  QQD     6.27                
         HA     20 LEU  QD1     4.70                
         HA     20 LEU  QD2     4.70                
         HA     24 ASN  HA      4.50                
         QB     21 ARG  HN      6.38                
         QB     25 LYS  HN      6.38                
         QB     26 PHE  HA      6.38                
         HG     21 ARG  QD      6.50                
         QD1    26 PHE  HA      4.70                
         QD1    27 PRO  HA      4.70                
         QD1    27 PRO  HD2     6.45                
         QD1    27 PRO  HD3     6.45                
         QD2    26 PHE  HA      4.70                
         QD2    27 PRO  HA      4.70                
         QD2    27 PRO  HD2     6.45                
         QD2    27 PRO  HD3     6.45                
         QQD    21 ARG  HN      6.27                
         QQD    21 ARG  QD      7.07                
         QQD    25 LYS  HN      6.27                
         QQD    25 LYS  HA      6.27                
         QQD    26 PHE  HN      6.27                
         QQD    26 PHE  QD      6.42                
         QQD    27 PRO  QB      6.15                
         QQD    27 PRO  QD      6.39                
         QQD    41 GLU  HA      6.27                
 21 ARG  
         HN     21 ARG  QB      3.70                
         HN     21 ARG  QG      5.30                
         HA     23 ALA  HN      4.50                
 22 ALA  
         HN     22 ALA  QB      3.40                
 23 ALA  
         HN     23 ALA  QB      3.40                
         HA     24 ASN  HA      4.50                
         HA     25 LYS  HN      4.50                
         QB     24 ASN  HN      4.00                
         QB     24 ASN  HA      4.70                
         QB     24 ASN  QB      6.58                
         QB     25 LYS  HN      4.70                
 24 ASN  
         HN     25 LYS  HN      4.40                
         HA     25 LYS  HN      2.70                
         HB2    24 ASN  HD21    3.80                
         HB2    24 ASN  HD22    3.80                
         HB2    25 LYS  HN      4.50                
         HB3    24 ASN  HD21    3.80                
         HB3    24 ASN  HD22    3.80                
         HB3    25 LYS  HN      4.50                
 25 LYS  
         HN     25 LYS  QB      3.91                
         HN     25 LYS  QG      6.38                
         HN     26 PHE  HN      4.40                
         HN     26 PHE  QB      4.50                
         HN     44 HIS  QB      6.38                
         HA     25 LYS  HD2     4.50                
         HA     25 LYS  HD3     4.50                
         HA     26 PHE  HN      2.70                
         HA     26 PHE  QD      5.62                
         HA     42 LEU  HN      4.50                
         HA     43 ASP  HA      3.80                
         HA     44 HIS  HN      3.80                
         HA     44 HIS  QB      6.38                
         QB     25 LYS  QE      6.38                
         QB     26 PHE  HN      6.38                
         QB     42 LEU  HN      6.38                
         QB     44 HIS  HN      6.38                
         HG2    26 PHE  HN      4.50                
         HG2    44 HIS  HN      4.50                
         HG3    26 PHE  HN      4.50                
         HG3    44 HIS  HN      4.50                
         QG     43 ASP  QB      6.25                
         HD2    43 ASP  HA      4.50                
         HD3    43 ASP  HA      4.50                
         QE     43 ASP  HN      6.50                
 26 PHE  
         HN     27 PRO  HD2     4.50                
         HN     27 PRO  HD3     4.50                
         HN     42 LEU  HN      4.40                
         HN     42 LEU  QB      6.38                
         HN     42 LEU  O       2.40                    
         HN     43 ASP  HA      4.50                
         HA     27 PRO  QG      5.71                
         HA     27 PRO  HD2     3.80                
         HA     27 PRO  HD3     3.80                
         HB2    27 PRO  HD2     4.50                
         HB2    27 PRO  HD3     4.50                
         HB3    27 PRO  HD2     4.50                
         HB3    27 PRO  HD3     4.50                
         QB     44 HIS  HA      6.38                
         QB     44 HIS  HD2     6.38                
         QD     27 PRO  HG2     5.62                
         QD     27 PRO  HG3     5.62                
         QD     27 PRO  HD2     5.62                
         QD     27 PRO  HD3     5.62                
         QD     27 PRO  QD      6.77                
         QD     28 ALA  QB      6.85                
         QD     42 LEU  QB      6.50                
         QD     44 HIS  HN      6.52                
         QD     44 HIS  HA      5.62                
         QD     44 HIS  QB      6.50                
         QD     44 HIS  HD2     5.62                
         QD     47 VAL  QG1     6.85                
         QD     47 VAL  QG2     6.85                
         QD     86 LEU  QQD     6.42                
         QD     87 GLN  QB      6.50                
         QD     88 HIS  HA      5.62                
         QD     89 ILE  HN      6.52                
         QD     89 ILE  QG1     6.50                
         QE     28 ALA  HA      5.62                
         QE     42 LEU  HB2     5.62                
         QE     42 LEU  HB3     5.62                
         QE     44 HIS  HN      6.52                
         QE     44 HIS  HA      5.92                
         QE     44 HIS  HD2     5.62                
         QE     47 VAL  HB      5.62                
         QE     47 VAL  QG1     6.85                
         QE     47 VAL  QG2     6.85                
         QE     86 LEU  QD1     6.85                
         QE     86 LEU  QD2     6.85                
         QE     87 GLN  QB      6.50                
         QE     88 HIS  HA      5.62                
         QE     89 ILE  HA      5.62                
         QE     89 ILE  QG2     6.85                
         QE     89 ILE  QG1     6.50                
         QE     89 ILE  QD1     6.85                
         HZ     42 LEU  QB      6.38                
         HZ     47 VAL  HB      4.50                
         HZ     47 VAL  QG1     4.70                
         HZ     47 VAL  QG2     4.70                
         HZ     47 VAL  QQG     4.67                
         HZ     86 LEU  QQD     6.27                
         HZ     89 ILE  QG1     6.38                
         HZ     89 ILE  QD1     4.70                
 27 PRO  
         HA     28 ALA  HN      2.70                
         HA     28 ALA  QB      4.70                
         HA     41 GLU  QG      6.50                
         HA     42 LEU  HN      4.50                
         HB2    88 HIS  HD2     4.50                
         HB3    88 HIS  HD2     4.50                
         QB     28 ALA  HN      4.21                
         HG2    88 HIS  HD2     4.50                
         HG3    88 HIS  HD2     4.50                
         QG     88 HIS  HD2     4.65                
 28 ALA  
         HN     29 ILE  QG1     6.38                
         HN     39 ALA  QB      4.70                
         HN     40 ILE  HN      4.40                
         HN     40 ILE  HB      4.50                
         HN     40 ILE  HG12    4.50                
         HN     40 ILE  HG13    4.50                
         HN     40 ILE  QD1     4.70                
         HN     41 GLU  HA      4.50                
         HA     29 ILE  HN      2.70                
         HA     88 HIS  HD2     4.50                
         HA     88 HIS  HE1     4.50                
         HA     89 ILE  HN      3.80                
         QB     29 ILE  HN      3.40                
         QB     40 ILE  HN      4.70                
         QB     40 ILE  QG1     6.58                
         QB     63 ILE  QD1     6.70                
         QB     89 ILE  HN      4.00                
         QB     89 ILE  QG2     6.70                
         QB     90 ASP  HA      6.10                
         QB     91 PHE  QD      6.15                
         O      40 ILE  HN      2.40                    
 29 ILE  
         HN     29 ILE  HB      3.80                
         HN     29 ILE  HG12    4.50                
         HN     29 ILE  HG13    4.50                
         HN     29 ILE  QD1     4.70                
         HN     30 ILE  HN      4.40                
         HN     30 ILE  QG1     6.38                
         HN     40 ILE  QG1     6.38                
         HN     40 ILE  QD1     4.70                
         HN     42 LEU  QD1     4.70                
         HN     42 LEU  QD2     4.70                
         HN     88 HIS  HE1     4.50                
         HN     89 ILE  HN      4.40                
         HN     89 ILE  QG2     4.70                
         HN     90 ASP  HA      3.80                
         HN     90 ASP  QB      6.38                
         HN     91 PHE  HN      4.40                
         HA     30 ILE  HN      2.70                
         HA     39 ALA  HA      3.80                
         HA     39 ALA  QB      4.70                
         HA     40 ILE  HN      4.50                
         HA     40 ILE  QG1     6.38                
         HB     30 ILE  HN      4.50                
         HB     31 TYR  QD      6.64                
         HB     31 TYR  QE      6.63                
         HB     88 HIS  HD2     4.50                
         HB     88 HIS  HE1     4.50                
         HB     90 ASP  HA      4.50                
         HB     91 PHE  HN      4.50                
         QG2    30 ILE  HN      4.00                
         QG2    31 TYR  HN      4.70                
         QG2    31 TYR  HA      4.70                
         QG2    31 TYR  QB      6.58                
         QG2    31 TYR  QD      6.87                
         QG2    31 TYR  QE      6.86                
         QG2    37 PRO  HA      4.70                
         QG2    37 PRO  HB2     4.00                
         QG2    37 PRO  HB3     4.00                
         QG2    37 PRO  QG      6.50                
         QG2    38 LEU  HN      4.70                
         QG2    39 ALA  HN      4.70                
         QG2    39 ALA  HA      4.70                
         QG2    39 ALA  QB      6.70                
         QG2    88 HIS  HE1     4.70                
         QG2    90 ASP  HA      4.70                
         HG12   39 ALA  HA      4.50                
         HG12   88 HIS  HE1     4.50                
         HG13   39 ALA  HA      4.50                
         HG13   88 HIS  HE1     4.50                
         QG1    30 ILE  HN      6.38                
         QG1    31 TYR  QD      6.52                
         QG1    39 ALA  HN      6.38                
         QG1    39 ALA  QB      6.58                
         QG1    88 HIS  HE1     4.65                
         QD1    30 ILE  HN      4.70                
         QD1    31 TYR  QE      6.86                
         QD1    37 PRO  HB2     4.70                
         QD1    37 PRO  HB3     4.70                
         QD1    39 ALA  HA      4.70                
         QD1    39 ALA  QB      6.70                
         QD1    88 HIS  HD2     4.70                
         QD1    88 HIS  HE1     4.00                
         QD1    90 ASP  HA      6.00                
         O      89 ILE  O       2.40                    
 30 ILE  
         HN     30 ILE  HB      3.80                
         HN     30 ILE  QG1     6.38                
         HN     30 ILE  QD1     4.70                
         HN     38 LEU  HB2     4.50                
         HN     38 LEU  HB3     4.50                
         HN     38 LEU  O       2.40                    
         HN     39 ALA  HA      4.50                
         HN     39 ALA  QB      4.70                
         HA     31 TYR  HN      2.70                
         HA     91 PHE  HN      4.50                
         HA     91 PHE  HA      4.50                
         HA     91 PHE  HB2     4.50                
         HA     91 PHE  HB3     4.50                
         HA     91 PHE  QB      4.65                
         HA     91 PHE  QD      5.62                
         HB     31 TYR  HN      4.50                
         HB     70 ILE  QG2     4.70                
         QG2    31 TYR  HN      4.00                
         QG2    31 TYR  HA      4.70                
         QG2    38 LEU  HN      4.70                
         QG2    72 VAL  HB      4.70                
         QG2    72 VAL  QQG     6.26                
         QG2    91 PHE  HA      4.70                
         QG2    91 PHE  HB2     4.70                
         QG2    91 PHE  HB3     4.70                
         QG2    92 VAL  HN      4.70                
         QG2    92 VAL  HA      4.70                
         QG2    93 ARG  HN      4.70                
         QG2    93 ARG  QG      6.58                
         QG2    93 ARG  QD      6.58                
         QG2    93 ARG  HE      4.70                
         HG12   91 PHE  HN      4.50                
         HG12   91 PHE  HB2     6.25                
         HG12   91 PHE  HB3     6.25                
         HG13   91 PHE  HN      4.50                
         HG13   91 PHE  HB2     6.25                
         HG13   91 PHE  HB3     6.25                
         QG1    31 TYR  HN      6.38                
         QG1    63 ILE  QD1     6.58                
         QG1    91 PHE  QB      6.32                
         QG1    91 PHE  QD      6.50                
         QD1    63 ILE  QD1     5.00                
         QD1    91 PHE  HB2     4.70                
         QD1    91 PHE  HB3     4.70                
         QD1    91 PHE  QD      6.85                
 31 TYR  
         HN     31 TYR  HB2     3.80                
         HN     31 TYR  HB3     3.80                
         HN     31 TYR  QE      6.63                
         HN     91 PHE  QB      6.38                
         HN     91 PHE  O       2.40                    
         HN     92 VAL  HA      3.80                
         HN     92 VAL  HB      4.50                
         HN     92 VAL  QQG     5.5                
         HN     93 ARG  HN      4.40                
         HA     32 GLY  HN      2.70                
         HA     37 PRO  HA      3.80                
         HA     37 PRO  HB2     4.50                
         HA     37 PRO  HB3     4.50                
         HA     37 PRO  QG      6.50                
         HA     38 LEU  HN      4.50                
         HB2    32 GLY  HN      3.80                
         HB2    37 PRO  HA      4.50                
         HB2    92 VAL  QG1     6.82                
         HB2    92 VAL  QG2     6.82                
         HB3    32 GLY  HN      3.80                
         HB3    37 PRO  HA      4.50                
         HB3    92 VAL  QG1     6.82                
         HB3    92 VAL  QG2     6.82                
         QB     32 GLY  QA      6.25                
         QB     37 PRO  QB      6.25                
         QB     92 VAL  HA      6.38                
         QB     92 VAL  QQG     6.21                
         QD     32 GLY  HN      5.94                
         QD     32 GLY  HA1     6.64                
         QD     32 GLY  HA2     6.64                
         QD     37 PRO  HA      6.64                
         QD     37 PRO  HB2     6.64                
         QD     37 PRO  HB3     6.64                
         QD     37 PRO  QG      7.52                
         QD     90 ASP  HA      6.64                
         QD     90 ASP  HB2     6.64                
         QD     90 ASP  HB3     6.64                
         QD     91 PHE  HN      6.64                
         QD     92 VAL  HA      6.64                
         QD     92 VAL  QQG     6.43                
         QE     32 GLY  HN      6.63                
         QE     36 ALA  QB      6.86                
         QE     37 PRO  HB2     6.63                
         QE     37 PRO  HB3     6.63                
         QE     37 PRO  QG      7.51                
         QE     90 ASP  HA      6.63                
         QE     90 ASP  QB      6.51                
         QE     92 VAL  QQG     6.42                
 32 GLY  
         HN     37 PRO  QB      6.38                
         HN     37 PRO  QG      6.50                
         HN     92 VAL  QQG     5.5                
         HA1    93 ARG  HN      4.50                
         HA1    93 ARG  HG2     6.25                
         HA1    93 ARG  HG3     6.25                
         HA2    93 ARG  HN      4.50                
         HA2    93 ARG  HG2     6.25                
         HA2    93 ARG  HG3     6.25                
         QA     92 VAL  QQG     6.14                
         QA     93 ARG  QG      6.32                
         QA     93 ARG  QD      6.25                
 33 GLY  
         QA     34 LYS  HA      6.38                
         QA     34 LYS  QG      6.38                
         QA     35 GLU  HN      6.38                
 34 LYS  
         HN     34 LYS  QG      6.50                
         HN     35 GLU  HN      4.40                
         HA     34 LYS  QD      6.50                
         HB2    35 GLU  HN      4.50                
         HB3    35 GLU  HN      4.50                
         QB     34 LYS  QE      6.38                
         QB     35 GLU  HN      4.65                
         QG     35 GLU  HN      6.50                
         QE     35 GLU  HN      6.50                
 35 GLU  
         HN     35 GLU  HB2     3.80                
         HN     35 GLU  HB3     3.80                
         HN     35 GLU  QG      5.30                
         HN     36 ALA  HN      4.40                
         HN     36 ALA  HA      4.50                
         HA     36 ALA  HN      2.70                
         HB2    36 ALA  HN      4.50                
         HB3    36 ALA  HN      4.50                
         QG     36 ALA  HN      6.50                
 36 ALA  
         HN     36 ALA  QB      3.40                
         HN     37 PRO  HD2     4.50                
         HN     37 PRO  HD3     4.50                
         HA     37 PRO  HD2     3.80                
         HA     37 PRO  HD3     3.80                
         QB     37 PRO  HD2     4.00                
         QB     37 PRO  HD3     4.00                
 37 PRO  
         HA     38 LEU  HN      2.70                
         HA     38 LEU  QB      6.38                
         HA     38 LEU  QD1     4.70                
         HA     38 LEU  QD2     4.70                
 38 LEU  
         HN     38 LEU  HB2     3.80                
         HN     38 LEU  HB3     3.80                
         HN     38 LEU  HG      4.50                
         HN     38 LEU  QD1     4.70                
         HN     38 LEU  QD2     4.70                
         HN     38 LEU  QQD     4.42                
         HA     38 LEU  QD1     4.70                
         HA     38 LEU  QD2     4.70                
         HB2    39 ALA  HN      4.50                
         HB3    39 ALA  HN      4.50                
         HG     39 ALA  HN      4.50                
         HG     40 ILE  QG1     6.38                
         QD1    39 ALA  HN      4.70                
         QD2    39 ALA  HN      4.70                
 39 ALA  
         HA     40 ILE  QG2     4.70                
         QB     40 ILE  HN      4.00                
         QB     40 ILE  HA      4.70                
 40 ILE  
         HN     40 ILE  HG12    3.80                
         HN     40 ILE  HG13    3.80                
         HN     40 ILE  QD1     4.70                
         HA     41 GLU  HN      3.00                
         HB     41 GLU  HN      2.70                
         QG2    41 GLU  HN      4.00                
         HG12   41 GLU  HN      4.50                
         HG13   41 GLU  HN      4.50                
         QG1    41 GLU  HN      4.65                
         QD1    41 GLU  HN      4.70                
         QD1    63 ILE  QD1     6.70                
         QD1    91 PHE  QD      6.85                
 41 GLU  
         HN     41 GLU  QG      5.30                
         HN     42 LEU  QB      6.38                
         QB     43 ASP  HN      6.38                
         QG     42 LEU  HN      6.50                
 42 LEU  
         HN     42 LEU  HG      4.50                
         HN     42 LEU  QQD     6.27                
         HA     42 LEU  QD1     4.70                
         HA     42 LEU  QD2     4.70                
         HB2    43 ASP  HN      4.50                
         HB3    43 ASP  HN      4.50                
         QD1    63 ILE  QD1     6.70                
         QD1    91 PHE  QE      6.85                
         QD1    91 PHE  HZ      4.70                
         QD2    63 ILE  QD1     6.70                
         QD2    91 PHE  QE      6.85                
         QD2    91 PHE  HZ      4.70                
         QQD    43 ASP  HN      6.27                
         QQD    63 ILE  QG2     6.27                
         QQD    89 ILE  QG2     6.27                
 43 ASP  
         HN     43 ASP  HA      2.70                
         HN     43 ASP  HB2     3.80                
         HN     43 ASP  HB3     3.80                
         HN     46 LYS  QB      6.38                
         HN     47 VAL  QQG     5.5                
         HA     44 HIS  QB      6.38                
         HB2    46 LYS  HB2     6.25                
         HB2    46 LYS  HB3     6.25                
         HB3    46 LYS  HB2     6.25                
         HB3    46 LYS  HB3     6.25                
         QB     45 ASP  HN      6.38                
         QB     46 LYS  HN      6.38                
         QB     46 LYS  QB      5.86                
         QB     46 LYS  QD      6.38                
         QB     47 VAL  HN      6.38                
 44 HIS  
         HN     44 HIS  HB2     3.80                
         HN     44 HIS  HB3     3.80                
         HN     44 HIS  HD2     4.50                
         HN     45 ASP  HN      4.40                
         HA     44 HIS  HD2     4.50                
         HA     47 VAL  HN      4.50                
         HA     47 VAL  HB      4.50                
         HA     47 VAL  QG1     4.70                
         HA     47 VAL  QG2     4.70                
         HA     48 MET  HN      4.50                
         HA     86 LEU  QQD     6.27                
         HB2    45 ASP  HN      4.50                
         HB3    45 ASP  HN      4.50                
         QB     45 ASP  HN      4.65                
         HD2    85 LYS  QB      6.38                
         HD2    85 LYS  QD      6.38                
         HD2    86 LEU  QB      6.38                
         HD2    86 LEU  QQD     6.27                
         HE1    45 ASP  HA      4.50                
         HE1    48 MET  QB      6.38                
         HE1    48 MET  HG2     4.50                
         HE1    48 MET  HG3     4.50                
         HE1    48 MET  QE      4.70                
         HE1    84 PRO  QG      6.38                
         HE1    85 LYS  HA      3.80                
         HE1    85 LYS  QG      6.38                
         HE1    85 LYS  QD      6.38                
         HE1    86 LEU  QB      6.38                
 45 ASP  
         HN     45 ASP  HB2     3.80                
         HN     45 ASP  HB3     3.80                
         HN     46 LYS  HN      2.40                
         HN     46 LYS  QB      6.38                
         HA     48 MET  HN      4.50                
         HA     48 MET  HB2     4.50                
         HA     48 MET  HB3     4.50                
         HA     49 ASN  HN      4.50                
         HB2    46 LYS  HN      4.50                
         HB3    46 LYS  HN      4.50                
         O      49 ASN  HN      2.40                    
 46 LYS  
         HN     46 LYS  HB2     3.80                
         HN     46 LYS  HB3     3.80                
         HN     46 LYS  HG2     4.50                
         HN     46 LYS  HG3     4.50                
         HN     46 LYS  QE      6.50                
         HN     47 VAL  HN      4.40                
         HN     47 VAL  QQG     5.5                
         HN     48 MET  HN      4.40                
         HA     46 LYS  QE      6.50                
         HA     47 VAL  HA      4.50                
         HA     49 ASN  HN      4.50                
         HA     49 ASN  HB2     4.50                
         HA     49 ASN  HB3     4.50                
         HA     49 ASN  QD2     6.37                
         HA     50 MET  QE      4.70                
         HB2    47 VAL  HN      4.50                
         HB3    47 VAL  HN      4.50                
         QB     48 MET  HN      6.38                
         QG     50 MET  QE      6.58                
         QE     50 MET  QE      6.50                
         O      50 MET  HN      2.40                    
 47 VAL  
         HN     47 VAL  HB      3.80                
         HN     47 VAL  QQG     4.20                
         HN     48 MET  HN      4.40                
         HA     49 ASN  HN      4.50                
         HA     50 MET  HN      3.80                
         HA     50 MET  HB2     4.50                
         HA     50 MET  HB3     4.50                
         HA     50 MET  HG2     4.50                
         HA     50 MET  HG3     4.50                
         HA     50 MET  QE      4.70                
         HA     56 PHE  QE      5.62                
         HB     86 LEU  QQD     6.27                
         QG1    48 MET  HN      4.70                
         QG1    56 PHE  QE      6.85                
         QG1    86 LEU  QD1     7.82                
         QG1    86 LEU  QD2     7.82                
         QG2    48 MET  HN      4.70                
         QG2    56 PHE  QE      6.85                
         QG2    86 LEU  QD1     7.82                
         QG2    86 LEU  QD2     7.82                
         QQG    48 MET  HA      5.5                
         QQG    50 MET  HN      5.5                
         QQG    50 MET  QG      6.14                
         QQG    50 MET  QE      6.26                
         QQG    51 GLN  HN      5.56                
         QQG    56 PHE  QD      6.41                
         QQG    56 PHE  QE      6.89                
         QQG    56 PHE  HZ      5.5                
         QQG    86 LEU  QQD     6.92                
         QQG    91 PHE  HZ      5.5                
         O      51 GLN  HN      2.40                    
 48 MET  
         HN     48 MET  HB2     3.80                
         HN     48 MET  HB3     3.80                
         HN     48 MET  QG      6.38                
         HN     49 ASN  HN      4.40                
         HN     49 ASN  QB      6.38                
         HN     50 MET  HN      4.40                
         HN     86 LEU  QQD     6.27                
         HA     48 MET  QE      4.00                
         HA     51 GLN  HN      3.80                
         HA     51 GLN  QB      6.38                
         HA     51 GLN  HG2     4.50                
         HA     51 GLN  HG3     4.50                
         HA     51 GLN  QG      4.65                
         HA     86 LEU  HG      4.50                
         HA     86 LEU  QD1     4.70                
         HA     86 LEU  QD2     4.70                
         HA     86 LEU  QQD     4.67                
         HB2    49 ASN  HN      4.50                
         HB3    49 ASN  HN      4.50                
         QB     84 PRO  QB      6.25                
         QG     49 ASN  HN      6.38                
         QE     79 ARG  HA      4.70                
         QE     84 PRO  HA      4.70                
         QE     84 PRO  HG2     4.70                
         QE     84 PRO  HG3     4.70                
         QE     84 PRO  HD2     6.00                
         QE     84 PRO  HD3     6.00                
         QE     85 LYS  HA      4.70                
         QE     86 LEU  QD1     6.70                
         QE     86 LEU  QD2     6.70                
         O      52 ALA  HN      2.40                    
 49 ASN  
         HN     49 ASN  HB2     3.80                
         HN     49 ASN  HB3     3.80                
         HN     50 MET  QB      6.38                
         HN     50 MET  QG      6.38                
         HA     52 ALA  HN      4.50                
         HB2    50 MET  HN      4.50                
         HB2    50 MET  HA      4.50                
         HB3    50 MET  HN      4.50                
         HB3    50 MET  HA      4.50                
 50 MET  
         HN     50 MET  HB2     3.80                
         HN     50 MET  HB3     3.80                
         HN     50 MET  HG2     3.80                
         HN     50 MET  HG3     3.80                
         HN     50 MET  QE      4.70                
         HN     51 GLN  HN      4.40                
         HN     52 ALA  HN      4.40                
         HA     50 MET  QE      4.70                
         HA     51 GLN  HA      4.50                
         HA     52 ALA  HN      4.50                
         HA     56 PHE  QD      5.62                
         HB2    51 GLN  HN      3.80                
         HB2    56 PHE  QD      5.62                
         HB2    56 PHE  QE      5.62                
         HB2    56 PHE  HZ      4.50                
         HB3    51 GLN  HN      3.80                
         HB3    56 PHE  QD      5.62                
         HB3    56 PHE  QE      5.62                
         HB3    56 PHE  HZ      4.50                
         QB     51 GLN  HA      6.38                
         QB     52 ALA  HN      6.38                
         QG     51 GLN  HN      4.68                
         QG     56 PHE  QD      6.50                
         QG     56 PHE  QE      6.50                
         QE     56 PHE  QD      6.85                
         QE     56 PHE  QE      6.85                
 51 GLN  
         HN     51 GLN  HB2     3.80                
         HN     51 GLN  HB3     3.80                
         HN     51 GLN  HG2     3.80                
         HN     51 GLN  HG3     3.80                
         HN     51 GLN  QE2     5.27                
         HN     52 ALA  HN      4.40                
         HN     52 ALA  QB      4.70                
         HN     56 PHE  QD      5.62                
         HN     86 LEU  QQD     5.57                
         HA     52 ALA  QB      4.70                
         HA     53 LYS  HN      4.50                
         HA     56 PHE  HB2     4.50                
         HA     56 PHE  HB3     4.50                
         HA     56 PHE  QD      5.62                
         HA     56 PHE  QE      5.62                
         HA     57 TYR  QE      6.63                
         HB2    52 ALA  HN      4.50                
         HB2    56 PHE  QD      5.62                
         HB2    56 PHE  QE      5.62                
         HB3    52 ALA  HN      4.50                
         HB3    56 PHE  QD      5.62                
         HB3    56 PHE  QE      5.62                
         QB     56 PHE  HZ      6.38                
         QB     57 TYR  QE      6.51                
         QB     77 VAL  QQG     6.14                
         QB     86 LEU  QQD     6.15                
         HG2    52 ALA  HN      4.50                
         HG2    86 LEU  QD1     4.70                
         HG2    86 LEU  QD2     4.70                
         HG3    52 ALA  HN      4.50                
         HG3    86 LEU  QD1     4.70                
         HG3    86 LEU  QD2     4.70                
         QG     89 ILE  QD1     6.58                
         HE21   79 ARG  HG2     6.25                
         HE21   79 ARG  HG3     6.25                
#         HE21   89 ILE  HA      4.50                
         HE22   79 ARG  HG2     6.25                
         HE22   79 ARG  HG3     6.25                
#         HE22   89 ILE  HA      4.50                
#         QE2    69 GLU  HA      6.37                
         QE2    79 ARG  QG      6.00                
         QE2    79 ARG  QD      6.37                
         QE2    86 LEU  QQD     6.14                
         QE2    89 ILE  QG1     6.24                
 52 ALA  
         HN     52 ALA  QB      3.40                
         HN     53 LYS  HN      4.40                
         HN     53 LYS  QB      6.50                
         QB     53 LYS  HN      4.00                
 53 LYS  
         HN     53 LYS  QB      3.70                
         HN     53 LYS  HG2     4.50                
         HN     53 LYS  HG3     4.50                
         HN     54 ALA  HN      4.40                
         HN     56 PHE  HN      4.40                
         HN     56 PHE  QB      6.38                
         HA     53 LYS  QD      6.38                
         HA     54 ALA  HN      3.00                
         HA     54 ALA  HA      4.50                
         HA     55 GLU  HN      4.50                
         QB     54 ALA  HN      6.50                
         QB     54 ALA  QB      6.50                
         QB     55 GLU  HN      6.50                
         QB     81 PRO  QD      6.38                
         QG     57 TYR  QE      6.51                
         QD     54 ALA  HN      6.38                
         QD     79 ARG  QD      6.38                
         QE     80 HIS  HA      6.50                
         O      56 PHE  HN      2.40                    
 54 ALA  
         HN     54 ALA  QB      3.40                
         HN     55 GLU  HN      4.40                
         HA     57 TYR  QD      5.94                
         HA     57 TYR  QE      6.63                
         QB     55 GLU  HN      4.00                
         QB     55 GLU  HA      4.70                
         QB     55 GLU  QB      6.50                
         QB     56 PHE  HN      5.60                
         QB     57 TYR  HN      4.70                
         QB     57 TYR  QD      6.87                
         QB     57 TYR  QE      6.86                
         O      57 TYR  HN      2.40                    
 55 GLU  
         HN     55 GLU  HG2     4.50                
         HN     55 GLU  HG3     4.50                
         HN     56 PHE  HN      5.10                
         HN     57 TYR  HN      4.70                
         HN     57 TYR  QD      6.64                
         HA     55 GLU  QG      3.95                
         HA     57 TYR  HN      4.50                
         HA     58 SER  HN      4.50                
         HA     58 SER  HB2     4.50                
         HA     58 SER  HB3     4.50                
         HA     59 GLU  HN      4.50                
         HA     59 GLU  HG2     4.50                
         HA     59 GLU  HG3     4.50                
         QB     58 SER  HN      6.50                
         HG2    56 PHE  HN      4.50                
         HG3    56 PHE  HN      4.50                
         QG     57 TYR  HN      6.38                
 56 PHE  
         HN     56 PHE  HB2     3.80                
         HN     56 PHE  HB3     3.80                
         HN     57 TYR  HN      4.40                
         HN     57 TYR  QD      5.94                
         HN     58 SER  HN      4.40                
         HA     61 LEU  QD1     4.70                
         HA     61 LEU  QD2     4.70                
         HA     61 LEU  QQD     4.67                
         HB2    57 TYR  HN      4.50                
         HB2    57 TYR  QE      6.63                
         HB3    57 TYR  HN      4.50                
         HB3    57 TYR  QE      6.63                
         QB     57 TYR  QD      6.52                
         QD     57 TYR  HN      5.62                
         QD     57 TYR  HA      5.62                
         QD     57 TYR  QD      7.76                
         QD     57 TYR  QE      9.01                
         QD     61 LEU  QD1     6.85                
         QD     61 LEU  QD2     6.85                
         QD     74 ALA  QB      6.85                
         QD     77 VAL  QG1     6.85                
         QD     77 VAL  QG2     6.85                
         QE     61 LEU  QD1     6.85                
         QE     61 LEU  QD2     6.85                
         QE     74 ALA  QB      6.85                
         QE     77 VAL  QG1     6.85                
         QE     77 VAL  QG2     6.85                
         QE     77 VAL  QQG     6.89                
         QE     86 LEU  QQD     6.42                
         QE     89 ILE  QG2     6.85                
         QE     89 ILE  QD1     6.15                
         HZ     61 LEU  QD1     4.70                
         HZ     61 LEU  QD2     4.70                
         HZ     74 ALA  QB      6.00                
         HZ     77 VAL  QQG     5.5                
         HZ     86 LEU  QQD     6.27                
         HZ     89 ILE  QG2     4.70                
         HZ     89 ILE  QD1     4.70                
 57 TYR  
         HN     57 TYR  QE      6.63                
         HN     58 SER  HN      4.40                
         HN     58 SER  HA      4.50                
         HN     74 ALA  QB      6.00                
         HA     59 GLU  HN      4.50                
         HA     74 ALA  HN      4.50                
         HA     74 ALA  QB      4.00                
         HB2    58 SER  HN      4.50                
         HB3    58 SER  HN      4.50                
         QB     58 SER  HA      6.38                
         QB     74 ALA  QB      6.58                
         QD     74 ALA  QB      6.87                
         QD     77 VAL  QQG     6.43                
         QE     77 VAL  HB      6.63                
         QE     77 VAL  QG1     6.86                
         QE     77 VAL  QG2     6.86                
         QE     77 VAL  QQG     6.90                
 58 SER  
         HN     58 SER  QB      3.91                
         HN     59 GLU  HN      4.40                
         HN     59 GLU  HA      4.50                
         HN     59 GLU  QB      6.38                
         HN     59 GLU  HG2     4.50                
         HN     59 GLU  HG3     4.50                
         HB2    59 GLU  HN      4.50                
         HB2    59 GLU  HG2     6.25                
         HB2    59 GLU  HG3     6.25                
         HB3    59 GLU  HN      4.50                
         HB3    59 GLU  HG2     6.25                
         HB3    59 GLU  HG3     6.25                
         QB     59 GLU  QG      6.32                
 59 GLU  
         HN     59 GLU  HB2     3.80                
         HN     59 GLU  HB3     3.80                
         HN     59 GLU  HG2     4.20                
         HN     59 GLU  HG3     3.80                
         HN     60 VAL  HN      4.40                
         HN     60 VAL  QQG     4.50                
         HN     61 LEU  QQD     6.27                
         HA     60 VAL  HN      3.00                
         HA     73 LYS  QE      6.38                
         HG2    60 VAL  HN      4.50                
         HG3    60 VAL  HN      4.50                
 60 VAL  
         HN     60 VAL  HA      2.40                
         HN     60 VAL  HB      3.80                
         HN     60 VAL  QQG     4.20                
         HN     61 LEU  HN      4.40                
         HN     61 LEU  QQD     5.30                
         HN     73 LYS  QG      6.38                
         HN     73 LYS  QE      6.38                
         HA     61 LEU  HN      2.70                
         HA     72 VAL  HN      4.50                
         HA     73 LYS  HA      4.50                
         HB     61 LEU  HN      4.50                
         QQG    61 LEU  HN      5.56                
         QQG    71 LYS  QB      6.14                
         QQG    72 VAL  HN      5.5                
         QQG    73 LYS  QB      6.14                
         QQG    73 LYS  QD      7.06                
 61 LEU  
         HN     61 LEU  HG      3.80                
         HN     61 LEU  QD1     4.70                
         HN     61 LEU  QD2     4.70                
         HN     62 THR  HN      4.40                
         HN     71 LYS  HA      4.50                
         HN     71 LYS  QG      6.50                
         HN     72 VAL  HN      4.40                
         HN     72 VAL  QQG     5.5                
         HN     72 VAL  O       2.40                    
         HN     73 LYS  HA      4.50                
         HN     94 ALA  QB      4.70                
         HA     61 LEU  QD1     4.70                
         HA     61 LEU  QD2     4.70                
         HB2    62 THR  HN      4.50                
         HB2    72 VAL  QG1     6.82                
         HB2    72 VAL  QG2     6.82                
         HB3    62 THR  HN      4.50                
         HB3    72 VAL  QG1     6.82                
         HB3    72 VAL  QG2     6.82                
         QB     62 THR  HA      6.38                
         QB     72 VAL  HN      6.38                
         QB     72 VAL  QQG     6.21                
         QB     91 PHE  HZ      6.38                
         HG     62 THR  HN      4.50                
         HG     72 VAL  QQG     5.5                
         HG     74 ALA  HN      4.50                
         HG     91 PHE  QE      5.62                
         QD1    62 THR  HN      4.70                
         QD1    73 LYS  HA      4.70                
         QD1    74 ALA  HN      4.70                
         QD1    91 PHE  QD      6.85                
         QD2    62 THR  HN      4.70                
         QD2    73 LYS  HA      4.70                
         QD2    74 ALA  HN      4.70                
         QD2    91 PHE  QD      6.85                
         QQD    63 ILE  QD1     6.27                
         QQD    73 LYS  HN      6.27                
         QQD    74 ALA  QB      6.57                
         QQD    91 PHE  QE      6.42                
         QQD    91 PHE  HZ      6.27                
         O      72 VAL  HN      2.40                    
 62 THR  
         HN     62 THR  HB      3.80                
         HN     63 ILE  HN      4.40                
         HN     72 VAL  QQG     5.5                
         HA     63 ILE  HN      2.70                
         HA     70 ILE  HN      4.50                
         HA     70 ILE  QG2     4.70                
         HA     71 LYS  HN      4.50                
         HA     71 LYS  HA      3.80                
         HA     71 LYS  QG      6.50                
         HA     72 VAL  HN      4.50                
         HA     72 VAL  QQG     5.5                
         HB     63 ILE  HN      4.50                
         QG2    63 ILE  HN      4.00                
         QG2    69 GLU  HN      4.70                
         QG2    69 GLU  HA      4.70                
         QG2    69 GLU  HG2     4.70                
         QG2    69 GLU  HG3     4.70                
         QG2    70 ILE  HN      4.70                
         QG2    71 LYS  HN      4.70                
         QG2    71 LYS  QE      6.50                
 63 ILE  
         HN     63 ILE  HB      3.80                
         HN     63 ILE  HG12    4.50                
         HN     63 ILE  HG13    4.50                
         HN     63 ILE  QD1     4.70                
         HN     64 VAL  QQG     5.5                
         HN     69 GLU  HA      4.50                
         HN     70 ILE  HN      4.40                
         HN     70 ILE  O       2.40                    
         HN     71 LYS  HN      5.00                
         HN     71 LYS  HA      4.50                
         HN     72 VAL  QQG     5.5                
         HB     64 VAL  HN      4.50                
         QG2    64 VAL  HN      4.00                
         QG2    65 VAL  HN      4.70                
         QG2    65 VAL  HA      4.70                
         QG2    65 VAL  HB      4.70                
         QG2    65 VAL  QG1     6.70                
         QG2    65 VAL  QG2     6.70                
         QG2    70 ILE  HN      4.70                
         QG2    70 ILE  QG1     6.58                
         QG2    72 VAL  QQG     6.26                
         HG12   64 VAL  HN      4.50                
         HG12   72 VAL  QG1     6.82                
         HG12   72 VAL  QG2     6.82                
         HG13   64 VAL  HN      4.50                
         HG13   72 VAL  QG1     6.82                
         HG13   72 VAL  QG2     6.82                
         QG1    72 VAL  QQG     6.21                
         QG1    91 PHE  QD      6.50                
         QD1    64 VAL  HN      4.70                
         QD1    72 VAL  HB      4.70                
         QD1    72 VAL  QG1     6.70                
         QD1    72 VAL  QG2     6.70                
         QD1    72 VAL  QQG     4.70                
         QD1    91 PHE  QD      6.85                
         QD1    91 PHE  QE      6.85                
         QD1    91 PHE  HZ      4.70                
         O      70 ILE  HN      2.40                    
 64 VAL  
         HN     64 VAL  HB      3.80                
         HN     64 VAL  QQG     4.20                
         HA     66 ASP  HN      3.80                
         HA     68 LYS  HN      4.50                
         HA     69 GLU  HA      3.80                
         HA     70 ILE  HN      4.50                
         HB     65 VAL  HN      4.50                
         QQG    65 VAL  HN      5.56                
         QQG    67 GLY  HN      5.5                
         O      66 ASP  HN      2.40                    
 65 VAL  
         HN     65 VAL  HB      3.80                
         HN     65 VAL  QQG     4.20                
         HN     66 ASP  HN      4.40                
         HN     67 GLY  HN      4.40                
         HN     68 LYS  HN      4.40                
         HN     68 LYS  O       2.40                    
         HN     69 GLU  HA      4.50                
         HN     69 GLU  QG      6.38                
         HN     70 ILE  HN      4.40                
         HN     70 ILE  HB      4.50                
         HN     70 ILE  HG12    4.50                
         HN     70 ILE  HG13    4.50                
         HA     66 ASP  HN      2.70                
         HA     67 GLY  HN      4.50                
         HA     68 LYS  HN      4.50                
         HB     66 ASP  HN      4.50                
         QQG    66 ASP  HN      5.5                
         QQG    66 ASP  QB      6.14                
         QQG    67 GLY  HN      5.5                
         QQG    68 LYS  HN      5.56                
         QQG    68 LYS  QE      7.06                
         QQG    70 ILE  HN      5.5                
 66 ASP  
         HN     66 ASP  HA      2.70                
         HN     67 GLY  HN      4.40                
         HN     68 LYS  HN      4.40                
         HA     68 LYS  HN      4.50                
         HB2    67 GLY  HN      4.50                
         HB2    68 LYS  HN      4.50                
         HB3    67 GLY  HN      4.50                
         HB3    68 LYS  HN      4.50                
 67 GLY  
         HN     68 LYS  HN      4.40                
         HN     68 LYS  QB      6.50                
         QA     68 LYS  HA      6.38                
 68 LYS  
         HN     68 LYS  QB      3.70                
         HN     68 LYS  QG      5.30                
         HN     68 LYS  QD      6.50                
         HN     69 GLU  HN      4.40                
         HA     68 LYS  QD      6.50                
         HA     68 LYS  QE      6.50                
         HA     69 GLU  QG      6.38                
         QB     69 GLU  HN      5.30                
         QG     69 GLU  HN      6.50                
 69 GLU  
         HN     69 GLU  HB2     3.80                
         HN     69 GLU  HB3     3.80                
         HN     69 GLU  HG2     4.50                
         HN     69 GLU  HG3     4.50                
         HN     69 GLU  QG      4.65                
         HN     70 ILE  HN      4.40                
         QG     70 ILE  HN      6.38                
 70 ILE  
         HN     70 ILE  HB      3.80                
         HN     70 ILE  HG12    4.50                
         HN     70 ILE  HG13    4.50                
         HN     70 ILE  QD1     4.70                
         HN     71 LYS  HN      4.40                
         HA     71 LYS  HN      2.70                
         HB     71 LYS  HN      4.50                
         QG2    71 LYS  HN      4.00                
         QG2    71 LYS  QB      6.58                
         QG2    72 VAL  HN      4.70                
         QG2    72 VAL  HA      4.70                
         QG2    72 VAL  QQG     6.26                
         QG2    93 ARG  HB2     4.70                
         QG2    93 ARG  HB3     4.70                
         QG2    93 ARG  QG      6.58                
         QG2    93 ARG  QD      6.58                
         QG2    94 ALA  HN      4.70                
         QG1    71 LYS  HN      6.38                
 71 LYS  
         HN     71 LYS  QB      3.91                
         HN     71 LYS  QG      6.50                
         HN     71 LYS  QD      6.38                
         HN     71 LYS  QE      6.50                
         HN     72 VAL  HN      4.40                
         HN     72 VAL  QG1     4.70                
         HN     72 VAL  QG2     6.20                
         HN     94 ALA  QB      4.70                
         HA     71 LYS  HD2     4.50                
         HA     71 LYS  HD3     4.50                
         HA     71 LYS  QE      6.50                
         HA     72 VAL  HN      2.70                
         HA     72 VAL  QG1     4.70                
         HA     72 VAL  QG2     4.70                
         HA     94 ALA  QB      4.70                
         HB2    72 VAL  HN      4.50                
         HB2    94 ALA  HN      4.50                
         HB2    94 ALA  QB      4.70                
         HB3    72 VAL  HN      4.50                
         HB3    94 ALA  HN      4.50                
         HB3    94 ALA  QB      4.70                
         QB     72 VAL  HA      6.38                
         QG     72 VAL  HN      6.50                
         O      94 ALA  HN      2.40                    
 72 VAL  
         HN     72 VAL  QQG     4.20                
         HN     94 ALA  QB      4.70                
         HA     73 LYS  HN      2.70                
         HA     73 LYS  HA      4.50                
         HA     91 PHE  QB      6.38                
         HA     93 ARG  HN      4.50                
         HA     93 ARG  HA      4.50                
         HA     94 ALA  HN      3.80                
         HA     94 ALA  HA      4.50                
         HA     94 ALA  QB      4.00                
         HB     73 LYS  HN      3.80                
         HB     73 LYS  HA      4.50                
         HB     91 PHE  HN      4.50                
         HB     91 PHE  HA      4.50                
         HB     91 PHE  HB2     4.50                
         HB     91 PHE  HB3     4.50                
         HB     91 PHE  QD      5.62                
         HB     92 VAL  HN      4.50                
         HB     93 ARG  HA      4.50                
         QG1    73 LYS  HN      4.70                
         QG1    91 PHE  HN      4.70                
         QG1    91 PHE  HA      4.70                
         QG1    91 PHE  HB2     4.70                
         QG1    91 PHE  HB3     4.70                
         QG1    91 PHE  QD      6.85                
         QG1    92 VAL  HN      4.70                
         QG2    73 LYS  HN      4.70                
         QG2    91 PHE  HA      5.80                
         QG2    91 PHE  HB2     4.70                
         QG2    91 PHE  HB3     4.70                
         QG2    91 PHE  QD      6.85                
         QG2    92 VAL  HN      4.70                
         QQG    74 ALA  HN      5.5                
         QQG    91 PHE  QD      6.89                
         QQG    91 PHE  QE      6.41                
         QQG    91 PHE  HZ      5.5                
         QQG    93 ARG  HN      5.5                
         QQG    93 ARG  HA      5.56                
         QQG    94 ALA  HN      5.5                
 73 LYS  
         HN     73 LYS  QG      6.38                
         HN     73 LYS  QD      6.50                
         HN     91 PHE  HB2     4.50                
         HN     91 PHE  HB3     4.50                
         HN     91 PHE  QD      5.00                
         HN     92 VAL  QQG     5.5                
         HN     93 ARG  HA      4.50                
         HN     94 ALA  HN      4.40                
         HN     94 ALA  HA      4.50                
         HN     94 ALA  QB      4.70                
         HA     73 LYS  QE      6.38                
         HA     74 ALA  QB      4.70                
         HA     94 ALA  HA      4.50                
         HA     94 ALA  QB      4.70                
         HB2    92 VAL  HN      4.50                
         HB3    92 VAL  HN      4.50                
         QB     74 ALA  HN      6.38                
         QG     74 ALA  HN      6.38                
         QE     94 ALA  QB      6.58                
 74 ALA  
         HN     75 GLN  HN      4.40                
         HN     91 PHE  QD      5.62                
         HA     75 GLN  HN      2.70                
         HA     76 ASP  HN      4.50                
         HA     89 ILE  QG2     4.70                
         HA     91 PHE  HA      3.80                
         HA     91 PHE  QD      5.92                
         HA     91 PHE  QE      5.62                
         HA     92 VAL  HN      4.50                
         QB     75 GLN  HN      4.00                
         QB     76 ASP  HN      4.70                
         QB     77 VAL  HN      4.70                
         QB     89 ILE  QG2     5.60                
         QB     91 PHE  HA      4.70                
         QB     91 PHE  QD      6.85                
 75 GLN  
         HN     75 GLN  QG      6.50                
         HN     76 ASP  HN      4.40                
         HN     76 ASP  QB      6.50                
         HN     89 ILE  QG2     4.70                
         HN     91 PHE  HA      3.80                
         HN     91 PHE  QB      6.38                
         HN     91 PHE  QD      5.62                
         HN     92 VAL  HN      4.40                
         QB     76 ASP  QB      6.50                
         QB     90 ASP  HN      6.50                
         QB     91 PHE  HA      6.50                
         QG     76 ASP  HN      6.50                
         QG     76 ASP  HA      6.50                
         QG     91 PHE  HA      6.50                
         QG     92 VAL  QG1     6.50                
         QG     92 VAL  QG2     6.50                
         QE2    76 ASP  QB      6.37                
         QE2    92 VAL  QQG     6.13                
 76 ASP  
         HN     77 VAL  HN      4.40                
         HN     77 VAL  QQG     5.5                
         HN     89 ILE  QG2     6.20                
         HN     90 ASP  HN      4.40                
         HN     90 ASP  QB      4.68                
         HA     77 VAL  HN      2.70                
         HA     90 ASP  HN      4.50                
         QB     78 GLN  QE2     6.37                
 77 VAL  
         HN     77 VAL  QG1     4.00                
         HN     77 VAL  QG2     4.00                
         HN     78 GLN  HN      4.40                
         HN     89 ILE  HA      4.50                
         HA     78 GLN  HN      2.70                
         HA     89 ILE  HA      3.80                
         HA     89 ILE  HB      4.50                
         HA     89 ILE  QG2     4.70                
         HA     89 ILE  HG12    4.50                
         HA     89 ILE  HG13    4.50                
         HA     90 ASP  HN      3.80                
         HB     78 GLN  HN      4.50                
         HB     90 ASP  HN      4.50                
         QG1    78 GLN  HN      4.70                
         QG1    86 LEU  QD1     7.84                
         QG1    86 LEU  QD2     7.84                
         QG1    89 ILE  QG2     6.70                
         QG1    89 ILE  HG12    6.45                
         QG1    89 ILE  HG13    6.45                
         QG2    78 GLN  HN      4.70                
         QG2    86 LEU  QD1     7.84                
         QG2    86 LEU  QD2     7.84                
         QG2    89 ILE  QG2     6.70                
         QG2    89 ILE  HG12    6.45                
         QG2    89 ILE  HG13    6.45                
         QQG    79 ARG  HN      5.5                
         QQG    79 ARG  HA      5.5                
         QQG    79 ARG  QD      7.06                
         QQG    86 LEU  QQD     6.12                
         QQG    89 ILE  HA      5.5                
         QQG    89 ILE  HB      5.5                
         QQG    89 ILE  QG2     4.70                
         QQG    89 ILE  QG1     6.39                
         QQG    91 PHE  QE      6.41                
 78 GLN  
         HN     78 GLN  QG      6.50                
         HN     87 GLN  QB      6.38                
         HN     88 HIS  HN      4.40                
         HN     88 HIS  QB      6.38                
         HN     88 HIS  O       2.40                    
         HN     89 ILE  HA      4.50                
         HN     89 ILE  QG2     4.70                
         HA     79 ARG  HN      2.70                
         HB2    78 GLN  HE21    6.23                
         HB2    78 GLN  HE22    6.23                
         HB2    88 HIS  HB2     4.50                
         HB2    88 HIS  HB3     4.50                
         HB3    78 GLN  HE21    6.23                
         HB3    78 GLN  HE22    6.23                
         HB3    88 HIS  HB2     4.50                
         HB3    88 HIS  HB3     4.50                
         QB     88 HIS  HN      6.38                
         QG     79 ARG  HN      6.50                
         QG     88 HIS  HN      6.50                
         QE2    87 GLN  QB      6.24                
 79 ARG  
         HN     79 ARG  QG      6.38                
         HN     80 HIS  HN      4.40                
         HN     86 LEU  QQD     6.27                
         HA     79 ARG  QD      6.50                
         HA     80 HIS  HA      4.50                
         HA     86 LEU  HA      4.50                
         HA     86 LEU  QD1     4.70                
         HA     86 LEU  QD2     4.70                
         HA     87 GLN  HN      4.50               
         HA     87 GLN  QG      6.50                
         HA     88 HIS  HN      4.50                
         HB2    80 HIS  HN      4.50                
         HB3    80 HIS  HN      4.50                
         QG     86 LEU  QQD     6.15                
         QD     86 LEU  QQD     7.07                
 80 HIS  
         HN     80 HIS  HB2     3.80                
         HN     80 HIS  HB3     3.80                
         HN     85 LYS  HN      4.40                
         HN     86 LEU  QQD     6.27                
         HA     80 HIS  HD2     4.50                
         HA     81 PRO  HD2     3.80                
         HA     81 PRO  HD3     3.80                
         HB2    80 HIS  HD2     3.80                
         HB2    85 LYS  HN      4.50                
         HB2    85 LYS  HB2     4.50                
         HB2    85 LYS  HB3     4.50                
         HB3    80 HIS  HD2     3.80                
         HB3    85 LYS  HN      4.50                
         HB3    85 LYS  HB2     4.50                
         HB3    85 LYS  HB3     4.50                
         QB     87 GLN  QG      6.38                
         HD2    81 PRO  QD      6.38                
         HD2    83 LYS  QD      6.50                
         HD2    85 LYS  HB2     4.50                
         HD2    85 LYS  HB3     4.50                
         HD2    85 LYS  QG      6.38                
         HD2    87 GLN  QG      6.50                
         HE1    81 PRO  QG      6.38                
         HE1    81 PRO  HD2     4.50                
         HE1    81 PRO  HD3     4.50                
         HE1    82 TYR  HB2     4.50                
         HE1    82 TYR  HB3     4.50                
         HE1    83 LYS  QB      6.50                
         HE1    83 LYS  HG2     4.50                
         HE1    83 LYS  HG3     4.50                
         HE1    83 LYS  QD      6.50                
         HE1    83 LYS  QE      6.50                
 81 PRO  
         HB2    82 TYR  QD      6.64                
         HB2    82 TYR  QE      6.63                
         HB3    82 TYR  QD      6.64                
         HB3    82 TYR  QE      6.63                
         HG2    82 TYR  QD      6.64                
         HG2    82 TYR  QE      6.63                
         HG3    82 TYR  QD      6.64                
         HG3    82 TYR  QE      6.63                
         QD     82 TYR  QD      6.52                
         QD     82 TYR  QE      6.51                
 82 TYR  
         HN     83 LYS  HN      4.40                
         HB2    83 LYS  HN      4.50                
         HB3    83 LYS  HN      4.50                
         QB     83 LYS  QE      6.38                
         QD     83 LYS  HN      6.64                
         QD     83 LYS  HG2     6.64                
         QD     83 LYS  HG3     6.64                
         QD     83 LYS  QD      7.52                
         QD     83 LYS  QE      7.52                
         QE     83 LYS  HG2     6.63                
         QE     83 LYS  HG3     6.63                
         QE     83 LYS  QD      7.51                
         QE     83 LYS  QE      7.51                
 83 LYS  
         HN     83 LYS  QG      3.28                
         HN     84 PRO  QD      4.68                
         HA     84 PRO  HD2     3.80                
         HA     84 PRO  HD3     3.80                
         QB     84 PRO  HD2     6.50                
         QB     84 PRO  HD3     6.50                
         QB     84 PRO  QD      5.87                
         QB     85 LYS  HN      6.50                
         HG2    84 PRO  HD2     6.25                
         HG2    84 PRO  HD3     6.25                
         HG3    84 PRO  HD2     6.25                
         HG3    84 PRO  HD3     6.25                
         QG     84 PRO  QD      6.32                
 84 PRO  
         HA     85 LYS  HN      2.70                
 85 LYS  
         HN     85 LYS  QB      3.91                
         HN     85 LYS  QG      6.38                
         QB     85 LYS  QE      6.38                
         QG     87 GLN  QG      6.38                
 86 LEU  
         HA     86 LEU  QD1     4.70                
         HA     86 LEU  QD2     4.70                
         HA     87 GLN  HN      2.70                
         HA     88 HIS  HN      4.50                
         HB2    87 GLN  HN      4.50                
         HB3    87 GLN  HN      4.50                
         HB3    88 HIS  HN      4.50                
         HG     87 GLN  HN      4.50                
         QD1    89 ILE  QD1     6.70                
         QD2    89 ILE  QD1     6.70                
         QQD    87 GLN  HN      6.27                
         QQD    88 HIS  HN      6.27                
 87 GLN  
         HN     87 GLN  HB2     3.80                
         HN     87 GLN  HB3     3.80                
         HN     87 GLN  QG      5.30                
         HN     88 HIS  HN      4.40                
         HA     87 GLN  QE2     6.37                
         HB2    87 GLN  HE21    6.23                
         HB2    87 GLN  HE22    6.23                
         HB2    88 HIS  HN      4.50                
         HB3    87 GLN  HE21    6.23                
         HB3    87 GLN  HE22    6.23                
         HB3    88 HIS  HN      4.50                
         QG     88 HIS  HN      6.50                
 88 HIS  
         HN     89 ILE  QD1     4.70                
         HA     88 HIS  HD2     4.50                
         HB2    89 ILE  HN      4.50                
         HB3    89 ILE  HN      4.50                
         HE1    90 ASP  HA      4.50                
 89 ILE  
         HN     89 ILE  HB      3.80                
         HN     89 ILE  HG12    4.50                
         HN     89 ILE  HG13    4.50                
         HN     89 ILE  QD1     4.70                
         HB     90 ASP  HN      4.50                
         HB     91 PHE  QE      5.92                
         HB     91 PHE  HZ      4.50                
         QG2    90 ASP  HN      3.40                
         QG2    90 ASP  HA      4.70                
         QG2    91 PHE  HN      4.70                
         QG2    91 PHE  HA      4.70                
         QG2    91 PHE  QD      6.85                
         QG2    91 PHE  QE      6.85                
         QG2    91 PHE  HZ      4.70                
         HG12   90 ASP  HN      4.50                
         HG13   90 ASP  HN      4.50                
         QD1    90 ASP  HN      4.70                
 90 ASP  
         HN     90 ASP  QB      3.42                
         HN     91 PHE  HN      4.40                
         HN     91 PHE  QD      5.62                
         HA     91 PHE  HN      2.70                
         QB     91 PHE  HA      6.38                
 91 PHE  
         HN     91 PHE  HB2     3.80                
         HN     91 PHE  HB3     3.80                
         HN     92 VAL  QQG     5.5                
         HA     92 VAL  HN      2.70                
         HB2    92 VAL  HN      4.50                
         HB3    92 VAL  HN      4.50                
         QD     92 VAL  HN      5.62                
 92 VAL  
         HN     92 VAL  QQG     4.20                
         HN     93 ARG  HN      4.40                
         HA     93 ARG  HN      2.70                
         HB     93 ARG  HN      4.50                
         QQG    93 ARG  HN      5.56                
         QQG    94 ALA  HN      5.5                
 93 ARG  
         HN     93 ARG  QB      3.91                
         HN     93 ARG  HG2     4.50                
         HN     93 ARG  HG3     4.50                
         HN     93 ARG  QG      4.65                
         HN     93 ARG  HD2     4.50                
         HN     93 ARG  HD3     4.50                
         HN     94 ALA  HN      4.40                
         HA     93 ARG  QD      5.38                
         HB2    94 ALA  HN      4.50                
         HB3    94 ALA  HN      4.50                
         QB     93 ARG  HE      5.38                




  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H    MET   1           H        MET   1 -13.845  -0.295   8.931
    2    HA   MET   1           HA       MET   1 -15.200  -1.996  10.499
    3   1HB   MET   1          1HB       MET   1 -14.974  -3.443   7.830
    4   2HB   MET   1          2HB       MET   1 -15.606  -4.093   9.344
    5   1HG   MET   1          1HG       MET   1 -16.870  -1.887   7.648
    6   2HG   MET   1          2HG       MET   1 -17.345  -3.573   7.769
    7   1HE   MET   1          1HE       MET   1 -17.900  -0.036   9.072
    8   2HE   MET   1          2HE       MET   1 -18.536  -0.260  10.715
    9   3HE   MET   1          3HE       MET   1 -16.808  -0.470  10.408
   10    H    PHE   2           H        PHE   2 -12.897  -2.831   7.849
   11    HA   PHE   2           HA       PHE   2 -11.142  -4.249   9.652
   12   1HB   PHE   2          1HB       PHE   2 -10.556  -3.201   6.883
   13   2HB   PHE   2          2HB       PHE   2  -9.748  -4.546   7.696
   14    HD1  PHE   2           HD1      PHE   2 -12.213  -6.073   8.693
   15    HD2  PHE   2           HD2      PHE   2 -11.255  -4.246   4.896
   16    HE1  PHE   2           HE1      PHE   2 -13.718  -7.660   7.534
   17    HE2  PHE   2           HE2      PHE   2 -12.841  -5.765   3.781
   18    HZ   PHE   2           HZ       PHE   2 -13.981  -7.553   5.064
   19    H    THR   3           H        THR   3  -8.698  -3.714   9.519
   20    HA   THR   3           HA       THR   3  -8.237  -0.807  10.087
   21    HB   THR   3           HB       THR   3  -7.017  -3.219  11.492
   22    HG1  THR   3           HG1      THR   3  -9.227  -2.873  11.991
   23   1HG2  THR   3          1HG2      THR   3  -6.909  -0.231  12.114
   24   2HG2  THR   3          2HG2      THR   3  -6.194  -1.529  13.090
   25   3HG2  THR   3          3HG2      THR   3  -5.547  -1.182  11.477
   26    H    ILE   4           H        ILE   4  -7.688  -0.641   7.795
   27    HA   ILE   4           HA       ILE   4  -5.238  -2.036   6.892
   28    HB   ILE   4           HB       ILE   4  -7.145  -0.066   5.586
   29   1HG1  ILE   4          1HG1      ILE   4  -7.362  -1.886   3.912
   30   2HG1  ILE   4          2HG1      ILE   4  -6.291  -2.920   4.868
   31   1HG2  ILE   4          1HG2      ILE   4  -4.473  -1.110   4.560
   32   2HG2  ILE   4          2HG2      ILE   4  -5.723  -0.358   3.548
   33   3HG2  ILE   4          3HG2      ILE   4  -4.927   0.587   4.806
   34   1HD1  ILE   4          1HD1      ILE   4  -8.940  -1.796   5.870
   35   2HD1  ILE   4          2HD1      ILE   4  -8.758  -3.380   5.080
   36   3HD1  ILE   4          3HD1      ILE   4  -7.955  -3.082   6.626
   37    H    ASN   5           H        ASN   5  -3.324  -1.295   7.609
   38    HA   ASN   5           HA       ASN   5  -3.025   1.291   8.871
   39   1HB   ASN   5          1HB       ASN   5  -0.960  -0.765   7.982
   40   2HB   ASN   5          2HB       ASN   5  -0.645   0.623   9.037
   41   1HD2  ASN   5          2HD2      ASN   5  -0.159  -2.136   9.717
   42   2HD2  ASN   5          1HD2      ASN   5  -1.185  -2.517  11.086
   43    H    ALA   6           H        ALA   6  -2.044   3.155   8.083
   44    HA   ALA   6           HA       ALA   6  -0.757   3.192   5.457
   45   1HB   ALA   6          1HB       ALA   6  -3.360   4.671   6.000
   46   2HB   ALA   6          2HB       ALA   6  -2.318   4.920   4.582
   47   3HB   ALA   6          3HB       ALA   6  -3.125   3.359   4.825
   48    H    GLU   7           H        GLU   7   0.177   5.254   4.986
   49    HA   GLU   7           HA       GLU   7   0.533   7.177   7.186
   50   1HB   GLU   7          1HB       GLU   7   2.263   5.459   7.481
   51   2HB   GLU   7          2HB       GLU   7   2.806   5.663   5.806
   52   1HG   GLU   7          1HG       GLU   7   3.583   7.923   6.278
   53   2HG   GLU   7          2HG       GLU   7   2.859   7.879   7.896
   54    H    VAL   8           H        VAL   8   1.566   9.190   6.315
   55    HA   VAL   8           HA       VAL   8   0.394   9.878   3.757
   56    HB   VAL   8           HB       VAL   8   1.370  12.135   4.229
   57   1HG1  VAL   8          1HG1      VAL   8  -0.927  11.565   4.775
   58   2HG1  VAL   8          2HG1      VAL   8  -0.427  10.879   6.332
   59   3HG1  VAL   8          3HG1      VAL   8  -0.237  12.616   6.024
   60   1HG2  VAL   8          1HG2      VAL   8   3.267  11.382   5.739
   61   2HG2  VAL   8          2HG2      VAL   8   2.243  12.659   6.409
   62   3HG2  VAL   8          3HG2      VAL   8   2.058  10.997   6.978
   63    H    ARG   9           H        ARG   9   1.724   8.091   2.736
   64    HA   ARG   9           HA       ARG   9   3.276   7.391   1.294
   65   1HB   ARG   9          1HB       ARG   9   2.032   9.187   0.090
   66   2HB   ARG   9          2HB       ARG   9   3.418  10.259   0.386
   67   1HG   ARG   9          1HG       ARG   9   4.885   8.595  -0.828
   68   2HG   ARG   9          2HG       ARG   9   3.482   7.540  -1.035
   69   1HD   ARG   9          1HD       ARG   9   3.897   8.723  -3.081
   70   2HD   ARG   9          2HD       ARG   9   2.364   9.279  -2.414
   71    HE   ARG   9           HE       ARG   9   4.940  10.732  -2.655
   72   1HH1  ARG   9          1HH2      ARG   9   1.629  10.871  -1.340
   73   2HH1  ARG   9          2HH2      ARG   9   1.634  12.608  -1.213
   74   1HH2  ARG   9          1HH1      ARG   9   4.923  12.991  -2.448
   75   2HH2  ARG   9          2HH1      ARG   9   3.517  13.815  -1.826
   76    H    LYS  10           H        LYS  10   4.564   7.264   3.508
   77    HA   LYS  10           HA       LYS  10   7.270   8.199   2.950
   78   1HB   LYS  10          1HB       LYS  10   6.172  10.044   4.205
   79   2HB   LYS  10          2HB       LYS  10   5.843   8.953   5.550
   80   1HG   LYS  10          1HG       LYS  10   8.673   9.246   4.517
   81   2HG   LYS  10          2HG       LYS  10   7.979  10.564   5.468
   82   1HD   LYS  10          1HD       LYS  10   7.586   9.142   7.372
   83   2HD   LYS  10          2HD       LYS  10   8.039   7.695   6.464
   84   1HE   LYS  10          1HE       LYS  10  10.342   8.759   6.121
   85   2HE   LYS  10          2HE       LYS  10   9.849  10.012   7.278
   86   1HZ   LYS  10          1HZ       LYS  10   9.939   7.123   7.767
   87   2HZ   LYS  10          2HZ       LYS  10  11.074   8.205   8.275
   88   3HZ   LYS  10          3HZ       LYS  10   9.534   8.263   8.895
   89    H    GLU  11           H        GLU  11   8.724   6.703   3.571
   90    HA   GLU  11           HA       GLU  11   7.709   4.248   4.934
   91   1HB   GLU  11          1HB       GLU  11   9.805   4.776   2.795
   92   2HB   GLU  11          2HB       GLU  11   9.719   3.243   3.656
   93   1HG   GLU  11          1HG       GLU  11   7.328   4.364   2.149
   94   2HG   GLU  11          2HG       GLU  11   8.556   3.336   1.402
   95    H    GLN  12           H        GLN  12   9.595   2.918   5.799
   96    HA   GLN  12           HA       GLN  12  10.639   4.270   8.095
   97   1HB   GLN  12          1HB       GLN  12  11.157   1.508   6.918
   98   2HB   GLN  12          2HB       GLN  12  11.827   2.091   8.447
   99   1HG   GLN  12          1HG       GLN  12   9.882   0.775   8.936
  100   2HG   GLN  12          2HG       GLN  12   9.546   2.459   9.342
  101   1HE2  GLN  12          2HE2      GLN  12   7.557   3.202   8.652
  102   2HE2  GLN  12          1HE2      GLN  12   6.654   2.551   7.307
  103    H    GLY  13           H        GLY  13  11.974   5.928   7.569
  104   1HA   GLY  13          1HA       GLY  13  14.665   5.842   7.177
  105   2HA   GLY  13          2HA       GLY  13  14.017   5.769   5.521
  106    H    LYS  14           H        LYS  14  14.459   7.838   4.806
  107    HA   LYS  14           HA       LYS  14  12.896  10.040   5.995
  108   1HB   LYS  14          1HB       LYS  14  15.164  10.199   6.944
  109   2HB   LYS  14          2HB       LYS  14  15.873  10.212   5.327
  110   1HG   LYS  14          1HG       LYS  14  13.766  12.260   6.053
  111   2HG   LYS  14          2HG       LYS  14  15.364  12.454   6.747
  112   1HD   LYS  14          1HD       LYS  14  15.215  12.048   3.754
  113   2HD   LYS  14          2HD       LYS  14  14.677  13.584   4.434
  114   1HE   LYS  14          1HE       LYS  14  17.018  13.715   3.778
  115   2HE   LYS  14          2HE       LYS  14  16.834  13.942   5.523
  116   1HZ   LYS  14          1HZ       LYS  14  17.662  11.451   4.198
  117   2HZ   LYS  14          2HZ       LYS  14  18.656  12.501   4.990
  118   3HZ   LYS  14          3HZ       LYS  14  17.506  11.669   5.824
  119    H    GLY  15           H        GLY  15  12.233  11.559   4.464
  120   1HA   GLY  15          1HA       GLY  15  12.009  12.490   2.326
  121   2HA   GLY  15          2HA       GLY  15  12.864  11.126   1.590
  122    H    ALA  16           H        ALA  16  11.512   9.760   0.482
  123    HA   ALA  16           HA       ALA  16   9.037   8.804   1.635
  124   1HB   ALA  16          1HB       ALA  16   8.958  10.589  -0.841
  125   2HB   ALA  16          2HB       ALA  16   7.616   9.573  -0.281
  126   3HB   ALA  16          3HB       ALA  16   8.183  10.921   0.725
  127    H    SER  17           H        SER  17   8.491   6.856   0.790
  128    HA   SER  17           HA       SER  17   8.585   4.943  -0.376
  129   1HB   SER  17          1HB       SER  17   9.011   6.824  -2.734
  130   2HB   SER  17          2HB       SER  17   8.328   5.192  -2.783
  131    HG   SER  17           HG       SER  17   6.684   6.018  -1.316
  132    H    ARG  18           H        ARG  18  10.975   5.218   0.878
  133    HA   ARG  18           HA       ARG  18  12.955   4.134  -1.105
  134   1HB   ARG  18          1HB       ARG  18  13.473   5.654   1.484
  135   2HB   ARG  18          2HB       ARG  18  14.696   4.875   0.459
  136   1HG   ARG  18          1HG       ARG  18  13.947   6.328  -1.456
  137   2HG   ARG  18          2HG       ARG  18  12.921   7.219  -0.309
  138   1HD   ARG  18          1HD       ARG  18  14.909   7.778   1.049
  139   2HD   ARG  18          2HD       ARG  18  15.931   6.839  -0.062
  140    HE   ARG  18           HE       ARG  18  14.436   8.837  -1.484
  141   1HH1  ARG  18          1HH2      ARG  18  17.257   8.454   0.636
  142   2HH1  ARG  18          2HH2      ARG  18  18.114   9.814  -0.044
  143   1HH2  ARG  18          1HH1      ARG  18  15.568  10.629  -2.363
  144   2HH2  ARG  18          2HH1      ARG  18  17.141  11.064  -1.748
  145    H    ARG  19           H        ARG  19  11.003   2.462  -0.239
  146    HA   ARG  19           HA       ARG  19  12.571   0.414   0.994
  147   1HB   ARG  19          1HB       ARG  19  11.790   1.755   3.051
  148   2HB   ARG  19          2HB       ARG  19  10.151   1.380   2.539
  149   1HG   ARG  19          1HG       ARG  19  10.464  -0.219   4.128
  150   2HG   ARG  19          2HG       ARG  19  10.935  -1.140   2.700
  151   1HD   ARG  19          1HD       ARG  19  12.759   0.242   4.720
  152   2HD   ARG  19          2HD       ARG  19  12.484  -1.489   4.569
  153    HE   ARG  19           HE       ARG  19  13.550  -1.508   2.401
  154   1HH1  ARG  19          1HH2      ARG  19  14.277   1.398   4.372
  155   2HH1  ARG  19          2HH2      ARG  19  15.736   1.737   3.486
  156   1HH2  ARG  19          1HH1      ARG  19  15.441  -0.996   1.284
  157   2HH2  ARG  19          2HH1      ARG  19  16.396   0.390   1.739
  158    H    LEU  20           H        LEU  20   9.229   1.516   0.237
  159    HA   LEU  20           HA       LEU  20   8.050  -0.932  -0.160
  160   1HB   LEU  20          1HB       LEU  20   6.362   0.199  -1.467
  161   2HB   LEU  20          2HB       LEU  20   6.848   1.134  -0.061
  162    HG   LEU  20           HG       LEU  20   8.390   2.418  -1.818
  163   1HD1  LEU  20          1HD1      LEU  20   7.728   0.972  -3.806
  164   2HD1  LEU  20          2HD1      LEU  20   6.045   1.426  -3.525
  165   3HD1  LEU  20          3HD1      LEU  20   7.235   2.657  -3.992
  166   1HD2  LEU  20          1HD2      LEU  20   5.373   2.712  -1.464
  167   2HD2  LEU  20          2HD2      LEU  20   6.640   3.440  -0.455
  168   3HD2  LEU  20          3HD2      LEU  20   6.423   3.970  -2.133
  169    H    ARG  21           H        ARG  21  10.144   0.788  -2.454
  170    HA   ARG  21           HA       ARG  21   9.594  -1.104  -4.612
  171   1HB   ARG  21          1HB       ARG  21  10.037   1.455  -4.730
  172   2HB   ARG  21          2HB       ARG  21  11.746   1.037  -4.581
  173   1HG   ARG  21          1HG       ARG  21  11.439  -0.463  -6.633
  174   2HG   ARG  21          2HG       ARG  21   9.762   0.102  -6.705
  175   1HD   ARG  21          1HD       ARG  21  10.755   2.504  -6.783
  176   2HD   ARG  21          2HD       ARG  21  12.313   1.725  -7.039
  177    HE   ARG  21           HE       ARG  21  11.734   1.215  -9.202
  178   1HH1  ARG  21          1HH2      ARG  21   8.785   2.160  -7.457
  179   2HH1  ARG  21          2HH2      ARG  21   7.819   2.287  -8.903
  180   1HH2  ARG  21          1HH1      ARG  21  10.444   1.374 -11.090
  181   2HH2  ARG  21          2HH1      ARG  21   8.763   1.828 -10.972
  182    H    ALA  22           H        ALA  22  10.466  -2.540  -2.467
  183    HA   ALA  22           HA       ALA  22  12.755  -3.971  -3.368
  184   1HB   ALA  22          1HB       ALA  22  13.210  -2.161  -0.945
  185   2HB   ALA  22          2HB       ALA  22  14.269  -3.491  -1.448
  186   3HB   ALA  22          3HB       ALA  22  14.073  -2.079  -2.492
  187    H    ALA  23           H        ALA  23  10.905  -2.975  -0.463
  188    HA   ALA  23           HA       ALA  23  10.935  -5.639   0.717
  189   1HB   ALA  23          1HB       ALA  23  11.047  -3.631   2.103
  190   2HB   ALA  23          2HB       ALA  23   9.473  -3.081   1.493
  191   3HB   ALA  23          3HB       ALA  23   9.588  -4.565   2.475
  192    H    ASN  24           H        ASN  24   7.821  -4.384   1.182
  193    HA   ASN  24           HA       ASN  24   6.607  -5.463  -1.208
  194   1HB   ASN  24          1HB       ASN  24   7.279  -7.510   0.198
  195   2HB   ASN  24          2HB       ASN  24   6.111  -6.969   1.401
  196   1HD2  ASN  24          2HD2      ASN  24   5.038  -9.050   1.024
  197   2HD2  ASN  24          1HD2      ASN  24   4.054  -9.301  -0.401
  198    H    LYS  25           H        LYS  25   6.185  -3.111  -0.884
  199    HA   LYS  25           HA       LYS  25   3.462  -2.816   0.230
  200   1HB   LYS  25          1HB       LYS  25   5.679  -0.743   0.538
  201   2HB   LYS  25          2HB       LYS  25   3.982  -0.503   0.914
  202   1HG   LYS  25          1HG       LYS  25   4.472  -2.595   2.566
  203   2HG   LYS  25          2HG       LYS  25   6.116  -1.946   2.420
  204   1HD   LYS  25          1HD       LYS  25   4.963   0.392   2.876
  205   2HD   LYS  25          2HD       LYS  25   3.577  -0.574   3.392
  206   1HE   LYS  25          1HE       LYS  25   4.739  -0.093   5.376
  207   2HE   LYS  25          2HE       LYS  25   5.219  -1.762   5.012
  208   1HZ   LYS  25          1HZ       LYS  25   6.732   0.676   4.357
  209   2HZ   LYS  25          2HZ       LYS  25   7.087  -0.322   5.613
  210   3HZ   LYS  25          3HZ       LYS  25   7.243  -0.854   4.055
  211    H    PHE  26           H        PHE  26   2.440  -0.820  -0.808
  212    HA   PHE  26           HA       PHE  26   3.688   0.251  -3.167
  213   1HB   PHE  26          1HB       PHE  26   2.111  -0.474  -4.810
  214   2HB   PHE  26          2HB       PHE  26   2.713  -1.919  -4.024
  215    HD1  PHE  26           HD1      PHE  26   1.228  -3.072  -2.258
  216    HD2  PHE  26           HD2      PHE  26  -0.199   0.082  -4.830
  217    HE1  PHE  26           HE1      PHE  26  -1.120  -3.620  -1.653
  218    HE2  PHE  26           HE2      PHE  26  -2.511  -0.351  -4.072
  219    HZ   PHE  26           HZ       PHE  26  -2.983  -2.255  -2.534
  220    HA   PRO  27           HA       PRO  27   1.102   3.475  -1.567
  221   1HB   PRO  27          1HB       PRO  27   1.138   5.360  -3.540
  222   2HB   PRO  27          2HB       PRO  27   2.603   4.910  -2.619
  223   1HG   PRO  27          1HG       PRO  27   1.731   3.837  -5.321
  224   2HG   PRO  27          2HG       PRO  27   3.326   4.520  -4.882
  225   1HD   PRO  27          1HD       PRO  27   2.872   1.836  -4.872
  226   2HD   PRO  27          2HD       PRO  27   3.889   2.600  -3.611
  227    H    ALA  28           H        ALA  28  -0.996   4.371  -1.686
  228    HA   ALA  28           HA       ALA  28  -2.809   3.573  -3.895
  229   1HB   ALA  28          1HB       ALA  28  -3.260   2.997  -0.941
  230   2HB   ALA  28          2HB       ALA  28  -4.486   2.836  -2.209
  231   3HB   ALA  28          3HB       ALA  28  -3.046   1.798  -2.234
  232    H    ILE  29           H        ILE  29  -4.937   4.797  -3.647
  233    HA   ILE  29           HA       ILE  29  -4.432   7.521  -2.507
  234    HB   ILE  29           HB       ILE  29  -5.535   6.821  -5.243
  235   1HG1  ILE  29          1HG1      ILE  29  -2.975   8.298  -4.435
  236   2HG1  ILE  29          2HG1      ILE  29  -3.027   6.638  -5.023
  237   1HG2  ILE  29          1HG2      ILE  29  -5.124   9.520  -3.899
  238   2HG2  ILE  29          2HG2      ILE  29  -5.640   9.279  -5.583
  239   3HG2  ILE  29          3HG2      ILE  29  -6.688   8.759  -4.280
  240   1HD1  ILE  29          1HD1      ILE  29  -4.072   7.494  -7.165
  241   2HD1  ILE  29          2HD1      ILE  29  -3.683   9.139  -6.605
  242   3HD1  ILE  29          3HD1      ILE  29  -2.388   7.965  -6.864
  243    H    ILE  30           H        ILE  30  -6.125   8.515  -1.559
  244    HA   ILE  30           HA       ILE  30  -8.732   7.060  -1.414
  245    HB   ILE  30           HB       ILE  30  -7.490   8.948   0.608
  246   1HG1  ILE  30          1HG1      ILE  30  -7.809   5.919   0.800
  247   2HG1  ILE  30          2HG1      ILE  30  -6.282   6.749   0.476
  248   1HG2  ILE  30          1HG2      ILE  30  -9.993   8.958   0.539
  249   2HG2  ILE  30          2HG2      ILE  30  -9.989   7.196   0.747
  250   3HG2  ILE  30          3HG2      ILE  30  -9.386   8.266   2.029
  251   1HD1  ILE  30          1HD1      ILE  30  -6.483   7.967   2.632
  252   2HD1  ILE  30          2HD1      ILE  30  -7.910   6.981   3.031
  253   3HD1  ILE  30          3HD1      ILE  30  -6.342   6.207   2.800
  254    H    TYR  31           H        TYR  31 -10.243   7.993  -2.593
  255    HA   TYR  31           HA       TYR  31 -10.233  10.915  -3.130
  256   1HB   TYR  31          1HB       TYR  31 -11.787   8.576  -4.293
  257   2HB   TYR  31          2HB       TYR  31 -12.101  10.260  -4.687
  258    HD1  TYR  31           HD1      TYR  31  -9.457   7.594  -4.873
  259    HD2  TYR  31           HD2      TYR  31 -10.848  11.409  -6.340
  260    HE1  TYR  31           HE1      TYR  31  -7.699   7.574  -6.607
  261    HE2  TYR  31           HE2      TYR  31  -9.117  11.357  -8.104
  262    HH   TYR  31           HH       TYR  31  -7.327  10.217  -8.998
  263    H    GLY  32           H        GLY  32 -12.200  12.085  -2.872
  264   1HA   GLY  32          1HA       GLY  32 -14.162  11.025  -0.871
  265   2HA   GLY  32          2HA       GLY  32 -13.566  12.692  -0.848
  266    H    GLY  33           H        GLY  33 -14.127  14.092  -2.619
  267   1HA   GLY  33          1HA       GLY  33 -15.290  13.625  -5.009
  268   2HA   GLY  33          2HA       GLY  33 -16.690  13.500  -3.925
  269    H    LYS  34           H        LYS  34 -13.810  15.653  -3.816
  270    HA   LYS  34           HA       LYS  34 -15.152  17.996  -4.736
  271   1HB   LYS  34          1HB       LYS  34 -16.304  17.883  -2.566
  272   2HB   LYS  34          2HB       LYS  34 -14.763  17.770  -1.709
  273   1HG   LYS  34          1HG       LYS  34 -14.145  20.037  -2.633
  274   2HG   LYS  34          2HG       LYS  34 -15.743  20.131  -3.387
  275   1HD   LYS  34          1HD       LYS  34 -15.186  19.841  -0.393
  276   2HD   LYS  34          2HD       LYS  34 -15.523  21.365  -1.232
  277   1HE   LYS  34          1HE       LYS  34 -17.756  20.464  -1.931
  278   2HE   LYS  34          2HE       LYS  34 -17.446  19.008  -0.963
  279   1HZ   LYS  34          1HZ       LYS  34 -17.564  21.747   0.073
  280   2HZ   LYS  34          2HZ       LYS  34 -18.732  20.597   0.230
  281   3HZ   LYS  34          3HZ       LYS  34 -17.272  20.393   0.964
  282    H    GLU  35           H        GLU  35 -12.762  17.259  -2.165
  283    HA   GLU  35           HA       GLU  35 -10.844  19.132  -3.321
  284   1HB   GLU  35          1HB       GLU  35 -11.490  18.964  -0.896
  285   2HB   GLU  35          2HB       GLU  35 -10.659  17.402  -0.817
  286   1HG   GLU  35          1HG       GLU  35  -8.514  18.490  -1.306
  287   2HG   GLU  35          2HG       GLU  35  -9.333  20.033  -1.629
  288    H    ALA  36           H        ALA  36  -8.523  18.469  -3.465
  289    HA   ALA  36           HA       ALA  36  -8.076  16.356  -5.244
  290   1HB   ALA  36          1HB       ALA  36  -6.588  18.292  -5.025
  291   2HB   ALA  36          2HB       ALA  36  -6.126  17.782  -3.385
  292   3HB   ALA  36          3HB       ALA  36  -5.669  16.793  -4.786
  293    HA   PRO  37           HA       PRO  37  -8.124  12.930  -2.471
  294   1HB   PRO  37          1HB       PRO  37  -7.003  10.959  -3.911
  295   2HB   PRO  37          2HB       PRO  37  -8.485  11.776  -4.467
  296   1HG   PRO  37          1HG       PRO  37  -5.639  12.437  -5.297
  297   2HG   PRO  37          2HG       PRO  37  -7.017  12.061  -6.374
  298   1HD   PRO  37          1HD       PRO  37  -6.389  14.628  -5.773
  299   2HD   PRO  37          2HD       PRO  37  -8.102  14.109  -5.845
  300    H    LEU  38           H        LEU  38  -6.804  11.406  -1.235
  301    HA   LEU  38           HA       LEU  38  -4.188  12.610  -0.484
  302   1HB   LEU  38          1HB       LEU  38  -6.061  10.739   1.015
  303   2HB   LEU  38          2HB       LEU  38  -4.528  11.367   1.607
  304    HG   LEU  38           HG       LEU  38  -6.246  12.571   2.644
  305   1HD1  LEU  38          1HD1      LEU  38  -4.261  13.892   1.923
  306   2HD1  LEU  38          2HD1      LEU  38  -5.170  14.436   0.491
  307   3HD1  LEU  38          3HD1      LEU  38  -5.730  14.867   2.116
  308   1HD2  LEU  38          1HD2      LEU  38  -8.060  12.136   0.950
  309   2HD2  LEU  38          2HD2      LEU  38  -8.034  13.761   1.658
  310   3HD2  LEU  38          3HD2      LEU  38  -7.434  13.519   0.018
  311    H    ALA  39           H        ALA  39  -2.528  11.670  -1.511
  312    HA   ALA  39           HA       ALA  39  -2.462   8.813  -2.164
  313   1HB   ALA  39          1HB       ALA  39  -0.399  11.028  -2.445
  314   2HB   ALA  39          2HB       ALA  39  -0.222   9.363  -3.048
  315   3HB   ALA  39          3HB       ALA  39  -1.485  10.420  -3.711
  316    H    ILE  40           H        ILE  40  -1.711   7.279  -0.830
  317    HA   ILE  40           HA       ILE  40  -0.076   7.951   1.545
  318    HB   ILE  40           HB       ILE  40  -1.713   6.518   2.874
  319   1HG1  ILE  40          1HG1      ILE  40  -4.112   6.701   2.093
  320   2HG1  ILE  40          2HG1      ILE  40  -3.539   7.012   0.463
  321   1HG2  ILE  40          1HG2      ILE  40  -1.550   8.983   3.055
  322   2HG2  ILE  40          2HG2      ILE  40  -2.798   9.149   1.803
  323   3HG2  ILE  40          3HG2      ILE  40  -3.182   8.381   3.350
  324   1HD1  ILE  40          1HD1      ILE  40  -3.074   4.518   2.156
  325   2HD1  ILE  40          2HD1      ILE  40  -4.189   4.680   0.790
  326   3HD1  ILE  40          3HD1      ILE  40  -2.445   4.738   0.504
  327    H    GLU  41           H        GLU  41   0.679   5.955   2.695
  328    HA   GLU  41           HA       GLU  41   1.762   3.992   0.819
  329   1HB   GLU  41          1HB       GLU  41   1.799   4.190   3.868
  330   2HB   GLU  41          2HB       GLU  41   2.607   2.918   2.957
  331   1HG   GLU  41          1HG       GLU  41   3.241   5.870   2.833
  332   2HG   GLU  41          2HG       GLU  41   4.183   4.627   3.647
  333    H    LEU  42           H        LEU  42   1.371   1.713   0.963
  334    HA   LEU  42           HA       LEU  42  -0.738   0.750   2.715
  335   1HB   LEU  42          1HB       LEU  42  -1.564   1.474   0.149
  336   2HB   LEU  42          2HB       LEU  42  -1.071  -0.196  -0.102
  337    HG   LEU  42           HG       LEU  42  -2.505  -0.724   2.016
  338   1HD1  LEU  42          1HD1      LEU  42  -3.521   2.057   1.257
  339   2HD1  LEU  42          2HD1      LEU  42  -4.447   0.916   2.232
  340   3HD1  LEU  42          3HD1      LEU  42  -2.904   1.536   2.836
  341   1HD2  LEU  42          1HD2      LEU  42  -3.090  -1.421  -0.263
  342   2HD2  LEU  42          2HD2      LEU  42  -4.525  -0.955   0.651
  343   3HD2  LEU  42          3HD2      LEU  42  -3.856   0.155  -0.568
  344    H    ASP  43           H        ASP  43  -0.290  -1.372   3.338
  345    HA   ASP  43           HA       ASP  43   2.202  -2.575   2.453
  346   1HB   ASP  43          1HB       ASP  43  -0.100  -3.766   4.030
  347   2HB   ASP  43          2HB       ASP  43   1.512  -4.469   3.864
  348    H    HIS  44           H        HIS  44   2.238  -4.816   1.533
  349    HA   HIS  44           HA       HIS  44   0.114  -5.245  -0.529
  350   1HB   HIS  44          1HB       HIS  44   2.374  -5.024  -1.415
  351   2HB   HIS  44          2HB       HIS  44   2.947  -6.258  -0.299
  352    HD1  HIS  44           HD1      HIS  44   2.133  -8.812  -0.790
  353    HD2  HIS  44           HD2      HIS  44   1.278  -5.889  -3.693
  354    HE1  HIS  44           HE1      HIS  44   1.582 -10.063  -2.945
  355    H    ASP  45           H        ASP  45   2.300  -7.154   1.594
  356    HA   ASP  45           HA       ASP  45   0.800  -9.532   1.536
  357   1HB   ASP  45          1HB       ASP  45   3.140  -9.456   2.185
  358   2HB   ASP  45          2HB       ASP  45   2.773  -8.449   3.594
  359    H    LYS  46           H        LYS  46   0.976  -7.057   4.138
  360    HA   LYS  46           HA       LYS  46  -0.680  -8.345   5.919
  361   1HB   LYS  46          1HB       LYS  46   0.844  -6.372   6.351
  362   2HB   LYS  46          2HB       LYS  46  -0.386  -5.331   5.629
  363   1HG   LYS  46          1HG       LYS  46  -0.615  -5.171   7.978
  364   2HG   LYS  46          2HG       LYS  46  -2.011  -6.095   7.407
  365   1HD   LYS  46          1HD       LYS  46  -0.918  -8.204   8.126
  366   2HD   LYS  46          2HD       LYS  46   0.546  -7.302   8.576
  367   1HE   LYS  46          1HE       LYS  46  -0.776  -6.043  10.271
  368   2HE   LYS  46          2HE       LYS  46  -2.221  -6.972   9.823
  369   1HZ   LYS  46          1HZ       LYS  46  -1.069  -8.956  10.504
  370   2HZ   LYS  46          2HZ       LYS  46   0.266  -8.085  10.924
  371   3HZ   LYS  46          3HZ       LYS  46  -1.146  -7.874  11.745
  372    H    VAL  47           H        VAL  47  -1.640  -5.827   3.516
  373    HA   VAL  47           HA       VAL  47  -4.391  -5.860   4.298
  374    HB   VAL  47           HB       VAL  47  -4.854  -4.574   2.319
  375   1HG1  VAL  47          1HG1      VAL  47  -3.868  -3.494   4.335
  376   2HG1  VAL  47          2HG1      VAL  47  -2.265  -3.611   3.579
  377   3HG1  VAL  47          3HG1      VAL  47  -3.536  -2.638   2.817
  378   1HG2  VAL  47          1HG2      VAL  47  -1.985  -5.146   1.502
  379   2HG2  VAL  47          2HG2      VAL  47  -3.454  -5.671   0.656
  380   3HG2  VAL  47          3HG2      VAL  47  -3.051  -3.949   0.730
  381    H    MET  48           H        MET  48  -2.564  -8.042   2.185
  382    HA   MET  48           HA       MET  48  -4.619  -8.787   0.470
  383   1HB   MET  48          1HB       MET  48  -2.047  -9.535   0.675
  384   2HB   MET  48          2HB       MET  48  -2.790 -10.973   1.383
  385   1HG   MET  48          1HG       MET  48  -3.292  -9.723  -1.348
  386   2HG   MET  48          2HG       MET  48  -2.469 -11.248  -1.012
  387   1HE   MET  48          1HE       MET  48  -4.789 -10.698  -3.223
  388   2HE   MET  48          2HE       MET  48  -4.022 -12.299  -3.060
  389   3HE   MET  48          3HE       MET  48  -5.791 -12.155  -3.041
  390    H    ASN  49           H        ASN  49  -3.900  -9.865   3.772
  391    HA   ASN  49           HA       ASN  49  -5.709 -11.934   4.194
  392   1HB   ASN  49          1HB       ASN  49  -4.031 -11.148   5.817
  393   2HB   ASN  49          2HB       ASN  49  -4.932  -9.643   6.040
  394   1HD2  ASN  49          2HD2      ASN  49  -5.243 -13.218   6.351
  395   2HD2  ASN  49          1HD2      ASN  49  -6.365 -13.165   7.694
  396    H    MET  50           H        MET  50  -6.327  -8.399   4.187
  397    HA   MET  50           HA       MET  50  -9.148  -8.690   4.892
  398   1HB   MET  50          1HB       MET  50  -7.548  -6.270   3.949
  399   2HB   MET  50          2HB       MET  50  -9.239  -6.274   4.452
  400   1HG   MET  50          1HG       MET  50  -8.073  -5.514   6.300
  401   2HG   MET  50          2HG       MET  50  -8.493  -7.180   6.698
  402   1HE   MET  50          1HE       MET  50  -6.792  -6.969   8.766
  403   2HE   MET  50          2HE       MET  50  -5.096  -6.460   8.594
  404   3HE   MET  50          3HE       MET  50  -6.406  -5.298   8.284
  405    H    GLN  51           H        GLN  51  -7.197  -8.051   1.947
  406    HA   GLN  51           HA       GLN  51  -9.225  -7.355   0.177
  407   1HB   GLN  51          1HB       GLN  51  -6.638  -8.821  -0.321
  408   2HB   GLN  51          2HB       GLN  51  -7.684  -8.280  -1.619
  409   1HG   GLN  51          1HG       GLN  51  -6.633  -6.342   0.482
  410   2HG   GLN  51          2HG       GLN  51  -5.719  -6.770  -0.967
  411   1HE2  GLN  51          2HE2      GLN  51  -5.980  -4.272  -1.040
  412   2HE2  GLN  51          1HE2      GLN  51  -7.342  -3.698  -1.980
  413    H    ALA  52           H        ALA  52  -7.704 -10.585   0.324
  414    HA   ALA  52           HA       ALA  52  -8.363 -12.642  -0.195
  415   1HB   ALA  52          1HB       ALA  52  -9.848 -12.371   1.719
  416   2HB   ALA  52          2HB       ALA  52 -11.143 -11.748   0.680
  417   3HB   ALA  52          3HB       ALA  52 -10.574 -13.415   0.482
  418    H    LYS  53           H        LYS  53 -11.295 -10.888  -1.314
  419    HA   LYS  53           HA       LYS  53 -10.668 -11.354  -4.112
  420   1HB   LYS  53          1HB       LYS  53 -11.530 -13.545  -3.245
  421   2HB   LYS  53          2HB       LYS  53 -13.078 -12.793  -2.894
  422   1HG   LYS  53          1HG       LYS  53 -13.372 -12.325  -5.335
  423   2HG   LYS  53          2HG       LYS  53 -11.727 -12.912  -5.638
  424   1HD   LYS  53          1HD       LYS  53 -12.396 -15.143  -4.673
  425   2HD   LYS  53          2HD       LYS  53 -14.065 -14.547  -4.570
  426   1HE   LYS  53          1HE       LYS  53 -14.078 -14.206  -7.035
  427   2HE   LYS  53          2HE       LYS  53 -12.390 -14.746  -7.120
  428   1HZ   LYS  53          1HZ       LYS  53 -13.093 -16.866  -6.267
  429   2HZ   LYS  53          2HZ       LYS  53 -14.670 -16.377  -6.242
  430   3HZ   LYS  53          3HZ       LYS  53 -13.858 -16.505  -7.674
  431    H    ALA  54           H        ALA  54 -14.054 -11.181  -3.518
  432    HA   ALA  54           HA       ALA  54 -14.051  -8.353  -4.309
  433   1HB   ALA  54          1HB       ALA  54 -15.460  -9.960  -5.508
  434   2HB   ALA  54          2HB       ALA  54 -16.305 -10.369  -3.996
  435   3HB   ALA  54          3HB       ALA  54 -16.446  -8.735  -4.683
  436    H    GLU  55           H        GLU  55 -14.743 -10.334  -1.497
  437    HA   GLU  55           HA       GLU  55 -16.641  -8.994  -0.154
  438   1HB   GLU  55          1HB       GLU  55 -15.513 -11.178   0.427
  439   2HB   GLU  55          2HB       GLU  55 -14.190 -10.250   1.148
  440   1HG   GLU  55          1HG       GLU  55 -15.743 -10.998   2.870
  441   2HG   GLU  55          2HG       GLU  55 -15.819  -9.238   2.760
  442    H    PHE  56           H        PHE  56 -13.228  -8.097  -0.238
  443    HA   PHE  56           HA       PHE  56 -12.690  -6.456   1.747
  444   1HB   PHE  56          1HB       PHE  56 -11.299  -6.947  -0.215
  445   2HB   PHE  56          2HB       PHE  56 -12.185  -5.798  -1.177
  446    HD1  PHE  56           HD1      PHE  56 -10.265  -5.968   2.076
  447    HD2  PHE  56           HD2      PHE  56 -11.339  -3.576  -1.337
  448    HE1  PHE  56           HE1      PHE  56  -8.368  -4.438   2.549
  449    HE2  PHE  56           HE2      PHE  56  -9.459  -2.041  -0.855
  450    HZ   PHE  56           HZ       PHE  56  -7.933  -2.501   1.059
  451    H    TYR  57           H        TYR  57 -14.276  -5.198  -1.192
  452    HA   TYR  57           HA       TYR  57 -14.910  -2.628   0.051
  453   1HB   TYR  57          1HB       TYR  57 -15.970  -2.243  -2.261
  454   2HB   TYR  57          2HB       TYR  57 -14.228  -2.350  -2.109
  455    HD1  TYR  57           HD1      TYR  57 -17.220  -4.063  -3.480
  456    HD2  TYR  57           HD2      TYR  57 -12.947  -4.224  -2.978
  457    HE1  TYR  57           HE1      TYR  57 -17.053  -5.691  -5.342
  458    HE2  TYR  57           HE2      TYR  57 -12.767  -5.783  -4.873
  459    HH   TYR  57           HH       TYR  57 -15.641  -6.929  -6.683
  460    H    SER  58           H        SER  58 -16.622  -5.615  -0.831
  461    HA   SER  58           HA       SER  58 -19.221  -4.781  -0.973
  462   1HB   SER  58          1HB       SER  58 -18.248  -7.339   0.347
  463   2HB   SER  58          2HB       SER  58 -19.836  -7.061  -0.382
  464    HG   SER  58           HG       SER  58 -18.308  -8.126  -1.772
  465    H    GLU  59           H        GLU  59 -17.618  -5.888   2.098
  466    HA   GLU  59           HA       GLU  59 -19.972  -5.043   3.615
  467   1HB   GLU  59          1HB       GLU  59 -18.932  -6.065   5.498
  468   2HB   GLU  59          2HB       GLU  59 -18.864  -7.157   4.113
  469   1HG   GLU  59          1HG       GLU  59 -16.494  -6.689   3.782
  470   2HG   GLU  59          2HG       GLU  59 -16.522  -5.412   5.006
  471    H    VAL  60           H        VAL  60 -17.605  -3.131   2.386
  472    HA   VAL  60           HA       VAL  60 -16.857  -1.085   2.831
  473    HB   VAL  60           HB       VAL  60 -18.575  -0.995   5.354
  474   1HG1  VAL  60          1HG1      VAL  60 -17.557   1.225   3.557
  475   2HG1  VAL  60          2HG1      VAL  60 -18.626   1.412   4.952
  476   3HG1  VAL  60          3HG1      VAL  60 -16.970   0.874   5.205
  477   1HG2  VAL  60          1HG2      VAL  60 -19.280  -0.298   2.467
  478   2HG2  VAL  60          2HG2      VAL  60 -20.034  -1.578   3.442
  479   3HG2  VAL  60          3HG2      VAL  60 -20.268   0.112   3.885
  480    H    LEU  61           H        LEU  61 -15.217   0.068   4.198
  481    HA   LEU  61           HA       LEU  61 -14.027  -1.490   6.365
  482   1HB   LEU  61          1HB       LEU  61 -11.949  -1.906   5.338
  483   2HB   LEU  61          2HB       LEU  61 -13.209  -2.669   4.379
  484    HG   LEU  61           HG       LEU  61 -11.887  -0.013   3.655
  485   1HD1  LEU  61          1HD1      LEU  61 -11.294  -2.835   2.706
  486   2HD1  LEU  61          2HD1      LEU  61 -10.581  -1.344   2.054
  487   3HD1  LEU  61          3HD1      LEU  61 -10.237  -1.828   3.721
  488   1HD2  LEU  61          1HD2      LEU  61 -13.591  -1.972   2.034
  489   2HD2  LEU  61          2HD2      LEU  61 -14.037  -0.314   2.442
  490   3HD2  LEU  61          3HD2      LEU  61 -12.702  -0.610   1.337
  491    H    THR  62           H        THR  62 -11.764  -0.414   6.928
  492    HA   THR  62           HA       THR  62 -11.990   2.536   6.723
  493    HB   THR  62           HB       THR  62 -11.618   1.000   9.325
  494    HG1  THR  62           HG1      THR  62 -13.665   1.705   9.798
  495   1HG2  THR  62          1HG2      THR  62 -11.975   3.973   8.801
  496   2HG2  THR  62          2HG2      THR  62 -11.924   3.190  10.391
  497   3HG2  THR  62          3HG2      THR  62 -10.480   3.191   9.369
  498    H    ILE  63           H        ILE  63 -10.087   3.617   6.726
  499    HA   ILE  63           HA       ILE  63  -7.554   2.038   6.771
  500    HB   ILE  63           HB       ILE  63  -8.162   4.646   5.335
  501   1HG1  ILE  63          1HG1      ILE  63  -7.847   1.858   4.127
  502   2HG1  ILE  63          2HG1      ILE  63  -9.389   2.704   4.325
  503   1HG2  ILE  63          1HG2      ILE  63  -5.772   4.299   6.045
  504   2HG2  ILE  63          2HG2      ILE  63  -5.757   2.774   5.149
  505   3HG2  ILE  63          3HG2      ILE  63  -5.951   4.318   4.300
  506   1HD1  ILE  63          1HD1      ILE  63  -8.524   4.588   2.936
  507   2HD1  ILE  63          2HD1      ILE  63  -7.097   3.589   2.547
  508   3HD1  ILE  63          3HD1      ILE  63  -8.715   3.048   2.098
  509    H    VAL  64           H        VAL  64  -6.099   2.642   8.306
  510    HA   VAL  64           HA       VAL  64  -6.628   5.010  10.025
  511    HB   VAL  64           HB       VAL  64  -4.713   2.668  10.346
  512   1HG1  VAL  64          1HG1      VAL  64  -5.411   4.999  12.194
  513   2HG1  VAL  64          2HG1      VAL  64  -4.466   3.572  12.666
  514   3HG1  VAL  64          3HG1      VAL  64  -3.826   4.687  11.457
  515   1HG2  VAL  64          1HG2      VAL  64  -7.361   3.352  11.698
  516   2HG2  VAL  64          2HG2      VAL  64  -7.050   1.964  10.627
  517   3HG2  VAL  64          3HG2      VAL  64  -6.255   2.060  12.207
  518    H    VAL  65           H        VAL  65  -5.982   6.701   8.661
  519    HA   VAL  65           HA       VAL  65  -3.240   6.669   7.509
  520    HB   VAL  65           HB       VAL  65  -5.446   8.755   7.288
  521   1HG1  VAL  65          1HG1      VAL  65  -2.784   8.412   5.822
  522   2HG1  VAL  65          2HG1      VAL  65  -4.036   9.612   5.426
  523   3HG1  VAL  65          3HG1      VAL  65  -3.175   9.714   6.964
  524   1HG2  VAL  65          1HG2      VAL  65  -4.550   6.585   5.344
  525   2HG2  VAL  65          2HG2      VAL  65  -6.135   6.700   6.152
  526   3HG2  VAL  65          3HG2      VAL  65  -5.652   7.915   4.961
  527    H    ASP  66           H        ASP  66  -2.076   6.635   9.477
  528    HA   ASP  66           HA       ASP  66  -1.109   7.419  11.372
  529   1HB   ASP  66          1HB       ASP  66  -1.483  10.102   9.965
  530   2HB   ASP  66          2HB       ASP  66  -0.373   9.777  11.306
  531    H    GLY  67           H        GLY  67  -3.412   6.697  12.172
  532   1HA   GLY  67          1HA       GLY  67  -4.948   6.927  13.843
  533   2HA   GLY  67          2HA       GLY  67  -4.102   8.390  14.367
  534    H    LYS  68           H        LYS  68  -5.723   7.654  11.251
  535    HA   LYS  68           HA       LYS  68  -7.998   9.435  11.922
  536   1HB   LYS  68          1HB       LYS  68  -6.440   9.590   9.307
  537   2HB   LYS  68          2HB       LYS  68  -7.973  10.388   9.670
  538   1HG   LYS  68          1HG       LYS  68  -6.881  11.660  11.508
  539   2HG   LYS  68          2HG       LYS  68  -5.325  10.905  11.097
  540   1HD   LYS  68          1HD       LYS  68  -5.440  11.846   8.822
  541   2HD   LYS  68          2HD       LYS  68  -7.012  12.592   9.195
  542   1HE   LYS  68          1HE       LYS  68  -5.948  13.937  10.992
  543   2HE   LYS  68          2HE       LYS  68  -4.377  13.195  10.621
  544   1HZ   LYS  68          1HZ       LYS  68  -5.974  14.834   8.777
  545   2HZ   LYS  68          2HZ       LYS  68  -4.626  15.325   9.584
  546   3HZ   LYS  68          3HZ       LYS  68  -4.513  14.149   8.438
  547    H    GLU  69           H        GLU  69  -9.498   7.899  12.023
  548    HA   GLU  69           HA       GLU  69  -9.397   5.450  10.484
  549   1HB   GLU  69          1HB       GLU  69 -11.347   6.620  12.509
  550   2HB   GLU  69          2HB       GLU  69 -11.550   5.038  11.756
  551   1HG   GLU  69          1HG       GLU  69 -10.515   4.775  13.935
  552   2HG   GLU  69          2HG       GLU  69  -9.410   4.260  12.657
  553    H    ILE  70           H        ILE  70  -9.423   6.571   8.373
  554    HA   ILE  70           HA       ILE  70 -11.822   7.962   7.511
  555    HB   ILE  70           HB       ILE  70  -9.428   6.921   5.946
  556   1HG1  ILE  70          1HG1      ILE  70 -10.135   9.685   7.056
  557   2HG1  ILE  70          2HG1      ILE  70  -8.825   8.634   7.605
  558   1HG2  ILE  70          1HG2      ILE  70 -11.459   7.201   4.515
  559   2HG2  ILE  70          2HG2      ILE  70 -11.665   8.832   5.157
  560   3HG2  ILE  70          3HG2      ILE  70 -10.261   8.428   4.151
  561   1HD1  ILE  70          1HD1      ILE  70  -7.838   8.779   5.274
  562   2HD1  ILE  70          2HD1      ILE  70  -8.999  10.092   4.957
  563   3HD1  ILE  70          3HD1      ILE  70  -7.803  10.263   6.248
  564    H    LYS  71           H        LYS  71 -13.658   6.812   7.407
  565    HA   LYS  71           HA       LYS  71 -13.816   4.017   6.680
  566   1HB   LYS  71          1HB       LYS  71 -15.910   6.199   7.001
  567   2HB   LYS  71          2HB       LYS  71 -16.274   4.500   6.638
  568   1HG   LYS  71          1HG       LYS  71 -15.151   3.776   8.690
  569   2HG   LYS  71          2HG       LYS  71 -14.762   5.456   9.109
  570   1HD   LYS  71          1HD       LYS  71 -17.154   6.020   9.197
  571   2HD   LYS  71          2HD       LYS  71 -17.595   4.369   8.733
  572   1HE   LYS  71          1HE       LYS  71 -16.056   5.126  11.262
  573   2HE   LYS  71          2HE       LYS  71 -17.800   4.816  11.186
  574   1HZ   LYS  71          1HZ       LYS  71 -17.325   2.597  10.442
  575   2HZ   LYS  71          2HZ       LYS  71 -15.702   2.868  10.532
  576   3HZ   LYS  71          3HZ       LYS  71 -16.617   2.888  11.901
  577    H    VAL  72           H        VAL  72 -13.885   3.178   4.688
  578    HA   VAL  72           HA       VAL  72 -14.639   4.857   2.353
  579    HB   VAL  72           HB       VAL  72 -12.855   3.826   1.051
  580   1HG1  VAL  72          1HG1      VAL  72 -12.464   6.018   2.186
  581   2HG1  VAL  72          2HG1      VAL  72 -11.715   5.140   3.541
  582   3HG1  VAL  72          3HG1      VAL  72 -10.978   5.086   1.935
  583   1HG2  VAL  72          1HG2      VAL  72 -11.918   2.587   3.676
  584   2HG2  VAL  72          2HG2      VAL  72 -12.524   1.734   2.235
  585   3HG2  VAL  72          3HG2      VAL  72 -11.004   2.620   2.159
  586    H    LYS  73           H        LYS  73 -15.516   3.686   0.615
  587    HA   LYS  73           HA       LYS  73 -16.415   0.887   1.177
  588   1HB   LYS  73          1HB       LYS  73 -18.239   2.450   0.777
  589   2HB   LYS  73          2HB       LYS  73 -17.523   2.945  -0.770
  590   1HG   LYS  73          1HG       LYS  73 -17.740   0.654  -1.642
  591   2HG   LYS  73          2HG       LYS  73 -18.361   0.077  -0.091
  592   1HD   LYS  73          1HD       LYS  73 -19.720   2.194  -1.825
  593   2HD   LYS  73          2HD       LYS  73 -20.066   0.458  -1.900
  594   1HE   LYS  73          1HE       LYS  73 -20.703   0.485   0.519
  595   2HE   LYS  73          2HE       LYS  73 -20.487   2.247   0.537
  596   1HZ   LYS  73          1HZ       LYS  73 -22.375   0.768  -1.147
  597   2HZ   LYS  73          2HZ       LYS  73 -22.750   1.635   0.201
  598   3HZ   LYS  73          3HZ       LYS  73 -22.176   2.404  -1.138
  599    H    ALA  74           H        ALA  74 -14.976   3.112  -1.215
  600    HA   ALA  74           HA       ALA  74 -13.378   2.846  -2.749
  601   1HB   ALA  74          1HB       ALA  74 -12.372   1.116  -1.182
  602   2HB   ALA  74          2HB       ALA  74 -13.130  -0.123  -2.199
  603   3HB   ALA  74          3HB       ALA  74 -11.944   0.984  -2.898
  604    H    GLN  75           H        GLN  75 -13.058   2.143  -4.928
  605    HA   GLN  75           HA       GLN  75 -15.410   0.801  -6.190
  606   1HB   GLN  75          1HB       GLN  75 -14.058   3.407  -6.995
  607   2HB   GLN  75          2HB       GLN  75 -15.168   2.500  -8.035
  608   1HG   GLN  75          1HG       GLN  75 -15.920   3.602  -5.282
  609   2HG   GLN  75          2HG       GLN  75 -16.198   4.424  -6.817
  610   1HE2  GLN  75          2HE2      GLN  75 -17.175   1.644  -4.818
  611   2HE2  GLN  75          1HE2      GLN  75 -18.652   1.319  -5.703
  612    H    ASP  76           H        ASP  76 -12.377   2.238  -7.531
  613    HA   ASP  76           HA       ASP  76 -11.900  -0.291  -8.918
  614   1HB   ASP  76          1HB       ASP  76 -11.560   1.791 -10.117
  615   2HB   ASP  76          2HB       ASP  76 -10.322   2.294  -8.959
  616    H    VAL  77           H        VAL  77 -11.744  -1.517  -6.997
  617    HA   VAL  77           HA       VAL  77  -9.187  -1.460  -5.498
  618    HB   VAL  77           HB       VAL  77 -11.583  -3.347  -5.407
  619   1HG1  VAL  77          1HG1      VAL  77  -9.245  -4.218  -4.582
  620   2HG1  VAL  77          2HG1      VAL  77  -9.463  -3.055  -3.262
  621   3HG1  VAL  77          3HG1      VAL  77 -10.633  -4.358  -3.502
  622   1HG2  VAL  77          1HG2      VAL  77 -10.768  -0.994  -3.646
  623   2HG2  VAL  77          2HG2      VAL  77 -12.246  -1.128  -4.624
  624   3HG2  VAL  77          3HG2      VAL  77 -12.020  -2.164  -3.213
  625    H    GLN  78           H        GLN  78  -7.819  -1.703  -7.349
  626    HA   GLN  78           HA       GLN  78  -8.274  -3.851  -9.239
  627   1HB   GLN  78          1HB       GLN  78  -7.336  -1.497  -9.649
  628   2HB   GLN  78          2HB       GLN  78  -5.792  -2.120  -9.055
  629   1HG   GLN  78          1HG       GLN  78  -5.879  -3.912 -10.799
  630   2HG   GLN  78          2HG       GLN  78  -7.386  -3.205 -11.413
  631   1HE2  GLN  78          2HE2      GLN  78  -7.124  -0.604 -11.664
  632   2HE2  GLN  78          1HE2      GLN  78  -5.707  -0.147 -12.583
  633    H    ARG  79           H        ARG  79  -8.273  -5.285  -7.144
  634    HA   ARG  79           HA       ARG  79  -5.585  -6.327  -6.506
  635   1HB   ARG  79          1HB       ARG  79  -6.707  -7.692  -4.827
  636   2HB   ARG  79          2HB       ARG  79  -7.054  -5.977  -4.643
  637   1HG   ARG  79          1HG       ARG  79  -8.997  -7.207  -4.129
  638   2HG   ARG  79          2HG       ARG  79  -9.320  -6.330  -5.618
  639   1HD   ARG  79          1HD       ARG  79  -8.301  -9.137  -5.947
  640   2HD   ARG  79          2HD       ARG  79  -9.840  -9.008  -5.146
  641    HE   ARG  79           HE       ARG  79  -9.217  -8.273  -7.928
  642   1HH1  ARG  79          1HH2      ARG  79 -11.667  -8.139  -5.321
  643   2HH1  ARG  79          2HH2      ARG  79 -12.944  -7.650  -6.404
  644   1HH2  ARG  79          1HH1      ARG  79 -10.936  -7.716  -9.310
  645   2HH2  ARG  79          2HH1      ARG  79 -12.540  -7.457  -8.674
  646    H    HIS  80           H        HIS  80  -5.375  -8.754  -6.495
  647    HA   HIS  80           HA       HIS  80  -6.823 -10.043  -8.744
  648   1HB   HIS  80          1HB       HIS  80  -4.567  -9.209  -9.434
  649   2HB   HIS  80          2HB       HIS  80  -3.844 -10.320  -8.261
  650    HD1  HIS  80           HD1      HIS  80  -4.997 -13.031  -8.774
  651    HD2  HIS  80           HD2      HIS  80  -4.657 -10.147 -11.822
  652    HE1  HIS  80           HE1      HIS  80  -5.161 -14.284 -10.992
  653    HA   PRO  81           HA       PRO  81  -7.072 -12.847  -5.158
  654   1HB   PRO  81          1HB       PRO  81  -9.059 -14.487  -5.987
  655   2HB   PRO  81          2HB       PRO  81  -9.362 -12.769  -5.597
  656   1HG   PRO  81          1HG       PRO  81  -8.867 -13.969  -8.339
  657   2HG   PRO  81          2HG       PRO  81 -10.224 -12.915  -7.847
  658   1HD   PRO  81          1HD       PRO  81  -7.962 -11.962  -9.055
  659   2HD   PRO  81          2HD       PRO  81  -8.831 -11.009  -7.813
  660    H    TYR  82           H        TYR  82  -6.852 -15.220  -4.837
  661    HA   TYR  82           HA       TYR  82  -5.922 -17.225  -5.088
  662   1HB   TYR  82          1HB       TYR  82  -5.489 -16.879  -8.060
  663   2HB   TYR  82          2HB       TYR  82  -5.745 -18.342  -7.132
  664    HD1  TYR  82           HD1      TYR  82  -7.210 -16.461  -9.556
  665    HD2  TYR  82           HD2      TYR  82  -8.183 -18.037  -5.658
  666    HE1  TYR  82           HE1      TYR  82  -9.612 -16.379 -10.122
  667    HE2  TYR  82           HE2      TYR  82 -10.592 -17.917  -6.217
  668    HH   TYR  82           HH       TYR  82 -11.747 -16.842  -9.436
  669    H    LYS  83           H        LYS  83  -4.211 -15.246  -7.522
  670    HA   LYS  83           HA       LYS  83  -1.666 -15.556  -6.017
  671   1HB   LYS  83          1HB       LYS  83  -0.467 -15.227  -8.074
  672   2HB   LYS  83          2HB       LYS  83  -1.537 -16.621  -8.153
  673   1HG   LYS  83          1HG       LYS  83  -2.098 -15.818 -10.174
  674   2HG   LYS  83          2HG       LYS  83  -3.202 -14.803  -9.266
  675   1HD   LYS  83          1HD       LYS  83  -2.123 -13.317 -10.734
  676   2HD   LYS  83          2HD       LYS  83  -1.254 -13.054  -9.214
  677   1HE   LYS  83          1HE       LYS  83   0.546 -14.610 -10.017
  678   2HE   LYS  83          2HE       LYS  83  -0.357 -14.842 -11.525
  679   1HZ   LYS  83          1HZ       LYS  83  -0.122 -12.508 -11.950
  680   2HZ   LYS  83          2HZ       LYS  83   0.727 -12.299 -10.550
  681   3HZ   LYS  83          3HZ       LYS  83   1.352 -13.221 -11.765
  682    HA   PRO  84           HA       PRO  84  -2.693 -11.270  -5.322
  683   1HB   PRO  84          1HB       PRO  84  -0.628 -10.456  -3.784
  684   2HB   PRO  84          2HB       PRO  84  -1.765 -11.711  -3.225
  685   1HG   PRO  84          1HG       PRO  84   0.931 -12.169  -4.528
  686   2HG   PRO  84          2HG       PRO  84   0.330 -12.857  -2.989
  687   1HD   PRO  84          1HD       PRO  84   0.142 -14.227  -5.335
  688   2HD   PRO  84          2HD       PRO  84  -1.170 -14.298  -4.117
  689    H    LYS  85           H        LYS  85  -2.182  -9.195  -6.014
  690    HA   LYS  85           HA       LYS  85   0.329  -8.643  -7.450
  691   1HB   LYS  85          1HB       LYS  85  -2.465  -8.408  -8.636
  692   2HB   LYS  85          2HB       LYS  85  -1.156  -7.373  -9.185
  693   1HG   LYS  85          1HG       LYS  85  -0.874 -10.395  -9.196
  694   2HG   LYS  85          2HG       LYS  85  -1.626  -9.534 -10.534
  695   1HD   LYS  85          1HD       LYS  85   1.080  -8.606  -9.541
  696   2HD   LYS  85          2HD       LYS  85   0.981 -10.030 -10.579
  697   1HE   LYS  85          1HE       LYS  85   0.078  -8.836 -12.397
  698   2HE   LYS  85          2HE       LYS  85  -0.427  -7.471 -11.395
  699   1HZ   LYS  85          1HZ       LYS  85   2.373  -8.176 -11.913
  700   2HZ   LYS  85          2HZ       LYS  85   1.525  -6.997 -12.693
  701   3HZ   LYS  85          3HZ       LYS  85   1.806  -6.865 -11.079
  702    H    LEU  86           H        LEU  86  -2.883  -7.230  -6.714
  703    HA   LEU  86           HA       LEU  86  -3.518  -5.241  -5.862
  704   1HB   LEU  86          1HB       LEU  86  -1.090  -5.440  -4.049
  705   2HB   LEU  86          2HB       LEU  86  -2.622  -4.609  -3.761
  706    HG   LEU  86           HG       LEU  86  -2.143  -7.618  -3.853
  707   1HD1  LEU  86          1HD1      LEU  86  -2.955  -5.680  -1.648
  708   2HD1  LEU  86          2HD1      LEU  86  -2.813  -7.441  -1.461
  709   3HD1  LEU  86          3HD1      LEU  86  -1.376  -6.475  -1.830
  710   1HD2  LEU  86          1HD2      LEU  86  -4.748  -6.061  -3.518
  711   2HD2  LEU  86          2HD2      LEU  86  -4.345  -7.239  -4.795
  712   3HD2  LEU  86          3HD2      LEU  86  -4.545  -7.784  -3.127
  713    H    GLN  87           H        GLN  87  -2.738  -4.560  -8.120
  714    HA   GLN  87           HA       GLN  87  -0.269  -3.225  -8.486
  715   1HB   GLN  87          1HB       GLN  87  -2.941  -2.961  -9.935
  716   2HB   GLN  87          2HB       GLN  87  -1.431  -2.239 -10.507
  717   1HG   GLN  87          1HG       GLN  87  -1.907  -5.222 -10.078
  718   2HG   GLN  87          2HG       GLN  87  -1.939  -4.378 -11.628
  719   1HE2  GLN  87          2HE2      GLN  87   0.110  -3.104 -12.198
  720   2HE2  GLN  87          1HE2      GLN  87   1.642  -3.838 -11.779
  721    H    HIS  88           H        HIS  88  -3.541  -1.829  -7.952
  722    HA   HIS  88           HA       HIS  88  -2.452   0.310  -6.327
  723   1HB   HIS  88          1HB       HIS  88  -2.101   1.116  -8.704
  724   2HB   HIS  88          2HB       HIS  88  -3.851   1.021  -8.941
  725    HD1  HIS  88           HD1      HIS  88  -5.277   3.026  -7.855
  726    HD2  HIS  88           HD2      HIS  88  -1.176   2.937  -6.869
  727    HE1  HIS  88           HE1      HIS  88  -4.778   5.167  -6.582
  728    H    ILE  89           H        ILE  89  -4.202   1.451  -5.224
  729    HA   ILE  89           HA       ILE  89  -6.921   0.281  -5.572
  730    HB   ILE  89           HB       ILE  89  -5.566   0.778  -2.900
  731   1HG1  ILE  89          1HG1      ILE  89  -4.630  -1.255  -3.991
  732   2HG1  ILE  89          2HG1      ILE  89  -5.491  -1.554  -2.488
  733   1HG2  ILE  89          1HG2      ILE  89  -8.317  -0.281  -3.665
  734   2HG2  ILE  89          2HG2      ILE  89  -7.630  -0.387  -2.037
  735   3HG2  ILE  89          3HG2      ILE  89  -7.940   1.195  -2.773
  736   1HD1  ILE  89          1HD1      ILE  89  -6.686  -2.029  -5.251
  737   2HD1  ILE  89          2HD1      ILE  89  -5.928  -3.260  -4.227
  738   3HD1  ILE  89          3HD1      ILE  89  -7.398  -2.443  -3.684
  739    H    ASP  90           H        ASP  90  -8.241   1.865  -6.083
  740    HA   ASP  90           HA       ASP  90  -7.689   4.663  -5.183
  741   1HB   ASP  90          1HB       ASP  90  -9.438   3.587  -7.410
  742   2HB   ASP  90          2HB       ASP  90  -9.250   5.288  -6.972
  743    H    PHE  91           H        PHE  91  -8.425   4.326  -3.054
  744    HA   PHE  91           HA       PHE  91 -10.995   3.169  -2.439
  745   1HB   PHE  91          1HB       PHE  91  -9.225   5.002  -0.797
  746   2HB   PHE  91          2HB       PHE  91 -10.589   4.081  -0.196
  747    HD1  PHE  91           HD1      PHE  91  -7.032   3.998  -0.997
  748    HD2  PHE  91           HD2      PHE  91 -10.492   1.583  -0.085
  749    HE1  PHE  91           HE1      PHE  91  -5.567   2.219  -0.094
  750    HE2  PHE  91           HE2      PHE  91  -9.014  -0.179   0.820
  751    HZ   PHE  91           HZ       PHE  91  -6.557   0.141   0.851
  752    H    VAL  92           H        VAL  92 -12.792   4.354  -1.472
  753    HA   VAL  92           HA       VAL  92 -13.106   7.192  -2.241
  754    HB   VAL  92           HB       VAL  92 -15.048   4.975  -3.042
  755   1HG1  VAL  92          1HG1      VAL  92 -15.111   7.992  -3.506
  756   2HG1  VAL  92          2HG1      VAL  92 -16.250   6.819  -4.200
  757   3HG1  VAL  92          3HG1      VAL  92 -16.210   7.072  -2.453
  758   1HG2  VAL  92          1HG2      VAL  92 -13.198   6.697  -4.747
  759   2HG2  VAL  92          2HG2      VAL  92 -13.154   4.927  -4.578
  760   3HG2  VAL  92          3HG2      VAL  92 -14.517   5.705  -5.384
  761    H    ARG  93           H        ARG  93 -14.120   8.252  -0.613
  762    HA   ARG  93           HA       ARG  93 -14.581   7.338   1.920
  763   1HB   ARG  93          1HB       ARG  93 -15.875   9.544   0.301
  764   2HB   ARG  93          2HB       ARG  93 -16.347   9.289   1.977
  765   1HG   ARG  93          1HG       ARG  93 -13.430   9.687   1.204
  766   2HG   ARG  93          2HG       ARG  93 -14.545  11.030   1.520
  767   1HD   ARG  93          1HD       ARG  93 -15.062  10.074   3.753
  768   2HD   ARG  93          2HD       ARG  93 -13.805   8.841   3.500
  769    HE   ARG  93           HE       ARG  93 -12.485  11.187   3.002
  770   1HH1  ARG  93          1HH2      ARG  93 -14.387  10.012   5.764
  771   2HH1  ARG  93          2HH2      ARG  93 -13.532  10.992   6.928
  772   1HH2  ARG  93          1HH1      ARG  93 -11.366  12.454   4.541
  773   2HH2  ARG  93          2HH1      ARG  93 -11.800  12.376   6.230
  774    H    ALA  94           H        ALA  94 -16.170   6.390   3.110
  775    HA   ALA  94           HA       ALA  94 -18.188   4.816   1.790
  776   1HB   ALA  94          1HB       ALA  94 -17.084   4.095   3.875
  777   2HB   ALA  94          2HB       ALA  94 -17.775   5.488   4.734
  778   3HB   ALA  94          3HB       ALA  94 -18.839   4.215   4.098
  Start of MODEL    2
    1    H    MET   1           H        MET   1 -15.507  -1.725   7.641
    2    HA   MET   1           HA       MET   1 -14.983  -2.107  10.489
    3   1HB   MET   1          1HB       MET   1 -15.780  -3.886   8.172
    4   2HB   MET   1          2HB       MET   1 -15.182  -4.589   9.675
    5   1HG   MET   1          1HG       MET   1 -17.561  -4.568   9.646
    6   2HG   MET   1          2HG       MET   1 -16.957  -3.598  10.980
    7   1HE   MET   1          1HE       MET   1 -17.879  -1.275  11.539
    8   2HE   MET   1          2HE       MET   1 -16.737  -0.614  10.350
    9   3HE   MET   1          3HE       MET   1 -18.429  -0.108  10.321
   10    H    PHE   2           H        PHE   2 -13.386  -3.270   7.448
   11    HA   PHE   2           HA       PHE   2 -11.166  -4.442   8.757
   12   1HB   PHE   2          1HB       PHE   2 -11.294  -3.222   5.979
   13   2HB   PHE   2          2HB       PHE   2 -10.021  -4.263   6.585
   14    HD1  PHE   2           HD1      PHE   2 -13.553  -4.182   5.421
   15    HD2  PHE   2           HD2      PHE   2 -10.283  -6.663   6.758
   16    HE1  PHE   2           HE1      PHE   2 -14.514  -6.110   4.219
   17    HE2  PHE   2           HE2      PHE   2 -11.329  -8.618   5.648
   18    HZ   PHE   2           HZ       PHE   2 -13.437  -8.340   4.359
   19    H    THR   3           H        THR   3  -9.509  -3.530   9.837
   20    HA   THR   3           HA       THR   3  -9.085  -0.639   9.827
   21    HB   THR   3           HB       THR   3  -7.664  -2.851  11.366
   22    HG1  THR   3           HG1      THR   3  -9.951  -1.301  11.979
   23   1HG2  THR   3          1HG2      THR   3  -6.469  -0.650  11.373
   24   2HG2  THR   3          2HG2      THR   3  -7.969   0.138  11.913
   25   3HG2  THR   3          3HG2      THR   3  -7.154  -1.040  12.960
   26    H    ILE   4           H        ILE   4  -8.224  -0.194   7.738
   27    HA   ILE   4           HA       ILE   4  -5.852  -1.669   6.812
   28    HB   ILE   4           HB       ILE   4  -7.072   0.765   5.507
   29   1HG1  ILE   4          1HG1      ILE   4  -8.959  -0.652   5.732
   30   2HG1  ILE   4          2HG1      ILE   4  -8.387  -0.695   4.071
   31   1HG2  ILE   4          1HG2      ILE   4  -4.871   0.107   4.702
   32   2HG2  ILE   4          2HG2      ILE   4  -5.438  -1.551   4.434
   33   3HG2  ILE   4          3HG2      ILE   4  -6.108  -0.212   3.478
   34   1HD1  ILE   4          1HD1      ILE   4  -7.318  -2.902   4.482
   35   2HD1  ILE   4          2HD1      ILE   4  -7.900  -2.856   6.166
   36   3HD1  ILE   4          3HD1      ILE   4  -9.056  -2.905   4.829
   37    H    ASN   5           H        ASN   5  -4.248  -1.189   8.356
   38    HA   ASN   5           HA       ASN   5  -3.626   1.463   9.242
   39   1HB   ASN   5          1HB       ASN   5  -1.961  -1.073   9.131
   40   2HB   ASN   5          2HB       ASN   5  -1.452   0.424   9.929
   41   1HD2  ASN   5          2HD2      ASN   5  -2.834   1.269  11.716
   42   2HD2  ASN   5          1HD2      ASN   5  -3.731   0.122  12.687
   43    H    ALA   6           H        ALA   6  -2.596   3.103   8.227
   44    HA   ALA   6           HA       ALA   6  -0.775   2.580   5.960
   45   1HB   ALA   6          1HB       ALA   6  -3.057   2.741   4.971
   46   2HB   ALA   6          2HB       ALA   6  -3.276   4.311   5.773
   47   3HB   ALA   6          3HB       ALA   6  -2.037   4.122   4.513
   48    H    GLU   7           H        GLU   7   0.211   4.619   5.205
   49    HA   GLU   7           HA       GLU   7   0.713   6.539   7.452
   50   1HB   GLU   7          1HB       GLU   7   2.665   5.362   5.436
   51   2HB   GLU   7          2HB       GLU   7   3.066   6.526   6.703
   52   1HG   GLU   7          1HG       GLU   7   1.959   3.734   7.315
   53   2HG   GLU   7          2HG       GLU   7   3.662   4.086   7.119
   54    H    VAL   8           H        VAL   8   1.614   8.591   6.675
   55    HA   VAL   8           HA       VAL   8   0.030   9.632   4.470
   56    HB   VAL   8           HB       VAL   8   0.956  11.814   5.194
   57   1HG1  VAL   8          1HG1      VAL   8  -1.137  10.915   6.119
   58   2HG1  VAL   8          2HG1      VAL   8  -0.234  10.114   7.424
   59   3HG1  VAL   8          3HG1      VAL   8  -0.259  11.885   7.313
   60   1HG2  VAL   8          1HG2      VAL   8   3.171  11.007   6.137
   61   2HG2  VAL   8          2HG2      VAL   8   2.241  12.036   7.233
   62   3HG2  VAL   8          3HG2      VAL   8   2.278  10.288   7.490
   63    H    ARG   9           H        ARG   9   1.431   7.914   3.194
   64    HA   ARG   9           HA       ARG   9   2.798   7.464   1.550
   65   1HB   ARG   9          1HB       ARG   9   1.431   9.688   0.877
   66   2HB   ARG   9          2HB       ARG   9   3.050  10.299   0.606
   67   1HG   ARG   9          1HG       ARG   9   1.731   7.817  -0.601
   68   2HG   ARG   9          2HG       ARG   9   2.091   9.335  -1.429
   69   1HD   ARG   9          1HD       ARG   9   4.141   7.357  -0.354
   70   2HD   ARG   9          2HD       ARG   9   3.684   7.547  -2.033
   71    HE   ARG   9           HE       ARG   9   5.327   9.340  -0.362
   72   1HH1  ARG   9          1HH2      ARG   9   3.616   9.044  -3.463
   73   2HH1  ARG   9          2HH2      ARG   9   4.648  10.193  -4.277
   74   1HH2  ARG   9          1HH1      ARG   9   6.735  10.731  -1.476
   75   2HH2  ARG   9          2HH1      ARG   9   6.404  11.199  -3.124
   76    H    LYS  10           H        LYS  10   4.236   7.417   3.790
   77    HA   LYS  10           HA       LYS  10   6.429   9.258   3.858
   78   1HB   LYS  10          1HB       LYS  10   7.219   8.056   5.714
   79   2HB   LYS  10          2HB       LYS  10   5.458   8.103   5.830
   80   1HG   LYS  10          1HG       LYS  10   5.386   5.743   4.959
   81   2HG   LYS  10          2HG       LYS  10   7.164   5.732   4.918
   82   1HD   LYS  10          1HD       LYS  10   7.169   6.306   7.381
   83   2HD   LYS  10          2HD       LYS  10   5.407   6.109   7.368
   84   1HE   LYS  10          1HE       LYS  10   5.794   3.738   6.483
   85   2HE   LYS  10          2HE       LYS  10   7.523   3.988   6.772
   86   1HZ   LYS  10          1HZ       LYS  10   5.420   4.202   8.814
   87   2HZ   LYS  10          2HZ       LYS  10   6.409   2.898   8.597
   88   3HZ   LYS  10          3HZ       LYS  10   7.039   4.349   9.073
   89    H    GLU  11           H        GLU  11   5.964   6.158   2.321
   90    HA   GLU  11           HA       GLU  11   7.105   4.905   0.906
   91   1HB   GLU  11          1HB       GLU  11   9.072   7.214   0.612
   92   2HB   GLU  11          2HB       GLU  11   8.933   5.806  -0.434
   93   1HG   GLU  11          1HG       GLU  11   6.478   6.429  -0.793
   94   2HG   GLU  11          2HG       GLU  11   6.827   7.937   0.069
   95    H    GLN  12           H        GLN  12   9.785   6.558   2.606
   96    HA   GLN  12           HA       GLN  12  10.235   4.250   4.299
   97   1HB   GLN  12          1HB       GLN  12  11.511   3.686   2.180
   98   2HB   GLN  12          2HB       GLN  12  12.508   5.119   2.465
   99   1HG   GLN  12          1HG       GLN  12  13.239   4.162   4.640
  100   2HG   GLN  12          2HG       GLN  12  12.161   2.778   4.383
  101   1HE2  GLN  12          2HE2      GLN  12  14.181   1.502   4.686
  102   2HE2  GLN  12          1HE2      GLN  12  15.221   1.255   3.299
  103    H    GLY  13           H        GLY  13   9.279   6.182   5.399
  104   1HA   GLY  13          1HA       GLY  13   9.618   7.625   7.145
  105   2HA   GLY  13          2HA       GLY  13  11.360   7.635   6.846
  106    H    LYS  14           H        LYS  14  11.976   8.738   4.665
  107    HA   LYS  14           HA       LYS  14  10.523  11.354   4.547
  108   1HB   LYS  14          1HB       LYS  14  12.658  11.219   5.893
  109   2HB   LYS  14          2HB       LYS  14  13.525  10.934   4.377
  110   1HG   LYS  14          1HG       LYS  14  12.674  13.138   3.527
  111   2HG   LYS  14          2HG       LYS  14  11.760  13.346   5.033
  112   1HD   LYS  14          1HD       LYS  14  13.879  13.313   6.323
  113   2HD   LYS  14          2HD       LYS  14  14.794  13.085   4.816
  114   1HE   LYS  14          1HE       LYS  14  13.948  15.263   3.971
  115   2HE   LYS  14          2HE       LYS  14  13.014  15.484   5.466
  116   1HZ   LYS  14          1HZ       LYS  14  15.937  15.276   5.289
  117   2HZ   LYS  14          2HZ       LYS  14  15.069  16.659   5.516
  118   3HZ   LYS  14          3HZ       LYS  14  15.068  15.486   6.674
  119    H    GLY  15           H        GLY  15   9.564   9.700   2.772
  120   1HA   GLY  15          1HA       GLY  15   8.998   9.637   0.599
  121   2HA   GLY  15          2HA       GLY  15   9.705  11.251   0.509
  122    H    ALA  16           H        ALA  16  11.319   8.059   0.985
  123    HA   ALA  16           HA       ALA  16  13.172   8.658  -1.249
  124   1HB   ALA  16          1HB       ALA  16  14.109   7.946   0.883
  125   2HB   ALA  16          2HB       ALA  16  13.172   6.441   0.814
  126   3HB   ALA  16          3HB       ALA  16  14.433   6.757  -0.395
  127    H    SER  17           H        SER  17  11.588   8.448  -2.938
  128    HA   SER  17           HA       SER  17  10.125   5.983  -3.309
  129   1HB   SER  17          1HB       SER  17   9.527   8.447  -4.005
  130   2HB   SER  17          2HB       SER  17  10.493   8.119  -5.435
  131    HG   SER  17           HG       SER  17   8.188   6.797  -4.467
  132    H    ARG  18           H        ARG  18  12.667   5.070  -3.110
  133    HA   ARG  18           HA       ARG  18  13.366   4.173  -5.859
  134   1HB   ARG  18          1HB       ARG  18  15.408   5.255  -3.847
  135   2HB   ARG  18          2HB       ARG  18  15.744   4.489  -5.403
  136   1HG   ARG  18          1HG       ARG  18  15.951   6.668  -6.006
  137   2HG   ARG  18          2HG       ARG  18  14.271   6.361  -6.433
  138   1HD   ARG  18          1HD       ARG  18  14.147   7.256  -3.744
  139   2HD   ARG  18          2HD       ARG  18  15.492   8.176  -4.428
  140    HE   ARG  18           HE       ARG  18  13.223   8.200  -6.201
  141   1HH1  ARG  18          1HH2      ARG  18  14.370   9.634  -3.160
  142   2HH1  ARG  18          2HH2      ARG  18  13.339  11.034  -3.285
  143   1HH2  ARG  18          1HH1      ARG  18  11.926  10.068  -6.383
  144   2HH2  ARG  18          2HH1      ARG  18  11.955  11.292  -5.141
  145    H    ARG  19           H        ARG  19  11.834   2.677  -4.168
  146    HA   ARG  19           HA       ARG  19  13.476   0.355  -4.004
  147   1HB   ARG  19          1HB       ARG  19  13.805   1.794  -1.696
  148   2HB   ARG  19          2HB       ARG  19  12.314   0.964  -1.286
  149   1HG   ARG  19          1HG       ARG  19  14.054  -0.416  -0.477
  150   2HG   ARG  19          2HG       ARG  19  13.512  -1.223  -1.961
  151   1HD   ARG  19          1HD       ARG  19  15.431  -0.150  -3.186
  152   2HD   ARG  19          2HD       ARG  19  15.917   0.647  -1.677
  153    HE   ARG  19           HE       ARG  19  15.776  -2.124  -1.174
  154   1HH1  ARG  19          1HH2      ARG  19  17.674   0.121  -3.165
  155   2HH1  ARG  19          2HH2      ARG  19  19.097  -0.888  -3.178
  156   1HH2  ARG  19          1HH1      ARG  19  17.657  -3.444  -1.199
  157   2HH2  ARG  19          2HH1      ARG  19  19.086  -2.923  -2.053
  158    H    LEU  20           H        LEU  20  10.455   1.812  -2.740
  159    HA   LEU  20           HA       LEU  20   9.048  -0.623  -2.625
  160   1HB   LEU  20          1HB       LEU  20   7.103   0.734  -2.141
  161   2HB   LEU  20          2HB       LEU  20   8.527   1.358  -1.315
  162    HG   LEU  20           HG       LEU  20   8.609   2.855  -3.645
  163   1HD1  LEU  20          1HD1      LEU  20   6.417   1.930  -4.440
  164   2HD1  LEU  20          2HD1      LEU  20   5.661   2.496  -2.936
  165   3HD1  LEU  20          3HD1      LEU  20   6.330   3.664  -4.094
  166   1HD2  LEU  20          1HD2      LEU  20   7.072   3.501  -1.106
  167   2HD2  LEU  20          2HD2      LEU  20   8.823   3.692  -1.358
  168   3HD2  LEU  20          3HD2      LEU  20   7.678   4.672  -2.298
  169    H    ARG  21           H        ARG  21   9.745   1.329  -5.394
  170    HA   ARG  21           HA       ARG  21   7.438   0.590  -6.982
  171   1HB   ARG  21          1HB       ARG  21  10.148   1.711  -7.808
  172   2HB   ARG  21          2HB       ARG  21   8.683   1.628  -8.803
  173   1HG   ARG  21          1HG       ARG  21   7.531   3.108  -7.101
  174   2HG   ARG  21          2HG       ARG  21   9.099   3.299  -6.284
  175   1HD   ARG  21          1HD       ARG  21  10.068   4.147  -8.440
  176   2HD   ARG  21          2HD       ARG  21   8.446   4.029  -9.161
  177    HE   ARG  21           HE       ARG  21   8.701   5.638  -6.692
  178   1HH1  ARG  21          1HH2      ARG  21   8.687   5.751 -10.255
  179   2HH1  ARG  21          2HH2      ARG  21   8.293   7.449 -10.304
  180   1HH2  ARG  21          1HH1      ARG  21   8.215   7.811  -6.786
  181   2HH2  ARG  21          2HH1      ARG  21   8.007   8.640  -8.317
  182    H    ALA  22           H        ALA  22   7.766  -1.754  -6.235
  183    HA   ALA  22           HA       ALA  22   8.856  -3.350  -8.389
  184   1HB   ALA  22          1HB       ALA  22  10.243  -3.396  -5.666
  185   2HB   ALA  22          2HB       ALA  22  10.457  -4.610  -6.946
  186   3HB   ALA  22          3HB       ALA  22  10.973  -2.938  -7.216
  187    H    ALA  23           H        ALA  23   8.161  -3.595  -4.858
  188    HA   ALA  23           HA       ALA  23   5.758  -5.155  -5.184
  189   1HB   ALA  23          1HB       ALA  23   8.308  -6.630  -4.383
  190   2HB   ALA  23          2HB       ALA  23   6.657  -7.273  -4.254
  191   3HB   ALA  23          3HB       ALA  23   7.347  -6.927  -5.847
  192    H    ASN  24           H        ASN  24   8.577  -4.425  -3.101
  193    HA   ASN  24           HA       ASN  24   7.307  -4.913  -0.602
  194   1HB   ASN  24          1HB       ASN  24   9.730  -3.215  -1.331
  195   2HB   ASN  24          2HB       ASN  24   9.278  -3.698   0.313
  196   1HD2  ASN  24          2HD2      ASN  24  11.784  -4.324  -0.533
  197   2HD2  ASN  24          1HD2      ASN  24  11.915  -6.044  -0.830
  198    H    LYS  25           H        LYS  25   5.331  -3.863  -0.578
  199    HA   LYS  25           HA       LYS  25   3.840  -2.288  -0.099
  200   1HB   LYS  25          1HB       LYS  25   6.055  -0.201   0.207
  201   2HB   LYS  25          2HB       LYS  25   4.375  -0.056   0.671
  202   1HG   LYS  25          1HG       LYS  25   4.855  -0.822   2.685
  203   2HG   LYS  25          2HG       LYS  25   5.241  -2.406   1.993
  204   1HD   LYS  25          1HD       LYS  25   7.594  -1.700   1.676
  205   2HD   LYS  25          2HD       LYS  25   7.206  -0.101   2.348
  206   1HE   LYS  25          1HE       LYS  25   6.551  -1.142   4.489
  207   2HE   LYS  25          2HE       LYS  25   6.866  -2.757   3.823
  208   1HZ   LYS  25          1HZ       LYS  25   8.865  -0.641   4.177
  209   2HZ   LYS  25          2HZ       LYS  25   8.668  -1.974   5.132
  210   3HZ   LYS  25          3HZ       LYS  25   9.147  -2.148   3.563
  211    H    PHE  26           H        PHE  26   2.796  -0.328  -1.065
  212    HA   PHE  26           HA       PHE  26   3.800   0.602  -3.617
  213   1HB   PHE  26          1HB       PHE  26   1.972  -0.283  -4.972
  214   2HB   PHE  26          2HB       PHE  26   2.869  -1.601  -4.250
  215    HD1  PHE  26           HD1      PHE  26  -0.311   0.249  -4.289
  216    HD2  PHE  26           HD2      PHE  26   1.812  -3.067  -2.560
  217    HE1  PHE  26           HE1      PHE  26  -2.388  -0.482  -3.168
  218    HE2  PHE  26           HE2      PHE  26  -0.319  -3.922  -1.609
  219    HZ   PHE  26           HZ       PHE  26  -2.400  -2.574  -1.819
  220    HA   PRO  27           HA       PRO  27   1.216   3.910  -2.178
  221   1HB   PRO  27          1HB       PRO  27   0.902   5.479  -4.374
  222   2HB   PRO  27          2HB       PRO  27   2.497   5.216  -3.608
  223   1HG   PRO  27          1HG       PRO  27   1.347   3.756  -6.008
  224   2HG   PRO  27          2HG       PRO  27   2.950   4.532  -5.868
  225   1HD   PRO  27          1HD       PRO  27   2.594   1.863  -5.444
  226   2HD   PRO  27          2HD       PRO  27   3.761   2.810  -4.477
  227    H    ALA  28           H        ALA  28  -0.971   4.305  -1.909
  228    HA   ALA  28           HA       ALA  28  -2.916   3.459  -4.006
  229   1HB   ALA  28          1HB       ALA  28  -2.951   1.761  -2.192
  230   2HB   ALA  28          2HB       ALA  28  -3.245   3.058  -1.010
  231   3HB   ALA  28          3HB       ALA  28  -4.453   2.705  -2.260
  232    H    ILE  29           H        ILE  29  -4.943   4.717  -3.821
  233    HA   ILE  29           HA       ILE  29  -4.448   7.452  -2.732
  234    HB   ILE  29           HB       ILE  29  -5.460   6.637  -5.472
  235   1HG1  ILE  29          1HG1      ILE  29  -2.984   8.210  -4.595
  236   2HG1  ILE  29          2HG1      ILE  29  -2.976   6.539  -5.158
  237   1HG2  ILE  29          1HG2      ILE  29  -6.717   8.614  -4.630
  238   2HG2  ILE  29          2HG2      ILE  29  -5.176   9.441  -4.322
  239   3HG2  ILE  29          3HG2      ILE  29  -5.671   9.020  -5.973
  240   1HD1  ILE  29          1HD1      ILE  29  -3.935   7.339  -7.359
  241   2HD1  ILE  29          2HD1      ILE  29  -3.610   9.001  -6.807
  242   3HD1  ILE  29          3HD1      ILE  29  -2.278   7.854  -6.989
  243    H    ILE  30           H        ILE  30  -6.160   8.522  -1.890
  244    HA   ILE  30           HA       ILE  30  -8.786   7.109  -1.748
  245    HB   ILE  30           HB       ILE  30  -7.664   9.239   0.104
  246   1HG1  ILE  30          1HG1      ILE  30  -8.027   6.253   0.622
  247   2HG1  ILE  30          2HG1      ILE  30  -6.472   7.051   0.348
  248   1HG2  ILE  30          1HG2      ILE  30 -10.138   9.272  -0.129
  249   2HG2  ILE  30          2HG2      ILE  30 -10.199   7.543   0.269
  250   3HG2  ILE  30          3HG2      ILE  30  -9.670   8.738   1.472
  251   1HD1  ILE  30          1HD1      ILE  30  -6.874   8.503   2.341
  252   2HD1  ILE  30          2HD1      ILE  30  -8.325   7.539   2.710
  253   3HD1  ILE  30          3HD1      ILE  30  -6.740   6.775   2.709
  254    H    TYR  31           H        TYR  31 -10.265   7.917  -3.035
  255    HA   TYR  31           HA       TYR  31 -10.268  10.778  -3.868
  256   1HB   TYR  31          1HB       TYR  31 -11.756   8.311  -4.859
  257   2HB   TYR  31          2HB       TYR  31 -12.114   9.946  -5.381
  258    HD1  TYR  31           HD1      TYR  31  -9.308   7.427  -5.280
  259    HD2  TYR  31           HD2      TYR  31 -11.013  10.883  -7.230
  260    HE1  TYR  31           HE1      TYR  31  -7.545   7.331  -7.009
  261    HE2  TYR  31           HE2      TYR  31  -9.296  10.728  -8.999
  262    HH   TYR  31           HH       TYR  31  -7.421   9.629  -9.755
  263    H    GLY  32           H        GLY  32 -12.430  11.846  -3.767
  264   1HA   GLY  32          1HA       GLY  32 -14.585  10.780  -2.262
  265   2HA   GLY  32          2HA       GLY  32 -13.571  11.779  -1.194
  266    H    GLY  33           H        GLY  33 -16.341  12.210  -2.199
  267   1HA   GLY  33          1HA       GLY  33 -16.271  14.526  -3.979
  268   2HA   GLY  33          2HA       GLY  33 -17.656  13.861  -3.098
  269    H    LYS  34           H        LYS  34 -14.534  15.491  -2.480
  270    HA   LYS  34           HA       LYS  34 -15.729  17.494  -0.727
  271   1HB   LYS  34          1HB       LYS  34 -15.567  15.566   0.787
  272   2HB   LYS  34          2HB       LYS  34 -13.846  15.371   0.410
  273   1HG   LYS  34          1HG       LYS  34 -13.370  17.613   1.345
  274   2HG   LYS  34          2HG       LYS  34 -15.082  17.861   1.680
  275   1HD   LYS  34          1HD       LYS  34 -13.244  15.736   2.898
  276   2HD   LYS  34          2HD       LYS  34 -13.790  17.217   3.689
  277   1HE   LYS  34          1HE       LYS  34 -15.509  14.816   2.920
  278   2HE   LYS  34          2HE       LYS  34 -15.068  15.364   4.541
  279   1HZ   LYS  34          1HZ       LYS  34 -16.310  17.372   4.134
  280   2HZ   LYS  34          2HZ       LYS  34 -16.746  16.834   2.636
  281   3HZ   LYS  34          3HZ       LYS  34 -17.259  16.031   3.980
  282    H    GLU  35           H        GLU  35 -12.688  15.849  -1.754
  283    HA   GLU  35           HA       GLU  35 -11.439  18.449  -2.356
  284   1HB   GLU  35          1HB       GLU  35 -11.118  17.224   0.169
  285   2HB   GLU  35          2HB       GLU  35  -9.695  16.692  -0.725
  286   1HG   GLU  35          1HG       GLU  35  -9.171  19.069  -1.262
  287   2HG   GLU  35          2HG       GLU  35 -10.629  19.579  -0.389
  288    H    ALA  36           H        ALA  36  -9.125  18.008  -3.152
  289    HA   ALA  36           HA       ALA  36  -9.196  16.260  -5.393
  290   1HB   ALA  36          1HB       ALA  36  -7.806  18.288  -5.306
  291   2HB   ALA  36          2HB       ALA  36  -6.852  17.603  -3.971
  292   3HB   ALA  36          3HB       ALA  36  -6.778  16.869  -5.585
  293    HA   PRO  37           HA       PRO  37  -8.097  12.463  -3.441
  294   1HB   PRO  37          1HB       PRO  37  -6.703  11.101  -5.399
  295   2HB   PRO  37          2HB       PRO  37  -8.459  11.406  -5.460
  296   1HG   PRO  37          1HG       PRO  37  -6.250  13.031  -6.753
  297   2HG   PRO  37          2HG       PRO  37  -7.731  12.400  -7.530
  298   1HD   PRO  37          1HD       PRO  37  -7.609  14.942  -6.637
  299   2HD   PRO  37          2HD       PRO  37  -9.097  13.985  -6.382
  300    H    LEU  38           H        LEU  38  -6.379  11.423  -2.325
  301    HA   LEU  38           HA       LEU  38  -3.674  12.595  -2.580
  302   1HB   LEU  38          1HB       LEU  38  -3.445  12.907  -0.206
  303   2HB   LEU  38          2HB       LEU  38  -4.658  13.955  -0.915
  304    HG   LEU  38           HG       LEU  38  -5.223  13.252   1.299
  305   1HD1  LEU  38          1HD1      LEU  38  -7.044  13.728  -0.341
  306   2HD1  LEU  38          2HD1      LEU  38  -7.253  11.972  -0.553
  307   3HD1  LEU  38          3HD1      LEU  38  -7.513  12.708   1.030
  308   1HD2  LEU  38          1HD2      LEU  38  -4.154  10.973   1.252
  309   2HD2  LEU  38          2HD2      LEU  38  -5.746  11.073   2.031
  310   3HD2  LEU  38          3HD2      LEU  38  -5.611  10.386   0.414
  311    H    ALA  39           H        ALA  39  -1.981  11.385  -1.660
  312    HA   ALA  39           HA       ALA  39  -2.485   8.511  -2.120
  313   1HB   ALA  39          1HB       ALA  39  -1.005   9.667  -3.675
  314   2HB   ALA  39          2HB       ALA  39   0.035  10.183  -2.331
  315   3HB   ALA  39          3HB       ALA  39  -0.109   8.456  -2.737
  316    H    ILE  40           H        ILE  40  -1.370   6.913  -0.934
  317    HA   ILE  40           HA       ILE  40  -0.093   7.552   1.635
  318    HB   ILE  40           HB       ILE  40  -1.623   5.888   2.765
  319   1HG1  ILE  40          1HG1      ILE  40  -3.510   6.382   0.415
  320   2HG1  ILE  40          2HG1      ILE  40  -2.540   4.912   0.603
  321   1HG2  ILE  40          1HG2      ILE  40  -1.813   8.405   3.002
  322   2HG2  ILE  40          2HG2      ILE  40  -3.133   8.352   1.813
  323   3HG2  ILE  40          3HG2      ILE  40  -3.283   7.503   3.357
  324   1HD1  ILE  40          1HD1      ILE  40  -3.645   4.441   2.757
  325   2HD1  ILE  40          2HD1      ILE  40  -4.654   5.887   2.546
  326   3HD1  ILE  40          3HD1      ILE  40  -4.792   4.538   1.407
  327    H    GLU  41           H        GLU  41   0.970   5.642   2.559
  328    HA   GLU  41           HA       GLU  41   1.816   3.670   0.507
  329   1HB   GLU  41          1HB       GLU  41   2.734   4.318   3.334
  330   2HB   GLU  41          2HB       GLU  41   3.194   2.819   2.529
  331   1HG   GLU  41          1HG       GLU  41   3.874   5.597   1.532
  332   2HG   GLU  41          2HG       GLU  41   4.949   4.436   2.323
  333    H    LEU  42           H        LEU  42   1.006   1.691   0.382
  334    HA   LEU  42           HA       LEU  42  -0.298   0.432   2.757
  335   1HB   LEU  42          1HB       LEU  42  -1.229   0.668  -0.078
  336   2HB   LEU  42          2HB       LEU  42  -1.191  -0.975   0.557
  337    HG   LEU  42           HG       LEU  42  -2.546  -0.305   2.505
  338   1HD1  LEU  42          1HD1      LEU  42  -2.675   2.387   1.097
  339   2HD1  LEU  42          2HD1      LEU  42  -3.833   1.857   2.336
  340   3HD1  LEU  42          3HD1      LEU  42  -2.129   2.048   2.749
  341   1HD2  LEU  42          1HD2      LEU  42  -3.513  -1.241   0.370
  342   2HD2  LEU  42          2HD2      LEU  42  -4.624  -0.233   1.306
  343   3HD2  LEU  42          3HD2      LEU  42  -3.842   0.426  -0.152
  344    H    ASP  43           H        ASP  43   0.566  -1.507   3.327
  345    HA   ASP  43           HA       ASP  43   2.990  -2.478   2.075
  346   1HB   ASP  43          1HB       ASP  43   1.170  -3.658   4.204
  347   2HB   ASP  43          2HB       ASP  43   2.720  -4.352   3.716
  348    H    HIS  44           H        HIS  44   3.019  -4.993   1.627
  349    HA   HIS  44           HA       HIS  44   0.681  -5.773  -0.073
  350   1HB   HIS  44          1HB       HIS  44   2.664  -4.926  -1.366
  351   2HB   HIS  44          2HB       HIS  44   3.602  -6.278  -0.738
  352    HD1  HIS  44           HD1      HIS  44   1.960  -8.752  -1.236
  353    HD2  HIS  44           HD2      HIS  44   1.865  -5.405  -3.783
  354    HE1  HIS  44           HE1      HIS  44   1.107  -9.577  -3.507
  355    H    ASP  45           H        ASP  45   0.338  -6.550   2.320
  356    HA   ASP  45           HA       ASP  45   0.750  -9.417   2.303
  357   1HB   ASP  45          1HB       ASP  45   2.911  -8.874   3.243
  358   2HB   ASP  45          2HB       ASP  45   2.203  -7.704   4.363
  359    H    LYS  46           H        LYS  46   0.276  -6.988   4.924
  360    HA   LYS  46           HA       LYS  46  -1.854  -8.314   6.140
  361   1HB   LYS  46          1HB       LYS  46  -2.183  -6.306   7.409
  362   2HB   LYS  46          2HB       LYS  46  -0.453  -6.526   7.124
  363   1HG   LYS  46          1HG       LYS  46  -0.764  -4.899   5.114
  364   2HG   LYS  46          2HG       LYS  46  -2.343  -4.529   5.848
  365   1HD   LYS  46          1HD       LYS  46  -1.044  -3.993   7.995
  366   2HD   LYS  46          2HD       LYS  46   0.435  -4.118   7.011
  367   1HE   LYS  46          1HE       LYS  46  -0.662  -2.418   5.408
  368   2HE   LYS  46          2HE       LYS  46  -1.903  -2.197   6.654
  369   1HZ   LYS  46          1HZ       LYS  46  -0.030  -1.617   8.153
  370   2HZ   LYS  46          2HZ       LYS  46   0.966  -1.626   6.827
  371   3HZ   LYS  46          3HZ       LYS  46  -0.297  -0.566   6.907
  372    H    VAL  47           H        VAL  47  -1.911  -5.794   3.611
  373    HA   VAL  47           HA       VAL  47  -4.742  -5.525   3.490
  374    HB   VAL  47           HB       VAL  47  -4.354  -4.278   1.457
  375   1HG1  VAL  47          1HG1      VAL  47  -3.907  -3.240   3.696
  376   2HG1  VAL  47          2HG1      VAL  47  -2.179  -3.616   3.490
  377   3HG1  VAL  47          3HG1      VAL  47  -2.985  -2.522   2.363
  378   1HG2  VAL  47          1HG2      VAL  47  -2.589  -5.668   0.411
  379   2HG2  VAL  47          2HG2      VAL  47  -2.124  -3.970   0.514
  380   3HG2  VAL  47          3HG2      VAL  47  -1.442  -5.158   1.655
  381    H    MET  48           H        MET  48  -2.483  -7.792   1.933
  382    HA   MET  48           HA       MET  48  -4.195  -8.656  -0.169
  383   1HB   MET  48          1HB       MET  48  -1.776  -9.083  -0.140
  384   2HB   MET  48          2HB       MET  48  -1.941 -10.100   1.289
  385   1HG   MET  48          1HG       MET  48  -1.689 -11.436  -0.700
  386   2HG   MET  48          2HG       MET  48  -3.212 -11.754   0.119
  387   1HE   MET  48          1HE       MET  48  -1.478  -9.997  -2.950
  388   2HE   MET  48          2HE       MET  48  -2.880  -9.430  -3.887
  389   3HE   MET  48          3HE       MET  48  -2.481  -8.675  -2.331
  390    H    ASN  49           H        ASN  49  -3.605  -9.868   3.145
  391    HA   ASN  49           HA       ASN  49  -5.508 -11.983   3.147
  392   1HB   ASN  49          1HB       ASN  49  -4.373 -10.274   5.402
  393   2HB   ASN  49          2HB       ASN  49  -5.439 -11.658   5.647
  394   1HD2  ASN  49          2HD2      ASN  49  -2.198 -10.690   4.457
  395   2HD2  ASN  49          1HD2      ASN  49  -1.507 -12.290   4.593
  396    H    MET  50           H        MET  50  -5.801  -8.541   4.188
  397    HA   MET  50           HA       MET  50  -8.465  -8.655   5.095
  398   1HB   MET  50          1HB       MET  50  -6.839  -6.386   3.907
  399   2HB   MET  50          2HB       MET  50  -8.431  -6.160   4.642
  400   1HG   MET  50          1HG       MET  50  -7.692  -6.788   6.789
  401   2HG   MET  50          2HG       MET  50  -6.204  -7.510   6.189
  402   1HE   MET  50          1HE       MET  50  -4.788  -6.321   8.049
  403   2HE   MET  50          2HE       MET  50  -4.824  -4.569   8.357
  404   3HE   MET  50          3HE       MET  50  -6.261  -5.560   8.700
  405    H    GLN  51           H        GLN  51  -7.229  -7.779   1.806
  406    HA   GLN  51           HA       GLN  51  -9.860  -7.159   0.929
  407   1HB   GLN  51          1HB       GLN  51  -8.952  -6.493  -1.124
  408   2HB   GLN  51          2HB       GLN  51  -7.863  -6.012   0.161
  409   1HG   GLN  51          1HG       GLN  51  -6.384  -6.759  -1.439
  410   2HG   GLN  51          2HG       GLN  51  -6.522  -8.174  -0.390
  411   1HE2  GLN  51          2HE2      GLN  51  -5.531  -9.021  -2.519
  412   2HE2  GLN  51          1HE2      GLN  51  -6.668  -9.663  -3.685
  413    H    ALA  52           H        ALA  52  -7.754  -9.953   0.210
  414    HA   ALA  52           HA       ALA  52  -8.137 -11.989  -0.591
  415   1HB   ALA  52          1HB       ALA  52  -9.632 -12.180   1.325
  416   2HB   ALA  52          2HB       ALA  52 -11.007 -11.617   0.358
  417   3HB   ALA  52          3HB       ALA  52 -10.205 -13.144  -0.047
  418    H    LYS  53           H        LYS  53 -11.296 -10.532  -1.513
  419    HA   LYS  53           HA       LYS  53 -10.575 -10.584  -4.358
  420   1HB   LYS  53          1HB       LYS  53 -11.422 -12.878  -3.909
  421   2HB   LYS  53          2HB       LYS  53 -12.921 -12.207  -3.288
  422   1HG   LYS  53          1HG       LYS  53 -12.939 -11.000  -5.724
  423   2HG   LYS  53          2HG       LYS  53 -11.856 -12.336  -6.115
  424   1HD   LYS  53          1HD       LYS  53 -13.590 -13.947  -5.321
  425   2HD   LYS  53          2HD       LYS  53 -14.647 -12.582  -4.895
  426   1HE   LYS  53          1HE       LYS  53 -14.613 -11.845  -7.295
  427   2HE   LYS  53          2HE       LYS  53 -13.664 -13.292  -7.695
  428   1HZ   LYS  53          1HZ       LYS  53 -15.494 -14.613  -6.894
  429   2HZ   LYS  53          2HZ       LYS  53 -16.362 -13.257  -6.536
  430   3HZ   LYS  53          3HZ       LYS  53 -15.976 -13.598  -8.101
  431    H    ALA  54           H        ALA  54 -13.945 -10.575  -3.437
  432    HA   ALA  54           HA       ALA  54 -14.089  -7.689  -4.123
  433   1HB   ALA  54          1HB       ALA  54 -15.131  -9.235  -5.706
  434   2HB   ALA  54          2HB       ALA  54 -16.121  -9.931  -4.403
  435   3HB   ALA  54          3HB       ALA  54 -16.354  -8.239  -4.892
  436    H    GLU  55           H        GLU  55 -15.022 -10.117  -1.771
  437    HA   GLU  55           HA       GLU  55 -17.027  -9.143  -0.266
  438   1HB   GLU  55          1HB       GLU  55 -15.799 -11.256   0.016
  439   2HB   GLU  55          2HB       GLU  55 -14.428 -10.385   0.722
  440   1HG   GLU  55          1HG       GLU  55 -15.831  -9.690   2.630
  441   2HG   GLU  55          2HG       GLU  55 -17.253 -10.432   1.876
  442    H    PHE  56           H        PHE  56 -13.674  -8.010  -0.161
  443    HA   PHE  56           HA       PHE  56 -13.408  -6.367   1.947
  444   1HB   PHE  56          1HB       PHE  56 -11.855  -6.819   0.043
  445   2HB   PHE  56          2HB       PHE  56 -12.732  -5.679  -0.944
  446    HD1  PHE  56           HD1      PHE  56 -11.196  -5.758   2.529
  447    HD2  PHE  56           HD2      PHE  56 -11.621  -3.627  -1.197
  448    HE1  PHE  56           HE1      PHE  56  -9.220  -4.393   3.082
  449    HE2  PHE  56           HE2      PHE  56  -9.674  -2.211  -0.603
  450    HZ   PHE  56           HZ       PHE  56  -8.430  -2.631   1.512
  451    H    TYR  57           H        TYR  57 -14.927  -5.295  -1.145
  452    HA   TYR  57           HA       TYR  57 -15.845  -2.796   0.145
  453   1HB   TYR  57          1HB       TYR  57 -16.340  -2.104  -2.182
  454   2HB   TYR  57          2HB       TYR  57 -14.662  -2.468  -1.842
  455    HD1  TYR  57           HD1      TYR  57 -17.702  -3.745  -3.588
  456    HD2  TYR  57           HD2      TYR  57 -13.437  -4.114  -3.045
  457    HE1  TYR  57           HE1      TYR  57 -17.553  -5.121  -5.642
  458    HE2  TYR  57           HE2      TYR  57 -13.301  -5.477  -5.107
  459    HH   TYR  57           HH       TYR  57 -14.420  -6.276  -6.934
  460    H    SER  58           H        SER  58 -17.130  -5.654   0.449
  461    HA   SER  58           HA       SER  58 -19.898  -4.956  -0.387
  462   1HB   SER  58          1HB       SER  58 -18.830  -7.561   0.741
  463   2HB   SER  58          2HB       SER  58 -20.410  -7.260   0.005
  464    HG   SER  58           HG       SER  58 -19.241  -6.678  -1.931
  465    H    GLU  59           H        GLU  59 -17.864  -4.564   2.344
  466    HA   GLU  59           HA       GLU  59 -20.217  -4.372   4.154
  467   1HB   GLU  59          1HB       GLU  59 -19.010  -5.586   5.879
  468   2HB   GLU  59          2HB       GLU  59 -19.225  -6.596   4.443
  469   1HG   GLU  59          1HG       GLU  59 -16.892  -6.129   3.745
  470   2HG   GLU  59          2HG       GLU  59 -16.666  -5.090   5.160
  471    H    VAL  60           H        VAL  60 -17.708  -2.673   2.835
  472    HA   VAL  60           HA       VAL  60 -16.861  -0.697   3.236
  473    HB   VAL  60           HB       VAL  60 -19.164  -0.519   4.753
  474   1HG1  VAL  60          1HG1      VAL  60 -17.835  -0.895   6.893
  475   2HG1  VAL  60          2HG1      VAL  60 -16.944   0.592   6.529
  476   3HG1  VAL  60          3HG1      VAL  60 -18.692   0.647   6.801
  477   1HG2  VAL  60          1HG2      VAL  60 -18.336   1.128   3.141
  478   2HG2  VAL  60          2HG2      VAL  60 -18.835   1.881   4.663
  479   3HG2  VAL  60          3HG2      VAL  60 -17.111   1.665   4.315
  480    H    LEU  61           H        LEU  61 -15.108   0.370   4.308
  481    HA   LEU  61           HA       LEU  61 -13.659  -1.141   6.394
  482   1HB   LEU  61          1HB       LEU  61 -11.595  -1.060   4.972
  483   2HB   LEU  61          2HB       LEU  61 -12.799  -2.264   4.533
  484    HG   LEU  61           HG       LEU  61 -13.145   0.284   3.087
  485   1HD1  LEU  61          1HD1      LEU  61 -10.656  -1.403   2.693
  486   2HD1  LEU  61          2HD1      LEU  61 -11.257  -0.181   1.548
  487   3HD1  LEU  61          3HD1      LEU  61 -10.716   0.306   3.169
  488   1HD2  LEU  61          1HD2      LEU  61 -14.405  -1.789   2.533
  489   2HD2  LEU  61          2HD2      LEU  61 -13.399  -1.261   1.178
  490   3HD2  LEU  61          3HD2      LEU  61 -12.872  -2.617   2.190
  491    H    THR  62           H        THR  62 -11.609   0.066   6.994
  492    HA   THR  62           HA       THR  62 -12.004   3.011   6.867
  493    HB   THR  62           HB       THR  62 -11.824   1.313   9.390
  494    HG1  THR  62           HG1      THR  62 -13.926   2.059   9.701
  495   1HG2  THR  62          1HG2      THR  62 -12.097   4.336   9.027
  496   2HG2  THR  62          2HG2      THR  62 -12.212   3.456  10.566
  497   3HG2  THR  62          3HG2      THR  62 -10.676   3.494   9.688
  498    H    ILE  63           H        ILE  63 -10.136   3.926   6.336
  499    HA   ILE  63           HA       ILE  63  -7.633   2.430   6.712
  500    HB   ILE  63           HB       ILE  63  -8.032   5.054   5.255
  501   1HG1  ILE  63          1HG1      ILE  63  -8.071   2.247   4.048
  502   2HG1  ILE  63          2HG1      ILE  63  -9.481   3.298   4.232
  503   1HG2  ILE  63          1HG2      ILE  63  -5.688   4.294   6.005
  504   2HG2  ILE  63          2HG2      ILE  63  -5.882   2.907   4.925
  505   3HG2  ILE  63          3HG2      ILE  63  -5.872   4.558   4.275
  506   1HD1  ILE  63          1HD1      ILE  63  -8.436   5.006   2.808
  507   2HD1  ILE  63          2HD1      ILE  63  -7.050   3.921   2.515
  508   3HD1  ILE  63          3HD1      ILE  63  -8.662   3.460   1.980
  509    H    VAL  64           H        VAL  64  -6.395   2.801   8.427
  510    HA   VAL  64           HA       VAL  64  -6.676   5.266  10.048
  511    HB   VAL  64           HB       VAL  64  -4.948   2.793  10.453
  512   1HG1  VAL  64          1HG1      VAL  64  -5.609   5.135  12.291
  513   2HG1  VAL  64          2HG1      VAL  64  -4.715   3.674  12.756
  514   3HG1  VAL  64          3HG1      VAL  64  -4.020   4.788  11.575
  515   1HG2  VAL  64          1HG2      VAL  64  -7.597   3.590  11.703
  516   2HG2  VAL  64          2HG2      VAL  64  -7.321   2.208  10.622
  517   3HG2  VAL  64          3HG2      VAL  64  -6.575   2.238  12.227
  518    H    VAL  65           H        VAL  65  -5.889   6.789   8.483
  519    HA   VAL  65           HA       VAL  65  -3.227   6.373   7.281
  520    HB   VAL  65           HB       VAL  65  -3.591   8.504   6.174
  521   1HG1  VAL  65          1HG1      VAL  65  -4.382   6.365   5.189
  522   2HG1  VAL  65          2HG1      VAL  65  -5.989   6.653   5.903
  523   3HG1  VAL  65          3HG1      VAL  65  -5.351   7.759   4.674
  524   1HG2  VAL  65          1HG2      VAL  65  -5.078   9.721   7.781
  525   2HG2  VAL  65          2HG2      VAL  65  -5.740   9.628   6.164
  526   3HG2  VAL  65          3HG2      VAL  65  -6.371   8.557   7.429
  527    H    ASP  66           H        ASP  66  -2.441   6.079   9.558
  528    HA   ASP  66           HA       ASP  66  -1.397   6.705  11.425
  529   1HB   ASP  66          1HB       ASP  66   0.170   7.836   9.946
  530   2HB   ASP  66          2HB       ASP  66  -0.816   9.305   9.943
  531    H    GLY  67           H        GLY  67  -3.342   6.541  12.583
  532   1HA   GLY  67          1HA       GLY  67  -4.521   7.349  14.372
  533   2HA   GLY  67          2HA       GLY  67  -4.146   9.019  13.934
  534    H    LYS  68           H        LYS  68  -5.153   9.508  11.543
  535    HA   LYS  68           HA       LYS  68  -7.917   9.773  12.087
  536   1HB   LYS  68          1HB       LYS  68  -6.229  10.301   9.634
  537   2HB   LYS  68          2HB       LYS  68  -7.979  10.575   9.643
  538   1HG   LYS  68          1HG       LYS  68  -7.774  12.095  11.549
  539   2HG   LYS  68          2HG       LYS  68  -6.013  11.862  11.583
  540   1HD   LYS  68          1HD       LYS  68  -5.771  12.793   9.356
  541   2HD   LYS  68          2HD       LYS  68  -7.524  12.902   9.137
  542   1HE   LYS  68          1HE       LYS  68  -5.960  14.436  11.267
  543   2HE   LYS  68          2HE       LYS  68  -6.426  15.082   9.684
  544   1HZ   LYS  68          1HZ       LYS  68  -8.711  14.720  10.267
  545   2HZ   LYS  68          2HZ       LYS  68  -8.285  14.149  11.754
  546   3HZ   LYS  68          3HZ       LYS  68  -7.971  15.715  11.353
  547    H    GLU  69           H        GLU  69  -9.405   8.262  12.035
  548    HA   GLU  69           HA       GLU  69  -9.306   5.863  10.382
  549   1HB   GLU  69          1HB       GLU  69 -11.359   7.021  12.320
  550   2HB   GLU  69          2HB       GLU  69 -11.500   5.453  11.516
  551   1HG   GLU  69          1HG       GLU  69  -9.382   4.719  12.573
  552   2HG   GLU  69          2HG       GLU  69  -9.274   6.264  13.433
  553    H    ILE  70           H        ILE  70  -9.295   6.893   8.244
  554    HA   ILE  70           HA       ILE  70 -11.676   8.404   7.413
  555    HB   ILE  70           HB       ILE  70  -9.248   7.423   5.866
  556   1HG1  ILE  70          1HG1      ILE  70 -10.129  10.141   6.962
  557   2HG1  ILE  70          2HG1      ILE  70  -8.745   9.176   7.491
  558   1HG2  ILE  70          1HG2      ILE  70 -11.609   9.143   5.015
  559   2HG2  ILE  70          2HG2      ILE  70 -10.146   8.880   4.037
  560   3HG2  ILE  70          3HG2      ILE  70 -11.217   7.540   4.384
  561   1HD1  ILE  70          1HD1      ILE  70  -7.818   9.418   5.121
  562   2HD1  ILE  70          2HD1      ILE  70  -9.074  10.650   4.857
  563   3HD1  ILE  70          3HD1      ILE  70  -7.864  10.891   6.120
  564    H    LYS  71           H        LYS  71 -13.506   7.258   7.324
  565    HA   LYS  71           HA       LYS  71 -13.676   4.484   6.606
  566   1HB   LYS  71          1HB       LYS  71 -16.078   4.824   6.609
  567   2HB   LYS  71          2HB       LYS  71 -15.280   5.439   8.061
  568   1HG   LYS  71          1HG       LYS  71 -15.497   7.769   7.219
  569   2HG   LYS  71          2HG       LYS  71 -16.204   7.170   5.721
  570   1HD   LYS  71          1HD       LYS  71 -17.950   7.994   7.161
  571   2HD   LYS  71          2HD       LYS  71 -18.133   6.260   6.887
  572   1HE   LYS  71          1HE       LYS  71 -18.618   6.894   9.215
  573   2HE   LYS  71          2HE       LYS  71 -17.268   5.757   9.128
  574   1HZ   LYS  71          1HZ       LYS  71 -17.031   8.672   9.442
  575   2HZ   LYS  71          2HZ       LYS  71 -16.855   7.550  10.638
  576   3HZ   LYS  71          3HZ       LYS  71 -15.775   7.601   9.396
  577    H    VAL  72           H        VAL  72 -13.872   3.529   4.657
  578    HA   VAL  72           HA       VAL  72 -14.544   5.119   2.263
  579    HB   VAL  72           HB       VAL  72 -12.722   4.113   0.983
  580   1HG1  VAL  72          1HG1      VAL  72 -12.365   6.333   2.071
  581   2HG1  VAL  72          2HG1      VAL  72 -11.577   5.492   3.429
  582   3HG1  VAL  72          3HG1      VAL  72 -10.870   5.420   1.810
  583   1HG2  VAL  72          1HG2      VAL  72 -11.827   2.887   3.619
  584   2HG2  VAL  72          2HG2      VAL  72 -12.326   2.062   2.119
  585   3HG2  VAL  72          3HG2      VAL  72 -10.836   2.986   2.152
  586    H    LYS  73           H        LYS  73 -15.416   3.896   0.562
  587    HA   LYS  73           HA       LYS  73 -16.626   1.328   1.415
  588   1HB   LYS  73          1HB       LYS  73 -17.933   3.316   0.439
  589   2HB   LYS  73          2HB       LYS  73 -17.216   2.878  -1.124
  590   1HG   LYS  73          1HG       LYS  73 -18.178   0.570  -0.865
  591   2HG   LYS  73          2HG       LYS  73 -18.865   1.064   0.695
  592   1HD   LYS  73          1HD       LYS  73 -20.106   2.915  -0.533
  593   2HD   LYS  73          2HD       LYS  73 -19.561   2.174  -2.055
  594   1HE   LYS  73          1HE       LYS  73 -20.681   0.037  -1.371
  595   2HE   LYS  73          2HE       LYS  73 -21.236   0.824   0.121
  596   1HZ   LYS  73          1HZ       LYS  73 -22.443   2.384  -1.230
  597   2HZ   LYS  73          2HZ       LYS  73 -21.959   1.618  -2.608
  598   3HZ   LYS  73          3HZ       LYS  73 -22.920   0.833  -1.523
  599    H    ALA  74           H        ALA  74 -14.595   2.796  -1.095
  600    HA   ALA  74           HA       ALA  74 -13.049   2.038  -2.484
  601   1HB   ALA  74          1HB       ALA  74 -12.355   0.487  -0.597
  602   2HB   ALA  74          2HB       ALA  74 -13.281  -0.787  -1.394
  603   3HB   ALA  74          3HB       ALA  74 -11.923  -0.038  -2.237
  604    H    GLN  75           H        GLN  75 -13.025   1.364  -4.616
  605    HA   GLN  75           HA       GLN  75 -15.266  -0.308  -5.635
  606   1HB   GLN  75          1HB       GLN  75 -14.551   2.520  -6.520
  607   2HB   GLN  75          2HB       GLN  75 -15.497   1.402  -7.511
  608   1HG   GLN  75          1HG       GLN  75 -16.321   2.292  -4.711
  609   2HG   GLN  75          2HG       GLN  75 -16.822   3.071  -6.210
  610   1HE2  GLN  75          2HE2      GLN  75 -17.146   0.131  -4.238
  611   2HE2  GLN  75          1HE2      GLN  75 -18.553  -0.490  -5.082
  612    H    ASP  76           H        ASP  76 -12.719   1.704  -7.173
  613    HA   ASP  76           HA       ASP  76 -11.955  -0.594  -8.799
  614   1HB   ASP  76          1HB       ASP  76 -12.215   1.580  -9.824
  615   2HB   ASP  76          2HB       ASP  76 -10.989   2.280  -8.770
  616    H    VAL  77           H        VAL  77 -11.287  -1.901  -7.036
  617    HA   VAL  77           HA       VAL  77  -8.641  -1.356  -5.829
  618    HB   VAL  77           HB       VAL  77  -8.969  -3.629  -4.833
  619   1HG1  VAL  77          1HG1      VAL  77 -11.049  -1.480  -4.253
  620   2HG1  VAL  77          2HG1      VAL  77 -10.694  -2.858  -3.196
  621   3HG1  VAL  77          3HG1      VAL  77  -9.439  -1.667  -3.520
  622   1HG2  VAL  77          1HG2      VAL  77 -10.716  -4.577  -6.405
  623   2HG2  VAL  77          2HG2      VAL  77 -11.166  -4.619  -4.706
  624   3HG2  VAL  77          3HG2      VAL  77 -11.867  -3.390  -5.768
  625    H    GLN  78           H        GLN  78  -6.886  -1.679  -7.113
  626    HA   GLN  78           HA       GLN  78  -7.126  -3.397  -9.484
  627   1HB   GLN  78          1HB       GLN  78  -5.993  -1.043  -9.329
  628   2HB   GLN  78          2HB       GLN  78  -4.639  -1.911  -8.625
  629   1HG   GLN  78          1HG       GLN  78  -4.159  -1.763 -10.915
  630   2HG   GLN  78          2HG       GLN  78  -4.691  -3.435 -10.685
  631   1HE2  GLN  78          2HE2      GLN  78  -4.684  -2.515 -13.231
  632   2HE2  GLN  78          1HE2      GLN  78  -6.306  -2.139 -13.784
  633    H    ARG  79           H        ARG  79  -7.618  -5.144  -7.963
  634    HA   ARG  79           HA       ARG  79  -5.232  -6.508  -6.810
  635   1HB   ARG  79          1HB       ARG  79  -6.728  -7.466  -5.169
  636   2HB   ARG  79          2HB       ARG  79  -6.928  -5.713  -5.185
  637   1HG   ARG  79          1HG       ARG  79  -9.113  -6.356  -5.060
  638   2HG   ARG  79          2HG       ARG  79  -8.948  -6.185  -6.806
  639   1HD   ARG  79          1HD       ARG  79  -8.581  -8.755  -6.865
  640   2HD   ARG  79          2HD       ARG  79  -8.928  -8.741  -5.151
  641    HE   ARG  79           HE       ARG  79 -11.148  -8.342  -5.551
  642   1HH1  ARG  79          1HH2      ARG  79  -9.350  -7.840  -8.591
  643   2HH1  ARG  79          2HH2      ARG  79 -10.792  -7.812  -9.571
  644   1HH2  ARG  79          1HH1      ARG  79 -13.013  -8.321  -6.860
  645   2HH2  ARG  79          2HH1      ARG  79 -12.886  -8.074  -8.584
  646    H    HIS  80           H        HIS  80  -5.210  -8.791  -6.888
  647    HA   HIS  80           HA       HIS  80  -6.786 -10.034  -9.077
  648   1HB   HIS  80          1HB       HIS  80  -4.465  -9.290  -9.743
  649   2HB   HIS  80          2HB       HIS  80  -3.817 -10.474  -8.608
  650    HD1  HIS  80           HD1      HIS  80  -5.825 -12.907  -9.385
  651    HD2  HIS  80           HD2      HIS  80  -3.779 -10.335 -12.017
  652    HE1  HIS  80           HE1      HIS  80  -5.668 -14.120 -11.618
  653    HA   PRO  81           HA       PRO  81  -7.095 -12.848  -5.473
  654   1HB   PRO  81          1HB       PRO  81  -9.106 -14.460  -6.327
  655   2HB   PRO  81          2HB       PRO  81  -9.395 -12.755  -5.869
  656   1HG   PRO  81          1HG       PRO  81  -8.948 -13.862  -8.659
  657   2HG   PRO  81          2HG       PRO  81 -10.289 -12.816  -8.109
  658   1HD   PRO  81          1HD       PRO  81  -8.060 -11.840  -9.330
  659   2HD   PRO  81          2HD       PRO  81  -8.872 -10.922  -8.025
  660    H    TYR  82           H        TYR  82  -6.964 -15.281  -5.248
  661    HA   TYR  82           HA       TYR  82  -6.034 -17.273  -5.564
  662   1HB   TYR  82          1HB       TYR  82  -5.534 -16.774  -8.509
  663   2HB   TYR  82          2HB       TYR  82  -5.762 -18.290  -7.665
  664    HD1  TYR  82           HD1      TYR  82  -8.185 -18.321  -6.297
  665    HD2  TYR  82           HD2      TYR  82  -7.283 -16.135  -9.906
  666    HE1  TYR  82           HE1      TYR  82 -10.597 -18.222  -6.844
  667    HE2  TYR  82           HE2      TYR  82  -9.692 -16.054 -10.457
  668    HH   TYR  82           HH       TYR  82 -12.189 -17.527  -8.357
  669    H    LYS  83           H        LYS  83  -4.218 -15.202  -7.855
  670    HA   LYS  83           HA       LYS  83  -1.659 -15.944  -6.577
  671   1HB   LYS  83          1HB       LYS  83  -0.730 -14.613  -8.543
  672   2HB   LYS  83          2HB       LYS  83  -1.413 -16.212  -8.837
  673   1HG   LYS  83          1HG       LYS  83  -3.392 -15.372  -9.805
  674   2HG   LYS  83          2HG       LYS  83  -3.096 -13.716  -9.265
  675   1HD   LYS  83          1HD       LYS  83  -1.242 -15.158 -11.201
  676   2HD   LYS  83          2HD       LYS  83  -2.664 -14.247 -11.719
  677   1HE   LYS  83          1HE       LYS  83  -1.759 -12.220 -10.502
  678   2HE   LYS  83          2HE       LYS  83  -0.259 -13.122 -10.219
  679   1HZ   LYS  83          1HZ       LYS  83  -1.429 -12.495 -12.834
  680   2HZ   LYS  83          2HZ       LYS  83  -0.131 -11.750 -12.144
  681   3HZ   LYS  83          3HZ       LYS  83  -0.031 -13.336 -12.588
  682    HA   PRO  84           HA       PRO  84  -2.309 -12.004  -4.473
  683   1HB   PRO  84          1HB       PRO  84  -0.134 -11.986  -2.809
  684   2HB   PRO  84          2HB       PRO  84  -1.520 -13.093  -2.588
  685   1HG   PRO  84          1HG       PRO  84   1.116 -13.701  -3.942
  686   2HG   PRO  84          2HG       PRO  84   0.276 -14.654  -2.687
  687   1HD   PRO  84          1HD       PRO  84   0.058 -15.217  -5.348
  688   2HD   PRO  84          2HD       PRO  84  -1.330 -15.437  -4.235
  689    H    LYS  85           H        LYS  85  -2.069 -10.355  -5.976
  690    HA   LYS  85           HA       LYS  85   0.607  -9.248  -6.391
  691   1HB   LYS  85          1HB       LYS  85   0.082 -11.187  -8.126
  692   2HB   LYS  85          2HB       LYS  85  -0.961  -9.996  -8.879
  693   1HG   LYS  85          1HG       LYS  85   1.081  -9.728  -9.995
  694   2HG   LYS  85          2HG       LYS  85   1.155  -8.440  -8.779
  695   1HD   LYS  85          1HD       LYS  85   2.531  -9.983  -7.312
  696   2HD   LYS  85          2HD       LYS  85   2.408 -11.221  -8.566
  697   1HE   LYS  85          1HE       LYS  85   4.555 -10.164  -8.758
  698   2HE   LYS  85          2HE       LYS  85   3.590  -9.679 -10.162
  699   1HZ   LYS  85          1HZ       LYS  85   4.034  -8.076  -7.736
  700   2HZ   LYS  85          2HZ       LYS  85   4.779  -7.863  -9.191
  701   3HZ   LYS  85          3HZ       LYS  85   3.159  -7.603  -9.051
  702    H    LEU  86           H        LEU  86  -0.591  -7.685  -5.044
  703    HA   LEU  86           HA       LEU  86  -2.690  -6.075  -6.263
  704   1HB   LEU  86          1HB       LEU  86  -0.975  -5.937  -3.779
  705   2HB   LEU  86          2HB       LEU  86  -1.788  -4.472  -4.312
  706    HG   LEU  86           HG       LEU  86  -3.352  -7.044  -3.969
  707   1HD1  LEU  86          1HD1      LEU  86  -2.131  -6.480  -1.831
  708   2HD1  LEU  86          2HD1      LEU  86  -2.894  -4.882  -1.871
  709   3HD1  LEU  86          3HD1      LEU  86  -3.896  -6.338  -1.701
  710   1HD2  LEU  86          1HD2      LEU  86  -4.061  -4.072  -3.877
  711   2HD2  LEU  86          2HD2      LEU  86  -4.448  -5.167  -5.198
  712   3HD2  LEU  86          3HD2      LEU  86  -5.203  -5.404  -3.610
  713    H    GLN  87           H        GLN  87  -2.522  -4.053  -7.135
  714    HA   GLN  87           HA       GLN  87   0.195  -3.103  -7.971
  715   1HB   GLN  87          1HB       GLN  87  -2.464  -2.592  -9.354
  716   2HB   GLN  87          2HB       GLN  87  -0.845  -2.191  -9.934
  717   1HG   GLN  87          1HG       GLN  87  -2.075  -4.965  -9.613
  718   2HG   GLN  87          2HG       GLN  87  -1.715  -4.120 -11.118
  719   1HE2  GLN  87          2HE2      GLN  87  -0.609  -6.579  -9.203
  720   2HE2  GLN  87          1HE2      GLN  87   1.093  -6.508  -9.623
  721    H    HIS  88           H        HIS  88  -3.146  -2.080  -7.142
  722    HA   HIS  88           HA       HIS  88  -2.302   0.323  -5.730
  723   1HB   HIS  88          1HB       HIS  88  -2.002   0.819  -8.219
  724   2HB   HIS  88          2HB       HIS  88  -3.730   0.536  -8.422
  725    HD1  HIS  88           HD1      HIS  88  -5.331   2.570  -7.620
  726    HD2  HIS  88           HD2      HIS  88  -1.185   3.065  -7.056
  727    HE1  HIS  88           HE1      HIS  88  -4.957   5.006  -7.015
  728    H    ILE  89           H        ILE  89  -4.255   1.484  -4.923
  729    HA   ILE  89           HA       ILE  89  -6.853   0.280  -5.579
  730    HB   ILE  89           HB       ILE  89  -6.032   0.832  -2.695
  731   1HG1  ILE  89          1HG1      ILE  89  -7.163  -1.538  -2.479
  732   2HG1  ILE  89          2HG1      ILE  89  -6.757  -1.729  -4.183
  733   1HG2  ILE  89          1HG2      ILE  89  -8.735   0.411  -4.022
  734   2HG2  ILE  89          2HG2      ILE  89  -8.480   0.188  -2.282
  735   3HG2  ILE  89          3HG2      ILE  89  -8.208   1.760  -3.010
  736   1HD1  ILE  89          1HD1      ILE  89  -4.764  -0.989  -1.984
  737   2HD1  ILE  89          2HD1      ILE  89  -5.137  -2.651  -2.454
  738   3HD1  ILE  89          3HD1      ILE  89  -4.383  -1.560  -3.625
  739    H    ASP  90           H        ASP  90  -8.257   1.787  -6.109
  740    HA   ASP  90           HA       ASP  90  -7.733   4.658  -5.461
  741   1HB   ASP  90          1HB       ASP  90  -9.451   3.356  -7.598
  742   2HB   ASP  90          2HB       ASP  90  -9.309   5.093  -7.305
  743    H    PHE  91           H        PHE  91  -8.477   4.331  -3.270
  744    HA   PHE  91           HA       PHE  91 -11.017   3.152  -2.625
  745   1HB   PHE  91          1HB       PHE  91  -9.313   5.141  -1.081
  746   2HB   PHE  91          2HB       PHE  91 -10.687   4.275  -0.433
  747    HD1  PHE  91           HD1      PHE  91  -7.116   4.155  -1.055
  748    HD2  PHE  91           HD2      PHE  91 -10.606   1.789  -0.179
  749    HE1  PHE  91           HE1      PHE  91  -5.677   2.373  -0.113
  750    HE2  PHE  91           HE2      PHE  91  -9.145  -0.021   0.713
  751    HZ   PHE  91           HZ       PHE  91  -6.703   0.274   0.755
  752    H    VAL  92           H        VAL  92 -12.901   4.318  -1.773
  753    HA   VAL  92           HA       VAL  92 -13.173   7.156  -2.600
  754    HB   VAL  92           HB       VAL  92 -15.429   6.788  -3.376
  755   1HG1  VAL  92          1HG1      VAL  92 -13.562   6.768  -5.004
  756   2HG1  VAL  92          2HG1      VAL  92 -13.471   4.997  -4.878
  757   3HG1  VAL  92          3HG1      VAL  92 -14.927   5.770  -5.530
  758   1HG2  VAL  92          1HG2      VAL  92 -14.895   3.800  -3.121
  759   2HG2  VAL  92          2HG2      VAL  92 -16.072   4.739  -2.170
  760   3HG2  VAL  92          3HG2      VAL  92 -16.294   4.555  -3.908
  761    H    ARG  93           H        ARG  93 -14.102   8.406  -1.060
  762    HA   ARG  93           HA       ARG  93 -14.367   7.649   1.604
  763   1HB   ARG  93          1HB       ARG  93 -15.576   9.865  -0.067
  764   2HB   ARG  93          2HB       ARG  93 -16.001   9.727   1.634
  765   1HG   ARG  93          1HG       ARG  93 -13.093   9.883   0.743
  766   2HG   ARG  93          2HG       ARG  93 -14.101  11.314   1.041
  767   1HD   ARG  93          1HD       ARG  93 -14.609  10.482   3.321
  768   2HD   ARG  93          2HD       ARG  93 -13.428   9.172   3.090
  769    HE   ARG  93           HE       ARG  93 -11.941  11.338   2.461
  770   1HH1  ARG  93          1HH2      ARG  93 -14.010  10.691   5.283
  771   2HH1  ARG  93          2HH2      ARG  93 -13.108  11.747   6.336
  772   1HH2  ARG  93          1HH1      ARG  93 -10.767  12.702   3.865
  773   2HH2  ARG  93          2HH1      ARG  93 -11.250  12.881   5.531
  774    H    ALA  94           H        ALA  94 -15.921   6.776   2.882
  775    HA   ALA  94           HA       ALA  94 -18.482   5.851   1.682
  776   1HB   ALA  94          1HB       ALA  94 -17.171   5.305   4.374
  777   2HB   ALA  94          2HB       ALA  94 -18.730   4.651   3.829
  778   3HB   ALA  94          3HB       ALA  94 -17.243   4.206   2.980
  Start of MODEL    3
    1    H    MET   1           H        MET   1 -15.115  -5.142  10.636
    2    HA   MET   1           HA       MET   1 -15.135  -4.532   8.428
    3   1HB   MET   1          1HB       MET   1 -15.436  -1.778   9.693
    4   2HB   MET   1          2HB       MET   1 -15.898  -2.220   8.037
    5   1HG   MET   1          1HG       MET   1 -17.477  -3.919   8.965
    6   2HG   MET   1          2HG       MET   1 -17.116  -3.334  10.594
    7   1HE   MET   1          1HE       MET   1 -17.673  -0.828  11.423
    8   2HE   MET   1          2HE       MET   1 -16.968  -0.065   9.974
    9   3HE   MET   1          3HE       MET   1 -18.629   0.323  10.461
   10    H    PHE   2           H        PHE   2 -12.660  -5.112   9.059
   11    HA   PHE   2           HA       PHE   2 -10.526  -4.965   8.452
   12   1HB   PHE   2          1HB       PHE   2 -11.276  -2.800   6.473
   13   2HB   PHE   2          2HB       PHE   2  -9.933  -3.932   6.385
   14    HD1  PHE   2           HD1      PHE   2 -10.561  -6.507   6.292
   15    HD2  PHE   2           HD2      PHE   2 -13.313  -3.315   5.403
   16    HE1  PHE   2           HE1      PHE   2 -12.067  -8.112   5.144
   17    HE2  PHE   2           HE2      PHE   2 -14.767  -4.900   4.180
   18    HZ   PHE   2           HZ       PHE   2 -14.175  -7.317   4.101
   19    H    THR   3           H        THR   3  -8.545  -3.504   8.231
   20    HA   THR   3           HA       THR   3  -8.683  -0.872   9.495
   21    HB   THR   3           HB       THR   3  -7.288  -3.201  10.899
   22    HG1  THR   3           HG1      THR   3  -9.644  -2.720  11.231
   23   1HG2  THR   3          1HG2      THR   3  -7.341  -0.224  11.577
   24   2HG2  THR   3          2HG2      THR   3  -6.635  -1.502  12.583
   25   3HG2  THR   3          3HG2      THR   3  -5.912  -1.116  11.017
   26    H    ILE   4           H        ILE   4  -7.844  -0.218   7.479
   27    HA   ILE   4           HA       ILE   4  -5.356  -1.440   6.489
   28    HB   ILE   4           HB       ILE   4  -6.962   0.902   5.418
   29   1HG1  ILE   4          1HG1      ILE   4  -7.263  -0.865   3.522
   30   2HG1  ILE   4          2HG1      ILE   4  -6.879  -2.066   4.752
   31   1HG2  ILE   4          1HG2      ILE   4  -4.547   1.031   4.832
   32   2HG2  ILE   4          2HG2      ILE   4  -4.616  -0.637   4.236
   33   3HG2  ILE   4          3HG2      ILE   4  -5.543   0.645   3.431
   34   1HD1  ILE   4          1HD1      ILE   4  -9.150  -0.019   4.907
   35   2HD1  ILE   4          2HD1      ILE   4  -9.318  -1.690   4.341
   36   3HD1  ILE   4          3HD1      ILE   4  -8.898  -1.382   6.024
   37    H    ASN   5           H        ASN   5  -3.727  -1.078   7.859
   38    HA   ASN   5           HA       ASN   5  -3.349   1.374   9.355
   39   1HB   ASN   5          1HB       ASN   5  -1.563  -1.057   8.919
   40   2HB   ASN   5          2HB       ASN   5  -1.257   0.241  10.082
   41   1HD2  ASN   5          2HD2      ASN   5  -3.069   0.671  11.710
   42   2HD2  ASN   5          1HD2      ASN   5  -3.899  -0.736  12.341
   43    H    ALA   6           H        ALA   6  -3.444   2.782   7.432
   44    HA   ALA   6           HA       ALA   6  -1.153   2.754   5.593
   45   1HB   ALA   6          1HB       ALA   6  -3.447   3.230   4.799
   46   2HB   ALA   6          2HB       ALA   6  -3.508   4.657   5.859
   47   3HB   ALA   6          3HB       ALA   6  -2.351   4.596   4.515
   48    H    GLU   7           H        GLU   7  -0.126   4.896   5.117
   49    HA   GLU   7           HA       GLU   7   0.001   6.832   7.320
   50   1HB   GLU   7          1HB       GLU   7   1.892   5.192   7.659
   51   2HB   GLU   7          2HB       GLU   7   2.523   5.640   6.064
   52   1HG   GLU   7          1HG       GLU   7   2.811   7.981   6.839
   53   2HG   GLU   7          2HG       GLU   7   2.102   7.556   8.409
   54    H    VAL   8           H        VAL   8   0.684   8.909   6.523
   55    HA   VAL   8           HA       VAL   8  -0.152   9.574   3.888
   56    HB   VAL   8           HB       VAL   8   0.881  11.758   4.312
   57   1HG1  VAL   8          1HG1      VAL   8  -1.369  11.224   5.206
   58   2HG1  VAL   8          2HG1      VAL   8  -0.635  10.712   6.742
   59   3HG1  VAL   8          3HG1      VAL   8  -0.505  12.399   6.211
   60   1HG2  VAL   8          1HG2      VAL   8   2.918  11.106   5.541
   61   2HG2  VAL   8          2HG2      VAL   8   1.962  12.269   6.465
   62   3HG2  VAL   8          3HG2      VAL   8   1.935  10.556   6.916
   63    H    ARG   9           H        ARG   9   1.014  10.004   2.001
   64    HA   ARG   9           HA       ARG   9   3.164   8.207   1.566
   65   1HB   ARG   9          1HB       ARG   9   1.510   8.747  -0.153
   66   2HB   ARG   9          2HB       ARG   9   2.012  10.441  -0.151
   67   1HG   ARG   9          1HG       ARG   9   2.929   9.348  -2.074
   68   2HG   ARG   9          2HG       ARG   9   4.263   9.765  -0.999
   69   1HD   ARG   9          1HD       ARG   9   4.280   7.402  -0.143
   70   2HD   ARG   9          2HD       ARG   9   2.997   6.991  -1.292
   71    HE   ARG   9           HE       ARG   9   5.849   7.352  -1.741
   72   1HH1  ARG   9          1HH2      ARG   9   2.718   7.579  -3.404
   73   2HH1  ARG   9          2HH2      ARG   9   3.422   7.440  -4.995
   74   1HH2  ARG   9          1HH1      ARG   9   6.740   7.170  -3.749
   75   2HH2  ARG   9          2HH1      ARG   9   5.761   7.201  -5.206
   76    H    LYS  10           H        LYS  10   4.970   8.674   2.811
   77    HA   LYS  10           HA       LYS  10   6.697  10.774   1.815
   78   1HB   LYS  10          1HB       LYS  10   5.216  11.914   3.592
   79   2HB   LYS  10          2HB       LYS  10   5.956  10.843   4.776
   80   1HG   LYS  10          1HG       LYS  10   7.179  12.846   4.905
   81   2HG   LYS  10          2HG       LYS  10   8.229  11.779   3.959
   82   1HD   LYS  10          1HD       LYS  10   7.356  12.871   1.853
   83   2HD   LYS  10          2HD       LYS  10   6.341  13.923   2.855
   84   1HE   LYS  10          1HE       LYS  10   8.392  14.832   3.937
   85   2HE   LYS  10          2HE       LYS  10   9.384  13.788   2.898
   86   1HZ   LYS  10          1HZ       LYS  10   8.475  14.921   0.999
   87   2HZ   LYS  10          2HZ       LYS  10   7.566  15.897   1.964
   88   3HZ   LYS  10          3HZ       LYS  10   9.210  15.991   2.012
   89    H    GLU  11           H        GLU  11   7.822   8.922   1.167
   90    HA   GLU  11           HA       GLU  11   8.852   6.980   3.041
   91   1HB   GLU  11          1HB       GLU  11  10.234   6.290   1.076
   92   2HB   GLU  11          2HB       GLU  11   8.490   6.187   0.877
   93   1HG   GLU  11          1HG       GLU  11   9.902   8.666  -0.142
   94   2HG   GLU  11          2HG       GLU  11  10.048   7.149  -1.027
   95    H    GLN  12           H        GLN  12   9.638   8.557   4.590
   96    HA   GLN  12           HA       GLN  12  12.310   9.741   3.974
   97   1HB   GLN  12          1HB       GLN  12   9.896  10.640   5.482
   98   2HB   GLN  12          2HB       GLN  12  11.397  10.928   6.335
   99   1HG   GLN  12          1HG       GLN  12  10.904  11.801   3.464
  100   2HG   GLN  12          2HG       GLN  12  10.662  12.820   4.894
  101   1HE2  GLN  12          2HE2      GLN  12  12.363  13.766   2.991
  102   2HE2  GLN  12          1HE2      GLN  12  14.025  13.638   3.526
  103    H    GLY  13           H        GLY  13  13.511  10.114   6.139
  104   1HA   GLY  13          1HA       GLY  13  14.273   9.284   8.208
  105   2HA   GLY  13          2HA       GLY  13  13.503   7.720   7.908
  106    H    LYS  14           H        LYS  14  15.763   9.821   6.068
  107    HA   LYS  14           HA       LYS  14  17.600   9.397   4.838
  108   1HB   LYS  14          1HB       LYS  14  18.353   7.599   7.187
  109   2HB   LYS  14          2HB       LYS  14  19.442   8.235   5.945
  110   1HG   LYS  14          1HG       LYS  14  18.802  10.570   6.673
  111   2HG   LYS  14          2HG       LYS  14  17.917   9.834   8.029
  112   1HD   LYS  14          1HD       LYS  14  20.056   8.686   8.732
  113   2HD   LYS  14          2HD       LYS  14  20.886   9.491   7.393
  114   1HE   LYS  14          1HE       LYS  14  21.372  10.733   9.377
  115   2HE   LYS  14          2HE       LYS  14  20.277  11.717   8.392
  116   1HZ   LYS  14          1HZ       LYS  14  19.511  10.056  10.699
  117   2HZ   LYS  14          2HZ       LYS  14  19.670  11.695  10.704
  118   3HZ   LYS  14          3HZ       LYS  14  18.482  10.987   9.809
  119    H    GLY  15           H        GLY  15  15.712   8.165   3.583
  120   1HA   GLY  15          1HA       GLY  15  16.892   5.632   2.636
  121   2HA   GLY  15          2HA       GLY  15  15.270   5.550   3.351
  122    H    ALA  16           H        ALA  16  16.648   5.488   0.491
  123    HA   ALA  16           HA       ALA  16  15.008   7.405  -1.008
  124   1HB   ALA  16          1HB       ALA  16  17.280   6.807  -1.764
  125   2HB   ALA  16          2HB       ALA  16  16.793   5.104  -1.909
  126   3HB   ALA  16          3HB       ALA  16  16.062   6.335  -2.963
  127    H    SER  17           H        SER  17  13.666   6.465  -2.844
  128    HA   SER  17           HA       SER  17  11.506   4.997  -1.809
  129   1HB   SER  17          1HB       SER  17  11.356   6.576  -3.694
  130   2HB   SER  17          2HB       SER  17  12.291   5.465  -4.719
  131    HG   SER  17           HG       SER  17   9.798   4.908  -3.476
  132    H    ARG  18           H        ARG  18  14.121   3.928  -4.031
  133    HA   ARG  18           HA       ARG  18  14.734   1.918  -4.837
  134   1HB   ARG  18          1HB       ARG  18  14.058   0.997  -2.004
  135   2HB   ARG  18          2HB       ARG  18  14.987   0.083  -3.210
  136   1HG   ARG  18          1HG       ARG  18  16.665   1.899  -3.302
  137   2HG   ARG  18          2HG       ARG  18  15.814   2.732  -1.978
  138   1HD   ARG  18          1HD       ARG  18  16.172   0.840  -0.483
  139   2HD   ARG  18          2HD       ARG  18  16.788  -0.148  -1.825
  140    HE   ARG  18           HE       ARG  18  18.327   2.273  -1.416
  141   1HH1  ARG  18          1HH2      ARG  18  17.907  -1.069  -0.277
  142   2HH1  ARG  18          2HH2      ARG  18  19.578  -1.253   0.185
  143   1HH2  ARG  18          1HH1      ARG  18  20.522   2.011  -0.793
  144   2HH2  ARG  18          2HH1      ARG  18  21.062   0.507  -0.095
  145    H    ARG  19           H        ARG  19  13.087  -0.503  -3.297
  146    HA   ARG  19           HA       ARG  19  11.176  -0.870  -5.481
  147   1HB   ARG  19          1HB       ARG  19  11.836  -2.481  -2.983
  148   2HB   ARG  19          2HB       ARG  19  10.607  -2.927  -4.179
  149   1HG   ARG  19          1HG       ARG  19  12.334  -2.942  -5.963
  150   2HG   ARG  19          2HG       ARG  19  13.581  -2.559  -4.757
  151   1HD   ARG  19          1HD       ARG  19  13.076  -4.646  -3.548
  152   2HD   ARG  19          2HD       ARG  19  11.785  -5.021  -4.713
  153    HE   ARG  19           HE       ARG  19  14.185  -4.597  -6.154
  154   1HH1  ARG  19          1HH2      ARG  19  12.810  -6.955  -3.885
  155   2HH1  ARG  19          2HH2      ARG  19  13.722  -8.296  -4.528
  156   1HH2  ARG  19          1HH1      ARG  19  15.375  -6.366  -6.991
  157   2HH2  ARG  19          2HH1      ARG  19  15.189  -7.958  -6.302
  158    H    LEU  20           H        LEU  20   9.226   0.021  -5.424
  159    HA   LEU  20           HA       LEU  20   7.650   0.196  -2.968
  160   1HB   LEU  20          1HB       LEU  20   9.054   2.308  -3.006
  161   2HB   LEU  20          2HB       LEU  20   8.334   2.715  -4.551
  162    HG   LEU  20           HG       LEU  20   6.058   2.259  -3.076
  163   1HD1  LEU  20          1HD1      LEU  20   7.423   1.814  -1.015
  164   2HD1  LEU  20          2HD1      LEU  20   8.085   3.457  -1.129
  165   3HD1  LEU  20          3HD1      LEU  20   6.351   3.218  -0.842
  166   1HD2  LEU  20          1HD2      LEU  20   7.648   4.846  -3.206
  167   2HD2  LEU  20          2HD2      LEU  20   6.488   4.254  -4.417
  168   3HD2  LEU  20          3HD2      LEU  20   5.923   4.703  -2.796
  169    H    ARG  21           H        ARG  21   7.785   1.670  -6.136
  170    HA   ARG  21           HA       ARG  21   5.708   2.087  -7.387
  171   1HB   ARG  21          1HB       ARG  21   7.646  -0.038  -8.370
  172   2HB   ARG  21          2HB       ARG  21   6.366   0.644  -9.374
  173   1HG   ARG  21          1HG       ARG  21   8.377   1.746  -9.901
  174   2HG   ARG  21          2HG       ARG  21   7.308   2.911  -9.116
  175   1HD   ARG  21          1HD       ARG  21   8.686   2.970  -7.144
  176   2HD   ARG  21          2HD       ARG  21   9.470   1.433  -7.567
  177    HE   ARG  21           HE       ARG  21  10.982   2.529  -8.836
  178   1HH1  ARG  21          1HH2      ARG  21   8.289   4.773  -8.249
  179   2HH1  ARG  21          2HH2      ARG  21   9.131   6.147  -8.917
  180   1HH2  ARG  21          1HH1      ARG  21  12.062   4.334  -9.713
  181   2HH2  ARG  21          2HH1      ARG  21  11.282   5.894  -9.758
  182    H    ALA  22           H        ALA  22   6.238  -1.470  -7.452
  183    HA   ALA  22           HA       ALA  22   3.493  -1.963  -6.536
  184   1HB   ALA  22          1HB       ALA  22   3.182  -1.696  -8.968
  185   2HB   ALA  22          2HB       ALA  22   4.445  -2.910  -9.274
  186   3HB   ALA  22          3HB       ALA  22   2.927  -3.377  -8.468
  187    H    ALA  23           H        ALA  23   5.608  -2.358  -5.018
  188    HA   ALA  23           HA       ALA  23   5.881  -5.288  -4.885
  189   1HB   ALA  23          1HB       ALA  23   8.280  -3.448  -5.298
  190   2HB   ALA  23          2HB       ALA  23   8.370  -5.161  -4.809
  191   3HB   ALA  23          3HB       ALA  23   7.706  -4.719  -6.389
  192    H    ASN  24           H        ASN  24   8.299  -3.431  -3.253
  193    HA   ASN  24           HA       ASN  24   7.245  -4.292  -0.711
  194   1HB   ASN  24          1HB       ASN  24   9.625  -4.350  -1.189
  195   2HB   ASN  24          2HB       ASN  24   9.649  -2.610  -1.491
  196   1HD2  ASN  24          2HD2      ASN  24  11.240  -2.277   0.158
  197   2HD2  ASN  24          1HD2      ASN  24  10.827  -2.383   1.857
  198    H    LYS  25           H        LYS  25   5.304  -3.239  -0.398
  199    HA   LYS  25           HA       LYS  25   3.951  -1.750   0.533
  200   1HB   LYS  25          1HB       LYS  25   6.361   0.071   0.945
  201   2HB   LYS  25          2HB       LYS  25   4.755   0.276   1.633
  202   1HG   LYS  25          1HG       LYS  25   4.977  -1.601   3.060
  203   2HG   LYS  25          2HG       LYS  25   6.357  -2.252   2.166
  204   1HD   LYS  25          1HD       LYS  25   7.066  -1.227   4.282
  205   2HD   LYS  25          2HD       LYS  25   7.789  -0.431   2.874
  206   1HE   LYS  25          1HE       LYS  25   6.122   1.407   3.038
  207   2HE   LYS  25          2HE       LYS  25   5.353   0.596   4.417
  208   1HZ   LYS  25          1HZ       LYS  25   8.104   1.619   4.309
  209   2HZ   LYS  25          2HZ       LYS  25   6.819   2.356   5.033
  210   3HZ   LYS  25          3HZ       LYS  25   7.389   0.919   5.622
  211    H    PHE  26           H        PHE  26   3.044  -1.674  -1.642
  212    HA   PHE  26           HA       PHE  26   3.843   0.417  -3.456
  213   1HB   PHE  26          1HB       PHE  26   2.156  -0.439  -4.916
  214   2HB   PHE  26          2HB       PHE  26   2.973  -1.798  -4.162
  215    HD1  PHE  26           HD1      PHE  26   1.793  -3.148  -2.387
  216    HD2  PHE  26           HD2      PHE  26  -0.187  -0.027  -4.591
  217    HE1  PHE  26           HE1      PHE  26  -0.370  -3.826  -1.412
  218    HE2  PHE  26           HE2      PHE  26  -2.318  -0.571  -3.455
  219    HZ   PHE  26           HZ       PHE  26  -2.422  -2.489  -1.860
  220    HA   PRO  27           HA       PRO  27   1.220   3.601  -1.857
  221   1HB   PRO  27          1HB       PRO  27   1.049   5.356  -3.921
  222   2HB   PRO  27          2HB       PRO  27   2.608   4.963  -3.134
  223   1HG   PRO  27          1HG       PRO  27   1.464   3.732  -5.661
  224   2HG   PRO  27          2HG       PRO  27   3.086   4.456  -5.443
  225   1HD   PRO  27          1HD       PRO  27   2.655   1.778  -5.214
  226   2HD   PRO  27          2HD       PRO  27   3.829   2.624  -4.164
  227    H    ALA  28           H        ALA  28  -0.889   4.578  -1.962
  228    HA   ALA  28           HA       ALA  28  -2.860   3.473  -3.884
  229   1HB   ALA  28          1HB       ALA  28  -3.089   3.306  -0.856
  230   2HB   ALA  28          2HB       ALA  28  -4.376   2.903  -1.998
  231   3HB   ALA  28          3HB       ALA  28  -2.883   1.938  -1.968
  232    H    ILE  29           H        ILE  29  -4.969   4.668  -3.643
  233    HA   ILE  29           HA       ILE  29  -4.537   7.518  -2.855
  234    HB   ILE  29           HB       ILE  29  -5.606   6.408  -5.470
  235   1HG1  ILE  29          1HG1      ILE  29  -3.218   8.213  -4.807
  236   2HG1  ILE  29          2HG1      ILE  29  -3.121   6.512  -5.269
  237   1HG2  ILE  29          1HG2      ILE  29  -5.548   9.297  -4.539
  238   2HG2  ILE  29          2HG2      ILE  29  -5.979   8.736  -6.167
  239   3HG2  ILE  29          3HG2      ILE  29  -7.005   8.318  -4.814
  240   1HD1  ILE  29          1HD1      ILE  29  -4.202   7.119  -7.479
  241   2HD1  ILE  29          2HD1      ILE  29  -3.946   8.827  -7.036
  242   3HD1  ILE  29          3HD1      ILE  29  -2.564   7.740  -7.193
  243    H    ILE  30           H        ILE  30  -6.343   8.657  -2.224
  244    HA   ILE  30           HA       ILE  30  -8.856   7.099  -1.744
  245    HB   ILE  30           HB       ILE  30  -7.614   9.275  -0.033
  246   1HG1  ILE  30          1HG1      ILE  30  -8.086   6.353   0.673
  247   2HG1  ILE  30          2HG1      ILE  30  -6.523   7.002   0.163
  248   1HG2  ILE  30          1HG2      ILE  30 -10.201   7.687   0.305
  249   2HG2  ILE  30          2HG2      ILE  30  -9.552   8.846   1.480
  250   3HG2  ILE  30          3HG2      ILE  30 -10.088   9.415  -0.084
  251   1HD1  ILE  30          1HD1      ILE  30  -6.547   8.602   2.061
  252   2HD1  ILE  30          2HD1      ILE  30  -8.040   7.843   2.663
  253   3HD1  ILE  30          3HD1      ILE  30  -6.557   6.905   2.566
  254    H    TYR  31           H        TYR  31 -10.120   7.709  -3.408
  255    HA   TYR  31           HA       TYR  31 -10.476  10.550  -4.139
  256   1HB   TYR  31          1HB       TYR  31 -11.856   7.980  -5.021
  257   2HB   TYR  31          2HB       TYR  31 -12.300   9.580  -5.577
  258    HD1  TYR  31           HD1      TYR  31  -9.481   7.112  -5.574
  259    HD2  TYR  31           HD2      TYR  31 -11.182  10.654  -7.361
  260    HE1  TYR  31           HE1      TYR  31  -7.758   7.054  -7.345
  261    HE2  TYR  31           HE2      TYR  31  -9.484  10.558  -9.160
  262    HH   TYR  31           HH       TYR  31  -6.967   8.010  -9.277
  263    H    GLY  32           H        GLY  32 -12.914  11.214  -4.184
  264   1HA   GLY  32          1HA       GLY  32 -14.875  10.175  -2.512
  265   2HA   GLY  32          2HA       GLY  32 -13.913  11.281  -1.504
  266    H    GLY  33           H        GLY  33 -16.486  11.979  -1.840
  267   1HA   GLY  33          1HA       GLY  33 -16.791  13.923  -4.029
  268   2HA   GLY  33          2HA       GLY  33 -17.919  13.575  -2.713
  269    H    LYS  34           H        LYS  34 -14.456  14.465  -2.573
  270    HA   LYS  34           HA       LYS  34 -14.595  17.154  -1.955
  271   1HB   LYS  34          1HB       LYS  34 -15.442  15.526   0.329
  272   2HB   LYS  34          2HB       LYS  34 -13.860  16.215   0.667
  273   1HG   LYS  34          1HG       LYS  34 -14.721  18.487   0.050
  274   2HG   LYS  34          2HG       LYS  34 -16.316  17.773  -0.226
  275   1HD   LYS  34          1HD       LYS  34 -16.357  18.757   1.932
  276   2HD   LYS  34          2HD       LYS  34 -16.335  17.003   2.172
  277   1HE   LYS  34          1HE       LYS  34 -13.922  17.094   2.725
  278   2HE   LYS  34          2HE       LYS  34 -13.875  18.820   2.319
  279   1HZ   LYS  34          1HZ       LYS  34 -15.379  19.216   4.126
  280   2HZ   LYS  34          2HZ       LYS  34 -15.421  17.610   4.500
  281   3HZ   LYS  34          3HZ       LYS  34 -14.015  18.459   4.656
  282    H    GLU  35           H        GLU  35 -12.514  17.944  -1.739
  283    HA   GLU  35           HA       GLU  35 -10.319  18.085  -1.608
  284   1HB   GLU  35          1HB       GLU  35 -10.713  16.465   0.390
  285   2HB   GLU  35          2HB       GLU  35 -10.087  15.199  -0.688
  286   1HG   GLU  35          1HG       GLU  35  -8.347  15.999   0.786
  287   2HG   GLU  35          2HG       GLU  35  -7.941  16.422  -0.872
  288    H    ALA  36           H        ALA  36  -8.327  17.521  -2.709
  289    HA   ALA  36           HA       ALA  36  -8.600  16.269  -5.291
  290   1HB   ALA  36          1HB       ALA  36  -6.147  17.012  -3.636
  291   2HB   ALA  36          2HB       ALA  36  -6.118  16.541  -5.346
  292   3HB   ALA  36          3HB       ALA  36  -6.945  18.031  -4.855
  293    HA   PRO  37           HA       PRO  37  -8.056  12.083  -3.902
  294   1HB   PRO  37          1HB       PRO  37  -7.060  10.798  -6.084
  295   2HB   PRO  37          2HB       PRO  37  -8.687  11.522  -6.029
  296   1HG   PRO  37          1HG       PRO  37  -6.172  12.777  -7.161
  297   2HG   PRO  37          2HG       PRO  37  -7.758  12.591  -7.967
  298   1HD   PRO  37          1HD       PRO  37  -7.078  14.898  -6.705
  299   2HD   PRO  37          2HD       PRO  37  -8.743  14.260  -6.601
  300    H    LEU  38           H        LEU  38  -6.536  12.795  -2.282
  301    HA   LEU  38           HA       LEU  38  -3.750  12.945  -2.709
  302   1HB   LEU  38          1HB       LEU  38  -3.511  13.213  -0.382
  303   2HB   LEU  38          2HB       LEU  38  -4.960  14.057  -0.897
  304    HG   LEU  38           HG       LEU  38  -5.383  13.141   1.201
  305   1HD1  LEU  38          1HD1      LEU  38  -7.295  12.936  -0.315
  306   2HD1  LEU  38          2HD1      LEU  38  -6.779  11.289  -0.754
  307   3HD1  LEU  38          3HD1      LEU  38  -7.280  11.644   0.901
  308   1HD2  LEU  38          1HD2      LEU  38  -3.578  11.389   1.189
  309   2HD2  LEU  38          2HD2      LEU  38  -5.100  10.951   1.980
  310   3HD2  LEU  38          3HD2      LEU  38  -4.732  10.297   0.387
  311    H    ALA  39           H        ALA  39  -2.066  11.638  -1.730
  312    HA   ALA  39           HA       ALA  39  -2.554   8.755  -2.254
  313   1HB   ALA  39          1HB       ALA  39  -1.038   9.899  -3.800
  314   2HB   ALA  39          2HB       ALA  39  -0.011  10.403  -2.439
  315   3HB   ALA  39          3HB       ALA  39  -0.182   8.679  -2.838
  316    H    ILE  40           H        ILE  40  -1.583   7.197  -1.001
  317    HA   ILE  40           HA       ILE  40  -0.276   7.860   1.568
  318    HB   ILE  40           HB       ILE  40  -1.715   6.085   2.639
  319   1HG1  ILE  40          1HG1      ILE  40  -3.643   6.527   0.315
  320   2HG1  ILE  40          2HG1      ILE  40  -2.522   5.159   0.384
  321   1HG2  ILE  40          1HG2      ILE  40  -2.076   8.533   2.988
  322   2HG2  ILE  40          2HG2      ILE  40  -3.294   8.511   1.698
  323   3HG2  ILE  40          3HG2      ILE  40  -3.543   7.578   3.185
  324   1HD1  ILE  40          1HD1      ILE  40  -4.646   5.743   2.473
  325   2HD1  ILE  40          2HD1      ILE  40  -4.727   4.514   1.199
  326   3HD1  ILE  40          3HD1      ILE  40  -3.507   4.389   2.479
  327    H    GLU  41           H        GLU  41   0.597   5.711   2.513
  328    HA   GLU  41           HA       GLU  41   1.384   3.835   0.323
  329   1HB   GLU  41          1HB       GLU  41   3.352   3.263   1.572
  330   2HB   GLU  41          2HB       GLU  41   3.323   4.974   1.137
  331   1HG   GLU  41          1HG       GLU  41   2.668   5.562   3.453
  332   2HG   GLU  41          2HG       GLU  41   2.676   3.845   3.897
  333    H    LEU  42           H        LEU  42   0.964   1.743   0.523
  334    HA   LEU  42           HA       LEU  42  -0.394   0.708   2.980
  335   1HB   LEU  42          1HB       LEU  42  -1.085   0.579   0.073
  336   2HB   LEU  42          2HB       LEU  42  -1.061  -0.985   0.876
  337    HG   LEU  42           HG       LEU  42  -2.658  -0.264   2.551
  338   1HD1  LEU  42          1HD1      LEU  42  -2.498   2.422   1.131
  339   2HD1  LEU  42          2HD1      LEU  42  -3.854   1.960   2.183
  340   3HD1  LEU  42          3HD1      LEU  42  -2.223   2.084   2.850
  341   1HD2  LEU  42          1HD2      LEU  42  -3.438  -1.205   0.392
  342   2HD2  LEU  42          2HD2      LEU  42  -4.610  -0.068   1.080
  343   3HD2  LEU  42          3HD2      LEU  42  -3.574   0.433  -0.272
  344    H    ASP  43           H        ASP  43  -0.026  -1.575   3.342
  345    HA   ASP  43           HA       ASP  43   2.745  -2.393   2.958
  346   1HB   ASP  43          1HB       ASP  43   2.093  -4.272   4.374
  347   2HB   ASP  43          2HB       ASP  43   1.460  -2.779   5.062
  348    H    HIS  44           H        HIS  44   2.760  -5.007   2.464
  349    HA   HIS  44           HA       HIS  44   0.869  -5.752   0.355
  350   1HB   HIS  44          1HB       HIS  44   2.814  -4.685  -0.830
  351   2HB   HIS  44          2HB       HIS  44   3.852  -5.956  -0.189
  352    HD1  HIS  44           HD1      HIS  44   2.152  -8.507  -0.751
  353    HD2  HIS  44           HD2      HIS  44   2.523  -5.237  -3.371
  354    HE1  HIS  44           HE1      HIS  44   1.592  -9.375  -3.080
  355    H    ASP  45           H        ASP  45   0.480  -6.655   2.694
  356    HA   ASP  45           HA       ASP  45   1.059  -9.503   2.492
  357   1HB   ASP  45          1HB       ASP  45   3.093  -8.854   3.668
  358   2HB   ASP  45          2HB       ASP  45   2.183  -7.850   4.804
  359    H    LYS  46           H        LYS  46   0.133  -7.076   4.957
  360    HA   LYS  46           HA       LYS  46  -1.979  -8.627   6.067
  361   1HB   LYS  46          1HB       LYS  46  -0.558  -6.648   7.030
  362   2HB   LYS  46          2HB       LYS  46  -1.768  -5.606   6.267
  363   1HG   LYS  46          1HG       LYS  46  -3.543  -6.864   7.582
  364   2HG   LYS  46          2HG       LYS  46  -2.236  -7.812   8.317
  365   1HD   LYS  46          1HD       LYS  46  -1.219  -5.589   9.107
  366   2HD   LYS  46          2HD       LYS  46  -2.690  -4.799   8.521
  367   1HE   LYS  46          1HE       LYS  46  -2.922  -5.148  10.889
  368   2HE   LYS  46          2HE       LYS  46  -4.035  -6.260  10.073
  369   1HZ   LYS  46          1HZ       LYS  46  -1.372  -6.950  11.128
  370   2HZ   LYS  46          2HZ       LYS  46  -2.808  -7.305  11.854
  371   3HZ   LYS  46          3HZ       LYS  46  -2.419  -8.001  10.413
  372    H    VAL  47           H        VAL  47  -1.831  -6.000   3.646
  373    HA   VAL  47           HA       VAL  47  -4.550  -5.532   3.280
  374    HB   VAL  47           HB       VAL  47  -2.736  -4.143   2.406
  375   1HG1  VAL  47          1HG1      VAL  47  -1.274  -5.990   1.499
  376   2HG1  VAL  47          2HG1      VAL  47  -2.423  -6.186   0.165
  377   3HG1  VAL  47          3HG1      VAL  47  -1.561  -4.657   0.373
  378   1HG2  VAL  47          1HG2      VAL  47  -5.028  -3.896   1.521
  379   2HG2  VAL  47          2HG2      VAL  47  -3.806  -3.531   0.288
  380   3HG2  VAL  47          3HG2      VAL  47  -4.672  -5.072   0.237
  381    H    MET  48           H        MET  48  -2.548  -8.143   1.836
  382    HA   MET  48           HA       MET  48  -4.535  -9.082   0.013
  383   1HB   MET  48          1HB       MET  48  -2.240  -9.687  -0.288
  384   2HB   MET  48          2HB       MET  48  -2.137 -10.403   1.321
  385   1HG   MET  48          1HG       MET  48  -2.264 -12.078  -0.479
  386   2HG   MET  48          2HG       MET  48  -3.526 -12.246   0.733
  387   1HE   MET  48          1HE       MET  48  -2.684 -10.948  -2.875
  388   2HE   MET  48          2HE       MET  48  -4.303 -10.658  -3.561
  389   3HE   MET  48          3HE       MET  48  -3.681  -9.604  -2.277
  390    H    ASN  49           H        ASN  49  -3.729  -9.963   3.398
  391    HA   ASN  49           HA       ASN  49  -5.650 -12.052   3.657
  392   1HB   ASN  49          1HB       ASN  49  -4.498 -10.225   5.805
  393   2HB   ASN  49          2HB       ASN  49  -5.327 -11.763   6.074
  394   1HD2  ASN  49          2HD2      ASN  49  -2.745 -11.300   7.069
  395   2HD2  ASN  49          1HD2      ASN  49  -1.613 -12.318   6.204
  396    H    MET  50           H        MET  50  -5.820  -8.542   4.389
  397    HA   MET  50           HA       MET  50  -8.534  -8.593   5.333
  398   1HB   MET  50          1HB       MET  50  -6.743  -6.350   4.338
  399   2HB   MET  50          2HB       MET  50  -8.364  -6.101   5.010
  400   1HG   MET  50          1HG       MET  50  -7.687  -7.259   7.095
  401   2HG   MET  50          2HG       MET  50  -6.041  -7.410   6.480
  402   1HE   MET  50          1HE       MET  50  -4.467  -5.314   5.972
  403   2HE   MET  50          2HE       MET  50  -5.697  -4.374   5.094
  404   3HE   MET  50          3HE       MET  50  -4.838  -3.660   6.474
  405    H    GLN  51           H        GLN  51  -7.111  -8.288   2.084
  406    HA   GLN  51           HA       GLN  51  -9.355  -7.213   0.763
  407   1HB   GLN  51          1HB       GLN  51  -6.930  -8.742  -0.072
  408   2HB   GLN  51          2HB       GLN  51  -8.245  -8.667  -1.229
  409   1HG   GLN  51          1HG       GLN  51  -7.391  -6.082   0.074
  410   2HG   GLN  51          2HG       GLN  51  -6.337  -6.819  -1.134
  411   1HE2  GLN  51          2HE2      GLN  51  -9.945  -6.945  -1.171
  412   2HE2  GLN  51          1HE2      GLN  51 -10.098  -6.029  -2.653
  413    H    ALA  52           H        ALA  52  -8.392 -10.630   0.308
  414    HA   ALA  52           HA       ALA  52  -9.566 -12.492  -0.041
  415   1HB   ALA  52          1HB       ALA  52 -10.570 -12.040   2.193
  416   2HB   ALA  52          2HB       ALA  52 -11.950 -11.260   1.389
  417   3HB   ALA  52          3HB       ALA  52 -11.613 -12.968   1.103
  418    H    LYS  53           H        LYS  53 -11.114  -9.506  -1.055
  419    HA   LYS  53           HA       LYS  53 -12.079  -8.843  -2.907
  420   1HB   LYS  53          1HB       LYS  53 -11.933 -11.656  -4.052
  421   2HB   LYS  53          2HB       LYS  53 -12.400 -10.191  -4.890
  422   1HG   LYS  53          1HG       LYS  53 -10.284  -9.780  -5.429
  423   2HG   LYS  53          2HG       LYS  53  -9.925  -9.505  -3.738
  424   1HD   LYS  53          1HD       LYS  53  -8.340 -11.075  -4.632
  425   2HD   LYS  53          2HD       LYS  53  -9.341 -11.891  -3.436
  426   1HE   LYS  53          1HE       LYS  53  -8.902 -13.292  -5.430
  427   2HE   LYS  53          2HE       LYS  53 -10.627 -13.011  -5.211
  428   1HZ   LYS  53          1HZ       LYS  53 -10.481 -11.286  -6.874
  429   2HZ   LYS  53          2HZ       LYS  53  -8.873 -11.595  -7.093
  430   3HZ   LYS  53          3HZ       LYS  53 -10.000 -12.737  -7.470
  431    H    ALA  54           H        ALA  54 -14.197  -8.744  -3.809
  432    HA   ALA  54           HA       ALA  54 -16.404  -8.580  -3.564
  433   1HB   ALA  54          1HB       ALA  54 -16.533 -11.011  -3.876
  434   2HB   ALA  54          2HB       ALA  54 -16.432 -11.259  -2.120
  435   3HB   ALA  54          3HB       ALA  54 -17.800 -10.378  -2.811
  436    H    GLU  55           H        GLU  55 -15.469 -10.134  -0.494
  437    HA   GLU  55           HA       GLU  55 -17.108  -8.788   1.254
  438   1HB   GLU  55          1HB       GLU  55 -14.293  -9.888   1.682
  439   2HB   GLU  55          2HB       GLU  55 -15.412  -9.458   2.988
  440   1HG   GLU  55          1HG       GLU  55 -17.007 -11.143   2.273
  441   2HG   GLU  55          2HG       GLU  55 -16.042 -11.538   0.842
  442    H    PHE  56           H        PHE  56 -13.855  -7.831   0.191
  443    HA   PHE  56           HA       PHE  56 -13.273  -5.740   1.884
  444   1HB   PHE  56          1HB       PHE  56 -11.917  -6.829   0.001
  445   2HB   PHE  56          2HB       PHE  56 -12.694  -5.711  -1.097
  446    HD1  PHE  56           HD1      PHE  56 -11.475  -3.697  -1.528
  447    HD2  PHE  56           HD2      PHE  56 -10.842  -5.774   2.195
  448    HE1  PHE  56           HE1      PHE  56  -9.467  -2.308  -1.092
  449    HE2  PHE  56           HE2      PHE  56  -8.817  -4.408   2.611
  450    HZ   PHE  56           HZ       PHE  56  -8.118  -2.679   0.963
  451    H    TYR  57           H        TYR  57 -15.051  -5.527  -1.230
  452    HA   TYR  57           HA       TYR  57 -16.164  -2.852  -0.500
  453   1HB   TYR  57          1HB       TYR  57 -16.870  -2.944  -3.001
  454   2HB   TYR  57          2HB       TYR  57 -15.232  -2.559  -2.565
  455    HD1  TYR  57           HD1      TYR  57 -13.357  -4.033  -2.938
  456    HD2  TYR  57           HD2      TYR  57 -17.333  -5.100  -4.209
  457    HE1  TYR  57           HE1      TYR  57 -12.435  -5.961  -4.185
  458    HE2  TYR  57           HE2      TYR  57 -16.401  -6.971  -5.537
  459    HH   TYR  57           HH       TYR  57 -12.920  -7.825  -5.405
  460    H    SER  58           H        SER  58 -17.236  -4.464   1.138
  461    HA   SER  58           HA       SER  58 -20.007  -4.671   0.121
  462   1HB   SER  58          1HB       SER  58 -18.652  -6.919   1.681
  463   2HB   SER  58          2HB       SER  58 -20.382  -6.783   1.339
  464    HG   SER  58           HG       SER  58 -18.326  -6.940  -0.607
  465    H    GLU  59           H        GLU  59 -18.074  -5.282   3.100
  466    HA   GLU  59           HA       GLU  59 -20.228  -4.094   4.696
  467   1HB   GLU  59          1HB       GLU  59 -19.098  -5.119   6.573
  468   2HB   GLU  59          2HB       GLU  59 -19.316  -6.282   5.263
  469   1HG   GLU  59          1HG       GLU  59 -16.938  -5.985   4.592
  470   2HG   GLU  59          2HG       GLU  59 -16.716  -4.808   5.898
  471    H    VAL  60           H        VAL  60 -18.171  -2.375   3.081
  472    HA   VAL  60           HA       VAL  60 -17.177  -0.404   3.286
  473    HB   VAL  60           HB       VAL  60 -19.160  -0.291   5.298
  474   1HG1  VAL  60          1HG1      VAL  60 -17.330  -0.379   7.041
  475   2HG1  VAL  60          2HG1      VAL  60 -16.695   1.135   6.364
  476   3HG1  VAL  60          3HG1      VAL  60 -18.321   1.083   7.054
  477   1HG2  VAL  60          1HG2      VAL  60 -18.918   1.213   3.379
  478   2HG2  VAL  60          2HG2      VAL  60 -19.122   2.083   4.908
  479   3HG2  VAL  60          3HG2      VAL  60 -17.520   1.981   4.163
  480    H    LEU  61           H        LEU  61 -15.283   0.746   4.333
  481    HA   LEU  61           HA       LEU  61 -13.613  -1.062   5.976
  482   1HB   LEU  61          1HB       LEU  61 -12.294   0.441   3.741
  483   2HB   LEU  61          2HB       LEU  61 -11.752  -0.939   4.677
  484    HG   LEU  61           HG       LEU  61 -13.789  -2.168   3.410
  485   1HD1  LEU  61          1HD1      LEU  61 -14.496  -0.059   2.217
  486   2HD1  LEU  61          2HD1      LEU  61 -12.906  -0.011   1.434
  487   3HD1  LEU  61          3HD1      LEU  61 -14.019  -1.343   1.106
  488   1HD2  LEU  61          1HD2      LEU  61 -11.067  -1.527   2.222
  489   2HD2  LEU  61          2HD2      LEU  61 -11.473  -2.876   3.308
  490   3HD2  LEU  61          3HD2      LEU  61 -12.173  -2.805   1.679
  491    H    THR  62           H        THR  62 -11.719   0.062   6.875
  492    HA   THR  62           HA       THR  62 -12.044   2.999   7.210
  493    HB   THR  62           HB       THR  62 -11.592   0.974   9.444
  494    HG1  THR  62           HG1      THR  62 -13.618   1.704  10.111
  495   1HG2  THR  62          1HG2      THR  62 -11.816   4.021   9.464
  496   2HG2  THR  62          2HG2      THR  62 -11.786   2.986  10.910
  497   3HG2  THR  62          3HG2      THR  62 -10.361   3.079   9.866
  498    H    ILE  63           H        ILE  63 -10.215   4.015   6.751
  499    HA   ILE  63           HA       ILE  63  -7.635   2.532   6.744
  500    HB   ILE  63           HB       ILE  63  -8.270   5.244   5.549
  501   1HG1  ILE  63          1HG1      ILE  63  -8.164   2.564   4.094
  502   2HG1  ILE  63          2HG1      ILE  63  -9.627   3.512   4.407
  503   1HG2  ILE  63          1HG2      ILE  63  -5.869   4.681   6.149
  504   2HG2  ILE  63          2HG2      ILE  63  -5.964   3.320   5.023
  505   3HG2  ILE  63          3HG2      ILE  63  -6.122   4.990   4.439
  506   1HD1  ILE  63          1HD1      ILE  63  -8.632   5.429   3.152
  507   2HD1  ILE  63          2HD1      ILE  63  -7.296   4.357   2.655
  508   3HD1  ILE  63          3HD1      ILE  63  -8.953   3.988   2.180
  509    H    VAL  64           H        VAL  64  -6.431   2.815   8.523
  510    HA   VAL  64           HA       VAL  64  -6.783   5.179  10.276
  511    HB   VAL  64           HB       VAL  64  -4.984   2.733  10.517
  512   1HG1  VAL  64          1HG1      VAL  64  -5.610   4.990  12.483
  513   2HG1  VAL  64          2HG1      VAL  64  -4.691   3.519  12.862
  514   3HG1  VAL  64          3HG1      VAL  64  -4.038   4.689  11.714
  515   1HG2  VAL  64          1HG2      VAL  64  -7.595   3.453  11.915
  516   2HG2  VAL  64          2HG2      VAL  64  -7.368   2.139  10.742
  517   3HG2  VAL  64          3HG2      VAL  64  -6.555   2.073  12.312
  518    H    VAL  65           H        VAL  65  -6.065   6.850   8.907
  519    HA   VAL  65           HA       VAL  65  -3.329   6.728   7.774
  520    HB   VAL  65           HB       VAL  65  -5.386   8.974   7.787
  521   1HG1  VAL  65          1HG1      VAL  65  -2.753   8.629   6.268
  522   2HG1  VAL  65          2HG1      VAL  65  -3.922   9.944   6.027
  523   3HG1  VAL  65          3HG1      VAL  65  -3.051   9.814   7.556
  524   1HG2  VAL  65          1HG2      VAL  65  -4.618   6.926   5.664
  525   2HG2  VAL  65          2HG2      VAL  65  -6.206   7.118   6.448
  526   3HG2  VAL  65          3HG2      VAL  65  -5.592   8.374   5.363
  527    H    ASP  66           H        ASP  66  -2.153   6.420   9.662
  528    HA   ASP  66           HA       ASP  66  -0.968   6.897  11.482
  529   1HB   ASP  66          1HB       ASP  66  -0.250   8.919  10.394
  530   2HB   ASP  66          2HB       ASP  66  -1.688   9.804  10.909
  531    H    GLY  67           H        GLY  67  -3.497   9.369  11.987
  532   1HA   GLY  67          1HA       GLY  67  -4.796   7.749  14.100
  533   2HA   GLY  67          2HA       GLY  67  -4.100   9.315  14.564
  534    H    LYS  68           H        LYS  68  -5.813   8.169  11.613
  535    HA   LYS  68           HA       LYS  68  -8.175   9.794  12.233
  536   1HB   LYS  68          1HB       LYS  68  -6.626  11.362  11.084
  537   2HB   LYS  68          2HB       LYS  68  -6.565  10.271   9.688
  538   1HG   LYS  68          1HG       LYS  68  -9.012  10.536   9.371
  539   2HG   LYS  68          2HG       LYS  68  -9.098  11.549  10.826
  540   1HD   LYS  68          1HD       LYS  68  -7.578  13.200   9.767
  541   2HD   LYS  68          2HD       LYS  68  -7.517  12.200   8.299
  542   1HE   LYS  68          1HE       LYS  68  -9.962  12.472   8.001
  543   2HE   LYS  68          2HE       LYS  68 -10.050  13.417   9.501
  544   1HZ   LYS  68          1HZ       LYS  68  -8.548  14.178   7.096
  545   2HZ   LYS  68          2HZ       LYS  68  -9.990  14.813   7.578
  546   3HZ   LYS  68          3HZ       LYS  68  -8.640  15.051   8.490
  547    H    GLU  69           H        GLU  69  -9.704   8.318  12.042
  548    HA   GLU  69           HA       GLU  69  -9.481   5.957  10.357
  549   1HB   GLU  69          1HB       GLU  69 -11.637   7.017  12.228
  550   2HB   GLU  69          2HB       GLU  69 -11.713   5.465  11.381
  551   1HG   GLU  69          1HG       GLU  69  -9.599   4.761  12.488
  552   2HG   GLU  69          2HG       GLU  69  -9.565   6.289  13.386
  553    H    ILE  70           H        ILE  70  -9.384   7.000   8.243
  554    HA   ILE  70           HA       ILE  70 -11.714   8.502   7.297
  555    HB   ILE  70           HB       ILE  70  -9.395   7.334   5.719
  556   1HG1  ILE  70          1HG1      ILE  70  -9.823  10.079   6.977
  557   2HG1  ILE  70          2HG1      ILE  70  -8.540   8.912   7.344
  558   1HG2  ILE  70          1HG2      ILE  70 -11.493   7.830   4.402
  559   2HG2  ILE  70          2HG2      ILE  70 -11.422   9.499   4.993
  560   3HG2  ILE  70          3HG2      ILE  70 -10.140   8.852   3.947
  561   1HD1  ILE  70          1HD1      ILE  70  -7.754   9.161   4.941
  562   2HD1  ILE  70          2HD1      ILE  70  -8.865  10.545   4.809
  563   3HD1  ILE  70          3HD1      ILE  70  -7.547  10.580   5.990
  564    H    LYS  71           H        LYS  71 -13.584   7.367   7.202
  565    HA   LYS  71           HA       LYS  71 -13.705   4.539   6.587
  566   1HB   LYS  71          1HB       LYS  71 -15.852   6.673   6.844
  567   2HB   LYS  71          2HB       LYS  71 -16.155   4.950   6.539
  568   1HG   LYS  71          1HG       LYS  71 -15.027   4.338   8.648
  569   2HG   LYS  71          2HG       LYS  71 -14.636   6.035   8.955
  570   1HD   LYS  71          1HD       LYS  71 -16.525   5.417  10.299
  571   2HD   LYS  71          2HD       LYS  71 -17.050   6.586   9.076
  572   1HE   LYS  71          1HE       LYS  71 -18.057   4.773   7.737
  573   2HE   LYS  71          2HE       LYS  71 -17.396   3.556   8.846
  574   1HZ   LYS  71          1HZ       LYS  71 -19.372   5.617   9.528
  575   2HZ   LYS  71          2HZ       LYS  71 -19.690   4.021   9.268
  576   3HZ   LYS  71          3HZ       LYS  71 -18.777   4.479  10.561
  577    H    VAL  72           H        VAL  72 -13.908   3.598   4.657
  578    HA   VAL  72           HA       VAL  72 -14.620   5.179   2.253
  579    HB   VAL  72           HB       VAL  72 -12.797   4.149   1.003
  580   1HG1  VAL  72          1HG1      VAL  72 -12.368   6.359   2.084
  581   2HG1  VAL  72          2HG1      VAL  72 -11.662   5.516   3.478
  582   3HG1  VAL  72          3HG1      VAL  72 -10.906   5.395   1.883
  583   1HG2  VAL  72          1HG2      VAL  72 -11.941   2.946   3.673
  584   2HG2  VAL  72          2HG2      VAL  72 -12.489   2.084   2.215
  585   3HG2  VAL  72          3HG2      VAL  72 -10.960   2.956   2.199
  586    H    LYS  73           H        LYS  73 -15.123   3.670   0.381
  587    HA   LYS  73           HA       LYS  73 -16.206   1.057   1.351
  588   1HB   LYS  73          1HB       LYS  73 -17.898   2.913   0.991
  589   2HB   LYS  73          2HB       LYS  73 -17.535   2.774  -0.734
  590   1HG   LYS  73          1HG       LYS  73 -18.022   0.125   0.448
  591   2HG   LYS  73          2HG       LYS  73 -19.333   1.196   0.892
  592   1HD   LYS  73          1HD       LYS  73 -18.425   0.982  -2.007
  593   2HD   LYS  73          2HD       LYS  73 -19.470  -0.234  -1.274
  594   1HE   LYS  73          1HE       LYS  73 -20.826   1.410  -2.436
  595   2HE   LYS  73          2HE       LYS  73 -21.160   1.424  -0.699
  596   1HZ   LYS  73          1HZ       LYS  73 -19.449   3.336  -2.131
  597   2HZ   LYS  73          2HZ       LYS  73 -20.980   3.624  -1.594
  598   3HZ   LYS  73          3HZ       LYS  73 -19.764   3.357  -0.514
  599    H    ALA  74           H        ALA  74 -13.775   2.229  -0.471
  600    HA   ALA  74           HA       ALA  74 -12.421   1.376  -2.014
  601   1HB   ALA  74          1HB       ALA  74 -13.956  -1.162  -1.479
  602   2HB   ALA  74          2HB       ALA  74 -12.603  -1.064  -2.608
  603   3HB   ALA  74          3HB       ALA  74 -12.367  -0.657  -0.900
  604    H    GLN  75           H        GLN  75 -12.307   2.122  -4.008
  605    HA   GLN  75           HA       GLN  75 -14.721   2.148  -5.706
  606   1HB   GLN  75          1HB       GLN  75 -13.239   4.161  -4.891
  607   2HB   GLN  75          2HB       GLN  75 -12.210   3.778  -6.240
  608   1HG   GLN  75          1HG       GLN  75 -15.223   4.321  -6.386
  609   2HG   GLN  75          2HG       GLN  75 -13.965   5.520  -6.684
  610   1HE2  GLN  75          2HE2      GLN  75 -12.424   5.136  -8.482
  611   2HE2  GLN  75          1HE2      GLN  75 -12.976   4.223  -9.875
  612    H    ASP  76           H        ASP  76 -12.068   2.590  -7.741
  613    HA   ASP  76           HA       ASP  76 -12.294  -0.122  -8.832
  614   1HB   ASP  76          1HB       ASP  76 -10.739   2.349  -9.697
  615   2HB   ASP  76          2HB       ASP  76 -10.746   0.810 -10.569
  616    H    VAL  77           H        VAL  77 -11.450  -0.724  -6.519
  617    HA   VAL  77           HA       VAL  77  -8.580  -0.654  -6.163
  618    HB   VAL  77           HB       VAL  77  -8.986  -2.213  -4.330
  619   1HG1  VAL  77          1HG1      VAL  77  -9.377   0.273  -4.105
  620   2HG1  VAL  77          2HG1      VAL  77 -11.107  -0.034  -4.330
  621   3HG1  VAL  77          3HG1      VAL  77 -10.255  -0.717  -2.931
  622   1HG2  VAL  77          1HG2      VAL  77 -11.897  -2.276  -5.239
  623   2HG2  VAL  77          2HG2      VAL  77 -10.761  -3.642  -5.161
  624   3HG2  VAL  77          3HG2      VAL  77 -11.285  -2.851  -3.680
  625    H    GLN  78           H        GLN  78  -7.061  -1.967  -7.058
  626    HA   GLN  78           HA       GLN  78  -8.045  -3.911  -9.048
  627   1HB   GLN  78          1HB       GLN  78  -6.612  -1.986  -9.667
  628   2HB   GLN  78          2HB       GLN  78  -5.276  -2.707  -8.755
  629   1HG   GLN  78          1HG       GLN  78  -5.312  -4.694 -10.180
  630   2HG   GLN  78          2HG       GLN  78  -6.765  -4.121 -11.014
  631   1HE2  GLN  78          2HE2      GLN  78  -6.514  -1.779 -11.975
  632   2HE2  GLN  78          1HE2      GLN  78  -5.028  -1.516 -12.861
  633    H    ARG  79           H        ARG  79  -8.021  -5.993  -8.596
  634    HA   ARG  79           HA       ARG  79  -6.207  -7.120  -6.508
  635   1HB   ARG  79          1HB       ARG  79  -8.774  -8.393  -7.486
  636   2HB   ARG  79          2HB       ARG  79  -7.848  -8.708  -6.020
  637   1HG   ARG  79          1HG       ARG  79  -9.542  -7.511  -5.063
  638   2HG   ARG  79          2HG       ARG  79  -8.476  -6.168  -5.459
  639   1HD   ARG  79          1HD       ARG  79 -10.771  -5.658  -6.099
  640   2HD   ARG  79          2HD       ARG  79  -9.799  -5.807  -7.568
  641    HE   ARG  79           HE       ARG  79 -11.027  -8.310  -6.920
  642   1HH1  ARG  79          1HH2      ARG  79 -11.772  -5.089  -8.225
  643   2HH1  ARG  79          2HH2      ARG  79 -13.116  -5.651  -9.185
  644   1HH2  ARG  79          1HH1      ARG  79 -12.817  -9.030  -8.174
  645   2HH2  ARG  79          2HH1      ARG  79 -13.706  -7.899  -9.159
  646    H    HIS  80           H        HIS  80  -5.979  -9.639  -6.990
  647    HA   HIS  80           HA       HIS  80  -5.935 -10.320  -9.823
  648   1HB   HIS  80          1HB       HIS  80  -3.812  -9.084  -9.494
  649   2HB   HIS  80          2HB       HIS  80  -3.348 -10.235  -8.241
  650    HD1  HIS  80           HD1      HIS  80  -4.945 -11.487 -11.508
  651    HD2  HIS  80           HD2      HIS  80  -1.181 -10.935  -9.719
  652    HE1  HIS  80           HE1      HIS  80  -3.251 -12.700 -12.978
  653    HA   PRO  81           HA       PRO  81  -6.872 -13.918  -7.188
  654   1HB   PRO  81          1HB       PRO  81  -8.058 -15.538  -9.071
  655   2HB   PRO  81          2HB       PRO  81  -8.871 -14.174  -8.273
  656   1HG   PRO  81          1HG       PRO  81  -7.603 -14.250 -11.001
  657   2HG   PRO  81          2HG       PRO  81  -9.144 -13.494 -10.523
  658   1HD   PRO  81          1HD       PRO  81  -6.808 -12.097 -10.841
  659   2HD   PRO  81          2HD       PRO  81  -8.052 -11.606  -9.656
  660    H    TYR  82           H        TYR  82  -5.587 -14.503 -10.515
  661    HA   TYR  82           HA       TYR  82  -4.699 -17.085 -10.134
  662   1HB   TYR  82          1HB       TYR  82  -3.594 -14.912 -11.944
  663   2HB   TYR  82          2HB       TYR  82  -3.123 -16.601 -12.044
  664    HD1  TYR  82           HD1      TYR  82  -5.753 -14.176 -12.856
  665    HD2  TYR  82           HD2      TYR  82  -4.765 -18.370 -12.658
  666    HE1  TYR  82           HE1      TYR  82  -7.733 -14.713 -14.248
  667    HE2  TYR  82           HE2      TYR  82  -6.724 -18.899 -14.074
  668    HH   TYR  82           HH       TYR  82  -8.544 -18.067 -15.211
  669    H    LYS  83           H        LYS  83  -2.802 -14.089  -9.591
  670    HA   LYS  83           HA       LYS  83  -0.991 -15.669  -7.834
  671   1HB   LYS  83          1HB       LYS  83  -0.220 -13.308  -9.570
  672   2HB   LYS  83          2HB       LYS  83   0.817 -14.124  -8.391
  673   1HG   LYS  83          1HG       LYS  83   0.526 -16.263  -9.670
  674   2HG   LYS  83          2HG       LYS  83  -0.374 -15.380 -10.912
  675   1HD   LYS  83          1HD       LYS  83   2.510 -14.820 -10.088
  676   2HD   LYS  83          2HD       LYS  83   1.998 -15.758 -11.502
  677   1HE   LYS  83          1HE       LYS  83   0.780 -13.729 -12.363
  678   2HE   LYS  83          2HE       LYS  83   1.459 -12.791 -11.017
  679   1HZ   LYS  83          1HZ       LYS  83   3.638 -13.319 -11.830
  680   2HZ   LYS  83          2HZ       LYS  83   3.005 -14.180 -13.085
  681   3HZ   LYS  83          3HZ       LYS  83   2.748 -12.556 -12.988
  682    HA   PRO  84           HA       PRO  84  -2.924 -12.641  -5.109
  683   1HB   PRO  84          1HB       PRO  84  -1.768 -13.297  -2.735
  684   2HB   PRO  84          2HB       PRO  84  -2.902 -14.387  -3.574
  685   1HG   PRO  84          1HG       PRO  84   0.125 -14.474  -3.664
  686   2HG   PRO  84          2HG       PRO  84  -0.999 -15.816  -3.311
  687   1HD   PRO  84          1HD       PRO  84   0.028 -15.398  -5.803
  688   2HD   PRO  84          2HD       PRO  84  -1.646 -15.986  -5.575
  689    H    LYS  85           H        LYS  85  -1.860 -10.956  -6.409
  690    HA   LYS  85           HA       LYS  85   0.341  -9.609  -4.941
  691   1HB   LYS  85          1HB       LYS  85   1.172 -10.995  -6.907
  692   2HB   LYS  85          2HB       LYS  85   0.264  -9.900  -7.966
  693   1HG   LYS  85          1HG       LYS  85   1.577  -7.977  -7.040
  694   2HG   LYS  85          2HG       LYS  85   2.433  -9.111  -5.975
  695   1HD   LYS  85          1HD       LYS  85   3.273 -10.323  -8.017
  696   2HD   LYS  85          2HD       LYS  85   2.445  -9.124  -9.027
  697   1HE   LYS  85          1HE       LYS  85   4.796  -8.538  -8.863
  698   2HE   LYS  85          2HE       LYS  85   3.836  -7.316  -8.012
  699   1HZ   LYS  85          1HZ       LYS  85   5.262  -9.557  -6.747
  700   2HZ   LYS  85          2HZ       LYS  85   5.779  -7.992  -6.788
  701   3HZ   LYS  85          3HZ       LYS  85   4.413  -8.385  -5.957
  702    H    LEU  86           H        LEU  86   0.018  -7.482  -4.655
  703    HA   LEU  86           HA       LEU  86  -2.424  -6.244  -5.744
  704   1HB   LEU  86          1HB       LEU  86  -0.330  -5.461  -3.690
  705   2HB   LEU  86          2HB       LEU  86  -1.471  -4.284  -4.326
  706    HG   LEU  86           HG       LEU  86  -2.156  -5.197  -2.168
  707   1HD1  LEU  86          1HD1      LEU  86  -3.788  -4.297  -3.805
  708   2HD1  LEU  86          2HD1      LEU  86  -4.140  -5.955  -4.343
  709   3HD1  LEU  86          3HD1      LEU  86  -4.474  -5.477  -2.670
  710   1HD2  LEU  86          1HD2      LEU  86  -1.316  -7.525  -2.449
  711   2HD2  LEU  86          2HD2      LEU  86  -2.992  -7.419  -1.875
  712   3HD2  LEU  86          3HD2      LEU  86  -2.669  -7.840  -3.567
  713    H    GLN  87           H        GLN  87  -2.363  -4.160  -6.715
  714    HA   GLN  87           HA       GLN  87   0.110  -3.452  -8.236
  715   1HB   GLN  87          1HB       GLN  87  -2.768  -3.632  -9.231
  716   2HB   GLN  87          2HB       GLN  87  -1.457  -2.845 -10.124
  717   1HG   GLN  87          1HG       GLN  87  -1.456  -5.796  -9.316
  718   2HG   GLN  87          2HG       GLN  87  -2.006  -5.176 -10.867
  719   1HE2  GLN  87          2HE2      GLN  87   0.875  -5.587  -8.800
  720   2HE2  GLN  87          1HE2      GLN  87   2.033  -5.383 -10.101
  721    H    HIS  88           H        HIS  88  -3.238  -2.273  -7.569
  722    HA   HIS  88           HA       HIS  88  -2.211   0.012  -6.117
  723   1HB   HIS  88          1HB       HIS  88  -1.957   0.669  -8.560
  724   2HB   HIS  88          2HB       HIS  88  -3.707   0.484  -8.730
  725    HD1  HIS  88           HD1      HIS  88  -5.170   2.519  -7.759
  726    HD2  HIS  88           HD2      HIS  88  -1.046   2.658  -6.907
  727    HE1  HIS  88           HE1      HIS  88  -4.713   4.789  -6.714
  728    H    ILE  89           H        ILE  89  -3.918   1.180  -5.080
  729    HA   ILE  89           HA       ILE  89  -6.595  -0.136  -5.032
  730    HB   ILE  89           HB       ILE  89  -4.791   0.596  -2.709
  731   1HG1  ILE  89          1HG1      ILE  89  -4.349  -1.646  -3.701
  732   2HG1  ILE  89          2HG1      ILE  89  -4.902  -1.691  -2.031
  733   1HG2  ILE  89          1HG2      ILE  89  -7.719  -0.208  -2.646
  734   2HG2  ILE  89          2HG2      ILE  89  -6.639  -0.157  -1.245
  735   3HG2  ILE  89          3HG2      ILE  89  -7.020   1.329  -2.132
  736   1HD1  ILE  89          1HD1      ILE  89  -6.623  -2.303  -4.471
  737   2HD1  ILE  89          2HD1      ILE  89  -5.914  -3.473  -3.356
  738   3HD1  ILE  89          3HD1      ILE  89  -7.157  -2.377  -2.767
  739    H    ASP  90           H        ASP  90  -8.042   1.287  -5.616
  740    HA   ASP  90           HA       ASP  90  -7.677   4.206  -5.085
  741   1HB   ASP  90          1HB       ASP  90  -9.350   2.735  -7.157
  742   2HB   ASP  90          2HB       ASP  90  -9.238   4.488  -6.929
  743    H    PHE  91           H        PHE  91  -8.661   4.525  -3.117
  744    HA   PHE  91           HA       PHE  91 -11.155   3.112  -2.428
  745   1HB   PHE  91          1HB       PHE  91  -9.447   5.105  -0.920
  746   2HB   PHE  91          2HB       PHE  91 -10.895   4.342  -0.291
  747    HD1  PHE  91           HD1      PHE  91 -10.967   1.731  -0.246
  748    HD2  PHE  91           HD2      PHE  91  -7.349   4.071  -0.477
  749    HE1  PHE  91           HE1      PHE  91  -9.717  -0.089   0.870
  750    HE2  PHE  91           HE2      PHE  91  -6.128   2.283   0.729
  751    HZ   PHE  91           HZ       PHE  91  -7.310   0.206   1.410
  752    H    VAL  92           H        VAL  92 -13.018   4.340  -1.623
  753    HA   VAL  92           HA       VAL  92 -13.274   7.129  -2.583
  754    HB   VAL  92           HB       VAL  92 -14.420   5.883  -4.252
  755   1HG1  VAL  92          1HG1      VAL  92 -14.885   3.761  -2.956
  756   2HG1  VAL  92          2HG1      VAL  92 -16.190   4.615  -2.110
  757   3HG1  VAL  92          3HG1      VAL  92 -16.272   4.379  -3.859
  758   1HG2  VAL  92          1HG2      VAL  92 -15.407   7.995  -3.499
  759   2HG2  VAL  92          2HG2      VAL  92 -16.620   6.861  -4.114
  760   3HG2  VAL  92          3HG2      VAL  92 -16.457   7.111  -2.368
  761    H    ARG  93           H        ARG  93 -13.823   8.409  -0.922
  762    HA   ARG  93           HA       ARG  93 -14.220   7.487   1.713
  763   1HB   ARG  93          1HB       ARG  93 -14.769  10.144   0.377
  764   2HB   ARG  93          2HB       ARG  93 -15.016   9.876   2.110
  765   1HG   ARG  93          1HG       ARG  93 -12.723   9.288   2.476
  766   2HG   ARG  93          2HG       ARG  93 -12.372   9.262   0.741
  767   1HD   ARG  93          1HD       ARG  93 -12.745  11.652   0.557
  768   2HD   ARG  93          2HD       ARG  93 -13.252  11.748   2.260
  769    HE   ARG  93           HE       ARG  93 -10.744  10.614   2.375
  770   1HH1  ARG  93          1HH2      ARG  93 -11.999  13.622   0.944
  771   2HH1  ARG  93          2HH2      ARG  93 -10.554  14.529   1.307
  772   1HH2  ARG  93          1HH1      ARG  93  -8.848  11.824   2.794
  773   2HH2  ARG  93          2HH1      ARG  93  -8.750  13.500   2.322
  774    H    ALA  94           H        ALA  94 -15.911   6.823   2.855
  775    HA   ALA  94           HA       ALA  94 -18.426   6.268   1.504
  776   1HB   ALA  94          1HB       ALA  94 -17.485   5.780   4.364
  777   2HB   ALA  94          2HB       ALA  94 -18.974   5.136   3.631
  778   3HB   ALA  94          3HB       ALA  94 -17.389   4.637   3.009
  Start of MODEL    4
    1    H    MET   1           H        MET   1 -14.436  -0.753   8.530
    2    HA   MET   1           HA       MET   1 -14.655  -2.898  10.195
    3   1HB   MET   1          1HB       MET   1 -15.202  -3.883   7.373
    4   2HB   MET   1          2HB       MET   1 -15.097  -4.861   8.839
    5   1HG   MET   1          1HG       MET   1 -17.312  -2.863   8.198
    6   2HG   MET   1          2HG       MET   1 -17.358  -4.609   8.034
    7   1HE   MET   1          1HE       MET   1 -18.055  -1.628  10.310
    8   2HE   MET   1          2HE       MET   1 -17.976  -2.298  11.953
    9   3HE   MET   1          3HE       MET   1 -16.483  -1.983  11.060
   10    H    PHE   2           H        PHE   2 -13.036  -4.805   9.336
   11    HA   PHE   2           HA       PHE   2 -10.872  -5.312   8.998
   12   1HB   PHE   2          1HB       PHE   2 -10.888  -3.198   6.814
   13   2HB   PHE   2          2HB       PHE   2  -9.816  -4.579   6.948
   14    HD1  PHE   2           HD1      PHE   2 -10.705  -6.928   6.625
   15    HD2  PHE   2           HD2      PHE   2 -13.065  -3.420   5.783
   16    HE1  PHE   2           HE1      PHE   2 -12.176  -8.265   5.145
   17    HE2  PHE   2           HE2      PHE   2 -14.556  -4.770   4.345
   18    HZ   PHE   2           HZ       PHE   2 -14.122  -7.196   4.026
   19    H    THR   3           H        THR   3  -8.531  -4.015   8.482
   20    HA   THR   3           HA       THR   3  -8.403  -1.460   9.893
   21    HB   THR   3           HB       THR   3  -6.794  -3.815  10.990
   22    HG1  THR   3           HG1      THR   3  -9.223  -2.674  11.796
   23   1HG2  THR   3          1HG2      THR   3  -7.223  -0.959  11.992
   24   2HG2  THR   3          2HG2      THR   3  -6.272  -2.220  12.801
   25   3HG2  THR   3          3HG2      THR   3  -5.728  -1.567  11.246
   26    H    ILE   4           H        ILE   4  -7.890  -0.917   7.662
   27    HA   ILE   4           HA       ILE   4  -5.437  -2.018   6.487
   28    HB   ILE   4           HB       ILE   4  -7.262   0.252   5.624
   29   1HG1  ILE   4          1HG1      ILE   4  -7.697  -1.236   3.688
   30   2HG1  ILE   4          2HG1      ILE   4  -6.751  -2.521   4.444
   31   1HG2  ILE   4          1HG2      ILE   4  -4.812  -0.929   4.240
   32   2HG2  ILE   4          2HG2      ILE   4  -5.932   0.258   3.542
   33   3HG2  ILE   4          3HG2      ILE   4  -4.918   0.711   4.906
   34   1HD1  ILE   4          1HD1      ILE   4  -9.255  -1.290   5.680
   35   2HD1  ILE   4          2HD1      ILE   4  -9.258  -2.719   4.627
   36   3HD1  ILE   4          3HD1      ILE   4  -8.422  -2.790   6.175
   37    H    ASN   5           H        ASN   5  -3.764  -1.631   7.856
   38    HA   ASN   5           HA       ASN   5  -3.255   0.854   9.206
   39   1HB   ASN   5          1HB       ASN   5  -2.328  -1.250  10.015
   40   2HB   ASN   5          2HB       ASN   5  -1.474  -1.501   8.485
   41   1HD2  ASN   5          2HD2      ASN   5  -1.807   1.145  10.956
   42   2HD2  ASN   5          1HD2      ASN   5  -0.094   1.504  11.013
   43    H    ALA   6           H        ALA   6  -2.771   2.720   8.170
   44    HA   ALA   6           HA       ALA   6  -1.037   2.666   5.740
   45   1HB   ALA   6          1HB       ALA   6  -3.438   2.919   5.105
   46   2HB   ALA   6          2HB       ALA   6  -3.537   4.349   6.159
   47   3HB   ALA   6          3HB       ALA   6  -2.476   4.362   4.738
   48    H    GLU   7           H        GLU   7  -0.374   4.996   5.251
   49    HA   GLU   7           HA       GLU   7  -0.083   6.773   7.530
   50   1HB   GLU   7          1HB       GLU   7   1.767   4.922   7.604
   51   2HB   GLU   7          2HB       GLU   7   2.475   5.761   6.217
   52   1HG   GLU   7          1HG       GLU   7   2.701   7.810   7.600
   53   2HG   GLU   7          2HG       GLU   7   1.814   7.033   8.921
   54    H    VAL   8           H        VAL   8   1.121   8.788   6.724
   55    HA   VAL   8           HA       VAL   8  -0.224   9.604   4.301
   56    HB   VAL   8           HB       VAL   8   0.652  11.848   4.909
   57   1HG1  VAL   8          1HG1      VAL   8  -1.510  11.014   5.744
   58   2HG1  VAL   8          2HG1      VAL   8  -0.708  10.330   7.175
   59   3HG1  VAL   8          3HG1      VAL   8  -0.723  12.084   6.917
   60   1HG2  VAL   8          1HG2      VAL   8   2.785  11.122   6.088
   61   2HG2  VAL   8          2HG2      VAL   8   1.777  12.240   7.014
   62   3HG2  VAL   8          3HG2      VAL   8   1.785  10.521   7.423
   63    H    ARG   9           H        ARG   9   1.244   7.825   3.229
   64    HA   ARG   9           HA       ARG   9   2.889   7.173   1.900
   65   1HB   ARG   9          1HB       ARG   9   1.652   9.150   0.656
   66   2HB   ARG   9          2HB       ARG   9   3.238   9.914   0.719
   67   1HG   ARG   9          1HG       ARG   9   2.502   7.176  -0.445
   68   2HG   ARG   9          2HG       ARG   9   2.889   8.635  -1.362
   69   1HD   ARG   9          1HD       ARG   9   5.229   8.558  -0.469
   70   2HD   ARG   9          2HD       ARG   9   4.820   7.093   0.439
   71    HE   ARG   9           HE       ARG   9   4.962   5.807  -1.399
   72   1HH1  ARG   9          1HH2      ARG   9   4.823   9.189  -2.482
   73   2HH1  ARG   9          2HH2      ARG   9   5.219   8.803  -4.136
   74   1HH2  ARG   9          1HH1      ARG   9   5.455   5.320  -3.561
   75   2HH2  ARG   9          2HH1      ARG   9   5.567   6.583  -4.757
   76    H    LYS  10           H        LYS  10   3.841   7.331   4.291
   77    HA   LYS  10           HA       LYS  10   6.168   9.038   4.577
   78   1HB   LYS  10          1HB       LYS  10   4.660   8.328   6.384
   79   2HB   LYS  10          2HB       LYS  10   5.228   6.675   6.240
   80   1HG   LYS  10          1HG       LYS  10   6.996   9.113   6.835
   81   2HG   LYS  10          2HG       LYS  10   6.187   8.193   8.094
   82   1HD   LYS  10          1HD       LYS  10   8.372   7.119   6.271
   83   2HD   LYS  10          2HD       LYS  10   8.516   7.587   7.959
   84   1HE   LYS  10          1HE       LYS  10   6.934   5.836   8.655
   85   2HE   LYS  10          2HE       LYS  10   6.741   5.302   6.976
   86   1HZ   LYS  10          1HZ       LYS  10   9.250   5.257   8.467
   87   2HZ   LYS  10          2HZ       LYS  10   8.283   3.966   8.127
   88   3HZ   LYS  10          3HZ       LYS  10   9.033   4.772   6.901
   89    H    GLU  11           H        GLU  11   7.072   8.461   2.561
   90    HA   GLU  11           HA       GLU  11   9.203   6.583   2.787
   91   1HB   GLU  11          1HB       GLU  11   7.111   5.173   1.978
   92   2HB   GLU  11          2HB       GLU  11   7.375   5.994   0.437
   93   1HG   GLU  11          1HG       GLU  11   8.525   3.870   0.410
   94   2HG   GLU  11          2HG       GLU  11   9.748   5.141   0.478
   95    H    GLN  12           H        GLN  12   7.197   8.662   0.743
   96    HA   GLN  12           HA       GLN  12   7.601  10.483  -0.443
   97   1HB   GLN  12          1HB       GLN  12   8.935  11.044   1.594
   98   2HB   GLN  12          2HB       GLN  12  10.402  10.527   0.746
   99   1HG   GLN  12          1HG       GLN  12   9.956  12.243  -1.019
  100   2HG   GLN  12          2HG       GLN  12   8.494  12.736  -0.157
  101   1HE2  GLN  12          2HE2      GLN  12   8.718  13.798   1.936
  102   2HE2  GLN  12          1HE2      GLN  12  10.230  14.567   2.372
  103    H    GLY  13           H        GLY  13   7.396   8.819  -2.188
  104   1HA   GLY  13          1HA       GLY  13   9.692   8.130  -3.809
  105   2HA   GLY  13          2HA       GLY  13   7.982   8.042  -4.260
  106    H    LYS  14           H        LYS  14   9.264   8.787  -6.299
  107    HA   LYS  14           HA       LYS  14   9.638  10.302  -7.890
  108   1HB   LYS  14          1HB       LYS  14   7.308  11.068  -6.976
  109   2HB   LYS  14          2HB       LYS  14   8.166  12.483  -6.376
  110   1HG   LYS  14          1HG       LYS  14   8.016  11.481  -9.261
  111   2HG   LYS  14          2HG       LYS  14   7.115  12.832  -8.562
  112   1HD   LYS  14          1HD       LYS  14   9.276  14.046  -8.169
  113   2HD   LYS  14          2HD       LYS  14  10.141  12.694  -8.926
  114   1HE   LYS  14          1HE       LYS  14   9.899  14.424 -10.566
  115   2HE   LYS  14          2HE       LYS  14   8.876  13.057 -11.038
  116   1HZ   LYS  14          1HZ       LYS  14   7.963  15.509  -9.694
  117   2HZ   LYS  14          2HZ       LYS  14   7.777  15.157 -11.292
  118   3HZ   LYS  14          3HZ       LYS  14   6.999  14.254 -10.157
  119    H    GLY  15           H        GLY  15  11.775   9.856  -6.747
  120   1HA   GLY  15          1HA       GLY  15  13.736  11.533  -6.962
  121   2HA   GLY  15          2HA       GLY  15  13.044  12.244  -5.491
  122    H    ALA  16           H        ALA  16  12.806  10.882  -3.587
  123    HA   ALA  16           HA       ALA  16  14.963   8.911  -3.262
  124   1HB   ALA  16          1HB       ALA  16  14.551  10.585  -1.529
  125   2HB   ALA  16          2HB       ALA  16  12.895   9.995  -1.308
  126   3HB   ALA  16          3HB       ALA  16  14.275   8.949  -0.913
  127    H    SER  17           H        SER  17  14.119   7.399  -4.853
  128    HA   SER  17           HA       SER  17  11.639   6.263  -5.013
  129   1HB   SER  17          1HB       SER  17  14.287   4.800  -5.374
  130   2HB   SER  17          2HB       SER  17  12.720   4.358  -6.086
  131    HG   SER  17           HG       SER  17  12.753   6.433  -7.120
  132    H    ARG  18           H        ARG  18  14.291   5.155  -2.875
  133    HA   ARG  18           HA       ARG  18  14.294   4.111  -0.874
  134   1HB   ARG  18          1HB       ARG  18  11.640   5.571  -0.931
  135   2HB   ARG  18          2HB       ARG  18  12.086   4.670   0.489
  136   1HG   ARG  18          1HG       ARG  18  14.144   6.548  -0.652
  137   2HG   ARG  18          2HG       ARG  18  12.748   7.231   0.191
  138   1HD   ARG  18          1HD       ARG  18  14.541   5.082   1.382
  139   2HD   ARG  18          2HD       ARG  18  14.754   6.805   1.681
  140    HE   ARG  18           HE       ARG  18  12.535   5.050   2.600
  141   1HH1  ARG  18          1HH2      ARG  18  13.720   8.405   2.429
  142   2HH1  ARG  18          2HH2      ARG  18  12.581   8.971   3.622
  143   1HH2  ARG  18          1HH1      ARG  18  11.062   5.805   4.047
  144   2HH2  ARG  18          2HH1      ARG  18  11.078   7.468   4.603
  145    H    ARG  19           H        ARG  19  12.605   2.813   0.736
  146    HA   ARG  19           HA       ARG  19  12.326   0.185  -0.401
  147   1HB   ARG  19          1HB       ARG  19  11.481   1.474   2.228
  148   2HB   ARG  19          2HB       ARG  19  11.255  -0.240   1.860
  149   1HG   ARG  19          1HG       ARG  19  13.664  -0.552   1.561
  150   2HG   ARG  19          2HG       ARG  19  13.955   1.177   1.852
  151   1HD   ARG  19          1HD       ARG  19  13.023   0.985   4.112
  152   2HD   ARG  19          2HD       ARG  19  12.673  -0.739   3.848
  153    HE   ARG  19           HE       ARG  19  15.380  -0.466   3.306
  154   1HH1  ARG  19          1HH2      ARG  19  13.292   0.121   6.116
  155   2HH1  ARG  19          2HH2      ARG  19  14.552  -0.201   7.279
  156   1HH2  ARG  19          1HH1      ARG  19  17.021  -0.902   4.843
  157   2HH2  ARG  19          2HH1      ARG  19  16.681  -0.791   6.550
  158    H    LEU  20           H        LEU  20  10.972   0.717  -2.225
  159    HA   LEU  20           HA       LEU  20   8.071   0.756  -1.554
  160   1HB   LEU  20          1HB       LEU  20   8.945   3.023  -2.306
  161   2HB   LEU  20          2HB       LEU  20   9.406   2.268  -3.832
  162    HG   LEU  20           HG       LEU  20   6.919   1.567  -4.058
  163   1HD1  LEU  20          1HD1      LEU  20   6.673   3.639  -1.818
  164   2HD1  LEU  20          2HD1      LEU  20   5.322   3.035  -2.791
  165   3HD1  LEU  20          3HD1      LEU  20   6.189   1.932  -1.723
  166   1HD2  LEU  20          1HD2      LEU  20   7.662   4.521  -4.048
  167   2HD2  LEU  20          2HD2      LEU  20   7.961   3.370  -5.367
  168   3HD2  LEU  20          3HD2      LEU  20   6.298   3.787  -4.929
  169    H    ARG  21           H        ARG  21  10.457   0.302  -4.176
  170    HA   ARG  21           HA       ARG  21   8.909  -1.923  -5.327
  171   1HB   ARG  21          1HB       ARG  21  10.470  -1.941  -7.104
  172   2HB   ARG  21          2HB       ARG  21   9.805  -0.329  -6.900
  173   1HG   ARG  21          1HG       ARG  21  12.579  -1.105  -5.854
  174   2HG   ARG  21          2HG       ARG  21  12.261  -0.606  -7.507
  175   1HD   ARG  21          1HD       ARG  21  11.248   1.557  -6.595
  176   2HD   ARG  21          2HD       ARG  21  11.898   1.096  -5.016
  177    HE   ARG  21           HE       ARG  21  13.987   1.627  -5.633
  178   1HH1  ARG  21          1HH2      ARG  21  12.049   1.390  -8.605
  179   2HH1  ARG  21          2HH2      ARG  21  13.285   2.097  -9.611
  180   1HH2  ARG  21          1HH1      ARG  21  15.592   2.553  -6.971
  181   2HH2  ARG  21          2HH1      ARG  21  15.305   2.759  -8.677
  182    H    ALA  22           H        ALA  22  11.930  -1.336  -3.523
  183    HA   ALA  22           HA       ALA  22  12.925  -4.022  -3.708
  184   1HB   ALA  22          1HB       ALA  22  13.491  -1.817  -1.680
  185   2HB   ALA  22          2HB       ALA  22  14.423  -3.319  -1.879
  186   3HB   ALA  22          3HB       ALA  22  14.376  -2.124  -3.191
  187    H    ALA  23           H        ALA  23  11.263  -2.236  -1.048
  188    HA   ALA  23           HA       ALA  23  10.608  -4.675   0.419
  189   1HB   ALA  23          1HB       ALA  23   9.616  -1.807   0.682
  190   2HB   ALA  23          2HB       ALA  23   9.281  -3.127   1.825
  191   3HB   ALA  23          3HB       ALA  23  10.948  -2.559   1.600
  192    H    ASN  24           H        ASN  24   8.376  -5.376   0.760
  193    HA   ASN  24           HA       ASN  24   6.912  -5.458  -1.755
  194   1HB   ASN  24          1HB       ASN  24   7.387  -7.416  -0.209
  195   2HB   ASN  24          2HB       ASN  24   6.183  -6.761   0.903
  196   1HD2  ASN  24          2HD2      ASN  24   5.188  -8.941   0.496
  197   2HD2  ASN  24          1HD2      ASN  24   4.199  -9.165  -0.932
  198    H    LYS  25           H        LYS  25   6.477  -3.145  -1.772
  199    HA   LYS  25           HA       LYS  25   4.081  -2.296  -0.208
  200   1HB   LYS  25          1HB       LYS  25   6.768  -0.893  -0.545
  201   2HB   LYS  25          2HB       LYS  25   5.285  -0.033  -0.102
  202   1HG   LYS  25          1HG       LYS  25   5.019  -1.436   1.876
  203   2HG   LYS  25          2HG       LYS  25   6.528  -2.300   1.519
  204   1HD   LYS  25          1HD       LYS  25   7.819  -0.253   1.721
  205   2HD   LYS  25          2HD       LYS  25   6.360   0.728   1.886
  206   1HE   LYS  25          1HE       LYS  25   7.392  -1.338   3.879
  207   2HE   LYS  25          2HE       LYS  25   7.416   0.429   4.048
  208   1HZ   LYS  25          1HZ       LYS  25   4.961   0.313   3.875
  209   2HZ   LYS  25          2HZ       LYS  25   5.079  -1.331   4.012
  210   3HZ   LYS  25          3HZ       LYS  25   5.594  -0.371   5.242
  211    H    PHE  26           H        PHE  26   3.062  -0.361  -1.170
  212    HA   PHE  26           HA       PHE  26   3.829   0.514  -3.785
  213   1HB   PHE  26          1HB       PHE  26   1.952  -0.248  -5.073
  214   2HB   PHE  26          2HB       PHE  26   2.696  -1.663  -4.365
  215    HD1  PHE  26           HD1      PHE  26   1.634  -2.562  -2.129
  216    HD2  PHE  26           HD2      PHE  26  -0.367   0.120  -4.847
  217    HE1  PHE  26           HE1      PHE  26  -0.534  -3.149  -1.110
  218    HE2  PHE  26           HE2      PHE  26  -2.538  -0.435  -3.790
  219    HZ   PHE  26           HZ       PHE  26  -2.634  -2.085  -1.943
  220    HA   PRO  27           HA       PRO  27   1.444   3.869  -2.048
  221   1HB   PRO  27          1HB       PRO  27   1.076   5.529  -4.164
  222   2HB   PRO  27          2HB       PRO  27   2.698   5.207  -3.485
  223   1HG   PRO  27          1HG       PRO  27   1.411   3.883  -5.890
  224   2HG   PRO  27          2HG       PRO  27   3.042   4.605  -5.784
  225   1HD   PRO  27          1HD       PRO  27   2.585   1.923  -5.465
  226   2HD   PRO  27          2HD       PRO  27   3.864   2.769  -4.554
  227    H    ALA  28           H        ALA  28  -0.720   4.390  -1.742
  228    HA   ALA  28           HA       ALA  28  -2.752   3.507  -3.740
  229   1HB   ALA  28          1HB       ALA  28  -2.899   3.106  -0.727
  230   2HB   ALA  28          2HB       ALA  28  -4.228   2.838  -1.871
  231   3HB   ALA  28          3HB       ALA  28  -2.764   1.838  -1.965
  232    H    ILE  29           H        ILE  29  -4.868   4.691  -3.267
  233    HA   ILE  29           HA       ILE  29  -4.269   7.520  -2.509
  234    HB   ILE  29           HB       ILE  29  -5.452   6.432  -5.088
  235   1HG1  ILE  29          1HG1      ILE  29  -2.967   8.121  -4.499
  236   2HG1  ILE  29          2HG1      ILE  29  -2.972   6.421  -4.977
  237   1HG2  ILE  29          1HG2      ILE  29  -6.729   8.434  -4.369
  238   2HG2  ILE  29          2HG2      ILE  29  -5.201   9.336  -4.218
  239   3HG2  ILE  29          3HG2      ILE  29  -5.768   8.756  -5.797
  240   1HD1  ILE  29          1HD1      ILE  29  -4.100   7.105  -7.142
  241   2HD1  ILE  29          2HD1      ILE  29  -3.738   8.792  -6.698
  242   3HD1  ILE  29          3HD1      ILE  29  -2.421   7.635  -6.915
  243    H    ILE  30           H        ILE  30  -5.948   8.713  -1.742
  244    HA   ILE  30           HA       ILE  30  -8.572   7.369  -1.275
  245    HB   ILE  30           HB       ILE  30  -7.166   9.427   0.458
  246   1HG1  ILE  30          1HG1      ILE  30  -7.791   6.471   0.888
  247   2HG1  ILE  30          2HG1      ILE  30  -6.192   7.215   0.750
  248   1HG2  ILE  30          1HG2      ILE  30  -9.640   9.767   0.361
  249   2HG2  ILE  30          2HG2      ILE  30  -9.876   8.065   0.811
  250   3HG2  ILE  30          3HG2      ILE  30  -9.125   9.221   1.936
  251   1HD1  ILE  30          1HD1      ILE  30  -6.705   8.536   2.844
  252   2HD1  ILE  30          2HD1      ILE  30  -8.185   7.560   3.025
  253   3HD1  ILE  30          3HD1      ILE  30  -6.613   6.782   3.076
  254    H    TYR  31           H        TYR  31  -9.660   8.043  -2.993
  255    HA   TYR  31           HA       TYR  31 -10.124  10.899  -3.598
  256   1HB   TYR  31          1HB       TYR  31 -11.484   8.307  -4.462
  257   2HB   TYR  31          2HB       TYR  31 -11.969   9.907  -4.991
  258    HD1  TYR  31           HD1      TYR  31  -9.133   7.450  -5.101
  259    HD2  TYR  31           HD2      TYR  31 -11.015  10.887  -6.910
  260    HE1  TYR  31           HE1      TYR  31  -7.579   7.295  -7.020
  261    HE2  TYR  31           HE2      TYR  31  -9.503  10.683  -8.859
  262    HH   TYR  31           HH       TYR  31  -6.961   8.167  -9.057
  263    H    GLY  32           H        GLY  32 -12.608  11.452  -3.451
  264   1HA   GLY  32          1HA       GLY  32 -14.210  10.082  -1.506
  265   2HA   GLY  32          2HA       GLY  32 -13.486  11.541  -0.799
  266    H    GLY  33           H        GLY  33 -14.553  13.433  -1.152
  267   1HA   GLY  33          1HA       GLY  33 -16.932  13.530  -2.880
  268   2HA   GLY  33          2HA       GLY  33 -16.326  14.766  -1.767
  269    H    LYS  34           H        LYS  34 -16.529  16.424  -3.334
  270    HA   LYS  34           HA       LYS  34 -14.997  16.320  -5.821
  271   1HB   LYS  34          1HB       LYS  34 -17.237  17.498  -5.483
  272   2HB   LYS  34          2HB       LYS  34 -16.385  18.686  -4.503
  273   1HG   LYS  34          1HG       LYS  34 -16.552  19.636  -6.650
  274   2HG   LYS  34          2HG       LYS  34 -14.873  19.082  -6.569
  275   1HD   LYS  34          1HD       LYS  34 -15.505  17.043  -7.876
  276   2HD   LYS  34          2HD       LYS  34 -17.199  17.578  -7.876
  277   1HE   LYS  34          1HE       LYS  34 -16.532  19.630  -9.126
  278   2HE   LYS  34          2HE       LYS  34 -14.849  19.061  -9.139
  279   1HZ   LYS  34          1HZ       LYS  34 -15.580  17.149 -10.378
  280   2HZ   LYS  34          2HZ       LYS  34 -17.139  17.687 -10.366
  281   3HZ   LYS  34          3HZ       LYS  34 -15.978  18.540 -11.165
  282    H    GLU  35           H        GLU  35 -13.081  15.675  -4.465
  283    HA   GLU  35           HA       GLU  35 -11.509  18.005  -3.461
  284   1HB   GLU  35          1HB       GLU  35 -12.638  16.769  -1.598
  285   2HB   GLU  35          2HB       GLU  35 -11.854  15.270  -2.139
  286   1HG   GLU  35          1HG       GLU  35  -9.617  16.342  -1.720
  287   2HG   GLU  35          2HG       GLU  35 -10.451  17.787  -1.120
  288    H    ALA  36           H        ALA  36  -9.297  17.828  -3.858
  289    HA   ALA  36           HA       ALA  36  -8.423  16.180  -6.001
  290   1HB   ALA  36          1HB       ALA  36  -7.417  18.351  -5.541
  291   2HB   ALA  36          2HB       ALA  36  -6.827  17.777  -3.966
  292   3HB   ALA  36          3HB       ALA  36  -6.184  17.077  -5.467
  293    HA   PRO  37           HA       PRO  37  -7.971  12.593  -3.405
  294   1HB   PRO  37          1HB       PRO  37  -6.819  10.815  -5.116
  295   2HB   PRO  37          2HB       PRO  37  -8.481  11.426  -5.321
  296   1HG   PRO  37          1HG       PRO  37  -5.970  12.462  -6.671
  297   2HG   PRO  37          2HG       PRO  37  -7.502  11.978  -7.454
  298   1HD   PRO  37          1HD       PRO  37  -6.989  14.569  -6.845
  299   2HD   PRO  37          2HD       PRO  37  -8.633  13.892  -6.620
  300    H    LEU  38           H        LEU  38  -6.524  12.062  -1.843
  301    HA   LEU  38           HA       LEU  38  -3.726  13.012  -2.118
  302   1HB   LEU  38          1HB       LEU  38  -3.624  13.017   0.272
  303   2HB   LEU  38          2HB       LEU  38  -5.017  13.913  -0.319
  304    HG   LEU  38           HG       LEU  38  -6.391  11.736   0.202
  305   1HD1  LEU  38          1HD1      LEU  38  -3.899  11.311   1.929
  306   2HD1  LEU  38          2HD1      LEU  38  -5.461  10.525   2.205
  307   3HD1  LEU  38          3HD1      LEU  38  -4.558  10.171   0.741
  308   1HD2  LEU  38          1HD2      LEU  38  -5.217  13.505   2.381
  309   2HD2  LEU  38          2HD2      LEU  38  -6.641  13.867   1.381
  310   3HD2  LEU  38          3HD2      LEU  38  -6.688  12.523   2.534
  311    H    ALA  39           H        ALA  39  -1.965  11.709  -1.322
  312    HA   ALA  39           HA       ALA  39  -2.302   8.856  -2.058
  313   1HB   ALA  39          1HB       ALA  39  -0.624  10.172  -3.266
  314   2HB   ALA  39          2HB       ALA  39   0.186  10.567  -1.731
  315   3HB   ALA  39          3HB       ALA  39   0.130   8.884  -2.303
  316    H    ILE  40           H        ILE  40  -1.457   7.192  -0.777
  317    HA   ILE  40           HA       ILE  40  -0.464   7.764   1.935
  318    HB   ILE  40           HB       ILE  40  -1.906   5.937   2.840
  319   1HG1  ILE  40          1HG1      ILE  40  -3.581   6.277   0.312
  320   2HG1  ILE  40          2HG1      ILE  40  -2.468   4.929   0.600
  321   1HG2  ILE  40          1HG2      ILE  40  -2.413   8.372   3.159
  322   2HG2  ILE  40          2HG2      ILE  40  -3.538   8.274   1.788
  323   3HG2  ILE  40          3HG2      ILE  40  -3.830   7.326   3.257
  324   1HD1  ILE  40          1HD1      ILE  40  -3.749   4.328   2.653
  325   2HD1  ILE  40          2HD1      ILE  40  -4.924   5.591   2.249
  326   3HD1  ILE  40          3HD1      ILE  40  -4.694   4.223   1.154
  327    H    GLU  41           H        GLU  41   0.588   5.879   2.880
  328    HA   GLU  41           HA       GLU  41   1.966   4.198   0.884
  329   1HB   GLU  41          1HB       GLU  41   2.857   5.372   3.205
  330   2HB   GLU  41          2HB       GLU  41   2.398   3.796   3.824
  331   1HG   GLU  41          1HG       GLU  41   4.307   4.356   1.504
  332   2HG   GLU  41          2HG       GLU  41   4.761   3.866   3.138
  333    H    LEU  42           H        LEU  42   1.620   1.914   0.792
  334    HA   LEU  42           HA       LEU  42  -0.193   0.687   2.735
  335   1HB   LEU  42          1HB       LEU  42  -1.223   1.512   0.228
  336   2HB   LEU  42          2HB       LEU  42  -0.898  -0.206   0.033
  337    HG   LEU  42           HG       LEU  42  -2.213  -0.642   2.153
  338   1HD1  LEU  42          1HD1      LEU  42  -2.726   2.351   1.886
  339   2HD1  LEU  42          2HD1      LEU  42  -3.833   1.284   2.759
  340   3HD1  LEU  42          3HD1      LEU  42  -2.178   1.470   3.333
  341   1HD2  LEU  42          1HD2      LEU  42  -3.232  -0.855  -0.100
  342   2HD2  LEU  42          2HD2      LEU  42  -4.405  -0.335   1.120
  343   3HD2  LEU  42          3HD2      LEU  42  -3.740   0.841  -0.026
  344    H    ASP  43           H        ASP  43   0.533  -1.178   3.369
  345    HA   ASP  43           HA       ASP  43   2.963  -2.242   2.112
  346   1HB   ASP  43          1HB       ASP  43   2.826  -1.608   4.538
  347   2HB   ASP  43          2HB       ASP  43   1.645  -2.901   4.775
  348    H    HIS  44           H        HIS  44   2.995  -4.083   0.941
  349    HA   HIS  44           HA       HIS  44   0.477  -5.452   0.410
  350   1HB   HIS  44          1HB       HIS  44   2.051  -4.747  -1.356
  351   2HB   HIS  44          2HB       HIS  44   3.238  -5.889  -0.744
  352    HD1  HIS  44           HD1      HIS  44   2.099  -8.580  -0.690
  353    HD2  HIS  44           HD2      HIS  44   0.610  -5.639  -3.286
  354    HE1  HIS  44           HE1      HIS  44   0.807  -9.819  -2.531
  355    H    ASP  45           H        ASP  45   0.420  -6.143   2.727
  356    HA   ASP  45           HA       ASP  45   0.930  -9.016   2.700
  357   1HB   ASP  45          1HB       ASP  45   2.131  -7.216   4.856
  358   2HB   ASP  45          2HB       ASP  45   1.709  -8.908   5.155
  359    H    LYS  46           H        LYS  46  -0.015  -6.308   4.857
  360    HA   LYS  46           HA       LYS  46  -2.294  -7.578   5.988
  361   1HB   LYS  46          1HB       LYS  46  -1.547  -4.646   5.629
  362   2HB   LYS  46          2HB       LYS  46  -2.986  -5.200   6.509
  363   1HG   LYS  46          1HG       LYS  46  -1.588  -6.519   8.038
  364   2HG   LYS  46          2HG       LYS  46  -0.118  -5.992   7.188
  365   1HD   LYS  46          1HD       LYS  46  -0.587  -3.653   7.733
  366   2HD   LYS  46          2HD       LYS  46  -2.100  -4.099   8.540
  367   1HE   LYS  46          1HE       LYS  46   0.687  -5.013   9.402
  368   2HE   LYS  46          2HE       LYS  46  -0.215  -3.667  10.120
  369   1HZ   LYS  46          1HZ       LYS  46  -1.925  -5.218  10.743
  370   2HZ   LYS  46          2HZ       LYS  46  -1.068  -6.475  10.110
  371   3HZ   LYS  46          3HZ       LYS  46  -0.473  -5.640  11.396
  372    H    VAL  47           H        VAL  47  -2.259  -4.954   3.468
  373    HA   VAL  47           HA       VAL  47  -4.989  -5.198   2.959
  374    HB   VAL  47           HB       VAL  47  -3.587  -3.247   2.423
  375   1HG1  VAL  47          1HG1      VAL  47  -1.731  -4.516   1.260
  376   2HG1  VAL  47          2HG1      VAL  47  -2.810  -4.719  -0.130
  377   3HG1  VAL  47          3HG1      VAL  47  -2.333  -3.093   0.396
  378   1HG2  VAL  47          1HG2      VAL  47  -5.887  -3.480   1.547
  379   2HG2  VAL  47          2HG2      VAL  47  -4.846  -2.598   0.419
  380   3HG2  VAL  47          3HG2      VAL  47  -5.263  -4.284   0.091
  381    H    MET  48           H        MET  48  -2.293  -7.002   1.499
  382    HA   MET  48           HA       MET  48  -3.690  -8.184  -0.654
  383   1HB   MET  48          1HB       MET  48  -1.252  -8.286  -0.420
  384   2HB   MET  48          2HB       MET  48  -1.404  -9.262   1.052
  385   1HG   MET  48          1HG       MET  48  -0.874 -10.706  -0.842
  386   2HG   MET  48          2HG       MET  48  -2.472 -11.070  -0.223
  387   1HE   MET  48          1HE       MET  48  -2.401 -12.530  -2.567
  388   2HE   MET  48          2HE       MET  48  -3.998 -12.012  -1.989
  389   3HE   MET  48          3HE       MET  48  -3.597 -11.879  -3.714
  390    H    ASN  49           H        ASN  49  -3.604  -8.991   2.828
  391    HA   ASN  49           HA       ASN  49  -5.179 -11.433   2.492
  392   1HB   ASN  49          1HB       ASN  49  -4.468  -9.852   4.991
  393   2HB   ASN  49          2HB       ASN  49  -5.229 -11.447   4.939
  394   1HD2  ASN  49          2HD2      ASN  49  -2.796 -10.923   6.314
  395   2HD2  ASN  49          1HD2      ASN  49  -1.521 -11.815   5.512
  396    H    MET  50           H        MET  50  -5.764  -8.052   3.591
  397    HA   MET  50           HA       MET  50  -8.437  -8.384   4.398
  398   1HB   MET  50          1HB       MET  50  -7.136  -5.920   3.179
  399   2HB   MET  50          2HB       MET  50  -8.673  -5.946   4.050
  400   1HG   MET  50          1HG       MET  50  -5.989  -6.655   5.274
  401   2HG   MET  50          2HG       MET  50  -6.826  -5.115   5.426
  402   1HE   MET  50          1HE       MET  50  -6.471  -5.233   8.014
  403   2HE   MET  50          2HE       MET  50  -6.988  -6.595   9.035
  404   3HE   MET  50          3HE       MET  50  -5.663  -6.811   7.866
  405    H    GLN  51           H        GLN  51  -7.154  -7.533   1.137
  406    HA   GLN  51           HA       GLN  51  -9.609  -6.910  -0.003
  407   1HB   GLN  51          1HB       GLN  51  -8.604  -6.998  -2.151
  408   2HB   GLN  51          2HB       GLN  51  -7.549  -6.254  -0.963
  409   1HG   GLN  51          1HG       GLN  51  -6.038  -7.499  -2.119
  410   2HG   GLN  51          2HG       GLN  51  -6.411  -8.579  -0.777
  411   1HE2  GLN  51          2HE2      GLN  51  -5.230  -9.810  -2.769
  412   2HE2  GLN  51          1HE2      GLN  51  -6.328 -10.679  -3.820
  413    H    ALA  52           H        ALA  52  -7.971 -10.087  -0.150
  414    HA   ALA  52           HA       ALA  52  -8.692 -12.166  -0.493
  415   1HB   ALA  52          1HB       ALA  52  -9.820 -11.760   1.618
  416   2HB   ALA  52          2HB       ALA  52 -11.263 -11.152   0.789
  417   3HB   ALA  52          3HB       ALA  52 -10.778 -12.848   0.596
  418    H    LYS  53           H        LYS  53 -11.803 -10.536  -1.192
  419    HA   LYS  53           HA       LYS  53 -11.653 -11.195  -4.023
  420   1HB   LYS  53          1HB       LYS  53 -12.584 -13.237  -2.737
  421   2HB   LYS  53          2HB       LYS  53 -13.974 -12.263  -2.351
  422   1HG   LYS  53          1HG       LYS  53 -14.541 -13.595  -4.249
  423   2HG   LYS  53          2HG       LYS  53 -14.363 -11.959  -4.860
  424   1HD   LYS  53          1HD       LYS  53 -13.381 -13.630  -6.365
  425   2HD   LYS  53          2HD       LYS  53 -12.183 -12.464  -5.820
  426   1HE   LYS  53          1HE       LYS  53 -11.340 -14.806  -5.897
  427   2HE   LYS  53          2HE       LYS  53 -11.193 -14.086  -4.293
  428   1HZ   LYS  53          1HZ       LYS  53 -13.322 -15.922  -5.160
  429   2HZ   LYS  53          2HZ       LYS  53 -12.033 -16.312  -4.208
  430   3HZ   LYS  53          3HZ       LYS  53 -13.174 -15.263  -3.655
  431    H    ALA  54           H        ALA  54 -14.879 -10.731  -3.216
  432    HA   ALA  54           HA       ALA  54 -14.748  -7.862  -3.862
  433   1HB   ALA  54          1HB       ALA  54 -17.051  -9.841  -3.714
  434   2HB   ALA  54          2HB       ALA  54 -17.169  -8.155  -4.253
  435   3HB   ALA  54          3HB       ALA  54 -16.199  -9.315  -5.185
  436    H    GLU  55           H        GLU  55 -15.251  -9.930  -1.111
  437    HA   GLU  55           HA       GLU  55 -17.136  -8.693   0.405
  438   1HB   GLU  55          1HB       GLU  55 -15.872 -10.838   0.860
  439   2HB   GLU  55          2HB       GLU  55 -14.529  -9.859   1.467
  440   1HG   GLU  55          1HG       GLU  55 -15.863 -10.649   3.329
  441   2HG   GLU  55          2HG       GLU  55 -16.086  -8.903   3.210
  442    H    PHE  56           H        PHE  56 -13.739  -7.787   0.102
  443    HA   PHE  56           HA       PHE  56 -13.149  -5.921   1.927
  444   1HB   PHE  56          1HB       PHE  56 -11.851  -6.723  -0.026
  445   2HB   PHE  56          2HB       PHE  56 -12.727  -5.635  -1.078
  446    HD1  PHE  56           HD1      PHE  56 -10.613  -5.670   2.051
  447    HD2  PHE  56           HD2      PHE  56 -11.780  -3.491  -1.477
  448    HE1  PHE  56           HE1      PHE  56  -8.675  -4.145   2.348
  449    HE2  PHE  56           HE2      PHE  56  -9.864  -1.938  -1.144
  450    HZ   PHE  56           HZ       PHE  56  -8.282  -2.304   0.733
  451    H    TYR  57           H        TYR  57 -14.830  -4.998  -1.135
  452    HA   TYR  57           HA       TYR  57 -15.520  -2.364  -0.034
  453   1HB   TYR  57          1HB       TYR  57 -16.431  -1.987  -2.318
  454   2HB   TYR  57          2HB       TYR  57 -14.717  -2.349  -2.204
  455    HD1  TYR  57           HD1      TYR  57 -18.016  -3.870  -3.129
  456    HD2  TYR  57           HD2      TYR  57 -13.724  -4.123  -3.367
  457    HE1  TYR  57           HE1      TYR  57 -18.211  -5.459  -5.023
  458    HE2  TYR  57           HE2      TYR  57 -13.915  -5.639  -5.317
  459    HH   TYR  57           HH       TYR  57 -15.351  -6.604  -6.844
  460    H    SER  58           H        SER  58 -17.046  -5.431   0.058
  461    HA   SER  58           HA       SER  58 -19.740  -4.574  -0.431
  462   1HB   SER  58          1HB       SER  58 -18.739  -6.996   1.112
  463   2HB   SER  58          2HB       SER  58 -20.365  -6.744   0.466
  464    HG   SER  58           HG       SER  58 -17.963  -6.885  -1.056
  465    H    GLU  59           H        GLU  59 -17.902  -5.214   2.611
  466    HA   GLU  59           HA       GLU  59 -20.223  -4.316   4.182
  467   1HB   GLU  59          1HB       GLU  59 -19.141  -5.414   6.029
  468   2HB   GLU  59          2HB       GLU  59 -19.226  -6.480   4.625
  469   1HG   GLU  59          1HG       GLU  59 -16.845  -6.095   4.137
  470   2HG   GLU  59          2HG       GLU  59 -16.748  -4.898   5.437
  471    H    VAL  60           H        VAL  60 -17.973  -2.429   2.869
  472    HA   VAL  60           HA       VAL  60 -17.121  -0.434   3.308
  473    HB   VAL  60           HB       VAL  60 -19.295  -0.393   5.026
  474   1HG1  VAL  60          1HG1      VAL  60 -17.791  -0.854   7.038
  475   2HG1  VAL  60          2HG1      VAL  60 -16.951   0.662   6.675
  476   3HG1  VAL  60          3HG1      VAL  60 -18.668   0.676   7.088
  477   1HG2  VAL  60          1HG2      VAL  60 -18.594   1.374   3.444
  478   2HG2  VAL  60          2HG2      VAL  60 -19.058   1.999   5.032
  479   3HG2  VAL  60          3HG2      VAL  60 -17.346   1.885   4.602
  480    H    LEU  61           H        LEU  61 -15.313   0.637   4.525
  481    HA   LEU  61           HA       LEU  61 -13.753  -1.264   6.170
  482   1HB   LEU  61          1HB       LEU  61 -12.358   0.287   3.989
  483   2HB   LEU  61          2HB       LEU  61 -11.810  -1.084   4.938
  484    HG   LEU  61           HG       LEU  61 -13.787  -2.348   3.651
  485   1HD1  LEU  61          1HD1      LEU  61 -12.939  -0.153   1.689
  486   2HD1  LEU  61          2HD1      LEU  61 -13.935  -1.546   1.306
  487   3HD1  LEU  61          3HD1      LEU  61 -14.565  -0.306   2.389
  488   1HD2  LEU  61          1HD2      LEU  61 -11.070  -1.631   2.492
  489   2HD2  LEU  61          2HD2      LEU  61 -11.451  -2.997   3.574
  490   3HD2  LEU  61          3HD2      LEU  61 -12.138  -2.938   1.941
  491    H    THR  62           H        THR  62 -11.866  -0.293   7.131
  492    HA   THR  62           HA       THR  62 -12.059   2.624   7.716
  493    HB   THR  62           HB       THR  62 -11.410   0.333   9.629
  494    HG1  THR  62           HG1      THR  62 -13.403   0.822  10.508
  495   1HG2  THR  62          1HG2      THR  62 -11.723   3.338  10.036
  496   2HG2  THR  62          2HG2      THR  62 -11.583   2.146  11.350
  497   3HG2  THR  62          3HG2      THR  62 -10.227   2.405  10.241
  498    H    ILE  63           H        ILE  63 -10.241   3.583   6.970
  499    HA   ILE  63           HA       ILE  63  -7.675   2.073   6.888
  500    HB   ILE  63           HB       ILE  63  -8.287   4.811   5.744
  501   1HG1  ILE  63          1HG1      ILE  63  -8.261   2.138   4.272
  502   2HG1  ILE  63          2HG1      ILE  63  -9.688   3.138   4.597
  503   1HG2  ILE  63          1HG2      ILE  63  -5.879   4.199   6.289
  504   2HG2  ILE  63          2HG2      ILE  63  -6.028   2.842   5.164
  505   3HG2  ILE  63          3HG2      ILE  63  -6.150   4.513   4.584
  506   1HD1  ILE  63          1HD1      ILE  63  -8.614   5.027   3.338
  507   2HD1  ILE  63          2HD1      ILE  63  -7.333   3.896   2.831
  508   3HD1  ILE  63          3HD1      ILE  63  -9.006   3.603   2.367
  509    H    VAL  64           H        VAL  64  -6.268   2.416   8.509
  510    HA   VAL  64           HA       VAL  64  -6.645   4.647  10.417
  511    HB   VAL  64           HB       VAL  64  -4.603   2.391  10.352
  512   1HG1  VAL  64          1HG1      VAL  64  -5.342   4.407  12.521
  513   2HG1  VAL  64          2HG1      VAL  64  -4.239   3.030  12.724
  514   3HG1  VAL  64          3HG1      VAL  64  -3.804   4.349  11.634
  515   1HG2  VAL  64          1HG2      VAL  64  -7.192   2.703  11.929
  516   2HG2  VAL  64          2HG2      VAL  64  -6.867   1.486  10.674
  517   3HG2  VAL  64          3HG2      VAL  64  -5.971   1.441  12.197
  518    H    VAL  65           H        VAL  65  -6.271   6.375   8.932
  519    HA   VAL  65           HA       VAL  65  -3.644   6.586   7.582
  520    HB   VAL  65           HB       VAL  65  -5.959   8.565   7.712
  521   1HG1  VAL  65          1HG1      VAL  65  -3.486   8.417   5.918
  522   2HG1  VAL  65          2HG1      VAL  65  -4.817   9.580   5.754
  523   3HG1  VAL  65          3HG1      VAL  65  -3.775   9.633   7.178
  524   1HG2  VAL  65          1HG2      VAL  65  -5.193   6.545   5.566
  525   2HG2  VAL  65          2HG2      VAL  65  -6.675   6.525   6.557
  526   3HG2  VAL  65          3HG2      VAL  65  -6.412   7.822   5.389
  527    H    ASP  66           H        ASP  66  -2.350   6.479   9.473
  528    HA   ASP  66           HA       ASP  66  -1.283   7.175  11.323
  529   1HB   ASP  66          1HB       ASP  66  -0.478   8.857   9.735
  530   2HB   ASP  66          2HB       ASP  66  -1.836   9.922  10.126
  531    H    GLY  67           H        GLY  67  -3.249   6.250  12.392
  532   1HA   GLY  67          1HA       GLY  67  -4.439   6.352  14.367
  533   2HA   GLY  67          2HA       GLY  67  -4.264   8.109  14.427
  534    H    LYS  68           H        LYS  68  -5.363   8.969  12.040
  535    HA   LYS  68           HA       LYS  68  -8.070   8.996  12.818
  536   1HB   LYS  68          1HB       LYS  68  -6.868   9.917  10.180
  537   2HB   LYS  68          2HB       LYS  68  -8.469  10.331  10.819
  538   1HG   LYS  68          1HG       LYS  68  -7.186  11.187  12.923
  539   2HG   LYS  68          2HG       LYS  68  -5.750  11.166  11.887
  540   1HD   LYS  68          1HD       LYS  68  -8.354  12.686  11.384
  541   2HD   LYS  68          2HD       LYS  68  -6.836  13.384  11.971
  542   1HE   LYS  68          1HE       LYS  68  -5.714  12.745   9.843
  543   2HE   LYS  68          2HE       LYS  68  -7.243  12.075   9.240
  544   1HZ   LYS  68          1HZ       LYS  68  -8.207  14.242   9.429
  545   2HZ   LYS  68          2HZ       LYS  68  -6.787  14.874   9.980
  546   3HZ   LYS  68          3HZ       LYS  68  -6.884  14.276   8.447
  547    H    GLU  69           H        GLU  69  -9.674   7.654  12.485
  548    HA   GLU  69           HA       GLU  69  -9.518   5.365  10.704
  549   1HB   GLU  69          1HB       GLU  69 -11.652   6.437  12.598
  550   2HB   GLU  69          2HB       GLU  69 -11.794   4.933  11.681
  551   1HG   GLU  69          1HG       GLU  69  -9.742   4.063  12.780
  552   2HG   GLU  69          2HG       GLU  69  -9.640   5.549  13.745
  553    H    ILE  70           H        ILE  70  -9.370   6.505   8.638
  554    HA   ILE  70           HA       ILE  70 -11.649   8.100   7.718
  555    HB   ILE  70           HB       ILE  70  -9.322   6.912   6.169
  556   1HG1  ILE  70          1HG1      ILE  70  -8.432   8.425   7.834
  557   2HG1  ILE  70          2HG1      ILE  70  -8.327   9.143   6.231
  558   1HG2  ILE  70          1HG2      ILE  70 -11.401   9.010   5.424
  559   2HG2  ILE  70          2HG2      ILE  70  -9.920   8.686   4.500
  560   3HG2  ILE  70          3HG2      ILE  70 -11.148   7.429   4.674
  561   1HD1  ILE  70          1HD1      ILE  70 -10.323  10.557   6.737
  562   2HD1  ILE  70          2HD1      ILE  70 -10.375   9.858   8.377
  563   3HD1  ILE  70          3HD1      ILE  70  -8.980  10.816   7.860
  564    H    LYS  71           H        LYS  71 -13.541   7.065   7.526
  565    HA   LYS  71           HA       LYS  71 -13.765   4.265   6.815
  566   1HB   LYS  71          1HB       LYS  71 -15.649   6.497   7.520
  567   2HB   LYS  71          2HB       LYS  71 -16.280   5.174   6.537
  568   1HG   LYS  71          1HG       LYS  71 -16.705   4.723   8.854
  569   2HG   LYS  71          2HG       LYS  71 -15.625   3.505   8.161
  570   1HD   LYS  71          1HD       LYS  71 -13.677   4.589   9.215
  571   2HD   LYS  71          2HD       LYS  71 -14.714   5.856   9.893
  572   1HE   LYS  71          1HE       LYS  71 -15.001   2.865  10.479
  573   2HE   LYS  71          2HE       LYS  71 -14.097   3.996  11.499
  574   1HZ   LYS  71          1HZ       LYS  71 -16.119   5.212  11.838
  575   2HZ   LYS  71          2HZ       LYS  71 -16.966   4.148  10.901
  576   3HZ   LYS  71          3HZ       LYS  71 -16.285   3.642  12.312
  577    H    VAL  72           H        VAL  72 -13.979   3.395   4.859
  578    HA   VAL  72           HA       VAL  72 -14.618   5.061   2.487
  579    HB   VAL  72           HB       VAL  72 -12.788   4.019   1.238
  580   1HG1  VAL  72          1HG1      VAL  72 -12.285   6.171   2.399
  581   2HG1  VAL  72          2HG1      VAL  72 -11.667   5.251   3.787
  582   3HG1  VAL  72          3HG1      VAL  72 -10.868   5.144   2.216
  583   1HG2  VAL  72          1HG2      VAL  72 -12.003   2.712   3.878
  584   2HG2  VAL  72          2HG2      VAL  72 -12.611   1.904   2.415
  585   3HG2  VAL  72          3HG2      VAL  72 -11.045   2.693   2.388
  586    H    LYS  73           H        LYS  73 -15.339   3.762   0.655
  587    HA   LYS  73           HA       LYS  73 -16.152   0.966   1.343
  588   1HB   LYS  73          1HB       LYS  73 -18.013   2.718   1.191
  589   2HB   LYS  73          2HB       LYS  73 -17.721   2.697  -0.563
  590   1HG   LYS  73          1HG       LYS  73 -18.062   0.155  -0.441
  591   2HG   LYS  73          2HG       LYS  73 -18.506   0.350   1.249
  592   1HD   LYS  73          1HD       LYS  73 -19.956   1.490  -1.187
  593   2HD   LYS  73          2HD       LYS  73 -20.419   0.090  -0.220
  594   1HE   LYS  73          1HE       LYS  73 -21.835   1.716   0.604
  595   2HE   LYS  73          2HE       LYS  73 -20.535   1.720   1.804
  596   1HZ   LYS  73          1HZ       LYS  73 -20.859   3.591  -0.449
  597   2HZ   LYS  73          2HZ       LYS  73 -21.192   3.917   1.131
  598   3HZ   LYS  73          3HZ       LYS  73 -19.639   3.652   0.653
  599    H    ALA  74           H        ALA  74 -13.946   2.724  -0.324
  600    HA   ALA  74           HA       ALA  74 -12.564   2.326  -1.969
  601   1HB   ALA  74          1HB       ALA  74 -12.558   0.015  -0.897
  602   2HB   ALA  74          2HB       ALA  74 -13.559  -0.496  -2.275
  603   3HB   ALA  74          3HB       ALA  74 -11.934   0.156  -2.545
  604    H    GLN  75           H        GLN  75 -12.490   1.138  -4.411
  605    HA   GLN  75           HA       GLN  75 -14.960   1.745  -5.863
  606   1HB   GLN  75          1HB       GLN  75 -13.633   3.888  -5.345
  607   2HB   GLN  75          2HB       GLN  75 -12.479   3.377  -6.549
  608   1HG   GLN  75          1HG       GLN  75 -15.484   3.823  -6.941
  609   2HG   GLN  75          2HG       GLN  75 -14.224   4.994  -7.331
  610   1HE2  GLN  75          2HE2      GLN  75 -12.418   4.096  -8.884
  611   2HE2  GLN  75          1HE2      GLN  75 -13.062   3.265 -10.280
  612    H    ASP  76           H        ASP  76 -12.180   2.009  -7.884
  613    HA   ASP  76           HA       ASP  76 -12.709  -0.695  -8.913
  614   1HB   ASP  76          1HB       ASP  76 -12.650   1.146 -10.498
  615   2HB   ASP  76          2HB       ASP  76 -11.024   1.605  -9.964
  616    H    VAL  77           H        VAL  77 -11.857  -1.484  -6.773
  617    HA   VAL  77           HA       VAL  77  -9.089  -1.313  -6.150
  618    HB   VAL  77           HB       VAL  77  -9.479  -3.238  -4.690
  619   1HG1  VAL  77          1HG1      VAL  77 -10.112  -0.903  -4.051
  620   2HG1  VAL  77          2HG1      VAL  77 -11.771  -1.226  -4.588
  621   3HG1  VAL  77          3HG1      VAL  77 -11.083  -2.138  -3.237
  622   1HG2  VAL  77          1HG2      VAL  77 -12.320  -3.342  -5.808
  623   2HG2  VAL  77          2HG2      VAL  77 -11.101  -4.620  -5.975
  624   3HG2  VAL  77          3HG2      VAL  77 -11.699  -4.201  -4.384
  625    H    GLN  78           H        GLN  78  -7.447  -1.955  -7.409
  626    HA   GLN  78           HA       GLN  78  -7.995  -3.809  -9.601
  627   1HB   GLN  78          1HB       GLN  78  -6.745  -1.534  -9.671
  628   2HB   GLN  78          2HB       GLN  78  -5.382  -2.395  -8.985
  629   1HG   GLN  78          1HG       GLN  78  -5.179  -2.281 -11.418
  630   2HG   GLN  78          2HG       GLN  78  -5.415  -3.966 -10.934
  631   1HE2  GLN  78          2HE2      GLN  78  -7.665  -1.155 -11.528
  632   2HE2  GLN  78          1HE2      GLN  78  -8.691  -2.018 -12.641
  633    H    ARG  79           H        ARG  79  -8.391  -5.298  -7.585
  634    HA   ARG  79           HA       ARG  79  -5.953  -6.493  -6.480
  635   1HB   ARG  79          1HB       ARG  79  -7.379  -7.453  -4.812
  636   2HB   ARG  79          2HB       ARG  79  -7.711  -5.737  -4.990
  637   1HG   ARG  79          1HG       ARG  79  -9.835  -6.606  -4.772
  638   2HG   ARG  79          2HG       ARG  79  -9.691  -6.440  -6.519
  639   1HD   ARG  79          1HD       ARG  79  -8.752  -9.073  -5.844
  640   2HD   ARG  79          2HD       ARG  79 -10.195  -8.809  -4.887
  641    HE   ARG  79           HE       ARG  79  -9.942  -8.998  -7.807
  642   1HH1  ARG  79          1HH2      ARG  79 -12.121  -8.053  -5.137
  643   2HH1  ARG  79          2HH2      ARG  79 -13.538  -8.068  -6.149
  644   1HH2  ARG  79          1HH1      ARG  79 -11.836  -9.090  -9.069
  645   2HH2  ARG  79          2HH1      ARG  79 -13.385  -8.685  -8.377
  646    H    HIS  80           H        HIS  80  -5.330  -8.561  -6.671
  647    HA   HIS  80           HA       HIS  80  -6.617 -10.167  -8.824
  648   1HB   HIS  80          1HB       HIS  80  -4.443  -9.038  -9.339
  649   2HB   HIS  80          2HB       HIS  80  -3.669 -10.073  -8.139
  650    HD1  HIS  80           HD1      HIS  80  -5.405 -12.760  -9.071
  651    HD2  HIS  80           HD2      HIS  80  -3.307 -10.022 -11.485
  652    HE1  HIS  80           HE1      HIS  80  -4.952 -13.934 -11.286
  653    HA   PRO  81           HA       PRO  81  -6.651 -12.938  -5.140
  654   1HB   PRO  81          1HB       PRO  81  -8.712 -14.551  -5.839
  655   2HB   PRO  81          2HB       PRO  81  -8.984 -12.863  -5.319
  656   1HG   PRO  81          1HG       PRO  81  -8.804 -13.904  -8.155
  657   2HG   PRO  81          2HG       PRO  81 -10.084 -12.873  -7.453
  658   1HD   PRO  81          1HD       PRO  81  -7.960 -11.897  -8.875
  659   2HD   PRO  81          2HD       PRO  81  -8.683 -10.971  -7.524
  660    H    TYR  82           H        TYR  82  -6.573 -15.436  -5.091
  661    HA   TYR  82           HA       TYR  82  -5.703 -17.405  -5.634
  662   1HB   TYR  82          1HB       TYR  82  -5.295 -16.624  -8.529
  663   2HB   TYR  82          2HB       TYR  82  -5.496 -18.216  -7.831
  664    HD1  TYR  82           HD1      TYR  82  -7.870 -18.291  -6.305
  665    HD2  TYR  82           HD2      TYR  82  -7.099 -15.960  -9.854
  666    HE1  TYR  82           HE1      TYR  82 -10.301 -18.129  -6.731
  667    HE2  TYR  82           HE2      TYR  82  -9.530 -15.828 -10.291
  668    HH   TYR  82           HH       TYR  82 -11.951 -17.372  -8.155
  669    H    LYS  83           H        LYS  83  -3.878 -15.099  -7.719
  670    HA   LYS  83           HA       LYS  83  -1.358 -16.065  -6.482
  671   1HB   LYS  83          1HB       LYS  83  -0.231 -15.030  -8.404
  672   2HB   LYS  83          2HB       LYS  83  -1.307 -16.373  -8.809
  673   1HG   LYS  83          1HG       LYS  83  -2.977 -14.882  -9.716
  674   2HG   LYS  83          2HG       LYS  83  -2.142 -13.454  -9.087
  675   1HD   LYS  83          1HD       LYS  83  -1.731 -13.613 -11.441
  676   2HD   LYS  83          2HD       LYS  83  -0.221 -13.869 -10.560
  677   1HE   LYS  83          1HE       LYS  83  -0.381 -16.301 -10.940
  678   2HE   LYS  83          2HE       LYS  83  -1.979 -16.102 -11.689
  679   1HZ   LYS  83          1HZ       LYS  83   0.544 -15.000 -12.710
  680   2HZ   LYS  83          2HZ       LYS  83  -0.243 -16.321 -13.300
  681   3HZ   LYS  83          3HZ       LYS  83  -0.937 -14.831 -13.415
  682    HA   PRO  84           HA       PRO  84  -1.206 -12.011  -4.530
  683   1HB   PRO  84          1HB       PRO  84   1.296 -12.065  -3.460
  684   2HB   PRO  84          2HB       PRO  84  -0.024 -13.104  -2.857
  685   1HG   PRO  84          1HG       PRO  84   2.175 -13.862  -4.794
  686   2HG   PRO  84          2HG       PRO  84   1.620 -14.755  -3.352
  687   1HD   PRO  84          1HD       PRO  84   0.753 -15.333  -5.892
  688   2HD   PRO  84          2HD       PRO  84  -0.305 -15.524  -4.459
  689    H    LYS  85           H        LYS  85  -1.267 -10.420  -6.039
  690    HA   LYS  85           HA       LYS  85   1.313  -9.507  -7.151
  691   1HB   LYS  85          1HB       LYS  85  -1.159 -10.226  -8.724
  692   2HB   LYS  85          2HB       LYS  85  -0.242  -8.807  -9.231
  693   1HG   LYS  85          1HG       LYS  85   1.063 -11.528  -8.856
  694   2HG   LYS  85          2HG       LYS  85   0.371 -10.961 -10.384
  695   1HD   LYS  85          1HD       LYS  85   1.864  -8.989 -10.373
  696   2HD   LYS  85          2HD       LYS  85   2.614  -9.543  -8.867
  697   1HE   LYS  85          1HE       LYS  85   3.346 -11.629  -9.991
  698   2HE   LYS  85          2HE       LYS  85   2.640 -11.045 -11.513
  699   1HZ   LYS  85          1HZ       LYS  85   4.137  -9.183 -11.410
  700   2HZ   LYS  85          2HZ       LYS  85   4.788  -9.731 -10.000
  701   3HZ   LYS  85          3HZ       LYS  85   4.974 -10.602 -11.385
  702    H    LEU  86           H        LEU  86  -2.094  -8.439  -7.425
  703    HA   LEU  86           HA       LEU  86  -3.105  -6.519  -6.963
  704   1HB   LEU  86          1HB       LEU  86  -2.336  -7.104  -4.646
  705   2HB   LEU  86          2HB       LEU  86  -0.945  -6.042  -4.885
  706    HG   LEU  86           HG       LEU  86  -2.328  -4.072  -4.940
  707   1HD1  LEU  86          1HD1      LEU  86  -4.694  -5.971  -4.630
  708   2HD1  LEU  86          2HD1      LEU  86  -4.758  -4.205  -4.456
  709   3HD1  LEU  86          3HD1      LEU  86  -4.372  -4.902  -6.023
  710   1HD2  LEU  86          1HD2      LEU  86  -3.056  -5.990  -2.675
  711   2HD2  LEU  86          2HD2      LEU  86  -1.627  -4.942  -2.746
  712   3HD2  LEU  86          3HD2      LEU  86  -3.248  -4.232  -2.625
  713    H    GLN  87           H        GLN  87  -2.940  -4.087  -7.214
  714    HA   GLN  87           HA       GLN  87  -0.469  -3.179  -8.624
  715   1HB   GLN  87          1HB       GLN  87  -3.316  -3.133  -9.684
  716   2HB   GLN  87          2HB       GLN  87  -2.019  -2.133 -10.344
  717   1HG   GLN  87          1HG       GLN  87  -1.940  -5.187 -10.268
  718   2HG   GLN  87          2HG       GLN  87  -2.528  -4.221 -11.618
  719   1HE2  GLN  87          2HE2      GLN  87   0.387  -5.107  -9.778
  720   2HE2  GLN  87          1HE2      GLN  87   1.525  -4.529 -10.981
  721    H    HIS  88           H        HIS  88  -3.781  -2.044  -7.751
  722    HA   HIS  88           HA       HIS  88  -2.683   0.165  -6.180
  723   1HB   HIS  88          1HB       HIS  88  -2.430   0.941  -8.534
  724   2HB   HIS  88          2HB       HIS  88  -4.151   0.642  -8.810
  725    HD1  HIS  88           HD1      HIS  88  -5.794   2.567  -8.011
  726    HD2  HIS  88           HD2      HIS  88  -1.816   2.925  -6.679
  727    HE1  HIS  88           HE1      HIS  88  -5.604   4.838  -6.855
  728    H    ILE  89           H        ILE  89  -4.306   1.321  -5.061
  729    HA   ILE  89           HA       ILE  89  -7.089   0.285  -5.168
  730    HB   ILE  89           HB       ILE  89  -5.439   0.785  -2.662
  731   1HG1  ILE  89          1HG1      ILE  89  -4.946  -1.435  -3.689
  732   2HG1  ILE  89          2HG1      ILE  89  -5.682  -1.509  -2.094
  733   1HG2  ILE  89          1HG2      ILE  89  -8.388   0.181  -3.077
  734   2HG2  ILE  89          2HG2      ILE  89  -7.556  -0.044  -1.529
  735   3HG2  ILE  89          3HG2      ILE  89  -7.661   1.567  -2.268
  736   1HD1  ILE  89          1HD1      ILE  89  -7.877  -2.065  -3.083
  737   2HD1  ILE  89          2HD1      ILE  89  -7.167  -1.982  -4.712
  738   3HD1  ILE  89          3HD1      ILE  89  -6.633  -3.214  -3.561
  739    H    ASP  90           H        ASP  90  -8.247   1.950  -5.848
  740    HA   ASP  90           HA       ASP  90  -7.578   4.741  -5.102
  741   1HB   ASP  90          1HB       ASP  90  -9.106   5.346  -6.876
  742   2HB   ASP  90          2HB       ASP  90  -7.840   4.280  -7.490
  743    H    PHE  91           H        PHE  91  -8.236   4.337  -2.848
  744    HA   PHE  91           HA       PHE  91 -10.795   3.360  -2.191
  745   1HB   PHE  91          1HB       PHE  91  -8.928   5.183  -0.660
  746   2HB   PHE  91          2HB       PHE  91 -10.409   4.519   0.011
  747    HD1  PHE  91           HD1      PHE  91  -6.916   3.964  -0.296
  748    HD2  PHE  91           HD2      PHE  91 -10.710   1.920  -0.079
  749    HE1  PHE  91           HE1      PHE  91  -5.819   2.025   0.792
  750    HE2  PHE  91           HE2      PHE  91  -9.612   0.004   1.040
  751    HZ   PHE  91           HZ       PHE  91  -7.165   0.053   1.480
  752    H    VAL  92           H        VAL  92 -12.743   4.430  -1.575
  753    HA   VAL  92           HA       VAL  92 -12.971   7.350  -2.140
  754    HB   VAL  92           HB       VAL  92 -14.784   5.107  -3.061
  755   1HG1  VAL  92          1HG1      VAL  92 -15.463   8.067  -2.764
  756   2HG1  VAL  92          2HG1      VAL  92 -16.389   6.913  -3.744
  757   3HG1  VAL  92          3HG1      VAL  92 -16.300   6.696  -1.997
  758   1HG2  VAL  92          1HG2      VAL  92 -12.941   5.970  -4.581
  759   2HG2  VAL  92          2HG2      VAL  92 -14.577   6.233  -5.215
  760   3HG2  VAL  92          3HG2      VAL  92 -13.689   7.576  -4.481
  761    H    ARG  93           H        ARG  93 -13.605   8.396  -0.392
  762    HA   ARG  93           HA       ARG  93 -14.159   7.241   2.103
  763   1HB   ARG  93          1HB       ARG  93 -14.824   9.988   1.022
  764   2HB   ARG  93          2HB       ARG  93 -14.977   9.516   2.725
  765   1HG   ARG  93          1HG       ARG  93 -12.577   8.990   2.853
  766   2HG   ARG  93          2HG       ARG  93 -12.379   9.396   1.139
  767   1HD   ARG  93          1HD       ARG  93 -13.284  11.682   1.649
  768   2HD   ARG  93          2HD       ARG  93 -13.193  11.290   3.378
  769    HE   ARG  93           HE       ARG  93 -10.672  10.706   2.526
  770   1HH1  ARG  93          1HH2      ARG  93 -12.706  13.599   2.175
  771   2HH1  ARG  93          2HH2      ARG  93 -11.365  14.652   1.810
  772   1HH2  ARG  93          1HH1      ARG  93  -8.898  12.142   2.108
  773   2HH2  ARG  93          2HH1      ARG  93  -9.232  13.821   1.727
  774    H    ALA  94           H        ALA  94 -15.958   6.633   3.184
  775    HA   ALA  94           HA       ALA  94 -18.398   6.129   1.655
  776   1HB   ALA  94          1HB       ALA  94 -17.488   4.455   3.221
  777   2HB   ALA  94          2HB       ALA  94 -17.688   5.597   4.567
  778   3HB   ALA  94          3HB       ALA  94 -19.113   4.976   3.706
  Start of MODEL    5
    1    H    MET   1           H        MET   1 -13.894  -0.362   8.646
    2    HA   MET   1           HA       MET   1 -14.459  -1.715  10.618
    3   1HB   MET   1          1HB       MET   1 -14.874  -3.926   8.560
    4   2HB   MET   1          2HB       MET   1 -14.996  -4.091  10.314
    5   1HG   MET   1          1HG       MET   1 -16.851  -2.485   8.507
    6   2HG   MET   1          2HG       MET   1 -17.150  -4.034   9.274
    7   1HE   MET   1          1HE       MET   1 -17.633  -0.268   9.531
    8   2HE   MET   1          2HE       MET   1 -17.664   0.063  11.276
    9   3HE   MET   1          3HE       MET   1 -16.123  -0.259  10.468
   10    H    PHE   2           H        PHE   2 -12.848  -3.339   7.852
   11    HA   PHE   2           HA       PHE   2 -10.816  -4.566   9.352
   12   1HB   PHE   2          1HB       PHE   2 -10.688  -3.662   6.454
   13   2HB   PHE   2          2HB       PHE   2  -9.729  -4.938   7.200
   14    HD1  PHE   2           HD1      PHE   2 -12.775  -4.171   5.448
   15    HD2  PHE   2           HD2      PHE   2 -11.014  -6.984   8.197
   16    HE1  PHE   2           HE1      PHE   2 -14.554  -5.807   4.907
   17    HE2  PHE   2           HE2      PHE   2 -12.811  -8.613   7.665
   18    HZ   PHE   2           HZ       PHE   2 -14.588  -8.023   6.035
   19    H    THR   3           H        THR   3  -8.766  -3.943   9.991
   20    HA   THR   3           HA       THR   3  -8.269  -1.039  10.048
   21    HB   THR   3           HB       THR   3  -6.909  -3.292  11.576
   22    HG1  THR   3           HG1      THR   3  -9.181  -1.721  12.193
   23   1HG2  THR   3          1HG2      THR   3  -5.699  -1.092  11.583
   24   2HG2  THR   3          2HG2      THR   3  -7.192  -0.307  12.151
   25   3HG2  THR   3          3HG2      THR   3  -6.368  -1.501  13.172
   26    H    ILE   4           H        ILE   4  -7.547  -0.829   7.802
   27    HA   ILE   4           HA       ILE   4  -5.104  -2.243   7.001
   28    HB   ILE   4           HB       ILE   4  -6.851  -0.162   5.652
   29   1HG1  ILE   4          1HG1      ILE   4  -7.010  -1.994   3.936
   30   2HG1  ILE   4          2HG1      ILE   4  -6.114  -3.063   5.023
   31   1HG2  ILE   4          1HG2      ILE   4  -4.206  -1.331   4.697
   32   2HG2  ILE   4          2HG2      ILE   4  -5.362  -0.456   3.674
   33   3HG2  ILE   4          3HG2      ILE   4  -4.563   0.385   4.998
   34   1HD1  ILE   4          1HD1      ILE   4  -8.866  -1.835   5.505
   35   2HD1  ILE   4          2HD1      ILE   4  -8.493  -3.512   5.061
   36   3HD1  ILE   4          3HD1      ILE   4  -8.024  -2.920   6.640
   37    H    ASN   5           H        ASN   5  -3.157  -1.642   7.647
   38    HA   ASN   5           HA       ASN   5  -2.542   0.779   9.044
   39   1HB   ASN   5          1HB       ASN   5  -0.788  -1.299   7.657
   40   2HB   ASN   5          2HB       ASN   5  -0.167   0.052   8.612
   41   1HD2  ASN   5          2HD2      ASN   5   0.603  -0.762  10.507
   42   2HD2  ASN   5          1HD2      ASN   5  -0.252  -1.899  11.530
   43    H    ALA   6           H        ALA   6  -1.838   2.752   8.272
   44    HA   ALA   6           HA       ALA   6  -0.663   3.015   5.630
   45   1HB   ALA   6          1HB       ALA   6  -3.100   3.028   5.088
   46   2HB   ALA   6          2HB       ALA   6  -3.332   4.361   6.231
   47   3HB   ALA   6          3HB       ALA   6  -2.343   4.602   4.779
   48    H    GLU   7           H        GLU   7   0.006   5.206   5.198
   49    HA   GLU   7           HA       GLU   7  -0.062   7.195   7.349
   50   1HB   GLU   7          1HB       GLU   7   2.545   6.176   6.104
   51   2HB   GLU   7          2HB       GLU   7   2.387   7.629   7.100
   52   1HG   GLU   7          1HG       GLU   7   1.631   6.237   9.015
   53   2HG   GLU   7          2HG       GLU   7   1.873   4.776   8.036
   54    H    VAL   8           H        VAL   8   0.827   9.295   6.385
   55    HA   VAL   8           HA       VAL   8  -0.092   9.801   3.709
   56    HB   VAL   8           HB       VAL   8   1.124  11.923   3.905
   57   1HG1  VAL   8          1HG1      VAL   8  -1.142  11.663   4.873
   58   2HG1  VAL   8          2HG1      VAL   8  -0.425  11.236   6.441
   59   3HG1  VAL   8          3HG1      VAL   8  -0.169  12.852   5.757
   60   1HG2  VAL   8          1HG2      VAL   8   2.133  10.895   6.599
   61   2HG2  VAL   8          2HG2      VAL   8   3.128  11.236   5.168
   62   3HG2  VAL   8          3HG2      VAL   8   2.281  12.550   5.990
   63    H    ARG   9           H        ARG   9   1.054   9.821   1.760
   64    HA   ARG   9           HA       ARG   9   2.893   7.721   1.553
   65   1HB   ARG   9          1HB       ARG   9   1.321   8.360  -0.197
   66   2HB   ARG   9          2HB       ARG   9   2.218   9.857  -0.497
   67   1HG   ARG   9          1HG       ARG   9   4.189   8.548  -1.186
   68   2HG   ARG   9          2HG       ARG   9   3.387   7.038  -0.713
   69   1HD   ARG   9          1HD       ARG   9   3.316   7.301  -3.118
   70   2HD   ARG   9          2HD       ARG   9   1.673   7.399  -2.445
   71    HE   ARG   9           HE       ARG   9   2.781  10.021  -2.641
   72   1HH1  ARG   9          1HH2      ARG   9   1.602   7.420  -4.749
   73   2HH1  ARG   9          2HH2      ARG   9   1.113   8.501  -6.027
   74   1HH2  ARG   9          1HH1      ARG   9   2.137  11.433  -4.327
   75   2HH2  ARG   9          2HH1      ARG   9   1.424  10.796  -5.787
   76    H    LYS  10           H        LYS  10   4.856   7.855   2.537
   77    HA   LYS  10           HA       LYS  10   6.926   9.582   1.484
   78   1HB   LYS  10          1HB       LYS  10   5.711  11.114   3.089
   79   2HB   LYS  10          2HB       LYS  10   6.043   9.944   4.375
   80   1HG   LYS  10          1HG       LYS  10   8.527  10.264   3.907
   81   2HG   LYS  10          2HG       LYS  10   8.079  11.425   2.658
   82   1HD   LYS  10          1HD       LYS  10   8.728  12.637   4.635
   83   2HD   LYS  10          2HD       LYS  10   7.006  12.881   4.331
   84   1HE   LYS  10          1HE       LYS  10   7.497  12.572   6.730
   85   2HE   LYS  10          2HE       LYS  10   6.417  11.311   6.132
   86   1HZ   LYS  10          1HZ       LYS  10   9.318  11.035   6.516
   87   2HZ   LYS  10          2HZ       LYS  10   8.154  10.454   7.528
   88   3HZ   LYS  10          3HZ       LYS  10   8.295   9.845   6.006
   89    H    GLU  11           H        GLU  11   8.727   8.264   1.519
   90    HA   GLU  11           HA       GLU  11   9.395   6.880   3.985
   91   1HB   GLU  11          1HB       GLU  11   7.961   5.340   2.310
   92   2HB   GLU  11          2HB       GLU  11   9.549   5.018   1.619
   93   1HG   GLU  11          1HG       GLU  11   8.859   4.762   4.596
   94   2HG   GLU  11          2HG       GLU  11   8.638   3.476   3.422
   95    H    GLN  12           H        GLN  12  11.074   8.164   4.197
   96    HA   GLN  12           HA       GLN  12  12.923   9.386   3.819
   97   1HB   GLN  12          1HB       GLN  12  13.872   6.681   2.845
   98   2HB   GLN  12          2HB       GLN  12  14.922   8.033   3.293
   99   1HG   GLN  12          1HG       GLN  12  13.948   8.043   5.570
  100   2HG   GLN  12          2HG       GLN  12  12.933   6.653   5.153
  101   1HE2  GLN  12          2HE2      GLN  12  14.613   6.488   7.333
  102   2HE2  GLN  12          1HE2      GLN  12  15.935   5.396   6.977
  103    H    GLY  13           H        GLY  13  11.532  10.491   2.196
  104   1HA   GLY  13          1HA       GLY  13  12.928  11.518   0.050
  105   2HA   GLY  13          2HA       GLY  13  11.967  10.170  -0.615
  106    H    LYS  14           H        LYS  14  10.860  12.059  -1.758
  107    HA   LYS  14           HA       LYS  14   8.973  13.682  -0.241
  108   1HB   LYS  14          1HB       LYS  14   9.290  12.955  -3.180
  109   2HB   LYS  14          2HB       LYS  14   7.883  13.844  -2.569
  110   1HG   LYS  14          1HG       LYS  14   9.302  15.598  -1.660
  111   2HG   LYS  14          2HG       LYS  14  10.766  14.755  -2.208
  112   1HD   LYS  14          1HD       LYS  14  10.124  14.969  -4.531
  113   2HD   LYS  14          2HD       LYS  14   8.526  15.602  -4.111
  114   1HE   LYS  14          1HE       LYS  14  11.150  17.014  -3.445
  115   2HE   LYS  14          2HE       LYS  14  10.171  17.340  -4.887
  116   1HZ   LYS  14          1HZ       LYS  14   8.358  17.946  -3.465
  117   2HZ   LYS  14          2HZ       LYS  14   9.268  17.682  -2.117
  118   3HZ   LYS  14          3HZ       LYS  14   9.680  18.881  -3.167
  119    H    GLY  15           H        GLY  15   8.556  10.897  -2.472
  120   1HA   GLY  15          1HA       GLY  15   5.989  10.169  -1.165
  121   2HA   GLY  15          2HA       GLY  15   6.602   9.634  -2.732
  122    H    ALA  16           H        ALA  16   5.875   7.539  -1.747
  123    HA   ALA  16           HA       ALA  16   7.672   6.151   0.076
  124   1HB   ALA  16          1HB       ALA  16   5.611   5.146  -1.939
  125   2HB   ALA  16          2HB       ALA  16   6.449   4.160  -0.721
  126   3HB   ALA  16          3HB       ALA  16   5.339   5.451  -0.215
  127    H    SER  17           H        SER  17   9.766   5.910  -0.563
  128    HA   SER  17           HA       SER  17  10.376   5.344  -3.444
  129   1HB   SER  17          1HB       SER  17  11.745   7.364  -1.615
  130   2HB   SER  17          2HB       SER  17  12.209   6.954  -3.280
  131    HG   SER  17           HG       SER  17  10.035   7.619  -3.866
  132    H    ARG  18           H        ARG  18  11.856   5.520  -0.153
  133    HA   ARG  18           HA       ARG  18  13.905   3.603  -0.932
  134   1HB   ARG  18          1HB       ARG  18  14.283   5.621   0.446
  135   2HB   ARG  18          2HB       ARG  18  13.268   4.919   1.713
  136   1HG   ARG  18          1HG       ARG  18  14.936   3.651   2.512
  137   2HG   ARG  18          2HG       ARG  18  15.394   3.049   0.913
  138   1HD   ARG  18          1HD       ARG  18  16.151   5.821   1.932
  139   2HD   ARG  18          2HD       ARG  18  17.172   4.407   2.169
  140    HE   ARG  18           HE       ARG  18  16.730   5.930  -0.279
  141   1HH1  ARG  18          1HH2      ARG  18  17.749   2.771   0.975
  142   2HH1  ARG  18          2HH2      ARG  18  18.718   2.382  -0.424
  143   1HH2  ARG  18          1HH1      ARG  18  17.977   5.396  -2.125
  144   2HH2  ARG  18          2HH1      ARG  18  18.834   3.881  -2.202
  145    H    ARG  19           H        ARG  19  11.612   2.234  -1.328
  146    HA   ARG  19           HA       ARG  19  11.783   0.063   0.552
  147   1HB   ARG  19          1HB       ARG  19  10.240   1.908   1.635
  148   2HB   ARG  19          2HB       ARG  19   9.029   1.362   0.476
  149   1HG   ARG  19          1HG       ARG  19   9.219  -0.937   1.377
  150   2HG   ARG  19          2HG       ARG  19  10.555  -0.420   2.437
  151   1HD   ARG  19          1HD       ARG  19   8.872   1.275   3.433
  152   2HD   ARG  19          2HD       ARG  19   7.651   0.398   2.536
  153    HE   ARG  19           HE       ARG  19   7.820  -1.393   4.005
  154   1HH1  ARG  19          1HH2      ARG  19  10.439   0.957   4.696
  155   2HH1  ARG  19          2HH2      ARG  19  10.912   0.143   6.161
  156   1HH2  ARG  19          1HH1      ARG  19   8.452  -2.384   5.959
  157   2HH2  ARG  19          2HH1      ARG  19   9.777  -1.737   6.892
  158    H    LEU  20           H        LEU  20   9.626   1.603  -1.857
  159    HA   LEU  20           HA       LEU  20   8.457  -0.622  -3.041
  160   1HB   LEU  20          1HB       LEU  20   9.444   1.870  -4.490
  161   2HB   LEU  20          2HB       LEU  20   8.165   0.770  -5.014
  162    HG   LEU  20           HG       LEU  20   8.086   2.711  -2.662
  163   1HD1  LEU  20          1HD1      LEU  20   7.738   3.644  -4.938
  164   2HD1  LEU  20          2HD1      LEU  20   6.438   2.469  -5.220
  165   3HD1  LEU  20          3HD1      LEU  20   6.255   3.712  -3.967
  166   1HD2  LEU  20          1HD2      LEU  20   6.065   0.599  -3.505
  167   2HD2  LEU  20          2HD2      LEU  20   6.906   0.694  -1.940
  168   3HD2  LEU  20          3HD2      LEU  20   5.717   1.927  -2.374
  169    H    ARG  21           H        ARG  21  11.699   0.626  -3.471
  170    HA   ARG  21           HA       ARG  21  12.733  -0.480  -5.731
  171   1HB   ARG  21          1HB       ARG  21  13.873  -0.259  -2.927
  172   2HB   ARG  21          2HB       ARG  21  14.861  -0.690  -4.336
  173   1HG   ARG  21          1HG       ARG  21  14.489   1.413  -5.400
  174   2HG   ARG  21          2HG       ARG  21  13.192   1.856  -4.286
  175   1HD   ARG  21          1HD       ARG  21  15.236   3.073  -3.761
  176   2HD   ARG  21          2HD       ARG  21  14.742   2.044  -2.424
  177    HE   ARG  21           HE       ARG  21  17.041   1.664  -4.289
  178   1HH1  ARG  21          1HH2      ARG  21  15.363   0.491  -1.360
  179   2HH1  ARG  21          2HH2      ARG  21  16.715  -0.480  -0.851
  180   1HH2  ARG  21          1HH1      ARG  21  18.768   0.371  -3.593
  181   2HH2  ARG  21          2HH1      ARG  21  18.645  -0.558  -2.121
  182    H    ALA  22           H        ALA  22  12.017  -2.298  -2.703
  183    HA   ALA  22           HA       ALA  22  12.384  -4.837  -4.160
  184   1HB   ALA  22          1HB       ALA  22  14.098  -4.107  -1.748
  185   2HB   ALA  22          2HB       ALA  22  14.008  -5.705  -2.520
  186   3HB   ALA  22          3HB       ALA  22  14.671  -4.326  -3.415
  187    H    ALA  23           H        ALA  23  11.835  -3.334  -0.926
  188    HA   ALA  23           HA       ALA  23  10.614  -5.653   0.182
  189   1HB   ALA  23          1HB       ALA  23  10.493  -2.734   1.001
  190   2HB   ALA  23          2HB       ALA  23   9.929  -4.092   2.000
  191   3HB   ALA  23          3HB       ALA  23  11.647  -3.952   1.571
  192    H    ASN  24           H        ASN  24   8.453  -6.069   0.705
  193    HA   ASN  24           HA       ASN  24   6.652  -5.659  -1.473
  194   1HB   ASN  24          1HB       ASN  24   6.220  -6.874   1.286
  195   2HB   ASN  24          2HB       ASN  24   5.094  -6.996  -0.074
  196   1HD2  ASN  24          2HD2      ASN  24   6.199  -9.238   1.273
  197   2HD2  ASN  24          1HD2      ASN  24   7.208 -10.104   0.132
  198    H    LYS  25           H        LYS  25   6.120  -3.470  -1.718
  199    HA   LYS  25           HA       LYS  25   3.867  -2.674  -0.138
  200   1HB   LYS  25          1HB       LYS  25   6.046  -1.861   1.128
  201   2HB   LYS  25          2HB       LYS  25   6.109  -0.616  -0.122
  202   1HG   LYS  25          1HG       LYS  25   3.864   0.176   0.542
  203   2HG   LYS  25          2HG       LYS  25   3.669  -1.259   1.572
  204   1HD   LYS  25          1HD       LYS  25   5.570  -0.496   2.977
  205   2HD   LYS  25          2HD       LYS  25   5.616   1.002   1.999
  206   1HE   LYS  25          1HE       LYS  25   3.280   1.469   2.655
  207   2HE   LYS  25          2HE       LYS  25   3.235  -0.002   3.620
  208   1HZ   LYS  25          1HZ       LYS  25   5.029   2.260   4.086
  209   2HZ   LYS  25          2HZ       LYS  25   3.686   1.885   4.975
  210   3HZ   LYS  25          3HZ       LYS  25   4.976   0.865   4.983
  211    H    PHE  26           H        PHE  26   2.794  -0.742  -1.070
  212    HA   PHE  26           HA       PHE  26   3.776   0.283  -3.602
  213   1HB   PHE  26          1HB       PHE  26   1.879  -0.388  -4.932
  214   2HB   PHE  26          2HB       PHE  26   2.666  -1.820  -4.299
  215    HD1  PHE  26           HD1      PHE  26   1.608  -3.085  -2.427
  216    HD2  PHE  26           HD2      PHE  26  -0.378   0.192  -4.318
  217    HE1  PHE  26           HE1      PHE  26  -0.506  -3.705  -1.249
  218    HE2  PHE  26           HE2      PHE  26  -2.502  -0.415  -3.184
  219    HZ   PHE  26           HZ       PHE  26  -2.568  -2.367  -1.649
  220    HA   PRO  27           HA       PRO  27   1.365   3.651  -1.903
  221   1HB   PRO  27          1HB       PRO  27   1.268   5.396  -3.972
  222   2HB   PRO  27          2HB       PRO  27   2.818   4.950  -3.190
  223   1HG   PRO  27          1HG       PRO  27   1.634   3.777  -5.727
  224   2HG   PRO  27          2HG       PRO  27   3.285   4.421  -5.489
  225   1HD   PRO  27          1HD       PRO  27   2.715   1.758  -5.279
  226   2HD   PRO  27          2HD       PRO  27   3.936   2.540  -4.233
  227    H    ALA  28           H        ALA  28  -0.796   4.345  -1.810
  228    HA   ALA  28           HA       ALA  28  -2.697   3.461  -3.938
  229   1HB   ALA  28          1HB       ALA  28  -3.052   3.121  -0.934
  230   2HB   ALA  28          2HB       ALA  28  -4.278   2.783  -2.176
  231   3HB   ALA  28          3HB       ALA  28  -2.787   1.821  -2.121
  232    H    ILE  29           H        ILE  29  -4.864   4.591  -3.578
  233    HA   ILE  29           HA       ILE  29  -4.484   7.396  -2.671
  234    HB   ILE  29           HB       ILE  29  -5.332   6.382  -5.400
  235   1HG1  ILE  29          1HG1      ILE  29  -3.144   8.309  -4.471
  236   2HG1  ILE  29          2HG1      ILE  29  -2.893   6.661  -5.051
  237   1HG2  ILE  29          1HG2      ILE  29  -6.918   8.161  -4.728
  238   2HG2  ILE  29          2HG2      ILE  29  -5.544   9.237  -4.393
  239   3HG2  ILE  29          3HG2      ILE  29  -5.876   8.662  -6.040
  240   1HD1  ILE  29          1HD1      ILE  29  -3.881   7.386  -7.277
  241   2HD1  ILE  29          2HD1      ILE  29  -3.776   9.060  -6.678
  242   3HD1  ILE  29          3HD1      ILE  29  -2.311   8.086  -6.836
  243    H    ILE  30           H        ILE  30  -6.260   8.415  -1.933
  244    HA   ILE  30           HA       ILE  30  -8.827   6.896  -1.779
  245    HB   ILE  30           HB       ILE  30  -7.734   8.939   0.191
  246   1HG1  ILE  30          1HG1      ILE  30  -7.983   5.907   0.401
  247   2HG1  ILE  30          2HG1      ILE  30  -6.493   6.861   0.419
  248   1HG2  ILE  30          1HG2      ILE  30 -10.222   8.960  -0.089
  249   2HG2  ILE  30          2HG2      ILE  30 -10.261   7.223   0.276
  250   3HG2  ILE  30          3HG2      ILE  30  -9.747   8.409   1.498
  251   1HD1  ILE  30          1HD1      ILE  30  -7.309   7.977   2.533
  252   2HD1  ILE  30          2HD1      ILE  30  -8.653   6.807   2.557
  253   3HD1  ILE  30          3HD1      ILE  30  -6.998   6.237   2.686
  254    H    TYR  31           H        TYR  31 -10.055   7.688  -3.358
  255    HA   TYR  31           HA       TYR  31 -10.193  10.542  -4.049
  256   1HB   TYR  31          1HB       TYR  31 -11.743   8.064  -4.885
  257   2HB   TYR  31          2HB       TYR  31 -12.197   9.684  -5.376
  258    HD1  TYR  31           HD1      TYR  31  -9.323   7.249  -5.510
  259    HD2  TYR  31           HD2      TYR  31 -11.294  10.637  -7.320
  260    HE1  TYR  31           HE1      TYR  31  -7.702   7.203  -7.378
  261    HE2  TYR  31           HE2      TYR  31  -9.706  10.548  -9.210
  262    HH   TYR  31           HH       TYR  31  -7.860   9.516 -10.111
  263    H    GLY  32           H        GLY  32 -12.208  11.730  -3.796
  264   1HA   GLY  32          1HA       GLY  32 -14.342  10.815  -2.123
  265   2HA   GLY  32          2HA       GLY  32 -13.238  11.873  -1.212
  266    H    GLY  33           H        GLY  33 -16.085  12.200  -2.363
  267   1HA   GLY  33          1HA       GLY  33 -15.913  14.303  -4.369
  268   2HA   GLY  33          2HA       GLY  33 -17.346  13.737  -3.499
  269    H    LYS  34           H        LYS  34 -14.265  15.455  -2.854
  270    HA   LYS  34           HA       LYS  34 -15.562  17.720  -1.655
  271   1HB   LYS  34          1HB       LYS  34 -15.342  15.584   0.125
  272   2HB   LYS  34          2HB       LYS  34 -13.833  16.448   0.413
  273   1HG   LYS  34          1HG       LYS  34 -15.239  18.582   0.650
  274   2HG   LYS  34          2HG       LYS  34 -16.670  17.551   0.497
  275   1HD   LYS  34          1HD       LYS  34 -16.406  17.877   2.804
  276   2HD   LYS  34          2HD       LYS  34 -15.811  16.234   2.516
  277   1HE   LYS  34          1HE       LYS  34 -13.470  17.068   2.595
  278   2HE   LYS  34          2HE       LYS  34 -14.057  18.735   2.737
  279   1HZ   LYS  34          1HZ       LYS  34 -15.053  18.148   4.818
  280   2HZ   LYS  34          2HZ       LYS  34 -14.494  16.601   4.701
  281   3HZ   LYS  34          3HZ       LYS  34 -13.433  17.856   4.837
  282    H    GLU  35           H        GLU  35 -12.583  15.805  -2.104
  283    HA   GLU  35           HA       GLU  35 -10.970  18.262  -2.456
  284   1HB   GLU  35          1HB       GLU  35 -11.050  17.532  -0.029
  285   2HB   GLU  35          2HB       GLU  35 -10.295  16.006  -0.512
  286   1HG   GLU  35          1HG       GLU  35  -8.293  17.258  -1.290
  287   2HG   GLU  35          2HG       GLU  35  -9.084  18.788  -0.861
  288    H    ALA  36           H        ALA  36  -8.827  17.731  -3.342
  289    HA   ALA  36           HA       ALA  36  -8.855  16.002  -5.543
  290   1HB   ALA  36          1HB       ALA  36  -7.344  17.923  -5.327
  291   2HB   ALA  36          2HB       ALA  36  -6.503  17.142  -3.969
  292   3HB   ALA  36          3HB       ALA  36  -6.393  16.452  -5.598
  293    HA   PRO  37           HA       PRO  37  -8.249  12.075  -3.728
  294   1HB   PRO  37          1HB       PRO  37  -7.085  10.598  -5.711
  295   2HB   PRO  37          2HB       PRO  37  -8.729  11.271  -5.812
  296   1HG   PRO  37          1HG       PRO  37  -6.195  12.488  -6.939
  297   2HG   PRO  37          2HG       PRO  37  -7.731  12.166  -7.798
  298   1HD   PRO  37          1HD       PRO  37  -7.208  14.606  -6.760
  299   2HD   PRO  37          2HD       PRO  37  -8.848  13.905  -6.629
  300    H    LEU  38           H        LEU  38  -6.917  12.373  -1.980
  301    HA   LEU  38           HA       LEU  38  -4.115  12.880  -2.141
  302   1HB   LEU  38          1HB       LEU  38  -4.150  12.713   0.284
  303   2HB   LEU  38          2HB       LEU  38  -5.492  13.663  -0.341
  304    HG   LEU  38           HG       LEU  38  -6.841  11.360  -0.124
  305   1HD1  LEU  38          1HD1      LEU  38  -4.624  11.061   1.961
  306   2HD1  LEU  38          2HD1      LEU  38  -6.132  10.130   1.922
  307   3HD1  LEU  38          3HD1      LEU  38  -4.954   9.939   0.627
  308   1HD2  LEU  38          1HD2      LEU  38  -6.112  13.144   2.231
  309   2HD2  LEU  38          2HD2      LEU  38  -7.386  13.454   1.030
  310   3HD2  LEU  38          3HD2      LEU  38  -7.528  12.073   2.130
  311    H    ALA  39           H        ALA  39  -2.359  11.564  -1.418
  312    HA   ALA  39           HA       ALA  39  -2.705   8.687  -2.102
  313   1HB   ALA  39          1HB       ALA  39  -1.347  10.016  -3.671
  314   2HB   ALA  39          2HB       ALA  39  -0.255  10.457  -2.338
  315   3HB   ALA  39          3HB       ALA  39  -0.410   8.758  -2.844
  316    H    ILE  40           H        ILE  40  -1.588   7.111  -0.949
  317    HA   ILE  40           HA       ILE  40  -0.380   7.808   1.658
  318    HB   ILE  40           HB       ILE  40  -1.839   6.082   2.736
  319   1HG1  ILE  40          1HG1      ILE  40  -3.599   6.330   0.255
  320   2HG1  ILE  40          2HG1      ILE  40  -2.528   4.957   0.577
  321   1HG2  ILE  40          1HG2      ILE  40  -2.243   8.550   2.921
  322   2HG2  ILE  40          2HG2      ILE  40  -3.434   8.408   1.610
  323   3HG2  ILE  40          3HG2      ILE  40  -3.689   7.565   3.147
  324   1HD1  ILE  40          1HD1      ILE  40  -3.720   4.515   2.701
  325   2HD1  ILE  40          2HD1      ILE  40  -4.843   5.836   2.322
  326   3HD1  ILE  40          3HD1      ILE  40  -4.778   4.410   1.276
  327    H    GLU  41           H        GLU  41   0.568   6.004   2.710
  328    HA   GLU  41           HA       GLU  41   1.893   3.998   1.005
  329   1HB   GLU  41          1HB       GLU  41   2.059   5.045   3.838
  330   2HB   GLU  41          2HB       GLU  41   2.618   3.412   3.562
  331   1HG   GLU  41          1HG       GLU  41   3.609   5.636   1.760
  332   2HG   GLU  41          2HG       GLU  41   4.286   5.424   3.380
  333    H    LEU  42           H        LEU  42   1.534   1.719   1.268
  334    HA   LEU  42           HA       LEU  42  -0.606   0.811   3.050
  335   1HB   LEU  42          1HB       LEU  42  -1.318   1.583   0.465
  336   2HB   LEU  42          2HB       LEU  42  -1.006  -0.131   0.257
  337    HG   LEU  42           HG       LEU  42  -2.568  -0.536   2.264
  338   1HD1  LEU  42          1HD1      LEU  42  -3.130   2.419   1.732
  339   2HD1  LEU  42          2HD1      LEU  42  -4.229   1.364   2.632
  340   3HD1  LEU  42          3HD1      LEU  42  -2.619   1.695   3.271
  341   1HD2  LEU  42          1HD2      LEU  42  -3.692   0.814  -0.225
  342   2HD2  LEU  42          2HD2      LEU  42  -3.278  -0.902  -0.056
  343   3HD2  LEU  42          3HD2      LEU  42  -4.601  -0.207   0.896
  344    H    ASP  43           H        ASP  43   0.240  -0.852   4.064
  345    HA   ASP  43           HA       ASP  43   2.612  -2.203   3.234
  346   1HB   ASP  43          1HB       ASP  43   0.673  -2.777   5.489
  347   2HB   ASP  43          2HB       ASP  43   2.284  -3.484   5.294
  348    H    HIS  44           H        HIS  44   2.641  -3.610   1.585
  349    HA   HIS  44           HA       HIS  44   0.410  -5.210   0.729
  350   1HB   HIS  44          1HB       HIS  44   2.171  -4.193  -0.696
  351   2HB   HIS  44          2HB       HIS  44   3.319  -5.373  -0.097
  352    HD1  HIS  44           HD1      HIS  44   1.279  -7.930  -0.323
  353    HD2  HIS  44           HD2      HIS  44   2.368  -5.088  -3.225
  354    HE1  HIS  44           HE1      HIS  44   0.989  -9.048  -2.601
  355    H    ASP  45           H        ASP  45   0.113  -6.188   2.918
  356    HA   ASP  45           HA       ASP  45   0.964  -8.954   2.853
  357   1HB   ASP  45          1HB       ASP  45   2.944  -8.152   3.987
  358   2HB   ASP  45          2HB       ASP  45   2.003  -7.095   5.041
  359    H    LYS  46           H        LYS  46  -0.029  -6.656   5.417
  360    HA   LYS  46           HA       LYS  46  -2.215  -8.248   6.291
  361   1HB   LYS  46          1HB       LYS  46  -0.958  -6.595   7.621
  362   2HB   LYS  46          2HB       LYS  46  -1.735  -5.270   6.722
  363   1HG   LYS  46          1HG       LYS  46  -3.963  -6.190   7.461
  364   2HG   LYS  46          2HG       LYS  46  -3.115  -7.397   8.435
  365   1HD   LYS  46          1HD       LYS  46  -3.022  -4.363   8.785
  366   2HD   LYS  46          2HD       LYS  46  -3.909  -5.518   9.774
  367   1HE   LYS  46          1HE       LYS  46  -2.071  -5.164  11.105
  368   2HE   LYS  46          2HE       LYS  46  -1.578  -6.627  10.238
  369   1HZ   LYS  46          1HZ       LYS  46  -0.825  -3.852   9.617
  370   2HZ   LYS  46          2HZ       LYS  46   0.147  -4.977  10.329
  371   3HZ   LYS  46          3HZ       LYS  46  -0.316  -5.164   8.761
  372    H    VAL  47           H        VAL  47  -2.022  -5.358   4.131
  373    HA   VAL  47           HA       VAL  47  -4.822  -5.232   3.658
  374    HB   VAL  47           HB       VAL  47  -3.101  -3.413   3.268
  375   1HG1  VAL  47          1HG1      VAL  47  -1.645  -4.913   1.729
  376   2HG1  VAL  47          2HG1      VAL  47  -2.861  -4.619   0.489
  377   3HG1  VAL  47          3HG1      VAL  47  -1.965  -3.253   1.176
  378   1HG2  VAL  47          1HG2      VAL  47  -5.485  -3.245   2.616
  379   2HG2  VAL  47          2HG2      VAL  47  -4.426  -2.418   1.467
  380   3HG2  VAL  47          3HG2      VAL  47  -5.119  -3.991   1.048
  381    H    MET  48           H        MET  48  -2.202  -7.093   2.109
  382    HA   MET  48           HA       MET  48  -3.567  -7.869  -0.219
  383   1HB   MET  48          1HB       MET  48  -1.126  -8.098   0.217
  384   2HB   MET  48          2HB       MET  48  -1.474  -9.413   1.343
  385   1HG   MET  48          1HG       MET  48  -0.733 -10.331  -0.680
  386   2HG   MET  48          2HG       MET  48  -2.431 -10.756  -0.537
  387   1HE   MET  48          1HE       MET  48  -3.969 -10.620  -2.550
  388   2HE   MET  48          2HE       MET  48  -4.326  -8.964  -2.014
  389   3HE   MET  48          3HE       MET  48  -3.962  -9.283  -3.718
  390    H    ASN  49           H        ASN  49  -3.582  -9.236   3.082
  391    HA   ASN  49           HA       ASN  49  -5.376 -11.437   2.432
  392   1HB   ASN  49          1HB       ASN  49  -4.451 -10.181   5.045
  393   2HB   ASN  49          2HB       ASN  49  -5.653 -11.472   4.958
  394   1HD2  ASN  49          2HD2      ASN  49  -2.238 -10.680   4.140
  395   2HD2  ASN  49          1HD2      ASN  49  -1.699 -12.345   4.145
  396    H    MET  50           H        MET  50  -5.808  -8.343   4.250
  397    HA   MET  50           HA       MET  50  -8.526  -8.598   4.753
  398   1HB   MET  50          1HB       MET  50  -6.768  -6.147   4.420
  399   2HB   MET  50          2HB       MET  50  -8.468  -6.038   4.891
  400   1HG   MET  50          1HG       MET  50  -8.113  -7.411   6.842
  401   2HG   MET  50          2HG       MET  50  -6.411  -7.661   6.429
  402   1HE   MET  50          1HE       MET  50  -5.960  -6.957   9.010
  403   2HE   MET  50          2HE       MET  50  -6.436  -5.378   9.682
  404   3HE   MET  50          3HE       MET  50  -7.680  -6.575   9.259
  405    H    GLN  51           H        GLN  51  -7.025  -7.349   1.757
  406    HA   GLN  51           HA       GLN  51  -9.313  -6.066   0.803
  407   1HB   GLN  51          1HB       GLN  51  -8.240  -5.848  -1.284
  408   2HB   GLN  51          2HB       GLN  51  -7.027  -5.691  -0.031
  409   1HG   GLN  51          1HG       GLN  51  -5.816  -7.260  -1.061
  410   2HG   GLN  51          2HG       GLN  51  -7.015  -8.468  -0.651
  411   1HE2  GLN  51          2HE2      GLN  51  -9.185  -7.823  -2.348
  412   2HE2  GLN  51          1HE2      GLN  51  -8.655  -7.980  -4.006
  413    H    ALA  52           H        ALA  52  -8.632  -9.459   0.900
  414    HA   ALA  52           HA       ALA  52  -9.541 -11.276  -0.142
  415   1HB   ALA  52          1HB       ALA  52 -11.890  -9.840   1.151
  416   2HB   ALA  52          2HB       ALA  52 -11.840 -11.572   0.732
  417   3HB   ALA  52          3HB       ALA  52 -10.712 -10.909   1.927
  418    H    LYS  53           H        LYS  53 -12.655 -10.019  -0.722
  419    HA   LYS  53           HA       LYS  53 -12.738  -8.653  -3.004
  420   1HB   LYS  53          1HB       LYS  53 -13.287 -10.306  -4.809
  421   2HB   LYS  53          2HB       LYS  53 -11.595 -10.229  -4.371
  422   1HG   LYS  53          1HG       LYS  53 -12.027 -12.323  -2.888
  423   2HG   LYS  53          2HG       LYS  53 -13.642 -12.354  -3.581
  424   1HD   LYS  53          1HD       LYS  53 -12.186 -13.924  -4.728
  425   2HD   LYS  53          2HD       LYS  53 -12.737 -12.662  -5.834
  426   1HE   LYS  53          1HE       LYS  53 -10.329 -13.318  -6.101
  427   2HE   LYS  53          2HE       LYS  53 -10.567 -11.592  -5.829
  428   1HZ   LYS  53          1HZ       LYS  53  -9.809 -13.535  -3.755
  429   2HZ   LYS  53          2HZ       LYS  53  -8.769 -12.519  -4.532
  430   3HZ   LYS  53          3HZ       LYS  53  -9.941 -11.899  -3.559
  431    H    ALA  54           H        ALA  54 -14.873  -8.198  -3.480
  432    HA   ALA  54           HA       ALA  54 -17.091  -8.132  -3.391
  433   1HB   ALA  54          1HB       ALA  54 -17.058 -10.514  -4.078
  434   2HB   ALA  54          2HB       ALA  54 -17.153 -10.997  -2.370
  435   3HB   ALA  54          3HB       ALA  54 -18.466 -10.068  -3.098
  436    H    GLU  55           H        GLU  55 -16.006  -9.927  -0.476
  437    HA   GLU  55           HA       GLU  55 -17.694  -8.788   1.467
  438   1HB   GLU  55          1HB       GLU  55 -16.195 -10.725   1.789
  439   2HB   GLU  55          2HB       GLU  55 -14.775  -9.682   1.613
  440   1HG   GLU  55          1HG       GLU  55 -15.482  -8.424   3.659
  441   2HG   GLU  55          2HG       GLU  55 -16.863  -9.521   3.826
  442    H    PHE  56           H        PHE  56 -14.512  -7.755   0.234
  443    HA   PHE  56           HA       PHE  56 -14.341  -5.373   1.854
  444   1HB   PHE  56          1HB       PHE  56 -12.495  -6.940   1.078
  445   2HB   PHE  56          2HB       PHE  56 -12.687  -6.260  -0.533
  446    HD1  PHE  56           HD1      PHE  56 -12.002  -5.351   3.040
  447    HD2  PHE  56           HD2      PHE  56 -11.326  -4.371  -1.104
  448    HE1  PHE  56           HE1      PHE  56 -10.168  -3.841   3.696
  449    HE2  PHE  56           HE2      PHE  56  -9.428  -2.916  -0.447
  450    HZ   PHE  56           HZ       PHE  56  -8.800  -2.695   1.952
  451    H    TYR  57           H        TYR  57 -16.705  -5.205   0.394
  452    HA   TYR  57           HA       TYR  57 -16.351  -2.748  -1.176
  453   1HB   TYR  57          1HB       TYR  57 -17.186  -5.398  -2.347
  454   2HB   TYR  57          2HB       TYR  57 -18.159  -4.006  -2.768
  455    HD1  TYR  57           HD1      TYR  57 -14.682  -5.381  -2.951
  456    HD2  TYR  57           HD2      TYR  57 -17.515  -2.479  -4.421
  457    HE1  TYR  57           HE1      TYR  57 -13.057  -4.660  -4.679
  458    HE2  TYR  57           HE2      TYR  57 -15.974  -1.906  -6.254
  459    HH   TYR  57           HH       TYR  57 -13.802  -2.013  -6.981
  460    H    SER  58           H        SER  58 -18.771  -5.312  -0.511
  461    HA   SER  58           HA       SER  58 -20.897  -3.457  -0.066
  462   1HB   SER  58          1HB       SER  58 -21.204  -5.759  -0.900
  463   2HB   SER  58          2HB       SER  58 -20.686  -6.411   0.667
  464    HG   SER  58           HG       SER  58 -22.465  -5.317   1.603
  465    H    GLU  59           H        GLU  59 -18.915  -5.467   2.186
  466    HA   GLU  59           HA       GLU  59 -20.402  -4.476   4.491
  467   1HB   GLU  59          1HB       GLU  59 -18.063  -6.408   4.289
  468   2HB   GLU  59          2HB       GLU  59 -19.086  -6.134   5.709
  469   1HG   GLU  59          1HG       GLU  59 -21.072  -6.914   4.455
  470   2HG   GLU  59          2HG       GLU  59 -20.075  -7.200   3.020
  471    H    VAL  60           H        VAL  60 -18.554  -2.629   2.929
  472    HA   VAL  60           HA       VAL  60 -17.074  -1.055   3.157
  473    HB   VAL  60           HB       VAL  60 -17.366   0.496   4.851
  474   1HG1  VAL  60          1HG1      VAL  60 -19.333   0.027   3.403
  475   2HG1  VAL  60          2HG1      VAL  60 -20.017  -0.982   4.693
  476   3HG1  VAL  60          3HG1      VAL  60 -19.748   0.748   4.967
  477   1HG2  VAL  60          1HG2      VAL  60 -16.980  -0.886   6.868
  478   2HG2  VAL  60          2HG2      VAL  60 -18.391   0.168   6.999
  479   3HG2  VAL  60          3HG2      VAL  60 -18.622  -1.558   6.706
  480    H    LEU  61           H        LEU  61 -15.315   0.035   4.725
  481    HA   LEU  61           HA       LEU  61 -13.525  -1.808   6.032
  482   1HB   LEU  61          1HB       LEU  61 -11.725  -1.560   4.286
  483   2HB   LEU  61          2HB       LEU  61 -13.035  -2.640   3.848
  484    HG   LEU  61           HG       LEU  61 -13.594   0.095   2.950
  485   1HD1  LEU  61          1HD1      LEU  61 -11.042   0.015   2.770
  486   2HD1  LEU  61          2HD1      LEU  61 -11.287  -1.281   1.587
  487   3HD1  LEU  61          3HD1      LEU  61 -11.955   0.329   1.281
  488   1HD2  LEU  61          1HD2      LEU  61 -14.846  -1.908   2.164
  489   2HD2  LEU  61          2HD2      LEU  61 -14.054  -1.064   0.836
  490   3HD2  LEU  61          3HD2      LEU  61 -13.347  -2.555   1.476
  491    H    THR  62           H        THR  62 -11.377  -0.607   6.486
  492    HA   THR  62           HA       THR  62 -11.722   2.332   6.544
  493    HB   THR  62           HB       THR  62 -11.345   0.578   9.015
  494    HG1  THR  62           HG1      THR  62 -13.486   2.113   7.999
  495   1HG2  THR  62          1HG2      THR  62 -11.400   3.609   8.686
  496   2HG2  THR  62          2HG2      THR  62 -11.607   2.759  10.235
  497   3HG2  THR  62          3HG2      THR  62 -10.084   2.617   9.349
  498    H    ILE  63           H        ILE  63  -9.859   3.511   6.755
  499    HA   ILE  63           HA       ILE  63  -7.281   1.999   6.616
  500    HB   ILE  63           HB       ILE  63  -8.045   4.528   5.120
  501   1HG1  ILE  63          1HG1      ILE  63  -7.560   1.737   3.970
  502   2HG1  ILE  63          2HG1      ILE  63  -9.169   2.412   4.244
  503   1HG2  ILE  63          1HG2      ILE  63  -5.626   4.296   5.793
  504   2HG2  ILE  63          2HG2      ILE  63  -5.568   2.743   4.944
  505   3HG2  ILE  63          3HG2      ILE  63  -5.845   4.251   4.049
  506   1HD1  ILE  63          1HD1      ILE  63  -8.639   4.336   2.779
  507   2HD1  ILE  63          2HD1      ILE  63  -7.101   3.546   2.343
  508   3HD1  ILE  63          3HD1      ILE  63  -8.645   2.764   1.977
  509    H    VAL  64           H        VAL  64  -5.990   2.501   8.251
  510    HA   VAL  64           HA       VAL  64  -6.519   4.820   9.991
  511    HB   VAL  64           HB       VAL  64  -4.406   2.622  10.128
  512   1HG1  VAL  64          1HG1      VAL  64  -5.322   4.695  12.176
  513   2HG1  VAL  64          2HG1      VAL  64  -4.218   3.344  12.505
  514   3HG1  VAL  64          3HG1      VAL  64  -3.726   4.623  11.398
  515   1HG2  VAL  64          1HG2      VAL  64  -7.093   2.902  11.540
  516   2HG2  VAL  64          2HG2      VAL  64  -6.646   1.649  10.358
  517   3HG2  VAL  64          3HG2      VAL  64  -5.843   1.704  11.931
  518    H    VAL  65           H        VAL  65  -6.115   6.453   8.352
  519    HA   VAL  65           HA       VAL  65  -3.454   6.652   7.123
  520    HB   VAL  65           HB       VAL  65  -5.773   8.631   7.162
  521   1HG1  VAL  65          1HG1      VAL  65  -3.251   8.453   5.443
  522   2HG1  VAL  65          2HG1      VAL  65  -4.602   9.571   5.165
  523   3HG1  VAL  65          3HG1      VAL  65  -3.616   9.727   6.621
  524   1HG2  VAL  65          1HG2      VAL  65  -4.970   6.545   5.096
  525   2HG2  VAL  65          2HG2      VAL  65  -6.468   6.561   6.058
  526   3HG2  VAL  65          3HG2      VAL  65  -6.181   7.817   4.851
  527    H    ASP  66           H        ASP  66  -2.221   6.554   9.084
  528    HA   ASP  66           HA       ASP  66  -1.176   7.298  10.931
  529   1HB   ASP  66          1HB       ASP  66  -0.258   8.889   9.315
  530   2HB   ASP  66          2HB       ASP  66  -1.599  10.009   9.600
  531    H    GLY  67           H        GLY  67  -3.181   6.485  12.000
  532   1HA   GLY  67          1HA       GLY  67  -4.462   6.707  13.906
  533   2HA   GLY  67          2HA       GLY  67  -4.223   8.457  13.903
  534    H    LYS  68           H        LYS  68  -5.160   9.164  11.368
  535    HA   LYS  68           HA       LYS  68  -7.884   9.469  11.921
  536   1HB   LYS  68          1HB       LYS  68  -6.332  10.936  10.535
  537   2HB   LYS  68          2HB       LYS  68  -6.544   9.792   9.214
  538   1HG   LYS  68          1HG       LYS  68  -8.128  11.413   8.703
  539   2HG   LYS  68          2HG       LYS  68  -9.086  10.167   9.499
  540   1HD   LYS  68          1HD       LYS  68  -9.908  11.990  10.595
  541   2HD   LYS  68          2HD       LYS  68  -8.556  11.670  11.684
  542   1HE   LYS  68          1HE       LYS  68  -8.640  13.683   9.377
  543   2HE   LYS  68          2HE       LYS  68  -8.740  14.063  11.102
  544   1HZ   LYS  68          1HZ       LYS  68  -6.519  13.204  11.355
  545   2HZ   LYS  68          2HZ       LYS  68  -6.422  12.886   9.741
  546   3HZ   LYS  68          3HZ       LYS  68  -6.561  14.440  10.265
  547    H    GLU  69           H        GLU  69  -9.403   7.904  11.883
  548    HA   GLU  69           HA       GLU  69  -9.214   5.536  10.214
  549   1HB   GLU  69          1HB       GLU  69 -11.420   5.006  11.238
  550   2HB   GLU  69          2HB       GLU  69 -10.084   5.201  12.372
  551   1HG   GLU  69          1HG       GLU  69 -10.891   7.265  13.196
  552   2HG   GLU  69          2HG       GLU  69 -11.986   7.515  11.835
  553    H    ILE  70           H        ILE  70  -9.088   6.721   8.143
  554    HA   ILE  70           HA       ILE  70 -11.482   8.034   7.118
  555    HB   ILE  70           HB       ILE  70  -9.021   6.928   5.718
  556   1HG1  ILE  70          1HG1      ILE  70  -8.483   8.798   7.246
  557   2HG1  ILE  70          2HG1      ILE  70  -8.244   9.194   5.550
  558   1HG2  ILE  70          1HG2      ILE  70 -11.385   8.533   4.681
  559   2HG2  ILE  70          2HG2      ILE  70  -9.807   8.512   3.868
  560   3HG2  ILE  70          3HG2      ILE  70 -10.717   7.011   4.068
  561   1HD1  ILE  70          1HD1      ILE  70 -10.419  10.438   5.533
  562   2HD1  ILE  70          2HD1      ILE  70 -10.587  10.103   7.274
  563   3HD1  ILE  70          3HD1      ILE  70  -9.242  11.085   6.674
  564    H    LYS  71           H        LYS  71 -13.280   6.804   7.182
  565    HA   LYS  71           HA       LYS  71 -13.233   3.965   6.541
  566   1HB   LYS  71          1HB       LYS  71 -15.613   5.749   7.139
  567   2HB   LYS  71          2HB       LYS  71 -15.563   3.975   7.072
  568   1HG   LYS  71          1HG       LYS  71 -13.623   4.262   8.867
  569   2HG   LYS  71          2HG       LYS  71 -14.368   5.838   9.144
  570   1HD   LYS  71          1HD       LYS  71 -15.725   3.109   9.347
  571   2HD   LYS  71          2HD       LYS  71 -15.151   4.097  10.701
  572   1HE   LYS  71          1HE       LYS  71 -16.742   5.904  10.054
  573   2HE   LYS  71          2HE       LYS  71 -17.368   4.874   8.750
  574   1HZ   LYS  71          1HZ       LYS  71 -18.006   3.278  10.408
  575   2HZ   LYS  71          2HZ       LYS  71 -17.430   4.242  11.615
  576   3HZ   LYS  71          3HZ       LYS  71 -18.711   4.738  10.704
  577    H    VAL  72           H        VAL  72 -13.868   3.005   4.700
  578    HA   VAL  72           HA       VAL  72 -14.598   4.652   2.334
  579    HB   VAL  72           HB       VAL  72 -12.736   3.225   1.185
  580   1HG1  VAL  72          1HG1      VAL  72 -12.081   5.545   3.030
  581   2HG1  VAL  72          2HG1      VAL  72 -10.974   4.900   1.805
  582   3HG1  VAL  72          3HG1      VAL  72 -12.506   5.622   1.309
  583   1HG2  VAL  72          1HG2      VAL  72 -12.342   1.869   3.350
  584   2HG2  VAL  72          2HG2      VAL  72 -10.920   2.483   2.491
  585   3HG2  VAL  72          3HG2      VAL  72 -11.497   3.293   3.959
  586    H    LYS  73           H        LYS  73 -14.944   3.208   0.414
  587    HA   LYS  73           HA       LYS  73 -16.187   0.595   1.138
  588   1HB   LYS  73          1HB       LYS  73 -17.460   3.013  -0.024
  589   2HB   LYS  73          2HB       LYS  73 -17.695   1.564  -1.001
  590   1HG   LYS  73          1HG       LYS  73 -18.446   0.331   1.046
  591   2HG   LYS  73          2HG       LYS  73 -18.387   1.866   1.942
  592   1HD   LYS  73          1HD       LYS  73 -20.059   2.828   0.383
  593   2HD   LYS  73          2HD       LYS  73 -20.023   1.340  -0.588
  594   1HE   LYS  73          1HE       LYS  73 -20.836   0.044   1.388
  595   2HE   LYS  73          2HE       LYS  73 -20.966   1.561   2.303
  596   1HZ   LYS  73          1HZ       LYS  73 -22.415   0.904  -0.165
  597   2HZ   LYS  73          2HZ       LYS  73 -23.043   0.898   1.357
  598   3HZ   LYS  73          3HZ       LYS  73 -22.549   2.316   0.677
  599    H    ALA  74           H        ALA  74 -13.715   1.963  -0.584
  600    HA   ALA  74           HA       ALA  74 -12.381   1.224  -2.241
  601   1HB   ALA  74          1HB       ALA  74 -12.227  -0.725  -0.787
  602   2HB   ALA  74          2HB       ALA  74 -13.627  -1.471  -1.586
  603   3HB   ALA  74          3HB       ALA  74 -12.132  -1.191  -2.487
  604    H    GLN  75           H        GLN  75 -13.440   2.492  -3.896
  605    HA   GLN  75           HA       GLN  75 -15.557   1.463  -5.498
  606   1HB   GLN  75          1HB       GLN  75 -15.048   3.816  -5.383
  607   2HB   GLN  75          2HB       GLN  75 -13.429   3.566  -6.060
  608   1HG   GLN  75          1HG       GLN  75 -14.975   4.469  -7.730
  609   2HG   GLN  75          2HG       GLN  75 -14.407   2.869  -8.207
  610   1HE2  GLN  75          2HE2      GLN  75 -15.997   1.470  -8.898
  611   2HE2  GLN  75          1HE2      GLN  75 -17.697   1.609  -8.500
  612    H    ASP  76           H        ASP  76 -12.005   1.667  -6.165
  613    HA   ASP  76           HA       ASP  76 -12.225  -0.847  -7.750
  614   1HB   ASP  76          1HB       ASP  76 -12.185   0.943  -9.383
  615   2HB   ASP  76          2HB       ASP  76 -10.768   1.667  -8.614
  616    H    VAL  77           H        VAL  77 -10.740  -2.288  -7.237
  617    HA   VAL  77           HA       VAL  77  -8.286  -1.470  -5.768
  618    HB   VAL  77           HB       VAL  77  -8.367  -3.404  -4.410
  619   1HG1  VAL  77          1HG1      VAL  77  -9.846  -1.488  -3.675
  620   2HG1  VAL  77          2HG1      VAL  77 -11.224  -2.344  -4.390
  621   3HG1  VAL  77          3HG1      VAL  77 -10.327  -3.064  -3.042
  622   1HG2  VAL  77          1HG2      VAL  77 -10.820  -4.322  -5.968
  623   2HG2  VAL  77          2HG2      VAL  77  -9.245  -5.141  -5.830
  624   3HG2  VAL  77          3HG2      VAL  77 -10.291  -5.020  -4.423
  625    H    GLN  78           H        GLN  78  -6.485  -1.941  -6.973
  626    HA   GLN  78           HA       GLN  78  -6.886  -3.540  -9.423
  627   1HB   GLN  78          1HB       GLN  78  -4.397  -2.025  -8.605
  628   2HB   GLN  78          2HB       GLN  78  -4.826  -2.705 -10.175
  629   1HG   GLN  78          1HG       GLN  78  -6.817  -1.187 -10.274
  630   2HG   GLN  78          2HG       GLN  78  -6.323  -0.457  -8.736
  631   1HE2  GLN  78          2HE2      GLN  78  -6.123   1.641  -9.656
  632   2HE2  GLN  78          1HE2      GLN  78  -4.803   2.028 -10.739
  633    H    ARG  79           H        ARG  79  -7.375  -5.256  -7.804
  634    HA   ARG  79           HA       ARG  79  -5.267  -6.710  -6.474
  635   1HB   ARG  79          1HB       ARG  79  -7.028  -8.432  -6.206
  636   2HB   ARG  79          2HB       ARG  79  -7.570  -6.829  -5.702
  637   1HG   ARG  79          1HG       ARG  79  -8.875  -6.539  -7.726
  638   2HG   ARG  79          2HG       ARG  79  -8.181  -7.989  -8.458
  639   1HD   ARG  79          1HD       ARG  79  -9.331  -9.424  -6.873
  640   2HD   ARG  79          2HD       ARG  79  -9.796  -8.032  -5.884
  641    HE   ARG  79           HE       ARG  79 -11.597  -7.666  -7.180
  642   1HH1  ARG  79          1HH2      ARG  79  -9.347  -9.606  -9.132
  643   2HH1  ARG  79          2HH2      ARG  79 -10.440  -9.723 -10.487
  644   1HH2  ARG  79          1HH1      ARG  79 -13.007  -7.839  -8.954
  645   2HH2  ARG  79          2HH1      ARG  79 -12.532  -8.723 -10.379
  646    H    HIS  80           H        HIS  80  -4.882  -9.043  -6.993
  647    HA   HIS  80           HA       HIS  80  -5.177  -9.750  -9.848
  648   1HB   HIS  80          1HB       HIS  80  -2.836  -8.964  -9.348
  649   2HB   HIS  80          2HB       HIS  80  -2.650 -10.368  -8.295
  650    HD1  HIS  80           HD1      HIS  80  -3.978 -12.600 -10.135
  651    HD2  HIS  80           HD2      HIS  80  -1.475  -9.492 -11.475
  652    HE1  HIS  80           HE1      HIS  80  -3.066 -13.322 -12.402
  653    HA   PRO  81           HA       PRO  81  -6.875 -13.099  -7.248
  654   1HB   PRO  81          1HB       PRO  81  -8.405 -14.371  -9.097
  655   2HB   PRO  81          2HB       PRO  81  -8.849 -12.761  -8.460
  656   1HG   PRO  81          1HG       PRO  81  -7.377 -13.380 -11.033
  657   2HG   PRO  81          2HG       PRO  81  -8.808 -12.330 -10.821
  658   1HD   PRO  81          1HD       PRO  81  -6.252 -11.373 -10.905
  659   2HD   PRO  81          2HD       PRO  81  -7.489 -10.611  -9.860
  660    H    TYR  82           H        TYR  82  -6.804 -15.504  -7.382
  661    HA   TYR  82           HA       TYR  82  -5.831 -17.482  -7.660
  662   1HB   TYR  82          1HB       TYR  82  -4.315 -16.596 -10.125
  663   2HB   TYR  82          2HB       TYR  82  -4.864 -18.197  -9.673
  664    HD1  TYR  82           HD1      TYR  82  -7.646 -18.143  -9.200
  665    HD2  TYR  82           HD2      TYR  82  -5.416 -15.697 -11.969
  666    HE1  TYR  82           HE1      TYR  82  -9.718 -17.692 -10.482
  667    HE2  TYR  82           HE2      TYR  82  -7.479 -15.280 -13.261
  668    HH   TYR  82           HH       TYR  82  -9.745 -15.649 -13.424
  669    H    LYS  83           H        LYS  83  -3.323 -15.212  -8.810
  670    HA   LYS  83           HA       LYS  83  -1.463 -16.147  -6.692
  671   1HB   LYS  83          1HB       LYS  83   0.308 -15.144  -8.003
  672   2HB   LYS  83          2HB       LYS  83  -0.539 -16.450  -8.827
  673   1HG   LYS  83          1HG       LYS  83  -0.818 -15.144 -10.618
  674   2HG   LYS  83          2HG       LYS  83  -1.883 -14.110  -9.685
  675   1HD   LYS  83          1HD       LYS  83  -0.246 -12.681 -10.586
  676   2HD   LYS  83          2HD       LYS  83   0.190 -12.848  -8.880
  677   1HE   LYS  83          1HE       LYS  83   1.931 -14.526  -9.513
  678   2HE   LYS  83          2HE       LYS  83   1.413 -14.421 -11.206
  679   1HZ   LYS  83          1HZ       LYS  83   2.058 -12.131 -11.203
  680   2HZ   LYS  83          2HZ       LYS  83   2.544 -12.222  -9.630
  681   3HZ   LYS  83          3HZ       LYS  83   3.329 -13.094 -10.788
  682    HA   PRO  84           HA       PRO  84  -3.015 -12.308  -4.947
  683   1HB   PRO  84          1HB       PRO  84  -1.797 -12.349  -2.498
  684   2HB   PRO  84          2HB       PRO  84  -3.133 -13.442  -2.953
  685   1HG   PRO  84          1HG       PRO  84  -0.163 -14.026  -3.022
  686   2HG   PRO  84          2HG       PRO  84  -1.461 -15.023  -2.304
  687   1HD   PRO  84          1HD       PRO  84  -0.481 -15.507  -4.789
  688   2HD   PRO  84          2HD       PRO  84  -2.226 -15.712  -4.439
  689    H    LYS  85           H        LYS  85  -2.273 -10.526  -5.968
  690    HA   LYS  85           HA       LYS  85   0.207  -9.309  -5.030
  691   1HB   LYS  85          1HB       LYS  85  -0.060 -10.520  -7.704
  692   2HB   LYS  85          2HB       LYS  85   0.245  -8.790  -7.831
  693   1HG   LYS  85          1HG       LYS  85   1.925 -10.614  -6.076
  694   2HG   LYS  85          2HG       LYS  85   2.295 -10.312  -7.780
  695   1HD   LYS  85          1HD       LYS  85   2.618  -7.963  -7.433
  696   2HD   LYS  85          2HD       LYS  85   1.952  -8.035  -5.800
  697   1HE   LYS  85          1HE       LYS  85   3.845  -9.505  -5.095
  698   2HE   LYS  85          2HE       LYS  85   4.555  -9.324  -6.713
  699   1HZ   LYS  85          1HZ       LYS  85   4.005  -7.150  -4.812
  700   2HZ   LYS  85          2HZ       LYS  85   5.485  -7.798  -5.133
  701   3HZ   LYS  85          3HZ       LYS  85   4.679  -6.966  -6.305
  702    H    LEU  86           H        LEU  86   0.114  -7.100  -5.029
  703    HA   LEU  86           HA       LEU  86  -2.321  -5.777  -6.145
  704   1HB   LEU  86          1HB       LEU  86  -0.920  -5.491  -3.475
  705   2HB   LEU  86          2HB       LEU  86  -1.786  -4.120  -4.172
  706    HG   LEU  86           HG       LEU  86  -3.181  -6.797  -3.909
  707   1HD1  LEU  86          1HD1      LEU  86  -2.278  -6.228  -1.672
  708   2HD1  LEU  86          2HD1      LEU  86  -2.997  -4.610  -1.806
  709   3HD1  LEU  86          3HD1      LEU  86  -4.042  -6.033  -1.728
  710   1HD2  LEU  86          1HD2      LEU  86  -4.135  -3.886  -3.909
  711   2HD2  LEU  86          2HD2      LEU  86  -4.246  -4.988  -5.287
  712   3HD2  LEU  86          3HD2      LEU  86  -5.181  -5.316  -3.819
  713    H    GLN  87           H        GLN  87  -2.038  -3.728  -6.918
  714    HA   GLN  87           HA       GLN  87   0.750  -2.851  -7.577
  715   1HB   GLN  87          1HB       GLN  87  -1.778  -2.775  -9.281
  716   2HB   GLN  87          2HB       GLN  87  -0.221  -2.080  -9.737
  717   1HG   GLN  87          1HG       GLN  87  -0.699  -5.058  -9.218
  718   2HG   GLN  87          2HG       GLN  87  -0.740  -4.278 -10.795
  719   1HE2  GLN  87          2HE2      GLN  87   1.428  -5.052  -8.039
  720   2HE2  GLN  87          1HE2      GLN  87   2.903  -4.954  -8.983
  721    H    HIS  88           H        HIS  88  -2.686  -1.880  -7.188
  722    HA   HIS  88           HA       HIS  88  -1.992   0.570  -5.788
  723   1HB   HIS  88          1HB       HIS  88  -1.583   1.105  -8.224
  724   2HB   HIS  88          2HB       HIS  88  -3.267   0.706  -8.541
  725    HD1  HIS  88           HD1      HIS  88  -5.056   2.624  -7.867
  726    HD2  HIS  88           HD2      HIS  88  -1.025   3.361  -6.871
  727    HE1  HIS  88           HE1      HIS  88  -4.896   5.068  -7.190
  728    H    ILE  89           H        ILE  89  -4.010   1.674  -5.072
  729    HA   ILE  89           HA       ILE  89  -6.521   0.264  -5.624
  730    HB   ILE  89           HB       ILE  89  -5.599   0.811  -2.767
  731   1HG1  ILE  89          1HG1      ILE  89  -6.255  -1.810  -4.201
  732   2HG1  ILE  89          2HG1      ILE  89  -4.653  -1.275  -3.677
  733   1HG2  ILE  89          1HG2      ILE  89  -8.251  -0.023  -3.994
  734   2HG2  ILE  89          2HG2      ILE  89  -7.917  -0.202  -2.272
  735   3HG2  ILE  89          3HG2      ILE  89  -7.940   1.398  -2.998
  736   1HD1  ILE  89          1HD1      ILE  89  -5.519  -1.229  -1.301
  737   2HD1  ILE  89          2HD1      ILE  89  -6.947  -2.114  -1.892
  738   3HD1  ILE  89          3HD1      ILE  89  -5.341  -2.822  -2.054
  739    H    ASP  90           H        ASP  90  -8.192   1.602  -5.804
  740    HA   ASP  90           HA       ASP  90  -7.775   4.543  -5.439
  741   1HB   ASP  90          1HB       ASP  90  -9.361   3.003  -7.528
  742   2HB   ASP  90          2HB       ASP  90  -9.270   4.763  -7.378
  743    H    PHE  91           H        PHE  91  -8.558   4.198  -3.232
  744    HA   PHE  91           HA       PHE  91 -11.132   2.994  -2.740
  745   1HB   PHE  91          1HB       PHE  91  -9.461   4.860  -1.024
  746   2HB   PHE  91          2HB       PHE  91 -10.853   3.946  -0.473
  747    HD1  PHE  91           HD1      PHE  91  -7.264   3.860  -0.989
  748    HD2  PHE  91           HD2      PHE  91 -10.777   1.417  -0.460
  749    HE1  PHE  91           HE1      PHE  91  -5.862   2.040  -0.073
  750    HE2  PHE  91           HE2      PHE  91  -9.362  -0.406   0.458
  751    HZ   PHE  91           HZ       PHE  91  -6.920  -0.083   0.697
  752    H    VAL  92           H        VAL  92 -13.002   4.129  -1.834
  753    HA   VAL  92           HA       VAL  92 -13.205   7.036  -2.358
  754    HB   VAL  92           HB       VAL  92 -15.138   4.901  -3.308
  755   1HG1  VAL  92          1HG1      VAL  92 -15.686   7.869  -2.879
  756   2HG1  VAL  92          2HG1      VAL  92 -16.691   6.791  -3.869
  757   3HG1  VAL  92          3HG1      VAL  92 -16.546   6.500  -2.137
  758   1HG2  VAL  92          1HG2      VAL  92 -13.355   5.706  -4.898
  759   2HG2  VAL  92          2HG2      VAL  92 -14.979   6.175  -5.430
  760   3HG2  VAL  92          3HG2      VAL  92 -13.930   7.368  -4.653
  761    H    ARG  93           H        ARG  93 -14.070   8.094  -0.690
  762    HA   ARG  93           HA       ARG  93 -14.299   6.929   1.861
  763   1HB   ARG  93          1HB       ARG  93 -15.262   9.576   0.738
  764   2HB   ARG  93          2HB       ARG  93 -15.399   9.136   2.450
  765   1HG   ARG  93          1HG       ARG  93 -12.982   8.804   2.621
  766   2HG   ARG  93          2HG       ARG  93 -12.772   9.189   0.901
  767   1HD   ARG  93          1HD       ARG  93 -13.609  11.448   1.251
  768   2HD   ARG  93          2HD       ARG  93 -13.974  11.093   2.955
  769    HE   ARG  93           HE       ARG  93 -11.296  10.498   2.718
  770   1HH1  ARG  93          1HH2      ARG  93 -13.244  13.404   2.099
  771   2HH1  ARG  93          2HH2      ARG  93 -11.951  14.505   2.506
  772   1HH2  ARG  93          1HH1      ARG  93  -9.630  11.958   3.291
  773   2HH2  ARG  93          2HH1      ARG  93  -9.893  13.680   3.194
  774    H    ALA  94           H        ALA  94 -15.966   6.208   3.106
  775    HA   ALA  94           HA       ALA  94 -18.350   5.237   1.789
  776   1HB   ALA  94          1HB       ALA  94 -17.233   3.988   3.593
  777   2HB   ALA  94          2HB       ALA  94 -17.560   5.312   4.733
  778   3HB   ALA  94          3HB       ALA  94 -18.905   4.381   4.036
  Start of MODEL    6
    1    H    MET   1           H        MET   1 -15.421  -5.475   9.721
    2    HA   MET   1           HA       MET   1 -14.984  -3.566   7.798
    3   1HB   MET   1          1HB       MET   1 -14.455  -1.503   8.998
    4   2HB   MET   1          2HB       MET   1 -16.122  -1.990   9.268
    5   1HG   MET   1          1HG       MET   1 -15.397  -1.268  11.363
    6   2HG   MET   1          2HG       MET   1 -15.402  -3.024  11.472
    7   1HE   MET   1          1HE       MET   1 -13.295   0.268  11.353
    8   2HE   MET   1          2HE       MET   1 -11.621  -0.329  11.369
    9   3HE   MET   1          3HE       MET   1 -12.622  -0.556   9.922
   10    H    PHE   2           H        PHE   2 -12.669  -2.777   7.779
   11    HA   PHE   2           HA       PHE   2 -10.853  -4.404   9.477
   12   1HB   PHE   2          1HB       PHE   2  -9.950  -3.914   6.708
   13   2HB   PHE   2          2HB       PHE   2  -9.675  -5.288   7.764
   14    HD1  PHE   2           HD1      PHE   2 -11.142  -4.242   4.775
   15    HD2  PHE   2           HD2      PHE   2 -11.924  -6.798   8.159
   16    HE1  PHE   2           HE1      PHE   2 -13.018  -5.278   3.563
   17    HE2  PHE   2           HE2      PHE   2 -13.696  -7.960   6.858
   18    HZ   PHE   2           HZ       PHE   2 -14.229  -7.218   4.547
   19    H    THR   3           H        THR   3  -8.874  -3.431   9.905
   20    HA   THR   3           HA       THR   3  -8.847  -0.465   9.638
   21    HB   THR   3           HB       THR   3  -7.435  -2.313  11.606
   22    HG1  THR   3           HG1      THR   3  -9.718  -2.291  11.814
   23   1HG2  THR   3          1HG2      THR   3  -6.330  -0.079  11.300
   24   2HG2  THR   3          2HG2      THR   3  -7.896   0.702  11.643
   25   3HG2  THR   3          3HG2      THR   3  -7.082  -0.253  12.898
   26    H    ILE   4           H        ILE   4  -7.885  -0.283   7.571
   27    HA   ILE   4           HA       ILE   4  -5.419  -1.706   6.916
   28    HB   ILE   4           HB       ILE   4  -6.925   0.526   5.499
   29   1HG1  ILE   4          1HG1      ILE   4  -7.289  -1.201   3.754
   30   2HG1  ILE   4          2HG1      ILE   4  -6.567  -2.423   4.804
   31   1HG2  ILE   4          1HG2      ILE   4  -4.445  -1.044   4.657
   32   2HG2  ILE   4          2HG2      ILE   4  -5.380   0.030   3.600
   33   3HG2  ILE   4          3HG2      ILE   4  -4.508   0.700   4.977
   34   1HD1  ILE   4          1HD1      ILE   4  -9.080  -0.808   5.448
   35   2HD1  ILE   4          2HD1      ILE   4  -9.069  -2.429   4.718
   36   3HD1  ILE   4          3HD1      ILE   4  -8.458  -2.209   6.356
   37    H    ASN   5           H        ASN   5  -3.636  -1.153   8.034
   38    HA   ASN   5           HA       ASN   5  -3.147   1.484   9.143
   39   1HB   ASN   5          1HB       ASN   5  -1.327  -0.922   8.714
   40   2HB   ASN   5          2HB       ASN   5  -0.895   0.537   9.621
   41   1HD2  ASN   5          2HD2      ASN   5  -0.659  -1.832  10.918
   42   2HD2  ASN   5          1HD2      ASN   5  -1.931  -2.013  12.108
   43    H    ALA   6           H        ALA   6  -2.339   3.224   8.054
   44    HA   ALA   6           HA       ALA   6  -0.473   2.869   5.824
   45   1HB   ALA   6          1HB       ALA   6  -2.716   2.710   4.742
   46   2HB   ALA   6          2HB       ALA   6  -3.160   4.273   5.454
   47   3HB   ALA   6          3HB       ALA   6  -1.849   4.179   4.263
   48    H    GLU   7           H        GLU   7   0.323   4.983   5.059
   49    HA   GLU   7           HA       GLU   7  -0.102   7.315   6.813
   50   1HB   GLU   7          1HB       GLU   7   2.643   6.082   6.275
   51   2HB   GLU   7          2HB       GLU   7   2.370   7.701   6.929
   52   1HG   GLU   7          1HG       GLU   7   1.132   6.686   8.862
   53   2HG   GLU   7          2HG       GLU   7   1.582   5.081   8.257
   54    H    VAL   8           H        VAL   8   1.045   9.233   5.802
   55    HA   VAL   8           HA       VAL   8   0.292   9.499   3.058
   56    HB   VAL   8           HB       VAL   8   1.379  11.684   3.173
   57   1HG1  VAL   8          1HG1      VAL   8  -0.914  11.370   4.058
   58   2HG1  VAL   8          2HG1      VAL   8  -0.249  11.083   5.682
   59   3HG1  VAL   8          3HG1      VAL   8  -0.036  12.660   4.900
   60   1HG2  VAL   8          1HG2      VAL   8   3.355  11.151   4.561
   61   2HG2  VAL   8          2HG2      VAL   8   2.427  12.498   5.238
   62   3HG2  VAL   8          3HG2      VAL   8   2.306  10.889   5.973
   63    H    ARG   9           H        ARG   9   1.659   9.920   1.225
   64    HA   ARG   9           HA       ARG   9   3.826   8.007   1.025
   65   1HB   ARG   9          1HB       ARG   9   2.574   9.971  -0.932
   66   2HB   ARG   9          2HB       ARG   9   3.936   8.928  -1.339
   67   1HG   ARG   9          1HG       ARG   9   2.122   7.201  -0.066
   68   2HG   ARG   9          2HG       ARG   9   1.091   8.234  -1.040
   69   1HD   ARG   9          1HD       ARG   9   3.564   6.830  -2.158
   70   2HD   ARG   9          2HD       ARG   9   2.014   6.028  -2.070
   71    HE   ARG   9           HE       ARG   9   2.829   8.134  -3.911
   72   1HH1  ARG   9          1HH2      ARG   9   0.019   6.526  -2.419
   73   2HH1  ARG   9          2HH2      ARG   9  -1.040   6.866  -3.758
   74   1HH2  ARG   9          1HH1      ARG   9   1.410   8.582  -5.656
   75   2HH2  ARG   9          2HH1      ARG   9  -0.252   8.056  -5.598
   76    H    LYS  10           H        LYS  10   5.248   8.801   2.628
   77    HA   LYS  10           HA       LYS  10   7.324  10.439   1.420
   78   1HB   LYS  10          1HB       LYS  10   5.624  12.026   2.641
   79   2HB   LYS  10          2HB       LYS  10   6.217  11.305   4.127
   80   1HG   LYS  10          1HG       LYS  10   7.474  13.272   3.869
   81   2HG   LYS  10          2HG       LYS  10   8.591  12.018   3.306
   82   1HD   LYS  10          1HD       LYS  10   7.917  12.548   0.938
   83   2HD   LYS  10          2HD       LYS  10   6.807  13.784   1.559
   84   1HE   LYS  10          1HE       LYS  10   8.745  14.979   2.584
   85   2HE   LYS  10          2HE       LYS  10   9.838  13.753   1.914
   86   1HZ   LYS  10          1HZ       LYS  10   9.102  14.399  -0.273
   87   2HZ   LYS  10          2HZ       LYS  10   8.098  15.541   0.359
   88   3HZ   LYS  10          3HZ       LYS  10   9.729  15.692   0.532
   89    H    GLU  11           H        GLU  11   7.550   7.808   1.764
   90    HA   GLU  11           HA       GLU  11   8.314   7.038   4.411
   91   1HB   GLU  11          1HB       GLU  11   8.482   4.929   3.622
   92   2HB   GLU  11          2HB       GLU  11   7.475   5.606   2.345
   93   1HG   GLU  11          1HG       GLU  11   9.684   5.988   1.038
   94   2HG   GLU  11          2HG       GLU  11  10.470   5.029   2.299
   95    H    GLN  12           H        GLN  12  10.418   6.142   4.990
   96    HA   GLN  12           HA       GLN  12  12.675   7.867   4.317
   97   1HB   GLN  12          1HB       GLN  12  13.907   6.502   5.936
   98   2HB   GLN  12          2HB       GLN  12  12.491   7.298   6.597
   99   1HG   GLN  12          1HG       GLN  12  12.497   4.353   5.769
  100   2HG   GLN  12          2HG       GLN  12  12.968   4.922   7.370
  101   1HE2  GLN  12          2HE2      GLN  12  10.891   3.086   7.044
  102   2HE2  GLN  12          1HE2      GLN  12   9.388   3.864   7.494
  103    H    GLY  13           H        GLY  13  12.242   7.157   1.992
  104   1HA   GLY  13          1HA       GLY  13  14.292   5.126   1.237
  105   2HA   GLY  13          2HA       GLY  13  12.667   5.067   0.514
  106    H    LYS  14           H        LYS  14  11.985   6.752  -0.864
  107    HA   LYS  14           HA       LYS  14  13.517   9.181  -1.101
  108   1HB   LYS  14          1HB       LYS  14  14.829   7.623  -2.564
  109   2HB   LYS  14          2HB       LYS  14  13.407   7.420  -3.594
  110   1HG   LYS  14          1HG       LYS  14  13.435   9.814  -4.148
  111   2HG   LYS  14          2HG       LYS  14  14.681  10.120  -2.922
  112   1HD   LYS  14          1HD       LYS  14  16.280   8.715  -4.162
  113   2HD   LYS  14          2HD       LYS  14  15.052   8.403  -5.410
  114   1HE   LYS  14          1HE       LYS  14  14.943  10.818  -5.927
  115   2HE   LYS  14          2HE       LYS  14  16.102  11.168  -4.631
  116   1HZ   LYS  14          1HZ       LYS  14  16.665   9.555  -7.020
  117   2HZ   LYS  14          2HZ       LYS  14  17.155  11.106  -6.765
  118   3HZ   LYS  14          3HZ       LYS  14  17.733   9.896  -5.811
  119    H    GLY  15           H        GLY  15  11.335   9.493  -0.134
  120   1HA   GLY  15          1HA       GLY  15   9.269  10.451  -0.270
  121   2HA   GLY  15          2HA       GLY  15   9.607  10.798  -1.973
  122    H    ALA  16           H        ALA  16   8.997   7.904   0.078
  123    HA   ALA  16           HA       ALA  16   7.783   6.018  -0.221
  124   1HB   ALA  16          1HB       ALA  16   5.940   7.581   0.026
  125   2HB   ALA  16          2HB       ALA  16   5.867   7.794  -1.741
  126   3HB   ALA  16          3HB       ALA  16   5.526   6.207  -1.009
  127    H    SER  17           H        SER  17   9.865   5.750  -1.675
  128    HA   SER  17           HA       SER  17   9.040   4.154  -3.897
  129   1HB   SER  17          1HB       SER  17   9.022   6.434  -4.978
  130   2HB   SER  17          2HB       SER  17  10.745   6.593  -4.581
  131    HG   SER  17           HG       SER  17  10.310   5.785  -6.707
  132    H    ARG  18           H        ARG  18  11.054   3.285  -4.995
  133    HA   ARG  18           HA       ARG  18  13.039   2.316  -5.056
  134   1HB   ARG  18          1HB       ARG  18  13.721   4.669  -4.020
  135   2HB   ARG  18          2HB       ARG  18  14.165   3.684  -2.617
  136   1HG   ARG  18          1HG       ARG  18  15.599   2.288  -4.155
  137   2HG   ARG  18          2HG       ARG  18  15.113   3.348  -5.497
  138   1HD   ARG  18          1HD       ARG  18  15.990   5.312  -4.096
  139   2HD   ARG  18          2HD       ARG  18  16.766   4.118  -3.052
  140    HE   ARG  18           HE       ARG  18  17.561   5.035  -5.681
  141   1HH1  ARG  18          1HH2      ARG  18  17.729   2.175  -3.584
  142   2HH1  ARG  18          2HH2      ARG  18  19.158   1.542  -4.361
  143   1HH2  ARG  18          1HH1      ARG  18  19.425   4.198  -6.681
  144   2HH2  ARG  18          2HH1      ARG  18  20.125   2.700  -6.131
  145    H    ARG  19           H        ARG  19  12.214   2.664  -1.577
  146    HA   ARG  19           HA       ARG  19  13.055   0.098  -0.683
  147   1HB   ARG  19          1HB       ARG  19  10.824   1.950   0.208
  148   2HB   ARG  19          2HB       ARG  19  11.326   0.555   1.151
  149   1HG   ARG  19          1HG       ARG  19  13.383   2.672   0.431
  150   2HG   ARG  19          2HG       ARG  19  12.187   2.989   1.695
  151   1HD   ARG  19          1HD       ARG  19  14.200   2.107   2.734
  152   2HD   ARG  19          2HD       ARG  19  12.839   1.013   2.942
  153    HE   ARG  19           HE       ARG  19  13.881  -0.600   1.698
  154   1HH1  ARG  19          1HH2      ARG  19  15.608   2.461   1.198
  155   2HH1  ARG  19          2HH2      ARG  19  16.940   1.719   0.351
  156   1HH2  ARG  19          1HH1      ARG  19  15.613  -1.558   0.562
  157   2HH2  ARG  19          2HH1      ARG  19  16.936  -0.583  -0.021
  158    H    LEU  20           H        LEU  20  10.028   1.249  -2.116
  159    HA   LEU  20           HA       LEU  20   8.360  -0.939  -1.561
  160   1HB   LEU  20          1HB       LEU  20   8.272   0.827  -4.036
  161   2HB   LEU  20          2HB       LEU  20   6.931  -0.066  -3.304
  162    HG   LEU  20           HG       LEU  20   8.391   2.354  -2.138
  163   1HD1  LEU  20          1HD1      LEU  20   6.776   2.845  -3.945
  164   2HD1  LEU  20          2HD1      LEU  20   5.517   1.980  -3.033
  165   3HD1  LEU  20          3HD1      LEU  20   6.230   3.461  -2.372
  166   1HD2  LEU  20          1HD2      LEU  20   6.109   0.731  -0.931
  167   2HD2  LEU  20          2HD2      LEU  20   7.762   0.854  -0.268
  168   3HD2  LEU  20          3HD2      LEU  20   6.718   2.277  -0.308
  169    H    ARG  21           H        ARG  21  10.759  -0.489  -4.129
  170    HA   ARG  21           HA       ARG  21  10.118  -3.128  -5.360
  171   1HB   ARG  21          1HB       ARG  21  11.835  -0.774  -6.200
  172   2HB   ARG  21          2HB       ARG  21  11.737  -2.302  -7.102
  173   1HG   ARG  21          1HG       ARG  21   9.432  -2.004  -7.618
  174   2HG   ARG  21          2HG       ARG  21   9.232  -0.717  -6.424
  175   1HD   ARG  21          1HD       ARG  21   9.235   0.273  -8.575
  176   2HD   ARG  21          2HD       ARG  21  10.690   0.788  -7.730
  177    HE   ARG  21           HE       ARG  21  10.421  -1.020 -10.072
  178   1HH1  ARG  21          1HH2      ARG  21  12.703   0.395  -7.732
  179   2HH1  ARG  21          2HH2      ARG  21  14.068   0.246  -8.807
  180   1HH2  ARG  21          1HH1      ARG  21  12.212  -1.171 -11.456
  181   2HH2  ARG  21          2HH1      ARG  21  13.789  -0.654 -10.924
  182    H    ALA  22           H        ALA  22  10.904  -3.601  -2.936
  183    HA   ALA  22           HA       ALA  22  13.359  -5.058  -3.243
  184   1HB   ALA  22          1HB       ALA  22  13.379  -2.767  -1.219
  185   2HB   ALA  22          2HB       ALA  22  14.591  -4.052  -1.354
  186   3HB   ALA  22          3HB       ALA  22  14.392  -2.884  -2.672
  187    H    ALA  23           H        ALA  23  11.167  -3.591  -0.798
  188    HA   ALA  23           HA       ALA  23  10.951  -6.134   0.686
  189   1HB   ALA  23          1HB       ALA  23  11.142  -3.963   1.857
  190   2HB   ALA  23          2HB       ALA  23   9.609  -3.440   1.133
  191   3HB   ALA  23          3HB       ALA  23   9.651  -4.818   2.264
  192    H    ASN  24           H        ASN  24   7.985  -5.132   1.160
  193    HA   ASN  24           HA       ASN  24   6.710  -5.965  -1.363
  194   1HB   ASN  24          1HB       ASN  24   7.225  -8.066  -0.124
  195   2HB   ASN  24          2HB       ASN  24   6.343  -7.449   1.277
  196   1HD2  ASN  24          2HD2      ASN  24   4.532  -8.739   1.383
  197   2HD2  ASN  24          1HD2      ASN  24   3.398  -8.960   0.071
  198    H    LYS  25           H        LYS  25   6.423  -3.609  -1.087
  199    HA   LYS  25           HA       LYS  25   3.893  -2.993   0.320
  200   1HB   LYS  25          1HB       LYS  25   6.330  -1.171   0.355
  201   2HB   LYS  25          2HB       LYS  25   4.760  -0.887   1.125
  202   1HG   LYS  25          1HG       LYS  25   5.298  -2.976   2.571
  203   2HG   LYS  25          2HG       LYS  25   6.931  -2.870   1.887
  204   1HD   LYS  25          1HD       LYS  25   6.948  -0.414   2.679
  205   2HD   LYS  25          2HD       LYS  25   5.429  -0.775   3.513
  206   1HE   LYS  25          1HE       LYS  25   7.163  -0.975   5.140
  207   2HE   LYS  25          2HE       LYS  25   6.634  -2.623   4.767
  208   1HZ   LYS  25          1HZ       LYS  25   9.000  -1.286   3.657
  209   2HZ   LYS  25          2HZ       LYS  25   9.012  -2.426   4.846
  210   3HZ   LYS  25          3HZ       LYS  25   8.529  -2.831   3.326
  211    H    PHE  26           H        PHE  26   2.926  -0.931  -0.623
  212    HA   PHE  26           HA       PHE  26   3.885  -0.158  -3.256
  213   1HB   PHE  26          1HB       PHE  26   2.190  -1.143  -4.578
  214   2HB   PHE  26          2HB       PHE  26   2.753  -2.433  -3.554
  215    HD1  PHE  26           HD1      PHE  26  -0.110  -0.701  -4.750
  216    HD2  PHE  26           HD2      PHE  26   1.368  -2.803  -1.291
  217    HE1  PHE  26           HE1      PHE  26  -2.432  -1.151  -4.026
  218    HE2  PHE  26           HE2      PHE  26  -0.947  -3.325  -0.622
  219    HZ   PHE  26           HZ       PHE  26  -2.860  -2.462  -1.957
  220    HA   PRO  27           HA       PRO  27   1.411   3.360  -2.132
  221   1HB   PRO  27          1HB       PRO  27   1.175   4.734  -4.443
  222   2HB   PRO  27          2HB       PRO  27   2.784   4.383  -3.740
  223   1HG   PRO  27          1HG       PRO  27   1.347   2.851  -5.924
  224   2HG   PRO  27          2HG       PRO  27   3.022   3.474  -5.946
  225   1HD   PRO  27          1HD       PRO  27   2.399   0.907  -5.257
  226   2HD   PRO  27          2HD       PRO  27   3.764   1.778  -4.509
  227    H    ALA  28           H        ALA  28  -0.722   4.286  -2.177
  228    HA   ALA  28           HA       ALA  28  -2.696   3.369  -4.110
  229   1HB   ALA  28          1HB       ALA  28  -2.954   2.586  -1.181
  230   2HB   ALA  28          2HB       ALA  28  -4.262   2.518  -2.381
  231   3HB   ALA  28          3HB       ALA  28  -2.830   1.493  -2.570
  232    H    ILE  29           H        ILE  29  -4.813   4.536  -3.749
  233    HA   ILE  29           HA       ILE  29  -4.317   7.233  -2.539
  234    HB   ILE  29           HB       ILE  29  -5.317   6.555  -5.321
  235   1HG1  ILE  29          1HG1      ILE  29  -2.836   8.094  -4.402
  236   2HG1  ILE  29          2HG1      ILE  29  -2.825   6.439  -5.012
  237   1HG2  ILE  29          1HG2      ILE  29  -5.045   9.266  -3.965
  238   2HG2  ILE  29          2HG2      ILE  29  -5.474   9.000  -5.669
  239   3HG2  ILE  29          3HG2      ILE  29  -6.570   8.468  -4.416
  240   1HD1  ILE  29          1HD1      ILE  29  -3.813   7.297  -7.179
  241   2HD1  ILE  29          2HD1      ILE  29  -3.468   8.942  -6.590
  242   3HD1  ILE  29          3HD1      ILE  29  -2.148   7.790  -6.816
  243    H    ILE  30           H        ILE  30  -6.092   8.315  -1.805
  244    HA   ILE  30           HA       ILE  30  -8.592   6.765  -1.413
  245    HB   ILE  30           HB       ILE  30  -7.673   9.271   0.016
  246   1HG1  ILE  30          1HG1      ILE  30  -7.240   6.403   0.965
  247   2HG1  ILE  30          2HG1      ILE  30  -5.975   7.524   0.438
  248   1HG2  ILE  30          1HG2      ILE  30 -10.119   8.695   0.123
  249   2HG2  ILE  30          2HG2      ILE  30  -9.677   7.148   0.871
  250   3HG2  ILE  30          3HG2      ILE  30  -9.340   8.681   1.696
  251   1HD1  ILE  30          1HD1      ILE  30  -6.715   9.120   2.262
  252   2HD1  ILE  30          2HD1      ILE  30  -7.670   7.770   2.928
  253   3HD1  ILE  30          3HD1      ILE  30  -5.911   7.631   2.771
  254    H    TYR  31           H        TYR  31 -10.559   7.730  -2.080
  255    HA   TYR  31           HA       TYR  31 -10.369  10.269  -3.660
  256   1HB   TYR  31          1HB       TYR  31 -11.674   7.626  -4.330
  257   2HB   TYR  31          2HB       TYR  31 -12.313   9.136  -4.969
  258    HD1  TYR  31           HD1      TYR  31 -11.247  10.325  -6.741
  259    HD2  TYR  31           HD2      TYR  31  -9.230   7.014  -4.845
  260    HE1  TYR  31           HE1      TYR  31  -9.469  10.425  -8.459
  261    HE2  TYR  31           HE2      TYR  31  -7.430   7.153  -6.535
  262    HH   TYR  31           HH       TYR  31  -6.723   8.127  -8.496
  263    H    GLY  32           H        GLY  32 -12.169  11.573  -3.724
  264   1HA   GLY  32          1HA       GLY  32 -14.228  12.419  -3.040
  265   2HA   GLY  32          2HA       GLY  32 -14.383  11.153  -1.814
  266    H    GLY  33           H        GLY  33 -14.624  12.364   0.023
  267   1HA   GLY  33          1HA       GLY  33 -13.806  13.346   1.941
  268   2HA   GLY  33          2HA       GLY  33 -12.292  13.765   1.128
  269    H    LYS  34           H        LYS  34 -12.156  15.739   0.004
  270    HA   LYS  34           HA       LYS  34 -14.372  17.698   0.384
  271   1HB   LYS  34          1HB       LYS  34 -12.191  18.383   1.203
  272   2HB   LYS  34          2HB       LYS  34 -11.443  18.072  -0.363
  273   1HG   LYS  34          1HG       LYS  34 -12.960  19.832  -1.374
  274   2HG   LYS  34          2HG       LYS  34 -13.617  20.135   0.245
  275   1HD   LYS  34          1HD       LYS  34 -11.365  20.784   1.038
  276   2HD   LYS  34          2HD       LYS  34 -10.686  20.407  -0.561
  277   1HE   LYS  34          1HE       LYS  34 -12.150  22.143  -1.587
  278   2HE   LYS  34          2HE       LYS  34 -12.795  22.540   0.017
  279   1HZ   LYS  34          1HZ       LYS  34  -9.988  22.793  -0.816
  280   2HZ   LYS  34          2HZ       LYS  34 -11.056  24.032  -0.643
  281   3HZ   LYS  34          3HZ       LYS  34 -10.582  23.166   0.675
  282    H    GLU  35           H        GLU  35 -11.942  17.561  -2.202
  283    HA   GLU  35           HA       GLU  35 -13.640  16.414  -4.204
  284   1HB   GLU  35          1HB       GLU  35 -14.587  18.802  -3.893
  285   2HB   GLU  35          2HB       GLU  35 -13.051  19.394  -4.531
  286   1HG   GLU  35          1HG       GLU  35 -13.503  18.084  -6.643
  287   2HG   GLU  35          2HG       GLU  35 -15.020  17.517  -5.930
  288    H    ALA  36           H        ALA  36 -11.221  15.653  -3.214
  289    HA   ALA  36           HA       ALA  36  -9.454  15.797  -5.471
  290   1HB   ALA  36          1HB       ALA  36  -8.638  17.227  -2.898
  291   2HB   ALA  36          2HB       ALA  36  -7.542  16.837  -4.239
  292   3HB   ALA  36          3HB       ALA  36  -8.869  17.983  -4.489
  293    HA   PRO  37           HA       PRO  37  -8.536  12.044  -3.246
  294   1HB   PRO  37          1HB       PRO  37  -6.541  10.970  -4.764
  295   2HB   PRO  37          2HB       PRO  37  -8.200  11.172  -5.397
  296   1HG   PRO  37          1HG       PRO  37  -5.827  13.030  -5.768
  297   2HG   PRO  37          2HG       PRO  37  -6.907  12.374  -7.035
  298   1HD   PRO  37          1HD       PRO  37  -7.290  14.850  -5.936
  299   2HD   PRO  37          2HD       PRO  37  -8.670  13.805  -6.394
  300    H    LEU  38           H        LEU  38  -6.908  11.008  -1.910
  301    HA   LEU  38           HA       LEU  38  -4.597  12.747  -1.100
  302   1HB   LEU  38          1HB       LEU  38  -6.416  11.013   0.618
  303   2HB   LEU  38          2HB       LEU  38  -4.886  11.688   1.149
  304    HG   LEU  38           HG       LEU  38  -6.650  12.959   2.052
  305   1HD1  LEU  38          1HD1      LEU  38  -4.588  14.169   1.362
  306   2HD1  LEU  38          2HD1      LEU  38  -5.398  14.651  -0.147
  307   3HD1  LEU  38          3HD1      LEU  38  -6.030  15.202   1.413
  308   1HD2  LEU  38          1HD2      LEU  38  -8.381  12.468   0.271
  309   2HD2  LEU  38          2HD2      LEU  38  -8.355  14.123   0.909
  310   3HD2  LEU  38          3HD2      LEU  38  -7.657  13.790  -0.674
  311    H    ALA  39           H        ALA  39  -2.673  11.807  -1.323
  312    HA   ALA  39           HA       ALA  39  -2.479   9.034  -2.233
  313   1HB   ALA  39          1HB       ALA  39  -0.433  11.260  -1.860
  314   2HB   ALA  39          2HB       ALA  39  -0.099   9.687  -2.597
  315   3HB   ALA  39          3HB       ALA  39  -1.241  10.798  -3.375
  316    H    ILE  40           H        ILE  40  -1.910   7.312  -0.988
  317    HA   ILE  40           HA       ILE  40  -0.327   7.729   1.471
  318    HB   ILE  40           HB       ILE  40  -1.741   6.088   2.686
  319   1HG1  ILE  40          1HG1      ILE  40  -4.162   5.914   1.940
  320   2HG1  ILE  40          2HG1      ILE  40  -3.651   6.381   0.321
  321   1HG2  ILE  40          1HG2      ILE  40  -1.946   8.539   3.003
  322   2HG2  ILE  40          2HG2      ILE  40  -3.283   8.556   1.830
  323   3HG2  ILE  40          3HG2      ILE  40  -3.432   7.648   3.345
  324   1HD1  ILE  40          1HD1      ILE  40  -2.632   3.966   1.900
  325   2HD1  ILE  40          2HD1      ILE  40  -3.905   3.924   0.666
  326   3HD1  ILE  40          3HD1      ILE  40  -2.247   4.332   0.206
  327    H    GLU  41           H        GLU  41   0.436   5.537   2.342
  328    HA   GLU  41           HA       GLU  41   0.958   3.573   0.194
  329   1HB   GLU  41          1HB       GLU  41   3.334   3.459   0.719
  330   2HB   GLU  41          2HB       GLU  41   2.885   5.057   0.162
  331   1HG   GLU  41          1HG       GLU  41   4.108   5.775   1.902
  332   2HG   GLU  41          2HG       GLU  41   2.664   5.478   2.864
  333    H    LEU  42           H        LEU  42   1.496   1.477   0.967
  334    HA   LEU  42           HA       LEU  42   1.248   0.809   3.757
  335   1HB   LEU  42          1HB       LEU  42  -0.963  -0.469   3.370
  336   2HB   LEU  42          2HB       LEU  42  -1.010   1.262   3.653
  337    HG   LEU  42           HG       LEU  42  -1.371   1.726   1.268
  338   1HD1  LEU  42          1HD1      LEU  42  -1.264  -1.301   0.963
  339   2HD1  LEU  42          2HD1      LEU  42  -1.942  -0.193  -0.253
  340   3HD1  LEU  42          3HD1      LEU  42  -0.230  -0.106   0.151
  341   1HD2  LEU  42          1HD2      LEU  42  -3.286   1.346   2.764
  342   2HD2  LEU  42          2HD2      LEU  42  -3.627   0.801   1.114
  343   3HD2  LEU  42          3HD2      LEU  42  -3.246  -0.392   2.372
  344    H    ASP  43           H        ASP  43   0.993  -1.578   4.064
  345    HA   ASP  43           HA       ASP  43   3.016  -2.888   2.509
  346   1HB   ASP  43          1HB       ASP  43   1.145  -3.954   4.666
  347   2HB   ASP  43          2HB       ASP  43   2.571  -4.790   4.036
  348    H    HIS  44           H        HIS  44   2.836  -4.831   1.314
  349    HA   HIS  44           HA       HIS  44   0.213  -5.365   0.002
  350   1HB   HIS  44          1HB       HIS  44   2.282  -4.879  -1.342
  351   2HB   HIS  44          2HB       HIS  44   3.030  -6.294  -0.632
  352    HD1  HIS  44           HD1      HIS  44   0.324  -8.167  -1.071
  353    HD2  HIS  44           HD2      HIS  44   2.539  -5.868  -3.804
  354    HE1  HIS  44           HE1      HIS  44  -0.050  -9.209  -3.371
  355    H    ASP  45           H        ASP  45  -0.085  -6.063   2.509
  356    HA   ASP  45           HA       ASP  45   0.185  -9.004   2.631
  357   1HB   ASP  45          1HB       ASP  45   2.326  -8.251   3.497
  358   2HB   ASP  45          2HB       ASP  45   1.544  -7.072   4.552
  359    H    LYS  46           H        LYS  46  -0.392  -6.448   5.100
  360    HA   LYS  46           HA       LYS  46  -2.662  -7.673   6.268
  361   1HB   LYS  46          1HB       LYS  46  -1.494  -4.890   6.216
  362   2HB   LYS  46          2HB       LYS  46  -3.142  -5.099   6.802
  363   1HG   LYS  46          1HG       LYS  46  -1.543  -5.097   8.608
  364   2HG   LYS  46          2HG       LYS  46  -2.471  -6.590   8.560
  365   1HD   LYS  46          1HD       LYS  46   0.271  -6.543   7.251
  366   2HD   LYS  46          2HD       LYS  46   0.150  -6.508   9.012
  367   1HE   LYS  46          1HE       LYS  46  -1.291  -8.564   8.948
  368   2HE   LYS  46          2HE       LYS  46  -0.950  -8.701   7.212
  369   1HZ   LYS  46          1HZ       LYS  46   1.062  -8.710   9.339
  370   2HZ   LYS  46          2HZ       LYS  46   0.493 -10.027   8.522
  371   3HZ   LYS  46          3HZ       LYS  46   1.349  -8.876   7.722
  372    H    VAL  47           H        VAL  47  -2.604  -4.994   3.843
  373    HA   VAL  47           HA       VAL  47  -5.409  -5.096   3.456
  374    HB   VAL  47           HB       VAL  47  -3.821  -3.196   2.927
  375   1HG1  VAL  47          1HG1      VAL  47  -2.291  -4.610   1.462
  376   2HG1  VAL  47          2HG1      VAL  47  -3.562  -4.581   0.224
  377   3HG1  VAL  47          3HG1      VAL  47  -2.824  -3.063   0.759
  378   1HG2  VAL  47          1HG2      VAL  47  -6.225  -3.162   2.352
  379   2HG2  VAL  47          2HG2      VAL  47  -5.235  -2.323   1.145
  380   3HG2  VAL  47          3HG2      VAL  47  -5.869  -3.941   0.795
  381    H    MET  48           H        MET  48  -2.794  -7.045   2.074
  382    HA   MET  48           HA       MET  48  -4.198  -7.981  -0.218
  383   1HB   MET  48          1HB       MET  48  -1.733  -8.053   0.166
  384   2HB   MET  48          2HB       MET  48  -1.967  -9.436   1.245
  385   1HG   MET  48          1HG       MET  48  -2.973  -9.367  -1.629
  386   2HG   MET  48          2HG       MET  48  -1.356  -9.898  -1.194
  387   1HE   MET  48          1HE       MET  48  -3.787 -11.404  -2.820
  388   2HE   MET  48          2HE       MET  48  -4.541 -12.724  -1.895
  389   3HE   MET  48          3HE       MET  48  -5.048 -11.047  -1.630
  390    H    ASN  49           H        ASN  49  -3.902  -9.240   3.139
  391    HA   ASN  49           HA       ASN  49  -5.585 -11.533   2.755
  392   1HB   ASN  49          1HB       ASN  49  -4.857  -9.882   5.207
  393   2HB   ASN  49          2HB       ASN  49  -5.966 -11.254   5.267
  394   1HD2  ASN  49          2HD2      ASN  49  -2.587 -10.355   4.409
  395   2HD2  ASN  49          1HD2      ASN  49  -1.939 -11.957   4.669
  396    H    MET  50           H        MET  50  -6.295  -8.133   3.653
  397    HA   MET  50           HA       MET  50  -9.044  -8.540   4.235
  398   1HB   MET  50          1HB       MET  50  -7.512  -6.052   3.421
  399   2HB   MET  50          2HB       MET  50  -9.181  -6.043   4.004
  400   1HG   MET  50          1HG       MET  50  -8.568  -6.867   6.155
  401   2HG   MET  50          2HG       MET  50  -6.944  -7.293   5.630
  402   1HE   MET  50          1HE       MET  50  -7.307  -5.785   8.317
  403   2HE   MET  50          2HE       MET  50  -5.717  -6.166   7.612
  404   3HE   MET  50          3HE       MET  50  -6.069  -4.515   8.173
  405    H    GLN  51           H        GLN  51  -7.448  -7.469   1.179
  406    HA   GLN  51           HA       GLN  51  -9.838  -6.862  -0.138
  407   1HB   GLN  51          1HB       GLN  51  -8.607  -6.862  -2.256
  408   2HB   GLN  51          2HB       GLN  51  -7.957  -5.889  -0.945
  409   1HG   GLN  51          1HG       GLN  51  -6.023  -6.708  -1.675
  410   2HG   GLN  51          2HG       GLN  51  -6.412  -7.970  -0.514
  411   1HE2  GLN  51          2HE2      GLN  51  -4.577  -8.184  -2.726
  412   2HE2  GLN  51          1HE2      GLN  51  -5.204  -9.422  -3.795
  413    H    ALA  52           H        ALA  52  -8.002  -9.916  -0.306
  414    HA   ALA  52           HA       ALA  52  -8.561 -11.993  -0.872
  415   1HB   ALA  52          1HB       ALA  52  -9.854 -11.791   1.163
  416   2HB   ALA  52          2HB       ALA  52 -11.263 -11.184   0.279
  417   3HB   ALA  52          3HB       ALA  52 -10.695 -12.844   0.010
  418    H    LYS  53           H        LYS  53 -11.766 -10.628  -1.706
  419    HA   LYS  53           HA       LYS  53 -11.387 -11.239  -4.552
  420   1HB   LYS  53          1HB       LYS  53 -12.105 -13.376  -3.437
  421   2HB   LYS  53          2HB       LYS  53 -13.561 -12.584  -2.878
  422   1HG   LYS  53          1HG       LYS  53 -14.204 -13.780  -4.780
  423   2HG   LYS  53          2HG       LYS  53 -14.067 -12.127  -5.401
  424   1HD   LYS  53          1HD       LYS  53 -11.776 -12.669  -6.254
  425   2HD   LYS  53          2HD       LYS  53 -11.932 -14.316  -5.630
  426   1HE   LYS  53          1HE       LYS  53 -13.687 -13.028  -7.774
  427   2HE   LYS  53          2HE       LYS  53 -12.359 -14.166  -8.065
  428   1HZ   LYS  53          1HZ       LYS  53 -13.570 -15.802  -6.798
  429   2HZ   LYS  53          2HZ       LYS  53 -14.828 -14.759  -6.592
  430   3HZ   LYS  53          3HZ       LYS  53 -14.435 -15.285  -8.099
  431    H    ALA  54           H        ALA  54 -14.618 -10.991  -3.188
  432    HA   ALA  54           HA       ALA  54 -14.833  -8.171  -4.150
  433   1HB   ALA  54          1HB       ALA  54 -16.924 -10.373  -3.935
  434   2HB   ALA  54          2HB       ALA  54 -17.211  -8.713  -4.503
  435   3HB   ALA  54          3HB       ALA  54 -16.155  -9.797  -5.434
  436    H    GLU  55           H        GLU  55 -15.083 -10.277  -1.415
  437    HA   GLU  55           HA       GLU  55 -16.916  -9.258   0.297
  438   1HB   GLU  55          1HB       GLU  55 -15.467 -11.233   0.612
  439   2HB   GLU  55          2HB       GLU  55 -14.071 -10.181   0.903
  440   1HG   GLU  55          1HG       GLU  55 -15.128  -9.306   2.941
  441   2HG   GLU  55          2HG       GLU  55 -16.597 -10.243   2.607
  442    H    PHE  56           H        PHE  56 -13.708  -7.906  -0.365
  443    HA   PHE  56           HA       PHE  56 -13.154  -6.231   1.603
  444   1HB   PHE  56          1HB       PHE  56 -11.926  -6.647  -0.514
  445   2HB   PHE  56          2HB       PHE  56 -12.944  -5.516  -1.354
  446    HD1  PHE  56           HD1      PHE  56 -11.841  -3.480  -1.802
  447    HD2  PHE  56           HD2      PHE  56 -10.943  -5.559   1.873
  448    HE1  PHE  56           HE1      PHE  56  -9.874  -2.019  -1.446
  449    HE2  PHE  56           HE2      PHE  56  -8.950  -4.134   2.188
  450    HZ   PHE  56           HZ       PHE  56  -8.355  -2.434   0.482
  451    H    TYR  57           H        TYR  57 -14.900  -4.951  -1.249
  452    HA   TYR  57           HA       TYR  57 -15.740  -2.547   0.169
  453   1HB   TYR  57          1HB       TYR  57 -16.797  -2.053  -2.087
  454   2HB   TYR  57          2HB       TYR  57 -15.050  -2.204  -2.018
  455    HD1  TYR  57           HD1      TYR  57 -13.875  -3.793  -3.341
  456    HD2  TYR  57           HD2      TYR  57 -18.164  -4.067  -2.986
  457    HE1  TYR  57           HE1      TYR  57 -13.915  -5.499  -5.136
  458    HE2  TYR  57           HE2      TYR  57 -18.201  -5.767  -4.784
  459    HH   TYR  57           HH       TYR  57 -16.962  -6.954  -6.322
  460    H    SER  58           H        SER  58 -17.051  -5.706   0.042
  461    HA   SER  58           HA       SER  58 -19.828  -5.014  -0.212
  462   1HB   SER  58          1HB       SER  58 -18.612  -7.456   1.141
  463   2HB   SER  58          2HB       SER  58 -20.270  -7.245   0.575
  464    HG   SER  58           HG       SER  58 -17.928  -7.230  -1.042
  465    H    GLU  59           H        GLU  59 -17.787  -5.833   2.656
  466    HA   GLU  59           HA       GLU  59 -19.940  -4.865   4.430
  467   1HB   GLU  59          1HB       GLU  59 -18.868  -6.140   6.143
  468   2HB   GLU  59          2HB       GLU  59 -19.085  -7.136   4.702
  469   1HG   GLU  59          1HG       GLU  59 -16.701  -6.832   4.104
  470   2HG   GLU  59          2HG       GLU  59 -16.463  -5.792   5.519
  471    H    VAL  60           H        VAL  60 -17.725  -3.094   3.013
  472    HA   VAL  60           HA       VAL  60 -16.808  -1.141   3.412
  473    HB   VAL  60           HB       VAL  60 -18.896  -1.071   5.176
  474   1HG1  VAL  60          1HG1      VAL  60 -17.358  -1.625   7.162
  475   2HG1  VAL  60          2HG1      VAL  60 -16.536  -0.093   6.847
  476   3HG1  VAL  60          3HG1      VAL  60 -18.250  -0.108   7.269
  477   1HG2  VAL  60          1HG2      VAL  60 -18.192   0.729   3.657
  478   2HG2  VAL  60          2HG2      VAL  60 -18.542   1.333   5.280
  479   3HG2  VAL  60          3HG2      VAL  60 -16.861   1.144   4.754
  480    H    LEU  61           H        LEU  61 -15.070   0.058   4.630
  481    HA   LEU  61           HA       LEU  61 -13.475  -1.416   6.517
  482   1HB   LEU  61          1HB       LEU  61 -11.451  -1.542   5.104
  483   2HB   LEU  61          2HB       LEU  61 -12.739  -2.611   4.576
  484    HG   LEU  61           HG       LEU  61 -12.864   0.004   3.222
  485   1HD1  LEU  61          1HD1      LEU  61 -10.423  -1.758   2.815
  486   2HD1  LEU  61          2HD1      LEU  61 -10.930  -0.429   1.752
  487   3HD1  LEU  61          3HD1      LEU  61 -10.428  -0.085   3.419
  488   1HD2  LEU  61          1HD2      LEU  61 -12.682  -2.868   2.235
  489   2HD2  LEU  61          2HD2      LEU  61 -14.175  -1.935   2.485
  490   3HD2  LEU  61          3HD2      LEU  61 -13.030  -1.458   1.221
  491    H    THR  62           H        THR  62 -11.280  -0.137   6.810
  492    HA   THR  62           HA       THR  62 -11.815   2.793   6.638
  493    HB   THR  62           HB       THR  62 -11.138   1.170   9.120
  494    HG1  THR  62           HG1      THR  62 -13.189   1.935   9.775
  495   1HG2  THR  62          1HG2      THR  62 -11.592   4.167   8.810
  496   2HG2  THR  62          2HG2      THR  62 -11.371   3.275  10.337
  497   3HG2  THR  62          3HG2      THR  62 -10.035   3.388   9.187
  498    H    ILE  63           H        ILE  63 -10.107   3.905   6.023
  499    HA   ILE  63           HA       ILE  63  -7.375   2.756   6.128
  500    HB   ILE  63           HB       ILE  63  -8.666   5.137   4.778
  501   1HG1  ILE  63          1HG1      ILE  63  -8.542   2.758   3.768
  502   2HG1  ILE  63          2HG1      ILE  63  -8.043   4.127   2.765
  503   1HG2  ILE  63          1HG2      ILE  63  -5.693   4.733   5.266
  504   2HG2  ILE  63          2HG2      ILE  63  -6.343   5.720   3.945
  505   3HG2  ILE  63          3HG2      ILE  63  -6.684   6.162   5.615
  506   1HD1  ILE  63          1HD1      ILE  63  -6.034   2.475   4.347
  507   2HD1  ILE  63          2HD1      ILE  63  -6.540   2.079   2.702
  508   3HD1  ILE  63          3HD1      ILE  63  -5.717   3.611   3.018
  509    H    VAL  64           H        VAL  64  -6.236   3.079   7.918
  510    HA   VAL  64           HA       VAL  64  -6.668   5.444   9.654
  511    HB   VAL  64           HB       VAL  64  -4.651   3.170   9.801
  512   1HG1  VAL  64          1HG1      VAL  64  -5.295   5.428  11.752
  513   2HG1  VAL  64          2HG1      VAL  64  -4.210   4.061  12.078
  514   3HG1  VAL  64          3HG1      VAL  64  -3.784   5.245  10.838
  515   1HG2  VAL  64          1HG2      VAL  64  -7.189   3.714  11.399
  516   2HG2  VAL  64          2HG2      VAL  64  -6.934   2.382  10.248
  517   3HG2  VAL  64          3HG2      VAL  64  -5.994   2.447  11.749
  518    H    VAL  65           H        VAL  65  -5.905   7.275   8.689
  519    HA   VAL  65           HA       VAL  65  -3.175   7.204   7.452
  520    HB   VAL  65           HB       VAL  65  -4.690   7.682   5.724
  521   1HG1  VAL  65          1HG1      VAL  65  -6.680   8.419   6.964
  522   2HG1  VAL  65          2HG1      VAL  65  -5.901   9.981   7.313
  523   3HG1  VAL  65          3HG1      VAL  65  -6.253   9.516   5.643
  524   1HG2  VAL  65          1HG2      VAL  65  -2.576   8.958   5.805
  525   2HG2  VAL  65          2HG2      VAL  65  -3.870   9.827   4.960
  526   3HG2  VAL  65          3HG2      VAL  65  -3.419  10.302   6.605
  527    H    ASP  66           H        ASP  66  -2.219   7.349   9.428
  528    HA   ASP  66           HA       ASP  66  -1.462   8.189  11.349
  529   1HB   ASP  66          1HB       ASP  66  -0.487   9.843   9.836
  530   2HB   ASP  66          2HB       ASP  66  -1.931  10.860   9.961
  531    H    GLY  67           H        GLY  67  -3.413   7.231  12.290
  532   1HA   GLY  67          1HA       GLY  67  -4.797   7.386  14.129
  533   2HA   GLY  67          2HA       GLY  67  -4.716   9.147  14.075
  534    H    LYS  68           H        LYS  68  -5.692   9.821  11.614
  535    HA   LYS  68           HA       LYS  68  -8.455   9.751  12.063
  536   1HB   LYS  68          1HB       LYS  68  -6.816  10.494   9.624
  537   2HB   LYS  68          2HB       LYS  68  -8.584  10.610   9.662
  538   1HG   LYS  68          1HG       LYS  68  -8.482  12.076  11.643
  539   2HG   LYS  68          2HG       LYS  68  -6.707  12.030  11.599
  540   1HD   LYS  68          1HD       LYS  68  -6.683  13.099   9.410
  541   2HD   LYS  68          2HD       LYS  68  -8.450  12.965   9.274
  542   1HE   LYS  68          1HE       LYS  68  -8.743  14.468  11.212
  543   2HE   LYS  68          2HE       LYS  68  -6.984  14.612  11.381
  544   1HZ   LYS  68          1HZ       LYS  68  -8.550  15.447   9.036
  545   2HZ   LYS  68          2HZ       LYS  68  -7.945  16.454  10.189
  546   3HZ   LYS  68          3HZ       LYS  68  -6.920  15.610   9.215
  547    H    GLU  69           H        GLU  69  -9.790   8.124  11.963
  548    HA   GLU  69           HA       GLU  69  -9.505   5.813  10.207
  549   1HB   GLU  69          1HB       GLU  69 -11.570   6.735  12.252
  550   2HB   GLU  69          2HB       GLU  69 -11.753   5.267  11.293
  551   1HG   GLU  69          1HG       GLU  69  -9.552   4.444  12.175
  552   2HG   GLU  69          2HG       GLU  69  -9.476   5.870  13.225
  553    H    ILE  70           H        ILE  70  -9.550   6.851   8.143
  554    HA   ILE  70           HA       ILE  70 -11.989   8.261   7.286
  555    HB   ILE  70           HB       ILE  70  -9.528   7.378   5.740
  556   1HG1  ILE  70          1HG1      ILE  70  -8.878   8.986   7.450
  557   2HG1  ILE  70          2HG1      ILE  70  -8.806   9.702   5.844
  558   1HG2  ILE  70          1HG2      ILE  70 -11.858   9.190   5.015
  559   2HG2  ILE  70          2HG2      ILE  70 -10.338   9.119   4.096
  560   3HG2  ILE  70          3HG2      ILE  70 -11.374   7.694   4.215
  561   1HD1  ILE  70          1HD1      ILE  70 -10.967  10.872   6.287
  562   2HD1  ILE  70          2HD1      ILE  70 -10.982  10.180   7.930
  563   3HD1  ILE  70          3HD1      ILE  70  -9.698  11.293   7.443
  564    H    LYS  71           H        LYS  71 -13.722   6.958   7.218
  565    HA   LYS  71           HA       LYS  71 -13.658   4.160   6.582
  566   1HB   LYS  71          1HB       LYS  71 -15.919   6.166   6.812
  567   2HB   LYS  71          2HB       LYS  71 -16.148   4.424   6.561
  568   1HG   LYS  71          1HG       LYS  71 -14.916   3.911   8.619
  569   2HG   LYS  71          2HG       LYS  71 -14.648   5.629   8.943
  570   1HD   LYS  71          1HD       LYS  71 -17.399   4.327   8.717
  571   2HD   LYS  71          2HD       LYS  71 -16.515   4.549  10.236
  572   1HE   LYS  71          1HE       LYS  71 -16.459   7.013   9.847
  573   2HE   LYS  71          2HE       LYS  71 -17.439   6.795   8.385
  574   1HZ   LYS  71          1HZ       LYS  71 -18.252   6.057  11.105
  575   2HZ   LYS  71          2HZ       LYS  71 -18.770   7.378  10.269
  576   3HZ   LYS  71          3HZ       LYS  71 -19.161   5.867   9.743
  577    H    VAL  72           H        VAL  72 -13.770   3.158   4.667
  578    HA   VAL  72           HA       VAL  72 -14.486   4.625   2.194
  579    HB   VAL  72           HB       VAL  72 -12.408   3.699   1.143
  580   1HG1  VAL  72          1HG1      VAL  72 -11.949   5.667   3.401
  581   2HG1  VAL  72          2HG1      VAL  72 -10.875   5.401   2.026
  582   3HG1  VAL  72          3HG1      VAL  72 -12.496   6.057   1.757
  583   1HG2  VAL  72          1HG2      VAL  72 -11.878   1.951   2.799
  584   2HG2  VAL  72          2HG2      VAL  72 -10.525   3.050   2.543
  585   3HG2  VAL  72          3HG2      VAL  72 -11.501   3.192   4.013
  586    H    LYS  73           H        LYS  73 -14.448   3.139   0.310
  587    HA   LYS  73           HA       LYS  73 -14.717   0.251   0.919
  588   1HB   LYS  73          1HB       LYS  73 -16.586   1.865  -0.877
  589   2HB   LYS  73          2HB       LYS  73 -16.367   0.104  -0.980
  590   1HG   LYS  73          1HG       LYS  73 -16.959  -0.099   1.410
  591   2HG   LYS  73          2HG       LYS  73 -17.407   1.620   1.441
  592   1HD   LYS  73          1HD       LYS  73 -19.171   1.237  -0.197
  593   2HD   LYS  73          2HD       LYS  73 -18.557  -0.382  -0.549
  594   1HE   LYS  73          1HE       LYS  73 -19.029  -0.947   1.936
  595   2HE   LYS  73          2HE       LYS  73 -19.979   0.552   1.968
  596   1HZ   LYS  73          1HZ       LYS  73 -21.284  -0.384   0.161
  597   2HZ   LYS  73          2HZ       LYS  73 -20.362  -1.757   0.188
  598   3HZ   LYS  73          3HZ       LYS  73 -21.305  -1.376   1.481
  599    H    ALA  74           H        ALA  74 -15.166   1.083  -2.361
  600    HA   ALA  74           HA       ALA  74 -12.430   1.615  -3.063
  601   1HB   ALA  74          1HB       ALA  74 -13.550  -1.171  -3.612
  602   2HB   ALA  74          2HB       ALA  74 -12.088  -0.477  -4.334
  603   3HB   ALA  74          3HB       ALA  74 -12.148  -0.787  -2.585
  604    H    GLN  75           H        GLN  75 -12.381   2.500  -5.055
  605    HA   GLN  75           HA       GLN  75 -14.833   2.588  -6.703
  606   1HB   GLN  75          1HB       GLN  75 -13.009   4.525  -6.011
  607   2HB   GLN  75          2HB       GLN  75 -12.349   4.045  -7.558
  608   1HG   GLN  75          1HG       GLN  75 -15.294   4.779  -7.161
  609   2HG   GLN  75          2HG       GLN  75 -14.033   5.966  -7.480
  610   1HE2  GLN  75          2HE2      GLN  75 -15.025   2.751  -8.912
  611   2HE2  GLN  75          1HE2      GLN  75 -14.891   3.323 -10.557
  612    H    ASP  76           H        ASP  76 -11.317   1.992  -6.979
  613    HA   ASP  76           HA       ASP  76 -11.731  -0.172  -8.978
  614   1HB   ASP  76          1HB       ASP  76  -9.851   2.209  -9.296
  615   2HB   ASP  76          2HB       ASP  76  -9.938   0.798 -10.359
  616    H    VAL  77           H        VAL  77 -11.342  -1.343  -6.915
  617    HA   VAL  77           HA       VAL  77  -8.665  -1.335  -5.794
  618    HB   VAL  77           HB       VAL  77 -10.494  -2.008  -4.432
  619   1HG1  VAL  77          1HG1      VAL  77 -11.998  -3.081  -6.136
  620   2HG1  VAL  77          2HG1      VAL  77 -10.934  -4.506  -6.112
  621   3HG1  VAL  77          3HG1      VAL  77 -11.775  -4.003  -4.647
  622   1HG2  VAL  77          1HG2      VAL  77  -8.551  -4.253  -4.990
  623   2HG2  VAL  77          2HG2      VAL  77  -8.367  -2.908  -3.851
  624   3HG2  VAL  77          3HG2      VAL  77  -9.594  -4.146  -3.556
  625    H    GLN  78           H        GLN  78  -7.065  -1.626  -7.294
  626    HA   GLN  78           HA       GLN  78  -7.389  -3.592  -9.433
  627   1HB   GLN  78          1HB       GLN  78  -6.341  -1.271  -9.673
  628   2HB   GLN  78          2HB       GLN  78  -4.933  -1.910  -8.829
  629   1HG   GLN  78          1HG       GLN  78  -4.521  -2.074 -11.192
  630   2HG   GLN  78          2HG       GLN  78  -4.756  -3.716 -10.580
  631   1HE2  GLN  78          2HE2      GLN  78  -6.707  -0.973 -11.932
  632   2HE2  GLN  78          1HE2      GLN  78  -7.719  -1.982 -12.941
  633    H    ARG  79           H        ARG  79  -7.724  -5.215  -7.744
  634    HA   ARG  79           HA       ARG  79  -5.220  -6.440  -6.689
  635   1HB   ARG  79          1HB       ARG  79  -6.625  -7.631  -5.126
  636   2HB   ARG  79          2HB       ARG  79  -6.849  -5.889  -4.984
  637   1HG   ARG  79          1HG       ARG  79  -9.017  -6.558  -4.826
  638   2HG   ARG  79          2HG       ARG  79  -8.939  -6.321  -6.568
  639   1HD   ARG  79          1HD       ARG  79  -8.464  -8.900  -6.689
  640   2HD   ARG  79          2HD       ARG  79  -8.824  -8.916  -4.976
  641    HE   ARG  79           HE       ARG  79 -11.038  -8.654  -5.365
  642   1HH1  ARG  79          1HH2      ARG  79  -9.311  -7.893  -8.389
  643   2HH1  ARG  79          2HH2      ARG  79 -10.779  -7.763  -9.322
  644   1HH2  ARG  79          1HH1      ARG  79 -12.919  -8.450  -6.579
  645   2HH2  ARG  79          2HH1      ARG  79 -12.857  -8.085  -8.286
  646    H    HIS  80           H        HIS  80  -4.750  -8.550  -7.134
  647    HA   HIS  80           HA       HIS  80  -6.330  -9.890  -9.273
  648   1HB   HIS  80          1HB       HIS  80  -3.918  -9.237  -9.674
  649   2HB   HIS  80          2HB       HIS  80  -3.473 -10.439  -8.461
  650    HD1  HIS  80           HD1      HIS  80  -5.431 -12.805  -9.393
  651    HD2  HIS  80           HD2      HIS  80  -3.080 -10.346 -11.870
  652    HE1  HIS  80           HE1      HIS  80  -5.089 -14.078 -11.574
  653    HA   PRO  81           HA       PRO  81  -7.066 -12.582  -5.617
  654   1HB   PRO  81          1HB       PRO  81  -9.164 -14.027  -6.534
  655   2HB   PRO  81          2HB       PRO  81  -9.318 -12.293  -6.130
  656   1HG   PRO  81          1HG       PRO  81  -8.871 -13.508  -8.869
  657   2HG   PRO  81          2HG       PRO  81 -10.113 -12.315  -8.400
  658   1HD   PRO  81          1HD       PRO  81  -7.713 -11.639  -9.545
  659   2HD   PRO  81          2HD       PRO  81  -8.524 -10.573  -8.360
  660    H    TYR  82           H        TYR  82  -7.257 -15.066  -5.436
  661    HA   TYR  82           HA       TYR  82  -6.466 -17.132  -5.703
  662   1HB   TYR  82          1HB       TYR  82  -5.724 -16.578  -8.593
  663   2HB   TYR  82          2HB       TYR  82  -6.011 -18.114  -7.803
  664    HD1  TYR  82           HD1      TYR  82  -8.439 -18.371  -6.674
  665    HD2  TYR  82           HD2      TYR  82  -7.466 -15.665  -9.890
  666    HE1  TYR  82           HE1      TYR  82 -10.832 -18.240  -7.292
  667    HE2  TYR  82           HE2      TYR  82  -9.860 -15.534 -10.500
  668    HH   TYR  82           HH       TYR  82 -12.371 -17.439  -8.807
  669    H    LYS  83           H        LYS  83  -4.214 -15.279  -7.806
  670    HA   LYS  83           HA       LYS  83  -1.919 -16.249  -6.236
  671   1HB   LYS  83          1HB       LYS  83  -0.545 -15.064  -7.878
  672   2HB   LYS  83          2HB       LYS  83  -1.602 -16.293  -8.582
  673   1HG   LYS  83          1HG       LYS  83  -3.114 -14.601  -9.453
  674   2HG   LYS  83          2HG       LYS  83  -2.266 -13.314  -8.583
  675   1HD   LYS  83          1HD       LYS  83  -1.614 -13.218 -10.872
  676   2HD   LYS  83          2HD       LYS  83  -0.224 -13.729  -9.909
  677   1HE   LYS  83          1HE       LYS  83  -0.552 -16.067 -10.622
  678   2HE   LYS  83          2HE       LYS  83  -2.048 -15.623 -11.469
  679   1HZ   LYS  83          1HZ       LYS  83   0.645 -14.650 -12.127
  680   2HZ   LYS  83          2HZ       LYS  83  -0.190 -15.804 -12.953
  681   3HZ   LYS  83          3HZ       LYS  83  -0.746 -14.254 -12.922
  682    HA   PRO  84           HA       PRO  84  -2.139 -12.507  -3.808
  683   1HB   PRO  84          1HB       PRO  84   0.226 -12.547  -2.473
  684   2HB   PRO  84          2HB       PRO  84  -1.043 -13.771  -2.213
  685   1HG   PRO  84          1HG       PRO  84   1.390 -14.026  -4.008
  686   2HG   PRO  84          2HG       PRO  84   0.814 -15.175  -2.769
  687   1HD   PRO  84          1HD       PRO  84   0.196 -15.456  -5.418
  688   2HD   PRO  84          2HD       PRO  84  -0.969 -15.890  -4.130
  689    H    LYS  85           H        LYS  85  -2.240 -10.983  -5.590
  690    HA   LYS  85           HA       LYS  85   0.231  -9.433  -5.792
  691   1HB   LYS  85          1HB       LYS  85   0.087 -11.107  -7.768
  692   2HB   LYS  85          2HB       LYS  85  -1.255 -10.143  -8.327
  693   1HG   LYS  85          1HG       LYS  85   0.751  -9.449  -9.475
  694   2HG   LYS  85          2HG       LYS  85   0.136  -8.146  -8.468
  695   1HD   LYS  85          1HD       LYS  85   2.489  -8.122  -8.365
  696   2HD   LYS  85          2HD       LYS  85   1.950  -8.612  -6.778
  697   1HE   LYS  85          1HE       LYS  85   2.999 -10.498  -8.958
  698   2HE   LYS  85          2HE       LYS  85   3.968  -9.800  -7.655
  699   1HZ   LYS  85          1HZ       LYS  85   2.432 -10.911  -6.091
  700   2HZ   LYS  85          2HZ       LYS  85   1.809 -11.741  -7.361
  701   3HZ   LYS  85          3HZ       LYS  85   3.393 -11.909  -6.982
  702    H    LEU  86           H        LEU  86  -0.073  -7.325  -5.775
  703    HA   LEU  86           HA       LEU  86  -2.731  -6.112  -6.362
  704   1HB   LEU  86          1HB       LEU  86  -0.846  -5.768  -4.010
  705   2HB   LEU  86          2HB       LEU  86  -1.802  -4.395  -4.544
  706    HG   LEU  86           HG       LEU  86  -3.221  -7.017  -4.076
  707   1HD1  LEU  86          1HD1      LEU  86  -2.362  -5.056  -1.912
  708   2HD1  LEU  86          2HD1      LEU  86  -3.581  -6.325  -1.704
  709   3HD1  LEU  86          3HD1      LEU  86  -1.898  -6.763  -2.045
  710   1HD2  LEU  86          1HD2      LEU  86  -4.393  -5.021  -5.074
  711   2HD2  LEU  86          2HD2      LEU  86  -5.061  -5.470  -3.493
  712   3HD2  LEU  86          3HD2      LEU  86  -3.970  -4.082  -3.640
  713    H    GLN  87           H        GLN  87  -2.594  -3.968  -7.144
  714    HA   GLN  87           HA       GLN  87   0.067  -3.069  -8.173
  715   1HB   GLN  87          1HB       GLN  87  -2.645  -3.094  -9.553
  716   2HB   GLN  87          2HB       GLN  87  -1.276  -2.146 -10.133
  717   1HG   GLN  87          1HG       GLN  87  -1.286  -5.181  -9.801
  718   2HG   GLN  87          2HG       GLN  87  -1.561  -4.322 -11.320
  719   1HE2  GLN  87          2HE2      GLN  87   0.515  -6.235 -10.980
  720   2HE2  GLN  87          1HE2      GLN  87   2.042  -5.391 -11.140
  721    H    HIS  88           H        HIS  88  -3.317  -2.081  -7.419
  722    HA   HIS  88           HA       HIS  88  -2.419   0.283  -5.987
  723   1HB   HIS  88          1HB       HIS  88  -2.228   0.896  -8.456
  724   2HB   HIS  88          2HB       HIS  88  -3.963   0.611  -8.602
  725    HD1  HIS  88           HD1      HIS  88  -5.507   2.656  -7.848
  726    HD2  HIS  88           HD2      HIS  88  -1.436   2.946  -6.778
  727    HE1  HIS  88           HE1      HIS  88  -5.148   5.004  -6.962
  728    H    ILE  89           H        ILE  89  -4.316   1.457  -5.082
  729    HA   ILE  89           HA       ILE  89  -6.930   0.177  -5.433
  730    HB   ILE  89           HB       ILE  89  -5.789   0.677  -2.654
  731   1HG1  ILE  89          1HG1      ILE  89  -6.323  -1.953  -4.093
  732   2HG1  ILE  89          2HG1      ILE  89  -4.756  -1.316  -3.583
  733   1HG2  ILE  89          1HG2      ILE  89  -8.468  -0.452  -3.593
  734   2HG2  ILE  89          2HG2      ILE  89  -7.952  -0.329  -1.905
  735   3HG2  ILE  89          3HG2      ILE  89  -8.214   1.129  -2.836
  736   1HD1  ILE  89          1HD1      ILE  89  -5.496  -1.412  -1.207
  737   2HD1  ILE  89          2HD1      ILE  89  -6.961  -2.277  -1.739
  738   3HD1  ILE  89          3HD1      ILE  89  -5.372  -2.986  -2.010
  739    H    ASP  90           H        ASP  90  -8.502   1.651  -5.543
  740    HA   ASP  90           HA       ASP  90  -7.880   4.534  -5.031
  741   1HB   ASP  90          1HB       ASP  90  -9.759   3.197  -6.997
  742   2HB   ASP  90          2HB       ASP  90  -9.618   4.937  -6.732
  743    H    PHE  91           H        PHE  91  -8.419   4.230  -2.771
  744    HA   PHE  91           HA       PHE  91 -10.853   2.989  -1.886
  745   1HB   PHE  91          1HB       PHE  91  -8.878   4.800  -0.451
  746   2HB   PHE  91          2HB       PHE  91 -10.191   3.922   0.302
  747    HD1  PHE  91           HD1      PHE  91 -10.139   1.478   0.539
  748    HD2  PHE  91           HD2      PHE  91  -6.792   3.698  -1.029
  749    HE1  PHE  91           HE1      PHE  91  -8.584  -0.296   1.313
  750    HE2  PHE  91           HE2      PHE  91  -5.267   1.878  -0.335
  751    HZ   PHE  91           HZ       PHE  91  -6.157  -0.122   0.829
  752    H    VAL  92           H        VAL  92 -12.612   4.117  -2.992
  753    HA   VAL  92           HA       VAL  92 -13.055   6.926  -2.577
  754    HB   VAL  92           HB       VAL  92 -14.054   5.605  -4.404
  755   1HG1  VAL  92          1HG1      VAL  92 -14.729   3.595  -3.012
  756   2HG1  VAL  92          2HG1      VAL  92 -16.055   4.566  -2.349
  757   3HG1  VAL  92          3HG1      VAL  92 -15.996   4.214  -4.085
  758   1HG2  VAL  92          1HG2      VAL  92 -14.944   7.815  -3.780
  759   2HG2  VAL  92          2HG2      VAL  92 -16.195   6.741  -4.429
  760   3HG2  VAL  92          3HG2      VAL  92 -16.110   7.041  -2.685
  761    H    ARG  93           H        ARG  93 -14.220   8.003  -1.017
  762    HA   ARG  93           HA       ARG  93 -14.526   7.136   1.613
  763   1HB   ARG  93          1HB       ARG  93 -15.894   9.220  -0.092
  764   2HB   ARG  93          2HB       ARG  93 -16.444   8.958   1.560
  765   1HG   ARG  93          1HG       ARG  93 -13.521   9.546   0.925
  766   2HG   ARG  93          2HG       ARG  93 -14.759  10.787   1.191
  767   1HD   ARG  93          1HD       ARG  93 -15.302   9.744   3.388
  768   2HD   ARG  93          2HD       ARG  93 -13.865   8.717   3.219
  769    HE   ARG  93           HE       ARG  93 -12.722  11.065   2.803
  770   1HH1  ARG  93          1HH2      ARG  93 -15.099  10.246   5.329
  771   2HH1  ARG  93          2HH2      ARG  93 -14.600  11.549   6.375
  772   1HH2  ARG  93          1HH1      ARG  93 -12.091  12.748   4.198
  773   2HH2  ARG  93          2HH1      ARG  93 -12.880  12.962   5.739
  774    H    ALA  94           H        ALA  94 -16.086   6.154   2.819
  775    HA   ALA  94           HA       ALA  94 -18.107   4.526   1.497
  776   1HB   ALA  94          1HB       ALA  94 -17.545   5.081   4.442
  777   2HB   ALA  94          2HB       ALA  94 -18.649   3.839   3.811
  778   3HB   ALA  94          3HB       ALA  94 -16.909   3.719   3.493
  Start of MODEL    7
    1    H    MET   1           H        MET   1 -14.735  -5.101  11.193
    2    HA   MET   1           HA       MET   1 -15.225  -4.551   9.044
    3   1HB   MET   1          1HB       MET   1 -15.945  -2.227   8.586
    4   2HB   MET   1          2HB       MET   1 -16.665  -2.899  10.052
    5   1HG   MET   1          1HG       MET   1 -15.178  -1.620  11.473
    6   2HG   MET   1          2HG       MET   1 -14.206  -1.099  10.099
    7   1HE   MET   1          1HE       MET   1 -17.651  -0.730  11.952
    8   2HE   MET   1          2HE       MET   1 -18.474   0.486  10.947
    9   3HE   MET   1          3HE       MET   1 -18.213  -1.152  10.314
   10    H    PHE   2           H        PHE   2 -12.532  -4.986   9.637
   11    HA   PHE   2           HA       PHE   2 -10.497  -4.903   8.750
   12   1HB   PHE   2          1HB       PHE   2 -11.601  -3.149   6.528
   13   2HB   PHE   2          2HB       PHE   2 -10.091  -4.032   6.529
   14    HD1  PHE   2           HD1      PHE   2 -13.688  -4.276   5.919
   15    HD2  PHE   2           HD2      PHE   2 -10.113  -6.576   6.644
   16    HE1  PHE   2           HE1      PHE   2 -14.753  -6.267   4.896
   17    HE2  PHE   2           HE2      PHE   2 -11.192  -8.564   5.621
   18    HZ   PHE   2           HZ       PHE   2 -13.506  -8.409   4.745
   19    H    THR   3           H        THR   3  -8.563  -3.680   8.720
   20    HA   THR   3           HA       THR   3  -8.710  -0.810   9.426
   21    HB   THR   3           HB       THR   3  -7.363  -2.855  11.240
   22    HG1  THR   3           HG1      THR   3  -9.820  -1.474  11.407
   23   1HG2  THR   3          1HG2      THR   3  -7.857   0.148  11.529
   24   2HG2  THR   3          2HG2      THR   3  -7.115  -0.912  12.744
   25   3HG2  THR   3          3HG2      THR   3  -6.278  -0.608  11.211
   26    H    ILE   4           H        ILE   4  -7.743  -0.469   7.408
   27    HA   ILE   4           HA       ILE   4  -5.200  -1.767   6.739
   28    HB   ILE   4           HB       ILE   4  -6.610   0.563   5.420
   29   1HG1  ILE   4          1HG1      ILE   4  -6.989  -1.197   3.593
   30   2HG1  ILE   4          2HG1      ILE   4  -6.698  -2.422   4.830
   31   1HG2  ILE   4          1HG2      ILE   4  -4.165   0.484   4.981
   32   2HG2  ILE   4          2HG2      ILE   4  -4.328  -1.202   4.456
   33   3HG2  ILE   4          3HG2      ILE   4  -5.106   0.108   3.539
   34   1HD1  ILE   4          1HD1      ILE   4  -8.826  -0.235   5.022
   35   2HD1  ILE   4          2HD1      ILE   4  -9.122  -1.820   4.325
   36   3HD1  ILE   4          3HD1      ILE   4  -8.712  -1.703   6.029
   37    H    ASN   5           H        ASN   5  -3.690  -1.292   8.262
   38    HA   ASN   5           HA       ASN   5  -3.365   1.318   9.463
   39   1HB   ASN   5          1HB       ASN   5  -2.793  -0.723  10.668
   40   2HB   ASN   5          2HB       ASN   5  -1.601  -1.160   9.437
   41   1HD2  ASN   5          2HD2      ASN   5  -2.430   1.735  11.479
   42   2HD2  ASN   5          1HD2      ASN   5  -0.774   2.075  11.933
   43    H    ALA   6           H        ALA   6  -3.108   2.799   7.788
   44    HA   ALA   6           HA       ALA   6  -0.718   2.525   6.014
   45   1HB   ALA   6          1HB       ALA   6  -2.932   2.502   4.880
   46   2HB   ALA   6          2HB       ALA   6  -3.302   4.077   5.604
   47   3HB   ALA   6          3HB       ALA   6  -1.970   3.920   4.442
   48    H    GLU   7           H        GLU   7  -0.207   4.896   5.188
   49    HA   GLU   7           HA       GLU   7  -0.449   7.030   7.096
   50   1HB   GLU   7          1HB       GLU   7   1.791   5.220   7.414
   51   2HB   GLU   7          2HB       GLU   7   2.424   6.713   6.721
   52   1HG   GLU   7          1HG       GLU   7   1.373   8.021   8.526
   53   2HG   GLU   7          2HG       GLU   7   0.665   6.545   9.207
   54    H    VAL   8           H        VAL   8   0.792   8.957   6.244
   55    HA   VAL   8           HA       VAL   8   0.321   9.361   3.460
   56    HB   VAL   8           HB       VAL   8   1.558  11.464   3.762
   57   1HG1  VAL   8          1HG1      VAL   8  -0.824  11.291   4.420
   58   2HG1  VAL   8          2HG1      VAL   8  -0.337  10.896   6.084
   59   3HG1  VAL   8          3HG1      VAL   8   0.060  12.481   5.394
   60   1HG2  VAL   8          1HG2      VAL   8   3.349  10.740   5.302
   61   2HG2  VAL   8          2HG2      VAL   8   2.456  12.120   5.954
   62   3HG2  VAL   8          3HG2      VAL   8   2.157  10.496   6.598
   63    H    ARG   9           H        ARG   9   1.812   9.554   1.708
   64    HA   ARG   9           HA       ARG   9   3.684   7.401   1.798
   65   1HB   ARG   9          1HB       ARG   9   2.196   7.839  -0.081
   66   2HB   ARG   9          2HB       ARG   9   3.139   9.279  -0.510
   67   1HG   ARG   9          1HG       ARG   9   5.106   7.930  -0.971
   68   2HG   ARG   9          2HG       ARG   9   4.409   6.519  -0.173
   69   1HD   ARG   9          1HD       ARG   9   4.277   6.147  -2.537
   70   2HD   ARG   9          2HD       ARG   9   2.651   6.358  -1.892
   71    HE   ARG   9           HE       ARG   9   2.369   8.263  -3.136
   72   1HH1  ARG   9          1HH2      ARG   9   5.834   7.480  -3.091
   73   2HH1  ARG   9          2HH2      ARG   9   6.241   8.640  -4.329
   74   1HH2  ARG   9          1HH1      ARG   9   2.919   9.787  -4.747
   75   2HH2  ARG   9          2HH1      ARG   9   4.575   9.966  -5.267
   76    H    LYS  10           H        LYS  10   5.139   8.038   3.369
   77    HA   LYS  10           HA       LYS  10   7.551   9.196   2.301
   78   1HB   LYS  10          1HB       LYS  10   6.247  11.244   3.018
   79   2HB   LYS  10          2HB       LYS  10   6.159  10.580   4.645
   80   1HG   LYS  10          1HG       LYS  10   7.853  12.242   4.574
   81   2HG   LYS  10          2HG       LYS  10   8.684  10.697   4.771
   82   1HD   LYS  10          1HD       LYS  10   9.245  10.653   2.369
   83   2HD   LYS  10          2HD       LYS  10   8.342  12.153   2.101
   84   1HE   LYS  10          1HE       LYS  10  10.772  11.852   3.931
   85   2HE   LYS  10          2HE       LYS  10  10.824  12.460   2.266
   86   1HZ   LYS  10          1HZ       LYS  10   9.374  14.243   2.942
   87   2HZ   LYS  10          2HZ       LYS  10   9.376  13.700   4.498
   88   3HZ   LYS  10          3HZ       LYS  10  10.772  14.242   3.815
   89    H    GLU  11           H        GLU  11   7.605   6.750   2.779
   90    HA   GLU  11           HA       GLU  11   7.729   5.704   5.358
   91   1HB   GLU  11          1HB       GLU  11   9.146   3.931   4.400
   92   2HB   GLU  11          2HB       GLU  11   7.709   4.275   3.433
   93   1HG   GLU  11          1HG       GLU  11   9.059   5.543   1.812
   94   2HG   GLU  11          2HG       GLU  11  10.511   5.304   2.803
   95    H    GLN  12           H        GLN  12  10.235   7.498   3.566
   96    HA   GLN  12           HA       GLN  12  11.530   8.311   5.975
   97   1HB   GLN  12          1HB       GLN  12  12.422   5.796   4.947
   98   2HB   GLN  12          2HB       GLN  12  13.635   6.961   4.422
   99   1HG   GLN  12          1HG       GLN  12  13.880   7.749   6.772
  100   2HG   GLN  12          2HG       GLN  12  12.599   6.628   7.272
  101   1HE2  GLN  12          2HE2      GLN  12  13.981   5.519   8.741
  102   2HE2  GLN  12          1HE2      GLN  12  15.246   4.448   8.172
  103    H    GLY  13           H        GLY  13  13.784   9.386   5.219
  104   1HA   GLY  13          1HA       GLY  13  13.177  11.500   3.384
  105   2HA   GLY  13          2HA       GLY  13  14.755  11.095   4.076
  106    H    LYS  14           H        LYS  14  12.707  10.840   1.318
  107    HA   LYS  14           HA       LYS  14  12.832   9.964  -0.739
  108   1HB   LYS  14          1HB       LYS  14  15.826   9.677  -0.274
  109   2HB   LYS  14          2HB       LYS  14  14.969   9.444  -1.802
  110   1HG   LYS  14          1HG       LYS  14  14.107  11.795  -1.637
  111   2HG   LYS  14          2HG       LYS  14  15.150  12.049  -0.228
  112   1HD   LYS  14          1HD       LYS  14  16.097  11.228  -3.019
  113   2HD   LYS  14          2HD       LYS  14  16.113  12.881  -2.379
  114   1HE   LYS  14          1HE       LYS  14  17.648  12.162  -0.553
  115   2HE   LYS  14          2HE       LYS  14  17.689  10.523  -1.237
  116   1HZ   LYS  14          1HZ       LYS  14  18.575  12.953  -2.614
  117   2HZ   LYS  14          2HZ       LYS  14  19.548  11.813  -1.931
  118   3HZ   LYS  14          3HZ       LYS  14  18.611  11.423  -3.228
  119    H    GLY  15           H        GLY  15  11.480   8.315   0.054
  120   1HA   GLY  15          1HA       GLY  15  12.311   5.874   1.197
  121   2HA   GLY  15          2HA       GLY  15  10.814   6.160   0.284
  122    H    ALA  16           H        ALA  16  12.098   3.713   0.154
  123    HA   ALA  16           HA       ALA  16  14.008   3.427  -1.918
  124   1HB   ALA  16          1HB       ALA  16  13.586   1.717  -0.202
  125   2HB   ALA  16          2HB       ALA  16  11.960   1.431  -0.864
  126   3HB   ALA  16          3HB       ALA  16  13.398   1.036  -1.831
  127    H    SER  17           H        SER  17  13.836   2.883  -4.070
  128    HA   SER  17           HA       SER  17  11.177   3.224  -5.405
  129   1HB   SER  17          1HB       SER  17  12.784   4.997  -5.927
  130   2HB   SER  17          2HB       SER  17  13.974   3.792  -6.462
  131    HG   SER  17           HG       SER  17  12.699   4.693  -8.172
  132    H    ARG  18           H        ARG  18  14.349   1.535  -5.653
  133    HA   ARG  18           HA       ARG  18  13.597  -0.436  -7.523
  134   1HB   ARG  18          1HB       ARG  18  15.658  -0.343  -5.287
  135   2HB   ARG  18          2HB       ARG  18  15.528  -1.733  -6.367
  136   1HG   ARG  18          1HG       ARG  18  15.911   1.093  -7.446
  137   2HG   ARG  18          2HG       ARG  18  17.264   0.071  -6.930
  138   1HD   ARG  18          1HD       ARG  18  16.549  -1.705  -8.485
  139   2HD   ARG  18          2HD       ARG  18  15.251  -0.659  -9.099
  140    HE   ARG  18           HE       ARG  18  17.507   0.885  -9.367
  141   1HH1  ARG  18          1HH2      ARG  18  16.592  -2.351 -10.518
  142   2HH1  ARG  18          2HH2      ARG  18  17.621  -2.276 -11.924
  143   1HH2  ARG  18          1HH1      ARG  18  18.840   0.969 -11.226
  144   2HH2  ARG  18          2HH1      ARG  18  18.895  -0.379 -12.332
  145    H    ARG  19           H        ARG  19  13.844  -0.775  -3.953
  146    HA   ARG  19           HA       ARG  19  12.778  -3.380  -3.861
  147   1HB   ARG  19          1HB       ARG  19  13.951  -1.602  -2.037
  148   2HB   ARG  19          2HB       ARG  19  12.296  -1.711  -1.452
  149   1HG   ARG  19          1HG       ARG  19  13.491  -3.401  -0.322
  150   2HG   ARG  19          2HG       ARG  19  12.573  -4.272  -1.564
  151   1HD   ARG  19          1HD       ARG  19  14.629  -4.322  -3.000
  152   2HD   ARG  19          2HD       ARG  19  15.496  -3.389  -1.764
  153    HE   ARG  19           HE       ARG  19  14.415  -5.737  -0.577
  154   1HH1  ARG  19          1HH2      ARG  19  16.954  -4.757  -2.856
  155   2HH1  ARG  19          2HH2      ARG  19  17.994  -6.105  -2.477
  156   1HH2  ARG  19          1HH1      ARG  19  15.794  -7.507  -0.088
  157   2HH2  ARG  19          2HH1      ARG  19  17.329  -7.675  -0.899
  158    H    LEU  20           H        LEU  20  11.219  -0.212  -3.436
  159    HA   LEU  20           HA       LEU  20   8.621  -0.986  -2.772
  160   1HB   LEU  20          1HB       LEU  20   9.420   1.282  -2.622
  161   2HB   LEU  20          2HB       LEU  20   9.729   1.352  -4.360
  162    HG   LEU  20           HG       LEU  20   7.285   1.215  -4.811
  163   1HD1  LEU  20          1HD1      LEU  20   7.098   1.278  -1.766
  164   2HD1  LEU  20          2HD1      LEU  20   5.744   1.620  -2.856
  165   3HD1  LEU  20          3HD1      LEU  20   6.481   0.010  -2.857
  166   1HD2  LEU  20          1HD2      LEU  20   8.433   3.400  -4.606
  167   2HD2  LEU  20          2HD2      LEU  20   6.756   3.485  -4.039
  168   3HD2  LEU  20          3HD2      LEU  20   8.087   3.416  -2.863
  169    H    ARG  21           H        ARG  21   9.943  -0.249  -6.024
  170    HA   ARG  21           HA       ARG  21   7.599  -0.875  -7.450
  171   1HB   ARG  21          1HB       ARG  21   9.514   0.536  -8.201
  172   2HB   ARG  21          2HB       ARG  21  10.472  -0.935  -8.470
  173   1HG   ARG  21          1HG       ARG  21   8.792  -1.689 -10.151
  174   2HG   ARG  21          2HG       ARG  21   7.790  -0.277  -9.769
  175   1HD   ARG  21          1HD       ARG  21   9.815   1.173 -10.458
  176   2HD   ARG  21          2HD       ARG  21  10.554  -0.316 -11.047
  177    HE   ARG  21           HE       ARG  21   9.177  -0.294 -12.880
  178   1HH1  ARG  21          1HH2      ARG  21   7.828   1.938 -10.465
  179   2HH1  ARG  21          2HH2      ARG  21   6.648   2.609 -11.560
  180   1HH2  ARG  21          1HH1      ARG  21   7.614   0.593 -14.302
  181   2HH2  ARG  21          2HH1      ARG  21   6.522   1.835 -13.745
  182    H    ALA  22           H        ALA  22  10.404  -2.912  -6.530
  183    HA   ALA  22           HA       ALA  22   9.668  -5.228  -8.018
  184   1HB   ALA  22          1HB       ALA  22  11.228  -4.977  -5.411
  185   2HB   ALA  22          2HB       ALA  22  11.122  -6.429  -6.427
  186   3HB   ALA  22          3HB       ALA  22  11.887  -4.957  -7.056
  187    H    ALA  23           H        ALA  23   9.279  -4.686  -4.476
  188    HA   ALA  23           HA       ALA  23   6.542  -5.119  -4.243
  189   1HB   ALA  23          1HB       ALA  23   8.127  -7.711  -3.946
  190   2HB   ALA  23          2HB       ALA  23   6.510  -7.448  -3.261
  191   3HB   ALA  23          3HB       ALA  23   6.729  -7.424  -5.005
  192    H    ASN  24           H        ASN  24   7.127  -3.371  -2.788
  193    HA   ASN  24           HA       ASN  24   7.417  -4.390  -0.087
  194   1HB   ASN  24          1HB       ASN  24   9.810  -4.157  -0.670
  195   2HB   ASN  24          2HB       ASN  24   9.536  -2.479  -1.148
  196   1HD2  ASN  24          2HD2      ASN  24  11.292  -2.087   0.458
  197   2HD2  ASN  24          1HD2      ASN  24  10.841  -1.913   2.140
  198    H    LYS  25           H        LYS  25   5.336  -3.571   0.158
  199    HA   LYS  25           HA       LYS  25   3.841  -2.087   0.906
  200   1HB   LYS  25          1HB       LYS  25   5.774  -1.668   2.400
  201   2HB   LYS  25          2HB       LYS  25   6.258  -0.298   1.401
  202   1HG   LYS  25          1HG       LYS  25   4.131   0.819   1.852
  203   2HG   LYS  25          2HG       LYS  25   3.606  -0.483   2.913
  204   1HD   LYS  25          1HD       LYS  25   6.231   0.979   3.407
  205   2HD   LYS  25          2HD       LYS  25   4.696   1.675   3.905
  206   1HE   LYS  25          1HE       LYS  25   5.711   0.556   5.771
  207   2HE   LYS  25          2HE       LYS  25   4.177  -0.220   5.348
  208   1HZ   LYS  25          1HZ       LYS  25   6.795  -1.233   4.482
  209   2HZ   LYS  25          2HZ       LYS  25   6.037  -1.714   5.866
  210   3HZ   LYS  25          3HZ       LYS  25   5.335  -2.015   4.421
  211    H    PHE  26           H        PHE  26   3.231  -2.131  -1.426
  212    HA   PHE  26           HA       PHE  26   4.018  -0.155  -3.237
  213   1HB   PHE  26          1HB       PHE  26   2.514  -1.136  -4.720
  214   2HB   PHE  26          2HB       PHE  26   2.924  -2.445  -3.639
  215    HD1  PHE  26           HD1      PHE  26   0.262  -0.514  -5.095
  216    HD2  PHE  26           HD2      PHE  26   1.264  -2.906  -1.645
  217    HE1  PHE  26           HE1      PHE  26  -2.103  -0.471  -4.371
  218    HE2  PHE  26           HE2      PHE  26  -1.106  -2.904  -0.966
  219    HZ   PHE  26           HZ       PHE  26  -2.783  -1.637  -2.278
  220    HA   PRO  27           HA       PRO  27   1.493   3.307  -2.093
  221   1HB   PRO  27          1HB       PRO  27   1.416   4.820  -4.331
  222   2HB   PRO  27          2HB       PRO  27   2.969   4.399  -3.551
  223   1HG   PRO  27          1HG       PRO  27   1.666   2.986  -5.897
  224   2HG   PRO  27          2HG       PRO  27   3.337   3.613  -5.791
  225   1HD   PRO  27          1HD       PRO  27   2.718   1.014  -5.255
  226   2HD   PRO  27          2HD       PRO  27   3.995   1.877  -4.353
  227    H    ALA  28           H        ALA  28  -0.607   4.213  -2.162
  228    HA   ALA  28           HA       ALA  28  -2.554   3.308  -4.193
  229   1HB   ALA  28          1HB       ALA  28  -2.686   1.609  -2.408
  230   2HB   ALA  28          2HB       ALA  28  -2.924   2.897  -1.204
  231   3HB   ALA  28          3HB       ALA  28  -4.156   2.612  -2.444
  232    H    ILE  29           H        ILE  29  -4.660   4.519  -3.861
  233    HA   ILE  29           HA       ILE  29  -4.233   7.219  -2.678
  234    HB   ILE  29           HB       ILE  29  -5.269   6.515  -5.444
  235   1HG1  ILE  29          1HG1      ILE  29  -2.917   8.228  -4.492
  236   2HG1  ILE  29          2HG1      ILE  29  -2.796   6.618  -5.208
  237   1HG2  ILE  29          1HG2      ILE  29  -5.287   9.239  -4.087
  238   2HG2  ILE  29          2HG2      ILE  29  -5.681   8.927  -5.787
  239   3HG2  ILE  29          3HG2      ILE  29  -6.710   8.274  -4.538
  240   1HD1  ILE  29          1HD1      ILE  29  -3.876   7.552  -7.307
  241   2HD1  ILE  29          2HD1      ILE  29  -3.635   9.171  -6.604
  242   3HD1  ILE  29          3HD1      ILE  29  -2.243   8.132  -6.922
  243    H    ILE  30           H        ILE  30  -6.053   8.239  -1.900
  244    HA   ILE  30           HA       ILE  30  -8.619   6.698  -1.852
  245    HB   ILE  30           HB       ILE  30  -7.478   8.661   0.178
  246   1HG1  ILE  30          1HG1      ILE  30  -8.292   5.758   0.601
  247   2HG1  ILE  30          2HG1      ILE  30  -6.629   6.273   0.286
  248   1HG2  ILE  30          1HG2      ILE  30 -10.236   7.373  -0.024
  249   2HG2  ILE  30          2HG2      ILE  30  -9.643   8.193   1.430
  250   3HG2  ILE  30          3HG2      ILE  30  -9.852   9.111  -0.039
  251   1HD1  ILE  30          1HD1      ILE  30  -6.711   7.747   2.292
  252   2HD1  ILE  30          2HD1      ILE  30  -8.306   7.075   2.698
  253   3HD1  ILE  30          3HD1      ILE  30  -6.903   6.023   2.659
  254    H    TYR  31           H        TYR  31 -10.412   7.809  -2.533
  255    HA   TYR  31           HA       TYR  31 -10.192  10.714  -3.213
  256   1HB   TYR  31          1HB       TYR  31 -11.808   8.503  -4.562
  257   2HB   TYR  31          2HB       TYR  31 -12.102  10.214  -4.790
  258    HD1  TYR  31           HD1      TYR  31 -11.011  11.418  -6.475
  259    HD2  TYR  31           HD2      TYR  31  -9.419   7.607  -5.216
  260    HE1  TYR  31           HE1      TYR  31  -9.387  11.478  -8.336
  261    HE2  TYR  31           HE2      TYR  31  -7.759   7.706  -7.048
  262    HH   TYR  31           HH       TYR  31  -7.614  10.434  -9.364
  263    H    GLY  32           H        GLY  32 -12.282  11.848  -2.895
  264   1HA   GLY  32          1HA       GLY  32 -14.485  10.498  -1.625
  265   2HA   GLY  32          2HA       GLY  32 -13.568  11.468  -0.460
  266    H    GLY  33           H        GLY  33 -14.158  12.121  -3.923
  267   1HA   GLY  33          1HA       GLY  33 -15.200  13.771  -5.060
  268   2HA   GLY  33          2HA       GLY  33 -16.423  13.745  -3.781
  269    H    LYS  34           H        LYS  34 -16.350  15.291  -2.152
  270    HA   LYS  34           HA       LYS  34 -15.230  17.854  -2.584
  271   1HB   LYS  34          1HB       LYS  34 -17.215  17.166  -1.170
  272   2HB   LYS  34          2HB       LYS  34 -16.095  16.600   0.067
  273   1HG   LYS  34          1HG       LYS  34 -16.301  19.464  -0.998
  274   2HG   LYS  34          2HG       LYS  34 -17.090  18.842   0.457
  275   1HD   LYS  34          1HD       LYS  34 -14.766  18.256   1.353
  276   2HD   LYS  34          2HD       LYS  34 -14.114  19.228   0.010
  277   1HE   LYS  34          1HE       LYS  34 -15.440  21.178   0.772
  278   2HE   LYS  34          2HE       LYS  34 -16.020  20.230   2.157
  279   1HZ   LYS  34          1HZ       LYS  34 -13.750  20.005   2.869
  280   2HZ   LYS  34          2HZ       LYS  34 -13.216  20.890   1.585
  281   3HZ   LYS  34          3HZ       LYS  34 -14.163  21.594   2.734
  282    H    GLU  35           H        GLU  35 -14.240  15.106  -0.484
  283    HA   GLU  35           HA       GLU  35 -11.724  16.280   0.344
  284   1HB   GLU  35          1HB       GLU  35 -12.903  14.580   1.668
  285   2HB   GLU  35          2HB       GLU  35 -12.722  13.405   0.357
  286   1HG   GLU  35          1HG       GLU  35 -10.271  13.476   0.599
  287   2HG   GLU  35          2HG       GLU  35 -10.414  14.738   1.836
  288    H    ALA  36           H        ALA  36 -10.442  16.886  -1.315
  289    HA   ALA  36           HA       ALA  36 -10.153  15.641  -3.821
  290   1HB   ALA  36          1HB       ALA  36  -9.487  17.962  -3.352
  291   2HB   ALA  36          2HB       ALA  36  -8.216  17.398  -2.246
  292   3HB   ALA  36          3HB       ALA  36  -8.098  17.059  -3.982
  293    HA   PRO  37           HA       PRO  37  -7.998  12.105  -2.806
  294   1HB   PRO  37          1HB       PRO  37  -6.421  11.483  -5.018
  295   2HB   PRO  37          2HB       PRO  37  -8.204  11.406  -4.990
  296   1HG   PRO  37          1HG       PRO  37  -6.471  13.717  -5.916
  297   2HG   PRO  37          2HG       PRO  37  -7.820  12.950  -6.807
  298   1HD   PRO  37          1HD       PRO  37  -8.230  15.208  -5.393
  299   2HD   PRO  37          2HD       PRO  37  -9.435  13.888  -5.309
  300    H    LEU  38           H        LEU  38  -6.028  11.008  -2.234
  301    HA   LEU  38           HA       LEU  38  -3.535  12.491  -2.155
  302   1HB   LEU  38          1HB       LEU  38  -3.302  12.593   0.230
  303   2HB   LEU  38          2HB       LEU  38  -4.683  13.526  -0.308
  304    HG   LEU  38           HG       LEU  38  -5.204  12.566   1.745
  305   1HD1  LEU  38          1HD1      LEU  38  -7.062  12.571   0.095
  306   2HD1  LEU  38          2HD1      LEU  38  -6.739  10.851  -0.230
  307   3HD1  LEU  38          3HD1      LEU  38  -7.242  11.366   1.382
  308   1HD2  LEU  38          1HD2      LEU  38  -3.550  10.678   1.691
  309   2HD2  LEU  38          2HD2      LEU  38  -5.124  10.315   2.421
  310   3HD2  LEU  38          3HD2      LEU  38  -4.764   9.726   0.800
  311    H    ALA  39           H        ALA  39  -1.751  11.235  -1.441
  312    HA   ALA  39           HA       ALA  39  -2.150   8.391  -2.145
  313   1HB   ALA  39          1HB       ALA  39  -0.699   9.746  -3.589
  314   2HB   ALA  39          2HB       ALA  39   0.340  10.130  -2.197
  315   3HB   ALA  39          3HB       ALA  39   0.208   8.454  -2.775
  316    H    ILE  40           H        ILE  40  -1.313   6.716  -0.947
  317    HA   ILE  40           HA       ILE  40  -0.009   7.222   1.649
  318    HB   ILE  40           HB       ILE  40  -1.704   5.727   2.746
  319   1HG1  ILE  40          1HG1      ILE  40  -3.443   6.237   0.289
  320   2HG1  ILE  40          2HG1      ILE  40  -2.546   4.735   0.544
  321   1HG2  ILE  40          1HG2      ILE  40  -1.751   8.233   2.907
  322   2HG2  ILE  40          2HG2      ILE  40  -2.975   8.240   1.620
  323   3HG2  ILE  40          3HG2      ILE  40  -3.305   7.453   3.169
  324   1HD1  ILE  40          1HD1      ILE  40  -3.739   4.358   2.674
  325   2HD1  ILE  40          2HD1      ILE  40  -4.676   5.839   2.396
  326   3HD1  ILE  40          3HD1      ILE  40  -4.844   4.466   1.289
  327    H    GLU  41           H        GLU  41   0.461   5.101   2.744
  328    HA   GLU  41           HA       GLU  41   1.681   3.245   0.765
  329   1HB   GLU  41          1HB       GLU  41   2.351   3.563   3.716
  330   2HB   GLU  41          2HB       GLU  41   3.282   2.776   2.429
  331   1HG   GLU  41          1HG       GLU  41   3.386   5.053   1.295
  332   2HG   GLU  41          2HG       GLU  41   2.744   5.723   2.817
  333    H    LEU  42           H        LEU  42   0.769   1.256   0.546
  334    HA   LEU  42           HA       LEU  42  -0.767   0.052   2.829
  335   1HB   LEU  42          1HB       LEU  42  -1.226   0.117  -0.137
  336   2HB   LEU  42          2HB       LEU  42  -1.547  -1.391   0.729
  337    HG   LEU  42           HG       LEU  42  -3.101  -0.383   2.218
  338   1HD1  LEU  42          1HD1      LEU  42  -2.385   2.247   0.878
  339   2HD1  LEU  42          2HD1      LEU  42  -3.892   2.003   1.793
  340   3HD1  LEU  42          3HD1      LEU  42  -2.334   1.844   2.603
  341   1HD2  LEU  42          1HD2      LEU  42  -3.841  -1.154  -0.069
  342   2HD2  LEU  42          2HD2      LEU  42  -4.887   0.071   0.661
  343   3HD2  LEU  42          3HD2      LEU  42  -3.742   0.524  -0.615
  344    H    ASP  43           H        ASP  43   0.366  -1.443   3.838
  345    HA   ASP  43           HA       ASP  43   2.812  -2.533   2.826
  346   1HB   ASP  43          1HB       ASP  43   2.348  -2.061   5.209
  347   2HB   ASP  43          2HB       ASP  43   1.159  -3.375   5.227
  348    H    HIS  44           H        HIS  44   3.077  -4.176   1.480
  349    HA   HIS  44           HA       HIS  44   0.808  -5.604   0.436
  350   1HB   HIS  44          1HB       HIS  44   2.720  -4.599  -0.849
  351   2HB   HIS  44          2HB       HIS  44   3.755  -5.888  -0.250
  352    HD1  HIS  44           HD1      HIS  44   2.180  -8.453  -0.823
  353    HD2  HIS  44           HD2      HIS  44   2.184  -5.074  -3.326
  354    HE1  HIS  44           HE1      HIS  44   1.527  -9.269  -3.165
  355    H    ASP  45           H        ASP  45   0.576  -6.529   2.812
  356    HA   ASP  45           HA       ASP  45   1.123  -9.389   2.538
  357   1HB   ASP  45          1HB       ASP  45   2.229  -7.758   4.877
  358   2HB   ASP  45          2HB       ASP  45   1.862  -9.486   5.001
  359    H    LYS  46           H        LYS  46   0.256  -7.409   5.365
  360    HA   LYS  46           HA       LYS  46  -2.028  -8.903   6.048
  361   1HB   LYS  46          1HB       LYS  46  -1.348  -6.002   6.703
  362   2HB   LYS  46          2HB       LYS  46  -2.598  -6.986   7.486
  363   1HG   LYS  46          1HG       LYS  46  -0.835  -8.603   8.230
  364   2HG   LYS  46          2HG       LYS  46   0.393  -7.588   7.472
  365   1HD   LYS  46          1HD       LYS  46   0.359  -7.135   9.842
  366   2HD   LYS  46          2HD       LYS  46  -0.151  -5.707   8.940
  367   1HE   LYS  46          1HE       LYS  46  -1.486  -6.065  10.991
  368   2HE   LYS  46          2HE       LYS  46  -2.499  -6.098   9.548
  369   1HZ   LYS  46          1HZ       LYS  46  -1.495  -8.455  10.992
  370   2HZ   LYS  46          2HZ       LYS  46  -3.027  -7.856  11.075
  371   3HZ   LYS  46          3HZ       LYS  46  -2.468  -8.488   9.662
  372    H    VAL  47           H        VAL  47  -1.690  -5.952   4.043
  373    HA   VAL  47           HA       VAL  47  -4.425  -5.367   3.855
  374    HB   VAL  47           HB       VAL  47  -2.412  -3.930   3.236
  375   1HG1  VAL  47          1HG1      VAL  47  -1.511  -5.643   1.518
  376   2HG1  VAL  47          2HG1      VAL  47  -2.823  -5.100   0.456
  377   3HG1  VAL  47          3HG1      VAL  47  -1.592  -3.948   1.003
  378   1HG2  VAL  47          1HG2      VAL  47  -4.759  -3.225   2.953
  379   2HG2  VAL  47          2HG2      VAL  47  -3.720  -2.618   1.656
  380   3HG2  VAL  47          3HG2      VAL  47  -4.805  -3.984   1.347
  381    H    MET  48           H        MET  48  -2.469  -7.735   2.027
  382    HA   MET  48           HA       MET  48  -4.427  -8.101  -0.024
  383   1HB   MET  48          1HB       MET  48  -1.840  -8.790   0.147
  384   2HB   MET  48          2HB       MET  48  -2.553 -10.343   0.603
  385   1HG   MET  48          1HG       MET  48  -3.146  -8.682  -1.884
  386   2HG   MET  48          2HG       MET  48  -2.191 -10.157  -1.839
  387   1HE   MET  48          1HE       MET  48  -3.827 -10.572  -4.065
  388   2HE   MET  48          2HE       MET  48  -5.590 -10.759  -3.929
  389   3HE   MET  48          3HE       MET  48  -4.843  -9.165  -3.686
  390    H    ASN  49           H        ASN  49  -3.591  -9.883   2.980
  391    HA   ASN  49           HA       ASN  49  -5.543 -11.891   2.905
  392   1HB   ASN  49          1HB       ASN  49  -4.368 -10.409   5.296
  393   2HB   ASN  49          2HB       ASN  49  -5.359 -11.866   5.395
  394   1HD2  ASN  49          2HD2      ASN  49  -3.959 -13.449   6.064
  395   2HD2  ASN  49          1HD2      ASN  49  -2.450 -13.832   5.263
  396    H    MET  50           H        MET  50  -5.795  -8.538   4.185
  397    HA   MET  50           HA       MET  50  -8.526  -8.794   5.042
  398   1HB   MET  50          1HB       MET  50  -6.728  -6.411   4.471
  399   2HB   MET  50          2HB       MET  50  -8.398  -6.249   5.032
  400   1HG   MET  50          1HG       MET  50  -7.871  -7.704   6.989
  401   2HG   MET  50          2HG       MET  50  -6.177  -7.729   6.500
  402   1HE   MET  50          1HE       MET  50  -4.603  -5.618   6.530
  403   2HE   MET  50          2HE       MET  50  -5.729  -4.575   5.623
  404   3HE   MET  50          3HE       MET  50  -5.062  -4.034   7.178
  405    H    GLN  51           H        GLN  51  -7.062  -7.455   2.020
  406    HA   GLN  51           HA       GLN  51  -9.550  -6.439   1.194
  407   1HB   GLN  51          1HB       GLN  51  -8.529  -5.618  -0.753
  408   2HB   GLN  51          2HB       GLN  51  -7.435  -5.417   0.610
  409   1HG   GLN  51          1HG       GLN  51  -5.863  -6.291  -0.745
  410   2HG   GLN  51          2HG       GLN  51  -6.606  -7.852  -0.382
  411   1HE2  GLN  51          2HE2      GLN  51  -6.759  -5.069  -2.629
  412   2HE2  GLN  51          1HE2      GLN  51  -7.200  -6.001  -4.039
  413    H    ALA  52           H        ALA  52  -7.950  -9.463   0.336
  414    HA   ALA  52           HA       ALA  52  -8.670 -11.223  -0.954
  415   1HB   ALA  52          1HB       ALA  52 -10.838 -10.770   1.129
  416   2HB   ALA  52          2HB       ALA  52 -10.534 -12.308   0.281
  417   3HB   ALA  52          3HB       ALA  52  -9.296 -11.611   1.340
  418    H    LYS  53           H        LYS  53 -12.083 -10.663  -0.494
  419    HA   LYS  53           HA       LYS  53 -12.623  -9.348  -2.964
  420   1HB   LYS  53          1HB       LYS  53 -11.939 -11.878  -3.558
  421   2HB   LYS  53          2HB       LYS  53 -13.518 -12.246  -2.896
  422   1HG   LYS  53          1HG       LYS  53 -13.937 -12.048  -5.185
  423   2HG   LYS  53          2HG       LYS  53 -14.458 -10.500  -4.563
  424   1HD   LYS  53          1HD       LYS  53 -13.234 -10.056  -6.556
  425   2HD   LYS  53          2HD       LYS  53 -12.220  -9.513  -5.221
  426   1HE   LYS  53          1HE       LYS  53 -10.927 -10.679  -6.966
  427   2HE   LYS  53          2HE       LYS  53 -10.813 -11.533  -5.427
  428   1HZ   LYS  53          1HZ       LYS  53 -12.598 -12.252  -7.653
  429   2HZ   LYS  53          2HZ       LYS  53 -11.190 -13.013  -7.261
  430   3HZ   LYS  53          3HZ       LYS  53 -12.466 -13.066  -6.227
  431    H    ALA  54           H        ALA  54 -14.885  -8.932  -3.167
  432    HA   ALA  54           HA       ALA  54 -17.045  -8.768  -2.753
  433   1HB   ALA  54          1HB       ALA  54 -17.010 -11.214  -2.841
  434   2HB   ALA  54          2HB       ALA  54 -16.784 -11.299  -1.081
  435   3HB   ALA  54          3HB       ALA  54 -18.268 -10.601  -1.751
  436    H    GLU  55           H        GLU  55 -15.855  -9.902   0.438
  437    HA   GLU  55           HA       GLU  55 -17.547  -8.357   2.068
  438   1HB   GLU  55          1HB       GLU  55 -14.704  -9.360   2.534
  439   2HB   GLU  55          2HB       GLU  55 -15.787  -8.743   3.797
  440   1HG   GLU  55          1HG       GLU  55 -17.379 -10.544   3.399
  441   2HG   GLU  55          2HG       GLU  55 -16.428 -11.152   2.033
  442    H    PHE  56           H        PHE  56 -14.306  -7.662   0.747
  443    HA   PHE  56           HA       PHE  56 -14.093  -5.077   2.020
  444   1HB   PHE  56          1HB       PHE  56 -12.281  -6.813   1.453
  445   2HB   PHE  56          2HB       PHE  56 -12.369  -6.199  -0.193
  446    HD1  PHE  56           HD1      PHE  56 -11.573  -5.414   3.345
  447    HD2  PHE  56           HD2      PHE  56 -11.182  -4.149  -0.759
  448    HE1  PHE  56           HE1      PHE  56  -9.557  -4.113   3.935
  449    HE2  PHE  56           HE2      PHE  56  -9.218  -2.778  -0.147
  450    HZ   PHE  56           HZ       PHE  56  -8.364  -2.795   2.184
  451    H    TYR  57           H        TYR  57 -16.409  -5.002   0.613
  452    HA   TYR  57           HA       TYR  57 -16.021  -2.749  -1.190
  453   1HB   TYR  57          1HB       TYR  57 -17.436  -5.279  -2.148
  454   2HB   TYR  57          2HB       TYR  57 -17.550  -3.706  -2.914
  455    HD1  TYR  57           HD1      TYR  57 -15.379  -6.636  -2.365
  456    HD2  TYR  57           HD2      TYR  57 -15.691  -2.758  -4.214
  457    HE1  TYR  57           HE1      TYR  57 -13.584  -7.254  -3.966
  458    HE2  TYR  57           HE2      TYR  57 -13.917  -3.380  -5.819
  459    HH   TYR  57           HH       TYR  57 -12.538  -5.048  -6.580
  460    H    SER  58           H        SER  58 -18.304  -5.238   0.073
  461    HA   SER  58           HA       SER  58 -20.491  -3.371   0.366
  462   1HB   SER  58          1HB       SER  58 -21.547  -5.336   1.535
  463   2HB   SER  58          2HB       SER  58 -20.988  -5.638  -0.121
  464    HG   SER  58           HG       SER  58 -19.709  -6.391   2.284
  465    H    GLU  59           H        GLU  59 -18.142  -4.908   2.656
  466    HA   GLU  59           HA       GLU  59 -19.512  -3.744   4.934
  467   1HB   GLU  59          1HB       GLU  59 -16.920  -5.316   4.837
  468   2HB   GLU  59          2HB       GLU  59 -17.937  -5.005   6.253
  469   1HG   GLU  59          1HG       GLU  59 -19.808  -6.250   5.084
  470   2HG   GLU  59          2HG       GLU  59 -18.625  -6.735   3.852
  471    H    VAL  60           H        VAL  60 -18.663  -1.634   3.407
  472    HA   VAL  60           HA       VAL  60 -17.171   0.170   3.299
  473    HB   VAL  60           HB       VAL  60 -17.961   1.656   5.169
  474   1HG1  VAL  60          1HG1      VAL  60 -19.151   1.442   3.030
  475   2HG1  VAL  60          2HG1      VAL  60 -20.082   0.070   3.669
  476   3HG1  VAL  60          3HG1      VAL  60 -20.275   1.684   4.377
  477   1HG2  VAL  60          1HG2      VAL  60 -18.263  -0.130   6.940
  478   2HG2  VAL  60          2HG2      VAL  60 -19.701   0.865   6.671
  479   3HG2  VAL  60          3HG2      VAL  60 -19.624  -0.771   6.001
  480    H    LEU  61           H        LEU  61 -15.188  -1.224   3.532
  481    HA   LEU  61           HA       LEU  61 -13.797  -1.476   5.874
  482   1HB   LEU  61          1HB       LEU  61 -11.748  -1.733   4.460
  483   2HB   LEU  61          2HB       LEU  61 -13.099  -2.806   4.149
  484    HG   LEU  61           HG       LEU  61 -11.861  -2.099   2.171
  485   1HD1  LEU  61          1HD1      LEU  61 -14.342  -2.792   2.113
  486   2HD1  LEU  61          2HD1      LEU  61 -14.666  -1.084   1.750
  487   3HD1  LEU  61          3HD1      LEU  61 -13.618  -2.011   0.691
  488   1HD2  LEU  61          1HD2      LEU  61 -11.417   0.249   2.793
  489   2HD2  LEU  61          2HD2      LEU  61 -12.090   0.048   1.158
  490   3HD2  LEU  61          3HD2      LEU  61 -13.142   0.604   2.462
  491    H    THR  62           H        THR  62 -11.988  -0.486   6.873
  492    HA   THR  62           HA       THR  62 -11.994   2.483   6.556
  493    HB   THR  62           HB       THR  62 -11.829   0.820   9.091
  494    HG1  THR  62           HG1      THR  62 -13.907   1.639   9.407
  495   1HG2  THR  62          1HG2      THR  62 -12.024   3.841   8.652
  496   2HG2  THR  62          2HG2      THR  62 -12.172   3.016  10.218
  497   3HG2  THR  62          3HG2      THR  62 -10.635   2.973   9.345
  498    H    ILE  63           H        ILE  63 -10.158   3.561   6.465
  499    HA   ILE  63           HA       ILE  63  -7.583   2.084   6.727
  500    HB   ILE  63           HB       ILE  63  -8.200   4.565   5.088
  501   1HG1  ILE  63          1HG1      ILE  63  -7.899   1.719   4.032
  502   2HG1  ILE  63          2HG1      ILE  63  -9.441   2.564   4.199
  503   1HG2  ILE  63          1HG2      ILE  63  -5.796   4.167   5.861
  504   2HG2  ILE  63          2HG2      ILE  63  -5.809   2.670   4.930
  505   3HG2  ILE  63          3HG2      ILE  63  -5.998   4.231   4.118
  506   1HD1  ILE  63          1HD1      ILE  63  -8.630   4.345   2.685
  507   2HD1  ILE  63          2HD1      ILE  63  -7.144   3.397   2.398
  508   3HD1  ILE  63          3HD1      ILE  63  -8.721   2.731   1.961
  509    H    VAL  64           H        VAL  64  -6.258   2.769   8.300
  510    HA   VAL  64           HA       VAL  64  -6.732   5.337   9.716
  511    HB   VAL  64           HB       VAL  64  -4.707   3.108  10.169
  512   1HG1  VAL  64          1HG1      VAL  64  -5.379   5.589  11.814
  513   2HG1  VAL  64          2HG1      VAL  64  -4.305   4.273  12.330
  514   3HG1  VAL  64          3HG1      VAL  64  -3.852   5.288  10.955
  515   1HG2  VAL  64          1HG2      VAL  64  -7.245   3.834  11.687
  516   2HG2  VAL  64          2HG2      VAL  64  -7.015   2.380  10.690
  517   3HG2  VAL  64          3HG2      VAL  64  -6.066   2.597  12.167
  518    H    VAL  65           H        VAL  65  -5.984   7.040   8.472
  519    HA   VAL  65           HA       VAL  65  -3.274   6.787   7.215
  520    HB   VAL  65           HB       VAL  65  -3.811   8.572   5.749
  521   1HG1  VAL  65          1HG1      VAL  65  -4.335   6.214   5.127
  522   2HG1  VAL  65          2HG1      VAL  65  -6.017   6.481   5.654
  523   3HG1  VAL  65          3HG1      VAL  65  -5.356   7.402   4.298
  524   1HG2  VAL  65          1HG2      VAL  65  -6.618   8.607   6.933
  525   2HG2  VAL  65          2HG2      VAL  65  -5.474   9.975   6.855
  526   3HG2  VAL  65          3HG2      VAL  65  -6.146   9.326   5.380
  527    H    ASP  66           H        ASP  66  -2.142   7.063   9.099
  528    HA   ASP  66           HA       ASP  66  -1.251   8.066  10.898
  529   1HB   ASP  66          1HB       ASP  66  -0.372   9.547   9.136
  530   2HB   ASP  66          2HB       ASP  66  -1.779  10.601   9.285
  531    H    GLY  67           H        GLY  67  -3.285   7.234  11.940
  532   1HA   GLY  67          1HA       GLY  67  -4.604   7.591  13.798
  533   2HA   GLY  67          2HA       GLY  67  -4.443   9.339  13.619
  534    H    LYS  68           H        LYS  68  -5.402   9.744  11.011
  535    HA   LYS  68           HA       LYS  68  -8.165   9.933  11.553
  536   1HB   LYS  68          1HB       LYS  68  -6.663  10.225   8.931
  537   2HB   LYS  68          2HB       LYS  68  -8.358  10.666   9.200
  538   1HG   LYS  68          1HG       LYS  68  -7.699  12.331  10.886
  539   2HG   LYS  68          2HG       LYS  68  -6.003  11.842  10.741
  540   1HD   LYS  68          1HD       LYS  68  -6.344  13.877   9.501
  541   2HD   LYS  68          2HD       LYS  68  -5.957  12.558   8.384
  542   1HE   LYS  68          1HE       LYS  68  -8.341  12.366   7.749
  543   2HE   LYS  68          2HE       LYS  68  -8.779  13.585   8.963
  544   1HZ   LYS  68          1HZ       LYS  68  -7.064  14.018   6.618
  545   2HZ   LYS  68          2HZ       LYS  68  -8.635  14.486   6.763
  546   3HZ   LYS  68          3HZ       LYS  68  -7.484  15.165   7.726
  547    H    GLU  69           H        GLU  69  -9.527   8.245  11.694
  548    HA   GLU  69           HA       GLU  69  -9.328   5.829  10.083
  549   1HB   GLU  69          1HB       GLU  69 -11.454   6.884  11.993
  550   2HB   GLU  69          2HB       GLU  69 -11.497   5.302  11.192
  551   1HG   GLU  69          1HG       GLU  69  -9.344   4.698  12.257
  552   2HG   GLU  69          2HG       GLU  69  -9.326   6.253  13.111
  553    H    ILE  70           H        ILE  70  -9.312   6.891   7.967
  554    HA   ILE  70           HA       ILE  70 -11.771   8.179   7.019
  555    HB   ILE  70           HB       ILE  70  -9.184   7.334   5.667
  556   1HG1  ILE  70          1HG1      ILE  70 -10.474   9.965   6.513
  557   2HG1  ILE  70          2HG1      ILE  70  -8.934   9.276   7.022
  558   1HG2  ILE  70          1HG2      ILE  70 -11.744   8.422   4.443
  559   2HG2  ILE  70          2HG2      ILE  70 -10.168   8.515   3.634
  560   3HG2  ILE  70          3HG2      ILE  70 -10.843   6.951   4.020
  561   1HD1  ILE  70          1HD1      ILE  70  -8.202   9.543   4.548
  562   2HD1  ILE  70          2HD1      ILE  70  -9.639  10.571   4.371
  563   3HD1  ILE  70          3HD1      ILE  70  -8.378  11.019   5.526
  564    H    LYS  71           H        LYS  71 -13.530   6.971   6.923
  565    HA   LYS  71           HA       LYS  71 -13.401   4.117   6.298
  566   1HB   LYS  71          1HB       LYS  71 -14.741   4.936   8.160
  567   2HB   LYS  71          2HB       LYS  71 -15.774   5.845   7.040
  568   1HG   LYS  71          1HG       LYS  71 -16.615   3.824   6.043
  569   2HG   LYS  71          2HG       LYS  71 -15.288   2.862   6.699
  570   1HD   LYS  71          1HD       LYS  71 -17.318   2.364   7.910
  571   2HD   LYS  71          2HD       LYS  71 -16.124   3.122   8.975
  572   1HE   LYS  71          1HE       LYS  71 -17.311   5.302   8.765
  573   2HE   LYS  71          2HE       LYS  71 -18.495   4.547   7.675
  574   1HZ   LYS  71          1HZ       LYS  71 -18.002   3.806  10.476
  575   2HZ   LYS  71          2HZ       LYS  71 -19.280   4.682   9.920
  576   3HZ   LYS  71          3HZ       LYS  71 -19.112   3.103   9.480
  577    H    VAL  72           H        VAL  72 -13.595   3.354   4.332
  578    HA   VAL  72           HA       VAL  72 -14.803   4.951   2.131
  579    HB   VAL  72           HB       VAL  72 -12.811   4.007   0.788
  580   1HG1  VAL  72          1HG1      VAL  72 -12.547   6.233   2.818
  581   2HG1  VAL  72          2HG1      VAL  72 -11.269   5.865   1.640
  582   3HG1  VAL  72          3HG1      VAL  72 -12.864   6.359   1.085
  583   1HG2  VAL  72          1HG2      VAL  72 -12.024   2.492   2.676
  584   2HG2  VAL  72          2HG2      VAL  72 -10.806   3.503   1.898
  585   3HG2  VAL  72          3HG2      VAL  72 -11.436   3.949   3.495
  586    H    LYS  73           H        LYS  73 -14.577   3.263   0.071
  587    HA   LYS  73           HA       LYS  73 -15.855   0.720   0.924
  588   1HB   LYS  73          1HB       LYS  73 -17.435   2.738   0.710
  589   2HB   LYS  73          2HB       LYS  73 -17.182   2.615  -1.037
  590   1HG   LYS  73          1HG       LYS  73 -18.080   0.324  -0.996
  591   2HG   LYS  73          2HG       LYS  73 -18.154   0.359   0.784
  592   1HD   LYS  73          1HD       LYS  73 -19.781   2.283   0.592
  593   2HD   LYS  73          2HD       LYS  73 -19.791   2.035  -1.163
  594   1HE   LYS  73          1HE       LYS  73 -20.631   0.026   0.989
  595   2HE   LYS  73          2HE       LYS  73 -21.707   0.905  -0.109
  596   1HZ   LYS  73          1HZ       LYS  73 -20.625  -0.252  -1.935
  597   2HZ   LYS  73          2HZ       LYS  73 -19.708  -1.112  -0.861
  598   3HZ   LYS  73          3HZ       LYS  73 -21.346  -1.294  -0.879
  599    H    ALA  74           H        ALA  74 -13.450   1.935  -0.961
  600    HA   ALA  74           HA       ALA  74 -12.192   1.070  -2.607
  601   1HB   ALA  74          1HB       ALA  74 -12.412  -1.023  -1.373
  602   2HB   ALA  74          2HB       ALA  74 -13.831  -1.474  -2.339
  603   3HB   ALA  74          3HB       ALA  74 -12.258  -1.280  -3.120
  604    H    GLN  75           H        GLN  75 -12.501   2.314  -4.396
  605    HA   GLN  75           HA       GLN  75 -15.025   2.167  -5.863
  606   1HB   GLN  75          1HB       GLN  75 -13.645   4.246  -5.148
  607   2HB   GLN  75          2HB       GLN  75 -12.678   3.966  -6.576
  608   1HG   GLN  75          1HG       GLN  75 -15.710   4.341  -6.512
  609   2HG   GLN  75          2HG       GLN  75 -14.527   5.572  -6.960
  610   1HE2  GLN  75          2HE2      GLN  75 -16.748   3.604  -8.325
  611   2HE2  GLN  75          1HE2      GLN  75 -15.978   3.302  -9.868
  612    H    ASP  76           H        ASP  76 -11.575   2.208  -6.877
  613    HA   ASP  76           HA       ASP  76 -12.094   0.067  -8.879
  614   1HB   ASP  76          1HB       ASP  76 -12.106   2.163 -10.124
  615   2HB   ASP  76          2HB       ASP  76 -10.624   2.704  -9.311
  616    H    VAL  77           H        VAL  77 -10.663  -1.544  -8.605
  617    HA   VAL  77           HA       VAL  77  -8.143  -1.078  -7.121
  618    HB   VAL  77           HB       VAL  77  -8.838  -2.933  -5.547
  619   1HG1  VAL  77          1HG1      VAL  77  -8.839  -0.433  -5.018
  620   2HG1  VAL  77          2HG1      VAL  77 -10.588  -0.455  -5.271
  621   3HG1  VAL  77          3HG1      VAL  77  -9.871  -1.444  -3.991
  622   1HG2  VAL  77          1HG2      VAL  77 -10.854  -3.778  -6.772
  623   2HG2  VAL  77          2HG2      VAL  77 -11.200  -3.312  -5.104
  624   3HG2  VAL  77          3HG2      VAL  77 -11.679  -2.249  -6.437
  625    H    GLN  78           H        GLN  78  -6.565  -2.084  -8.131
  626    HA   GLN  78           HA       GLN  78  -7.170  -4.205 -10.087
  627   1HB   GLN  78          1HB       GLN  78  -4.649  -2.668  -9.385
  628   2HB   GLN  78          2HB       GLN  78  -4.709  -3.993 -10.550
  629   1HG   GLN  78          1HG       GLN  78  -4.813  -1.881 -11.705
  630   2HG   GLN  78          2HG       GLN  78  -6.292  -2.810 -11.951
  631   1HE2  GLN  78          2HE2      GLN  78  -8.164  -1.631 -11.785
  632   2HE2  GLN  78          1HE2      GLN  78  -8.329  -0.125 -10.916
  633    H    ARG  79           H        ARG  79  -7.985  -5.295  -7.942
  634    HA   ARG  79           HA       ARG  79  -5.975  -6.752  -6.457
  635   1HB   ARG  79          1HB       ARG  79  -7.693  -7.791  -5.333
  636   2HB   ARG  79          2HB       ARG  79  -8.315  -6.164  -5.639
  637   1HG   ARG  79          1HG       ARG  79  -9.087  -8.714  -7.127
  638   2HG   ARG  79          2HG       ARG  79 -10.008  -7.910  -5.864
  639   1HD   ARG  79          1HD       ARG  79 -10.292  -5.912  -7.220
  640   2HD   ARG  79          2HD       ARG  79  -9.366  -6.600  -8.551
  641    HE   ARG  79           HE       ARG  79 -12.108  -7.162  -7.814
  642   1HH1  ARG  79          1HH2      ARG  79  -9.239  -8.483  -9.470
  643   2HH1  ARG  79          2HH2      ARG  79 -10.177  -9.468 -10.562
  644   1HH2  ARG  79          1HH1      ARG  79 -13.312  -8.467  -9.263
  645   2HH2  ARG  79          2HH1      ARG  79 -12.499  -9.473 -10.434
  646    H    HIS  80           H        HIS  80  -5.105  -8.724  -6.914
  647    HA   HIS  80           HA       HIS  80  -6.011 -10.149  -9.377
  648   1HB   HIS  80          1HB       HIS  80  -3.828  -9.029  -9.558
  649   2HB   HIS  80          2HB       HIS  80  -3.212 -10.038  -8.249
  650    HD1  HIS  80           HD1      HIS  80  -4.770 -12.765  -9.483
  651    HD2  HIS  80           HD2      HIS  80  -2.132 -10.060 -11.347
  652    HE1  HIS  80           HE1      HIS  80  -3.741 -13.992 -11.458
  653    HA   PRO  81           HA       PRO  81  -6.717 -13.019  -5.845
  654   1HB   PRO  81          1HB       PRO  81  -8.554 -14.665  -6.991
  655   2HB   PRO  81          2HB       PRO  81  -8.967 -13.017  -6.438
  656   1HG   PRO  81          1HG       PRO  81  -8.229 -13.885  -9.249
  657   2HG   PRO  81          2HG       PRO  81  -9.654 -12.929  -8.758
  658   1HD   PRO  81          1HD       PRO  81  -7.382 -11.786  -9.694
  659   2HD   PRO  81          2HD       PRO  81  -8.317 -10.995  -8.386
  660    H    TYR  82           H        TYR  82  -6.220 -15.279  -5.565
  661    HA   TYR  82           HA       TYR  82  -5.155 -17.209  -5.828
  662   1HB   TYR  82          1HB       TYR  82  -4.834 -16.805  -8.808
  663   2HB   TYR  82          2HB       TYR  82  -4.889 -18.299  -7.893
  664    HD1  TYR  82           HD1      TYR  82  -7.205 -18.483  -6.379
  665    HD2  TYR  82           HD2      TYR  82  -6.737 -16.330 -10.090
  666    HE1  TYR  82           HE1      TYR  82  -9.660 -18.480  -6.691
  667    HE2  TYR  82           HE2      TYR  82  -9.191 -16.340 -10.401
  668    HH   TYR  82           HH       TYR  82 -11.419 -17.841  -8.032
  669    H    LYS  83           H        LYS  83  -3.605 -14.992  -8.190
  670    HA   LYS  83           HA       LYS  83  -0.957 -15.455  -6.891
  671   1HB   LYS  83          1HB       LYS  83  -1.587 -14.489  -9.698
  672   2HB   LYS  83          2HB       LYS  83   0.011 -14.741  -8.977
  673   1HG   LYS  83          1HG       LYS  83  -0.641 -17.188  -8.630
  674   2HG   LYS  83          2HG       LYS  83  -2.138 -16.842  -9.509
  675   1HD   LYS  83          1HD       LYS  83  -0.711 -17.799 -11.101
  676   2HD   LYS  83          2HD       LYS  83  -0.720 -16.065 -11.470
  677   1HE   LYS  83          1HE       LYS  83   1.480 -15.820 -10.317
  678   2HE   LYS  83          2HE       LYS  83   1.433 -17.536  -9.862
  679   1HZ   LYS  83          1HZ       LYS  83   1.476 -18.079 -12.187
  680   2HZ   LYS  83          2HZ       LYS  83   1.532 -16.486 -12.601
  681   3HZ   LYS  83          3HZ       LYS  83   2.781 -17.167 -11.773
  682    HA   PRO  84           HA       PRO  84  -2.312 -11.285  -5.628
  683   1HB   PRO  84          1HB       PRO  84  -0.528 -10.775  -3.622
  684   2HB   PRO  84          2HB       PRO  84  -1.875 -11.940  -3.449
  685   1HG   PRO  84          1HG       PRO  84   0.993 -12.563  -4.189
  686   2HG   PRO  84          2HG       PRO  84   0.006 -13.327  -2.906
  687   1HD   PRO  84          1HD       PRO  84   0.265 -14.445  -5.356
  688   2HD   PRO  84          2HD       PRO  84  -1.315 -14.495  -4.514
  689    H    LYS  85           H        LYS  85  -1.543  -9.113  -5.881
  690    HA   LYS  85           HA       LYS  85   1.099  -8.688  -7.043
  691   1HB   LYS  85          1HB       LYS  85  -0.762  -9.578  -8.831
  692   2HB   LYS  85          2HB       LYS  85  -1.174  -7.866  -8.837
  693   1HG   LYS  85          1HG       LYS  85   0.396  -8.133 -10.573
  694   2HG   LYS  85          2HG       LYS  85   1.342  -7.432  -9.246
  695   1HD   LYS  85          1HD       LYS  85   2.143  -9.772  -8.666
  696   2HD   LYS  85          2HD       LYS  85   1.140 -10.404  -9.975
  697   1HE   LYS  85          1HE       LYS  85   3.422 -10.289 -10.731
  698   2HE   LYS  85          2HE       LYS  85   2.478  -9.079 -11.618
  699   1HZ   LYS  85          1HZ       LYS  85   4.195  -8.555  -9.285
  700   2HZ   LYS  85          2HZ       LYS  85   4.583  -8.235 -10.852
  701   3HZ   LYS  85          3HZ       LYS  85   3.352  -7.418 -10.127
  702    H    LEU  86           H        LEU  86  -2.151  -7.253  -6.548
  703    HA   LEU  86           HA       LEU  86  -2.821  -5.151  -6.008
  704   1HB   LEU  86          1HB       LEU  86  -0.371  -5.355  -4.218
  705   2HB   LEU  86          2HB       LEU  86  -1.653  -4.161  -4.037
  706    HG   LEU  86           HG       LEU  86  -2.136  -7.166  -3.849
  707   1HD1  LEU  86          1HD1      LEU  86  -1.601  -5.077  -1.701
  708   2HD1  LEU  86          2HD1      LEU  86  -2.234  -6.694  -1.370
  709   3HD1  LEU  86          3HD1      LEU  86  -0.622  -6.508  -2.069
  710   1HD2  LEU  86          1HD2      LEU  86  -3.814  -4.736  -3.045
  711   2HD2  LEU  86          2HD2      LEU  86  -4.181  -5.860  -4.374
  712   3HD2  LEU  86          3HD2      LEU  86  -4.218  -6.430  -2.703
  713    H    GLN  87           H        GLN  87  -2.190  -4.597  -8.295
  714    HA   GLN  87           HA       GLN  87   0.270  -3.223  -8.798
  715   1HB   GLN  87          1HB       GLN  87  -2.353  -3.156 -10.347
  716   2HB   GLN  87          2HB       GLN  87  -0.781  -2.565 -10.914
  717   1HG   GLN  87          1HG       GLN  87   0.157  -4.882 -10.598
  718   2HG   GLN  87          2HG       GLN  87  -1.464  -5.449 -10.170
  719   1HE2  GLN  87          2HE2      GLN  87   0.396  -3.830 -12.792
  720   2HE2  GLN  87          1HE2      GLN  87  -0.587  -4.461 -14.097
  721    H    HIS  88           H        HIS  88  -3.091  -2.001  -8.318
  722    HA   HIS  88           HA       HIS  88  -2.113   0.193  -6.764
  723   1HB   HIS  88          1HB       HIS  88  -1.828   0.998  -9.198
  724   2HB   HIS  88          2HB       HIS  88  -3.590   0.988  -9.302
  725    HD1  HIS  88           HD1      HIS  88  -4.789   3.105  -8.173
  726    HD2  HIS  88           HD2      HIS  88  -0.706   2.621  -7.235
  727    HE1  HIS  88           HE1      HIS  88  -4.085   5.156  -6.846
  728    H    ILE  89           H        ILE  89  -3.917   1.470  -5.874
  729    HA   ILE  89           HA       ILE  89  -6.559   0.128  -5.831
  730    HB   ILE  89           HB       ILE  89  -4.633   0.573  -3.526
  731   1HG1  ILE  89          1HG1      ILE  89  -4.297  -1.588  -4.595
  732   2HG1  ILE  89          2HG1      ILE  89  -4.933  -1.750  -2.963
  733   1HG2  ILE  89          1HG2      ILE  89  -7.586  -0.071  -3.263
  734   2HG2  ILE  89          2HG2      ILE  89  -6.379  -0.145  -1.973
  735   3HG2  ILE  89          3HG2      ILE  89  -6.751   1.399  -2.752
  736   1HD1  ILE  89          1HD1      ILE  89  -7.170  -2.263  -3.828
  737   2HD1  ILE  89          2HD1      ILE  89  -6.572  -2.090  -5.497
  738   3HD1  ILE  89          3HD1      ILE  89  -5.945  -3.373  -4.458
  739    H    ASP  90           H        ASP  90  -8.111   1.625  -5.951
  740    HA   ASP  90           HA       ASP  90  -7.584   4.432  -5.075
  741   1HB   ASP  90          1HB       ASP  90  -9.057   3.517  -7.560
  742   2HB   ASP  90          2HB       ASP  90  -8.918   5.171  -6.960
  743    H    PHE  91           H        PHE  91  -8.735   4.554  -3.223
  744    HA   PHE  91           HA       PHE  91 -11.299   3.142  -2.896
  745   1HB   PHE  91          1HB       PHE  91  -9.723   4.931  -1.028
  746   2HB   PHE  91          2HB       PHE  91 -11.159   4.030  -0.610
  747    HD1  PHE  91           HD1      PHE  91  -7.547   3.861  -0.978
  748    HD2  PHE  91           HD2      PHE  91 -11.148   1.533  -0.537
  749    HE1  PHE  91           HE1      PHE  91  -6.226   1.991  -0.049
  750    HE2  PHE  91           HE2      PHE  91  -9.811  -0.366   0.330
  751    HZ   PHE  91           HZ       PHE  91  -7.357  -0.132   0.613
  752    H    VAL  92           H        VAL  92 -13.193   4.291  -1.998
  753    HA   VAL  92           HA       VAL  92 -13.357   7.194  -2.491
  754    HB   VAL  92           HB       VAL  92 -14.377   6.154  -4.455
  755   1HG1  VAL  92          1HG1      VAL  92 -15.171   3.995  -3.361
  756   2HG1  VAL  92          2HG1      VAL  92 -16.431   4.929  -2.535
  757   3HG1  VAL  92          3HG1      VAL  92 -16.430   4.820  -4.296
  758   1HG2  VAL  92          1HG2      VAL  92 -15.226   8.296  -3.582
  759   2HG2  VAL  92          2HG2      VAL  92 -16.459   7.352  -4.436
  760   3HG2  VAL  92          3HG2      VAL  92 -16.475   7.421  -2.668
  761    H    ARG  93           H        ARG  93 -14.617   8.255  -0.962
  762    HA   ARG  93           HA       ARG  93 -14.904   7.231   1.610
  763   1HB   ARG  93          1HB       ARG  93 -16.181   9.522   0.115
  764   2HB   ARG  93          2HB       ARG  93 -16.693   9.166   1.762
  765   1HG   ARG  93          1HG       ARG  93 -13.760   9.598   1.052
  766   2HG   ARG  93          2HG       ARG  93 -14.871  10.907   1.508
  767   1HD   ARG  93          1HD       ARG  93 -15.396   9.680   3.626
  768   2HD   ARG  93          2HD       ARG  93 -14.098   8.526   3.242
  769    HE   ARG  93           HE       ARG  93 -12.867  10.974   3.030
  770   1HH1  ARG  93          1HH2      ARG  93 -14.601   9.234   5.594
  771   2HH1  ARG  93          2HH2      ARG  93 -13.795  10.082   6.888
  772   1HH2  ARG  93          1HH1      ARG  93 -11.834  12.095   4.730
  773   2HH2  ARG  93          2HH1      ARG  93 -12.214  11.719   6.396
  774    H    ALA  94           H        ALA  94 -16.482   6.317   2.829
  775    HA   ALA  94           HA       ALA  94 -18.535   4.754   1.505
  776   1HB   ALA  94          1HB       ALA  94 -17.341   3.944   3.505
  777   2HB   ALA  94          2HB       ALA  94 -17.987   5.304   4.453
  778   3HB   ALA  94          3HB       ALA  94 -19.086   4.062   3.813
  Start of MODEL    8
    1    H    MET   1           H        MET   1 -14.104  -0.529   9.012
    2    HA   MET   1           HA       MET   1 -14.767  -2.287  10.631
    3   1HB   MET   1          1HB       MET   1 -15.236  -3.933   8.111
    4   2HB   MET   1          2HB       MET   1 -15.381  -4.494   9.780
    5   1HG   MET   1          1HG       MET   1 -17.153  -2.448   8.381
    6   2HG   MET   1          2HG       MET   1 -17.525  -4.116   8.785
    7   1HE   MET   1          1HE       MET   1 -17.837  -0.483   9.843
    8   2HE   MET   1          2HE       MET   1 -17.919  -0.530  11.616
    9   3HE   MET   1          3HE       MET   1 -16.363  -0.739  10.803
   10    H    PHE   2           H        PHE   2 -13.198  -3.433   7.583
   11    HA   PHE   2           HA       PHE   2 -11.023  -4.718   8.888
   12   1HB   PHE   2          1HB       PHE   2 -11.198  -3.542   6.089
   13   2HB   PHE   2          2HB       PHE   2  -9.924  -4.603   6.666
   14    HD1  PHE   2           HD1      PHE   2 -13.435  -4.431   5.559
   15    HD2  PHE   2           HD2      PHE   2 -10.296  -6.997   7.021
   16    HE1  PHE   2           HE1      PHE   2 -14.702  -6.416   4.789
   17    HE2  PHE   2           HE2      PHE   2 -11.548  -8.979   6.203
   18    HZ   PHE   2           HZ       PHE   2 -13.765  -8.695   5.133
   19    H    THR   3           H        THR   3  -9.302  -3.839   9.922
   20    HA   THR   3           HA       THR   3  -8.912  -0.935   9.899
   21    HB   THR   3           HB       THR   3  -7.521  -3.087  11.539
   22    HG1  THR   3           HG1      THR   3  -9.894  -1.620  12.006
   23   1HG2  THR   3          1HG2      THR   3  -6.417  -0.838  11.563
   24   2HG2  THR   3          2HG2      THR   3  -7.974  -0.107  12.024
   25   3HG2  THR   3          3HG2      THR   3  -7.159  -1.233  13.123
   26    H    ILE   4           H        ILE   4  -8.082  -0.708   7.708
   27    HA   ILE   4           HA       ILE   4  -5.600  -2.041   6.927
   28    HB   ILE   4           HB       ILE   4  -7.211   0.234   5.720
   29   1HG1  ILE   4          1HG1      ILE   4  -7.460  -1.341   3.820
   30   2HG1  ILE   4          2HG1      ILE   4  -6.646  -2.605   4.750
   31   1HG2  ILE   4          1HG2      ILE   4  -4.604  -0.988   4.741
   32   2HG2  ILE   4          2HG2      ILE   4  -5.660   0.059   3.769
   33   3HG2  ILE   4          3HG2      ILE   4  -4.858   0.704   5.196
   34   1HD1  ILE   4          1HD1      ILE   4  -9.191  -1.187   5.646
   35   2HD1  ILE   4          2HD1      ILE   4  -9.188  -2.685   4.695
   36   3HD1  ILE   4          3HD1      ILE   4  -8.493  -2.689   6.315
   37    H    ASN   5           H        ASN   5  -3.833  -1.580   8.150
   38    HA   ASN   5           HA       ASN   5  -3.368   0.976   9.415
   39   1HB   ASN   5          1HB       ASN   5  -2.447  -1.144  10.288
   40   2HB   ASN   5          2HB       ASN   5  -1.475  -1.333   8.821
   41   1HD2  ASN   5          2HD2      ASN   5  -2.105   0.969  11.536
   42   2HD2  ASN   5          1HD2      ASN   5  -0.465   1.578  11.614
   43    H    ALA   6           H        ALA   6  -2.398   2.795   8.534
   44    HA   ALA   6           HA       ALA   6  -0.741   2.578   6.120
   45   1HB   ALA   6          1HB       ALA   6  -3.089   2.615   5.262
   46   2HB   ALA   6          2HB       ALA   6  -3.365   4.131   6.144
   47   3HB   ALA   6          3HB       ALA   6  -2.193   4.075   4.811
   48    H    GLU   7           H        GLU   7  -0.123   4.804   5.370
   49    HA   GLU   7           HA       GLU   7   0.045   6.891   7.460
   50   1HB   GLU   7          1HB       GLU   7   2.058   5.341   7.635
   51   2HB   GLU   7          2HB       GLU   7   2.448   5.742   5.955
   52   1HG   GLU   7          1HG       GLU   7   2.689   8.164   6.669
   53   2HG   GLU   7          2HG       GLU   7   2.380   7.651   8.334
   54    H    VAL   8           H        VAL   8   0.636   8.974   6.408
   55    HA   VAL   8           HA       VAL   8  -0.312   9.368   3.717
   56    HB   VAL   8           HB       VAL   8   0.727  11.583   3.902
   57   1HG1  VAL   8          1HG1      VAL   8  -1.511  11.157   4.883
   58   2HG1  VAL   8          2HG1      VAL   8  -0.754  10.807   6.452
   59   3HG1  VAL   8          3HG1      VAL   8  -0.626  12.427   5.746
   60   1HG2  VAL   8          1HG2      VAL   8   2.778  11.034   5.176
   61   2HG2  VAL   8          2HG2      VAL   8   1.852  12.314   5.961
   62   3HG2  VAL   8          3HG2      VAL   8   1.804  10.671   6.613
   63    H    ARG   9           H        ARG   9   0.969   9.732   1.767
   64    HA   ARG   9           HA       ARG   9   3.042   7.825   1.530
   65   1HB   ARG   9          1HB       ARG   9   1.553   8.617  -0.345
   66   2HB   ARG   9          2HB       ARG   9   2.523  10.101  -0.404
   67   1HG   ARG   9          1HG       ARG   9   4.574   8.418  -0.571
   68   2HG   ARG   9          2HG       ARG   9   3.347   7.235  -1.029
   69   1HD   ARG   9          1HD       ARG   9   3.881   9.891  -2.424
   70   2HD   ARG   9          2HD       ARG   9   4.491   8.301  -2.933
   71    HE   ARG   9           HE       ARG   9   1.660   8.167  -2.683
   72   1HH1  ARG   9          1HH2      ARG   9   4.178   9.543  -4.763
   73   2HH1  ARG   9          2HH2      ARG   9   3.191   9.535  -6.201
   74   1HH2  ARG   9          1HH1      ARG   9   0.352   8.164  -4.595
   75   2HH2  ARG   9          2HH1      ARG   9   1.003   8.759  -6.099
   76    H    LYS  10           H        LYS  10   4.966   7.994   2.539
   77    HA   LYS  10           HA       LYS  10   6.675  10.331   2.180
   78   1HB   LYS  10          1HB       LYS  10   5.126  11.007   4.022
   79   2HB   LYS  10          2HB       LYS  10   5.580   9.566   4.928
   80   1HG   LYS  10          1HG       LYS  10   6.733  11.460   5.814
   81   2HG   LYS  10          2HG       LYS  10   7.938  10.427   5.047
   82   1HD   LYS  10          1HD       LYS  10   8.053  11.910   3.104
   83   2HD   LYS  10          2HD       LYS  10   6.672  12.857   3.705
   84   1HE   LYS  10          1HE       LYS  10   8.012  13.503   5.708
   85   2HE   LYS  10          2HE       LYS  10   9.393  12.588   5.065
   86   1HZ   LYS  10          1HZ       LYS  10   8.096  14.890   3.774
   87   2HZ   LYS  10          2HZ       LYS  10   9.543  14.911   4.566
   88   3HZ   LYS  10          3HZ       LYS  10   9.381  14.050   3.168
   89    H    GLU  11           H        GLU  11   6.203   7.514   4.352
   90    HA   GLU  11           HA       GLU  11   7.564   6.064   5.281
   91   1HB   GLU  11          1HB       GLU  11   8.759   4.551   3.914
   92   2HB   GLU  11          2HB       GLU  11   7.285   5.015   3.079
   93   1HG   GLU  11          1HG       GLU  11   8.441   6.249   1.433
   94   2HG   GLU  11          2HG       GLU  11   9.905   6.410   2.424
   95    H    GLN  12           H        GLN  12  10.331   5.358   4.824
   96    HA   GLN  12           HA       GLN  12  11.558   7.502   6.396
   97   1HB   GLN  12          1HB       GLN  12  11.806   5.090   6.950
   98   2HB   GLN  12          2HB       GLN  12  12.720   4.856   5.454
   99   1HG   GLN  12          1HG       GLN  12  14.367   6.604   6.274
  100   2HG   GLN  12          2HG       GLN  12  13.461   6.687   7.789
  101   1HE2  GLN  12          2HE2      GLN  12  13.203   4.548   8.990
  102   2HE2  GLN  12          1HE2      GLN  12  14.554   3.438   8.940
  103    H    GLY  13           H        GLY  13  11.331   9.100   4.606
  104   1HA   GLY  13          1HA       GLY  13  13.857   9.502   3.337
  105   2HA   GLY  13          2HA       GLY  13  12.654   8.967   2.140
  106    H    LYS  14           H        LYS  14  13.858  11.474   2.014
  107    HA   LYS  14           HA       LYS  14  12.327  13.616   3.110
  108   1HB   LYS  14          1HB       LYS  14  14.590  13.853   2.148
  109   2HB   LYS  14          2HB       LYS  14  13.965  13.461   0.538
  110   1HG   LYS  14          1HG       LYS  14  12.502  15.487   0.637
  111   2HG   LYS  14          2HG       LYS  14  13.159  15.860   2.245
  112   1HD   LYS  14          1HD       LYS  14  15.437  16.038   1.253
  113   2HD   LYS  14          2HD       LYS  14  14.766  15.647  -0.345
  114   1HE   LYS  14          1HE       LYS  14  13.325  17.677  -0.228
  115   2HE   LYS  14          2HE       LYS  14  14.029  18.076   1.352
  116   1HZ   LYS  14          1HZ       LYS  14  16.159  18.253   0.284
  117   2HZ   LYS  14          2HZ       LYS  14  15.502  17.888  -1.182
  118   3HZ   LYS  14          3HZ       LYS  14  15.074  19.278  -0.411
  119    H    GLY  15           H        GLY  15  12.240  11.964  -0.072
  120   1HA   GLY  15          1HA       GLY  15   9.442  11.809  -0.325
  121   2HA   GLY  15          2HA       GLY  15   9.971  13.297  -1.147
  122    H    ALA  16           H        ALA  16  10.932   9.844  -0.798
  123    HA   ALA  16           HA       ALA  16  11.259   9.568  -3.718
  124   1HB   ALA  16          1HB       ALA  16  13.489  10.271  -2.909
  125   2HB   ALA  16          2HB       ALA  16  13.468   8.967  -1.700
  126   3HB   ALA  16          3HB       ALA  16  13.502   8.575  -3.434
  127    H    SER  17           H        SER  17  10.931   7.483  -4.420
  128    HA   SER  17           HA       SER  17   9.196   5.953  -2.811
  129   1HB   SER  17          1HB       SER  17  10.530   5.225  -5.459
  130   2HB   SER  17          2HB       SER  17   9.076   4.477  -4.768
  131    HG   SER  17           HG       SER  17   8.561   6.101  -6.271
  132    H    ARG  18           H        ARG  18  12.402   5.105  -4.119
  133    HA   ARG  18           HA       ARG  18  13.715   3.294  -3.805
  134   1HB   ARG  18          1HB       ARG  18  13.747   4.820  -1.182
  135   2HB   ARG  18          2HB       ARG  18  14.858   3.484  -1.541
  136   1HG   ARG  18          1HG       ARG  18  15.527   4.667  -3.662
  137   2HG   ARG  18          2HG       ARG  18  14.605   6.081  -3.108
  138   1HD   ARG  18          1HD       ARG  18  16.043   6.270  -1.130
  139   2HD   ARG  18          2HD       ARG  18  16.812   4.714  -1.514
  140    HE   ARG  18           HE       ARG  18  17.042   6.699  -3.634
  141   1HH1  ARG  18          1HH2      ARG  18  18.561   5.495  -0.654
  142   2HH1  ARG  18          2HH2      ARG  18  20.167   5.974  -1.136
  143   1HH2  ARG  18          1HH1      ARG  18  19.155   7.323  -4.244
  144   2HH2  ARG  18          2HH1      ARG  18  20.503   7.030  -3.175
  145    H    ARG  19           H        ARG  19  12.474   3.123  -0.449
  146    HA   ARG  19           HA       ARG  19  12.875   0.336  -0.349
  147   1HB   ARG  19          1HB       ARG  19  11.025   2.009   1.381
  148   2HB   ARG  19          2HB       ARG  19  11.619   0.388   1.736
  149   1HG   ARG  19          1HG       ARG  19  13.941   1.218   1.789
  150   2HG   ARG  19          2HG       ARG  19  13.382   2.868   1.457
  151   1HD   ARG  19          1HD       ARG  19  12.082   2.935   3.492
  152   2HD   ARG  19          2HD       ARG  19  12.430   1.245   3.858
  153    HE   ARG  19           HE       ARG  19  14.096   3.561   4.362
  154   1HH1  ARG  19          1HH2      ARG  19  14.259   0.080   3.681
  155   2HH1  ARG  19          2HH2      ARG  19  15.749  -0.151   4.559
  156   1HH2  ARG  19          1HH1      ARG  19  16.001   3.217   5.602
  157   2HH2  ARG  19          2HH1      ARG  19  16.773   1.651   5.599
  158    H    LEU  20           H        LEU  20   9.840   2.217  -0.955
  159    HA   LEU  20           HA       LEU  20   8.201  -0.119  -1.101
  160   1HB   LEU  20          1HB       LEU  20   6.454   1.285  -1.809
  161   2HB   LEU  20          2HB       LEU  20   7.437   2.235  -0.706
  162    HG   LEU  20           HG       LEU  20   8.594   3.048  -2.993
  163   1HD1  LEU  20          1HD1      LEU  20   5.742   2.331  -3.814
  164   2HD1  LEU  20          2HD1      LEU  20   6.851   3.336  -4.764
  165   3HD1  LEU  20          3HD1      LEU  20   7.194   1.621  -4.525
  166   1HD2  LEU  20          1HD2      LEU  20   5.910   4.051  -1.989
  167   2HD2  LEU  20          2HD2      LEU  20   7.511   4.517  -1.358
  168   3HD2  LEU  20          3HD2      LEU  20   7.035   4.964  -3.006
  169    H    ARG  21           H        ARG  21  10.192   1.566  -3.483
  170    HA   ARG  21           HA       ARG  21   9.168  -0.012  -5.733
  171   1HB   ARG  21          1HB       ARG  21   9.785   2.443  -5.772
  172   2HB   ARG  21          2HB       ARG  21  11.481   1.963  -5.637
  173   1HG   ARG  21          1HG       ARG  21  11.212   0.668  -7.787
  174   2HG   ARG  21          2HG       ARG  21   9.521   1.194  -7.859
  175   1HD   ARG  21          1HD       ARG  21  10.236   3.555  -7.912
  176   2HD   ARG  21          2HD       ARG  21  11.933   3.074  -7.823
  177    HE   ARG  21           HE       ARG  21  10.168   3.073 -10.131
  178   1HH1  ARG  21          1HH2      ARG  21  13.058   1.498  -8.790
  179   2HH1  ARG  21          2HH2      ARG  21  13.712   1.091 -10.355
  180   1HH2  ARG  21          1HH1      ARG  21  11.033   2.522 -12.170
  181   2HH2  ARG  21          2HH1      ARG  21  12.549   1.666 -12.284
  182    H    ALA  22           H        ALA  22   9.965  -1.790  -3.937
  183    HA   ALA  22           HA       ALA  22  11.992  -3.362  -5.127
  184   1HB   ALA  22          1HB       ALA  22  12.847  -1.851  -2.612
  185   2HB   ALA  22          2HB       ALA  22  13.657  -3.299  -3.242
  186   3HB   ALA  22          3HB       ALA  22  13.643  -1.814  -4.196
  187    H    ALA  23           H        ALA  23  10.821  -2.526  -1.829
  188    HA   ALA  23           HA       ALA  23  10.462  -5.345  -1.131
  189   1HB   ALA  23          1HB       ALA  23  11.471  -3.655   0.411
  190   2HB   ALA  23          2HB       ALA  23   9.904  -2.822   0.476
  191   3HB   ALA  23          3HB       ALA  23  10.063  -4.472   1.104
  192    H    ASN  24           H        ASN  24   8.397  -5.652   0.358
  193    HA   ASN  24           HA       ASN  24   6.104  -5.544  -1.441
  194   1HB   ASN  24          1HB       ASN  24   6.514  -6.708   1.348
  195   2HB   ASN  24          2HB       ASN  24   5.044  -6.907   0.388
  196   1HD2  ASN  24          2HD2      ASN  24   6.104  -9.193   1.182
  197   2HD2  ASN  24          1HD2      ASN  24   6.959 -10.003  -0.116
  198    H    LYS  25           H        LYS  25   6.299  -3.073  -1.304
  199    HA   LYS  25           HA       LYS  25   4.040  -2.222   0.344
  200   1HB   LYS  25          1HB       LYS  25   6.349  -1.599   1.500
  201   2HB   LYS  25          2HB       LYS  25   6.457  -0.417   0.186
  202   1HG   LYS  25          1HG       LYS  25   4.057   0.301   0.961
  203   2HG   LYS  25          2HG       LYS  25   4.444  -0.593   2.435
  204   1HD   LYS  25          1HD       LYS  25   5.863   1.824   1.249
  205   2HD   LYS  25          2HD       LYS  25   4.902   1.749   2.727
  206   1HE   LYS  25          1HE       LYS  25   6.971   1.701   3.674
  207   2HE   LYS  25          2HE       LYS  25   6.775  -0.042   3.436
  208   1HZ   LYS  25          1HZ       LYS  25   8.013   0.265   1.350
  209   2HZ   LYS  25          2HZ       LYS  25   8.201   1.869   1.690
  210   3HZ   LYS  25          3HZ       LYS  25   8.889   0.737   2.662
  211    H    PHE  26           H        PHE  26   2.880  -0.474  -0.682
  212    HA   PHE  26           HA       PHE  26   3.823   0.489  -3.272
  213   1HB   PHE  26          1HB       PHE  26   2.153  -0.586  -4.585
  214   2HB   PHE  26          2HB       PHE  26   2.878  -1.863  -3.635
  215    HD1  PHE  26           HD1      PHE  26   1.621  -2.458  -1.342
  216    HD2  PHE  26           HD2      PHE  26  -0.174  -0.298  -4.613
  217    HE1  PHE  26           HE1      PHE  26  -0.621  -2.884  -0.395
  218    HE2  PHE  26           HE2      PHE  26  -2.396  -0.612  -3.591
  219    HZ   PHE  26           HZ       PHE  26  -2.631  -1.917  -1.484
  220    HA   PRO  27           HA       PRO  27   1.090   3.693  -1.876
  221   1HB   PRO  27          1HB       PRO  27   0.697   5.232  -4.067
  222   2HB   PRO  27          2HB       PRO  27   2.334   4.980  -3.391
  223   1HG   PRO  27          1HG       PRO  27   1.041   3.474  -5.690
  224   2HG   PRO  27          2HG       PRO  27   2.646   4.265  -5.672
  225   1HD   PRO  27          1HD       PRO  27   2.323   1.595  -5.163
  226   2HD   PRO  27          2HD       PRO  27   3.563   2.573  -4.326
  227    H    ALA  28           H        ALA  28  -1.099   4.405  -1.851
  228    HA   ALA  28           HA       ALA  28  -2.971   3.446  -3.906
  229   1HB   ALA  28          1HB       ALA  28  -3.437   2.955  -0.939
  230   2HB   ALA  28          2HB       ALA  28  -4.622   2.710  -2.246
  231   3HB   ALA  28          3HB       ALA  28  -3.163   1.709  -2.180
  232    H    ILE  29           H        ILE  29  -5.115   4.663  -3.604
  233    HA   ILE  29           HA       ILE  29  -4.606   7.406  -2.542
  234    HB   ILE  29           HB       ILE  29  -5.505   6.608  -5.328
  235   1HG1  ILE  29          1HG1      ILE  29  -3.096   8.229  -4.361
  236   2HG1  ILE  29          2HG1      ILE  29  -3.028   6.563  -4.934
  237   1HG2  ILE  29          1HG2      ILE  29  -6.824   8.553  -4.500
  238   2HG2  ILE  29          2HG2      ILE  29  -5.306   9.414  -4.171
  239   3HG2  ILE  29          3HG2      ILE  29  -5.766   8.975  -5.829
  240   1HD1  ILE  29          1HD1      ILE  29  -3.923   7.351  -7.160
  241   2HD1  ILE  29          2HD1      ILE  29  -3.671   9.019  -6.588
  242   3HD1  ILE  29          3HD1      ILE  29  -2.299   7.916  -6.725
  243    H    ILE  30           H        ILE  30  -6.334   8.447  -1.717
  244    HA   ILE  30           HA       ILE  30  -8.958   7.026  -1.703
  245    HB   ILE  30           HB       ILE  30  -7.958   9.057   0.314
  246   1HG1  ILE  30          1HG1      ILE  30  -8.101   6.027   0.634
  247   2HG1  ILE  30          2HG1      ILE  30  -6.614   6.971   0.471
  248   1HG2  ILE  30          1HG2      ILE  30 -10.421   8.948   0.018
  249   2HG2  ILE  30          2HG2      ILE  30 -10.377   7.199   0.316
  250   3HG2  ILE  30          3HG2      ILE  30  -9.949   8.354   1.596
  251   1HD1  ILE  30          1HD1      ILE  30  -7.236   8.254   2.534
  252   2HD1  ILE  30          2HD1      ILE  30  -8.575   7.105   2.784
  253   3HD1  ILE  30          3HD1      ILE  30  -6.909   6.533   2.794
  254    H    TYR  31           H        TYR  31 -10.619   7.994  -2.603
  255    HA   TYR  31           HA       TYR  31 -10.403  10.776  -3.643
  256   1HB   TYR  31          1HB       TYR  31 -12.078   8.379  -4.484
  257   2HB   TYR  31          2HB       TYR  31 -12.285  10.006  -5.111
  258    HD1  TYR  31           HD1      TYR  31 -11.216  10.580  -7.111
  259    HD2  TYR  31           HD2      TYR  31  -9.564   7.376  -4.726
  260    HE1  TYR  31           HE1      TYR  31  -9.580  10.071  -8.897
  261    HE2  TYR  31           HE2      TYR  31  -7.882   6.957  -6.458
  262    HH   TYR  31           HH       TYR  31  -7.390   7.270  -8.709
  263    H    GLY  32           H        GLY  32 -12.033  12.212  -3.203
  264   1HA   GLY  32          1HA       GLY  32 -14.128  11.463  -1.202
  265   2HA   GLY  32          2HA       GLY  32 -12.966  12.756  -0.881
  266    H    GLY  33           H        GLY  33 -13.190  13.420  -3.978
  267   1HA   GLY  33          1HA       GLY  33 -14.569  14.591  -5.380
  268   2HA   GLY  33          2HA       GLY  33 -15.932  14.373  -4.274
  269    H    LYS  34           H        LYS  34 -15.268  15.503  -2.006
  270    HA   LYS  34           HA       LYS  34 -15.603  18.217  -2.051
  271   1HB   LYS  34          1HB       LYS  34 -14.081  16.455  -0.096
  272   2HB   LYS  34          2HB       LYS  34 -14.500  18.138   0.244
  273   1HG   LYS  34          1HG       LYS  34 -16.830  17.734   0.146
  274   2HG   LYS  34          2HG       LYS  34 -16.654  16.095  -0.481
  275   1HD   LYS  34          1HD       LYS  34 -15.325  16.739   2.153
  276   2HD   LYS  34          2HD       LYS  34 -17.086  16.641   2.121
  277   1HE   LYS  34          1HE       LYS  34 -16.066  14.488   2.746
  278   2HE   LYS  34          2HE       LYS  34 -17.068  14.376   1.290
  279   1HZ   LYS  34          1HZ       LYS  34 -14.140  14.600   1.281
  280   2HZ   LYS  34          2HZ       LYS  34 -14.992  13.197   1.108
  281   3HZ   LYS  34          3HZ       LYS  34 -15.119  14.371  -0.030
  282    H    GLU  35           H        GLU  35 -12.471  16.486  -2.086
  283    HA   GLU  35           HA       GLU  35 -11.121  18.880  -3.167
  284   1HB   GLU  35          1HB       GLU  35 -10.794  18.851  -0.694
  285   2HB   GLU  35          2HB       GLU  35 -10.105  17.225  -0.807
  286   1HG   GLU  35          1HG       GLU  35  -8.189  18.079  -2.057
  287   2HG   GLU  35          2HG       GLU  35  -8.958  19.672  -2.223
  288    H    ALA  36           H        ALA  36  -9.012  18.224  -4.119
  289    HA   ALA  36           HA       ALA  36  -9.176  16.086  -5.910
  290   1HB   ALA  36          1HB       ALA  36  -7.675  18.015  -6.194
  291   2HB   ALA  36          2HB       ALA  36  -6.726  17.516  -4.776
  292   3HB   ALA  36          3HB       ALA  36  -6.727  16.516  -6.241
  293    HA   PRO  37           HA       PRO  37  -8.323  12.578  -3.395
  294   1HB   PRO  37          1HB       PRO  37  -7.143  10.813  -5.125
  295   2HB   PRO  37          2HB       PRO  37  -8.847  11.315  -5.260
  296   1HG   PRO  37          1HG       PRO  37  -6.476  12.477  -6.742
  297   2HG   PRO  37          2HG       PRO  37  -8.008  11.876  -7.443
  298   1HD   PRO  37          1HD       PRO  37  -7.666  14.500  -6.942
  299   2HD   PRO  37          2HD       PRO  37  -9.230  13.727  -6.552
  300    H    LEU  38           H        LEU  38  -6.661  11.496  -2.212
  301    HA   LEU  38           HA       LEU  38  -3.920  12.614  -2.507
  302   1HB   LEU  38          1HB       LEU  38  -3.812  12.855  -0.052
  303   2HB   LEU  38          2HB       LEU  38  -4.784  14.036  -0.909
  304    HG   LEU  38           HG       LEU  38  -5.624  13.324   1.302
  305   1HD1  LEU  38          1HD1      LEU  38  -7.096  14.392  -0.402
  306   2HD1  LEU  38          2HD1      LEU  38  -7.685  12.779  -0.861
  307   3HD1  LEU  38          3HD1      LEU  38  -7.938  13.375   0.779
  308   1HD2  LEU  38          1HD2      LEU  38  -5.136  10.876   1.112
  309   2HD2  LEU  38          2HD2      LEU  38  -6.779  11.258   1.662
  310   3HD2  LEU  38          3HD2      LEU  38  -6.517  10.751  -0.011
  311    H    ALA  39           H        ALA  39  -2.233  11.449  -1.554
  312    HA   ALA  39           HA       ALA  39  -2.722   8.573  -1.986
  313   1HB   ALA  39          1HB       ALA  39  -1.214   9.778  -3.510
  314   2HB   ALA  39          2HB       ALA  39  -0.156  10.184  -2.137
  315   3HB   ALA  39          3HB       ALA  39  -0.396   8.485  -2.608
  316    H    ILE  40           H        ILE  40  -1.680   6.967  -0.818
  317    HA   ILE  40           HA       ILE  40  -0.505   7.603   1.818
  318    HB   ILE  40           HB       ILE  40  -1.925   5.813   2.820
  319   1HG1  ILE  40          1HG1      ILE  40  -3.659   6.034   0.319
  320   2HG1  ILE  40          2HG1      ILE  40  -2.530   4.702   0.621
  321   1HG2  ILE  40          1HG2      ILE  40  -2.449   8.253   3.044
  322   2HG2  ILE  40          2HG2      ILE  40  -3.592   8.101   1.692
  323   3HG2  ILE  40          3HG2      ILE  40  -3.860   7.207   3.196
  324   1HD1  ILE  40          1HD1      ILE  40  -3.742   4.171   2.729
  325   2HD1  ILE  40          2HD1      ILE  40  -4.935   5.425   2.315
  326   3HD1  ILE  40          3HD1      ILE  40  -4.739   4.015   1.268
  327    H    GLU  41           H        GLU  41   0.550   5.760   2.757
  328    HA   GLU  41           HA       GLU  41   1.646   3.769   0.818
  329   1HB   GLU  41          1HB       GLU  41   2.751   5.195   3.263
  330   2HB   GLU  41          2HB       GLU  41   3.420   3.638   2.771
  331   1HG   GLU  41          1HG       GLU  41   3.137   5.781   0.679
  332   2HG   GLU  41          2HG       GLU  41   4.452   5.901   1.870
  333    H    LEU  42           H        LEU  42   1.435   1.648   1.314
  334    HA   LEU  42           HA       LEU  42   0.923   0.659   3.932
  335   1HB   LEU  42          1HB       LEU  42  -1.332  -0.422   3.265
  336   2HB   LEU  42          2HB       LEU  42  -1.278   1.215   3.886
  337    HG   LEU  42           HG       LEU  42  -1.558   2.182   1.660
  338   1HD1  LEU  42          1HD1      LEU  42  -1.627  -0.709   0.713
  339   2HD1  LEU  42          2HD1      LEU  42  -2.197   0.670  -0.246
  340   3HD1  LEU  42          3HD1      LEU  42  -0.497   0.559   0.200
  341   1HD2  LEU  42          1HD2      LEU  42  -3.526   1.621   3.030
  342   2HD2  LEU  42          2HD2      LEU  42  -3.864   1.487   1.297
  343   3HD2  LEU  42          3HD2      LEU  42  -3.609   0.022   2.263
  344    H    ASP  43           H        ASP  43   0.835  -1.670   4.014
  345    HA   ASP  43           HA       ASP  43   2.939  -2.550   2.270
  346   1HB   ASP  43          1HB       ASP  43   1.597  -3.900   4.631
  347   2HB   ASP  43          2HB       ASP  43   3.072  -4.458   3.824
  348    H    HIS  44           H        HIS  44   3.064  -4.297   0.926
  349    HA   HIS  44           HA       HIS  44   0.564  -5.299  -0.256
  350   1HB   HIS  44          1HB       HIS  44   2.571  -4.493  -1.566
  351   2HB   HIS  44          2HB       HIS  44   3.450  -5.898  -0.996
  352    HD1  HIS  44           HD1      HIS  44   1.553  -8.242  -1.526
  353    HD2  HIS  44           HD2      HIS  44   1.971  -4.900  -4.047
  354    HE1  HIS  44           HE1      HIS  44   0.792  -8.979  -3.850
  355    H    ASP  45           H        ASP  45   0.297  -6.180   2.142
  356    HA   ASP  45           HA       ASP  45   0.621  -9.057   1.991
  357   1HB   ASP  45          1HB       ASP  45   2.844  -8.565   2.849
  358   2HB   ASP  45          2HB       ASP  45   2.188  -7.509   4.102
  359    H    LYS  46           H        LYS  46   0.298  -6.700   4.696
  360    HA   LYS  46           HA       LYS  46  -1.921  -7.976   5.912
  361   1HB   LYS  46          1HB       LYS  46  -0.601  -5.282   6.143
  362   2HB   LYS  46          2HB       LYS  46  -2.275  -5.411   6.687
  363   1HG   LYS  46          1HG       LYS  46  -0.963  -5.822   8.584
  364   2HG   LYS  46          2HG       LYS  46  -1.706  -7.346   8.117
  365   1HD   LYS  46          1HD       LYS  46   0.857  -7.262   6.805
  366   2HD   LYS  46          2HD       LYS  46   1.104  -6.603   8.416
  367   1HE   LYS  46          1HE       LYS  46   1.489  -8.936   8.607
  368   2HE   LYS  46          2HE       LYS  46  -0.095  -8.660   9.350
  369   1HZ   LYS  46          1HZ       LYS  46  -1.064  -9.404   7.227
  370   2HZ   LYS  46          2HZ       LYS  46   0.455  -9.660   6.641
  371   3HZ   LYS  46          3HZ       LYS  46  -0.100 -10.558   7.902
  372    H    VAL  47           H        VAL  47  -1.799  -5.301   3.529
  373    HA   VAL  47           HA       VAL  47  -4.621  -4.945   3.401
  374    HB   VAL  47           HB       VAL  47  -2.546  -4.366   1.245
  375   1HG1  VAL  47          1HG1      VAL  47  -5.318  -3.193   1.796
  376   2HG1  VAL  47          2HG1      VAL  47  -4.193  -2.648   0.537
  377   3HG1  VAL  47          3HG1      VAL  47  -4.905  -4.264   0.446
  378   1HG2  VAL  47          1HG2      VAL  47  -3.586  -2.657   3.550
  379   2HG2  VAL  47          2HG2      VAL  47  -1.924  -3.249   3.382
  380   3HG2  VAL  47          3HG2      VAL  47  -2.560  -2.087   2.220
  381    H    MET  48           H        MET  48  -2.354  -6.902   1.392
  382    HA   MET  48           HA       MET  48  -4.163  -8.011  -0.398
  383   1HB   MET  48          1HB       MET  48  -1.479  -8.709   0.654
  384   2HB   MET  48          2HB       MET  48  -2.397 -10.116   0.151
  385   1HG   MET  48          1HG       MET  48  -1.743  -7.692  -1.550
  386   2HG   MET  48          2HG       MET  48  -1.023  -9.298  -1.647
  387   1HE   MET  48          1HE       MET  48  -2.558 -11.513  -2.168
  388   2HE   MET  48          2HE       MET  48  -4.024 -11.010  -1.301
  389   3HE   MET  48          3HE       MET  48  -4.118 -11.419  -3.023
  390    H    ASN  49           H        ASN  49  -3.401  -9.213   2.914
  391    HA   ASN  49           HA       ASN  49  -5.003 -11.530   2.854
  392   1HB   ASN  49          1HB       ASN  49  -4.570  -9.671   5.233
  393   2HB   ASN  49          2HB       ASN  49  -5.088 -11.354   5.297
  394   1HD2  ASN  49          2HD2      ASN  49  -3.315 -12.603   3.489
  395   2HD2  ASN  49          1HD2      ASN  49  -1.692 -12.460   4.129
  396    H    MET  50           H        MET  50  -5.903  -8.143   3.539
  397    HA   MET  50           HA       MET  50  -8.616  -8.773   4.309
  398   1HB   MET  50          1HB       MET  50  -7.273  -6.133   3.630
  399   2HB   MET  50          2HB       MET  50  -8.884  -6.320   4.343
  400   1HG   MET  50          1HG       MET  50  -7.972  -7.363   6.326
  401   2HG   MET  50          2HG       MET  50  -6.354  -7.402   5.633
  402   1HE   MET  50          1HE       MET  50  -5.231  -6.383   7.687
  403   2HE   MET  50          2HE       MET  50  -5.777  -4.899   8.494
  404   3HE   MET  50          3HE       MET  50  -6.805  -6.350   8.519
  405    H    GLN  51           H        GLN  51  -7.051  -7.597   1.303
  406    HA   GLN  51           HA       GLN  51  -9.161  -6.703  -0.176
  407   1HB   GLN  51          1HB       GLN  51  -6.748  -8.341  -1.021
  408   2HB   GLN  51          2HB       GLN  51  -7.890  -7.744  -2.205
  409   1HG   GLN  51          1HG       GLN  51  -6.300  -6.019  -0.274
  410   2HG   GLN  51          2HG       GLN  51  -5.914  -6.303  -1.966
  411   1HE2  GLN  51          2HE2      GLN  51  -8.930  -6.124  -2.681
  412   2HE2  GLN  51          1HE2      GLN  51  -9.223  -4.401  -2.656
  413    H    ALA  52           H        ALA  52  -8.075 -10.123  -0.289
  414    HA   ALA  52           HA       ALA  52  -9.083 -12.021  -0.959
  415   1HB   ALA  52          1HB       ALA  52 -11.334 -10.805   0.692
  416   2HB   ALA  52          2HB       ALA  52 -11.204 -12.516   0.222
  417   3HB   ALA  52          3HB       ALA  52  -9.975 -11.780   1.267
  418    H    LYS  53           H        LYS  53 -12.266 -10.477  -1.087
  419    HA   LYS  53           HA       LYS  53 -12.216 -10.102  -3.951
  420   1HB   LYS  53          1HB       LYS  53 -12.695 -12.662  -3.398
  421   2HB   LYS  53          2HB       LYS  53 -14.285 -12.081  -2.960
  422   1HG   LYS  53          1HG       LYS  53 -14.614 -12.584  -5.211
  423   2HG   LYS  53          2HG       LYS  53 -14.176 -10.888  -5.352
  424   1HD   LYS  53          1HD       LYS  53 -12.938 -11.980  -7.025
  425   2HD   LYS  53          2HD       LYS  53 -11.777 -11.581  -5.758
  426   1HE   LYS  53          1HE       LYS  53 -11.385 -13.817  -6.688
  427   2HE   LYS  53          2HE       LYS  53 -11.799 -13.937  -4.976
  428   1HZ   LYS  53          1HZ       LYS  53 -13.642 -14.381  -7.227
  429   2HZ   LYS  53          2HZ       LYS  53 -12.921 -15.558  -6.328
  430   3HZ   LYS  53          3HZ       LYS  53 -14.016 -14.550  -5.630
  431    H    ALA  54           H        ALA  54 -15.305 -10.397  -3.782
  432    HA   ALA  54           HA       ALA  54 -15.974  -7.746  -3.614
  433   1HB   ALA  54          1HB       ALA  54 -17.366  -9.488  -4.624
  434   2HB   ALA  54          2HB       ALA  54 -17.729 -10.156  -3.017
  435   3HB   ALA  54          3HB       ALA  54 -18.298  -8.530  -3.455
  436    H    GLU  55           H        GLU  55 -16.057 -10.118  -0.987
  437    HA   GLU  55           HA       GLU  55 -17.245  -9.124   1.162
  438   1HB   GLU  55          1HB       GLU  55 -15.803 -11.133   1.009
  439   2HB   GLU  55          2HB       GLU  55 -14.360 -10.114   1.032
  440   1HG   GLU  55          1HG       GLU  55 -15.059  -9.293   3.312
  441   2HG   GLU  55          2HG       GLU  55 -16.405 -10.443   3.263
  442    H    PHE  56           H        PHE  56 -13.926  -8.073   0.304
  443    HA   PHE  56           HA       PHE  56 -13.633  -6.066   2.274
  444   1HB   PHE  56          1HB       PHE  56 -11.834  -7.175   1.092
  445   2HB   PHE  56          2HB       PHE  56 -12.329  -6.477  -0.441
  446    HD1  PHE  56           HD1      PHE  56 -10.706  -5.813   2.817
  447    HD2  PHE  56           HD2      PHE  56 -11.762  -4.166  -1.021
  448    HE1  PHE  56           HE1      PHE  56  -8.804  -4.220   2.966
  449    HE2  PHE  56           HE2      PHE  56  -9.955  -2.485  -0.798
  450    HZ   PHE  56           HZ       PHE  56  -8.421  -2.567   1.158
  451    H    TYR  57           H        TYR  57 -14.229  -5.681  -1.258
  452    HA   TYR  57           HA       TYR  57 -14.970  -2.869  -0.864
  453   1HB   TYR  57          1HB       TYR  57 -14.961  -2.715  -3.278
  454   2HB   TYR  57          2HB       TYR  57 -13.453  -3.325  -2.630
  455    HD1  TYR  57           HD1      TYR  57 -16.129  -3.944  -4.979
  456    HD2  TYR  57           HD2      TYR  57 -12.862  -5.778  -2.842
  457    HE1  TYR  57           HE1      TYR  57 -16.024  -5.738  -6.674
  458    HE2  TYR  57           HE2      TYR  57 -12.730  -7.541  -4.562
  459    HH   TYR  57           HH       TYR  57 -14.966  -7.657  -7.361
  460    H    SER  58           H        SER  58 -16.742  -4.145   0.526
  461    HA   SER  58           HA       SER  58 -19.241  -3.526  -0.787
  462   1HB   SER  58          1HB       SER  58 -18.935  -5.835  -1.639
  463   2HB   SER  58          2HB       SER  58 -18.748  -6.430   0.025
  464    HG   SER  58           HG       SER  58 -20.878  -6.655  -0.733
  465    H    GLU  59           H        GLU  59 -17.907  -5.487   1.951
  466    HA   GLU  59           HA       GLU  59 -19.970  -4.459   3.746
  467   1HB   GLU  59          1HB       GLU  59 -17.656  -6.372   4.229
  468   2HB   GLU  59          2HB       GLU  59 -19.017  -6.067   5.320
  469   1HG   GLU  59          1HG       GLU  59 -20.601  -6.887   3.595
  470   2HG   GLU  59          2HG       GLU  59 -19.250  -7.235   2.507
  471    H    VAL  60           H        VAL  60 -17.948  -2.564   2.695
  472    HA   VAL  60           HA       VAL  60 -16.660  -0.918   3.182
  473    HB   VAL  60           HB       VAL  60 -17.333   0.603   4.761
  474   1HG1  VAL  60          1HG1      VAL  60 -19.082  -0.091   3.094
  475   2HG1  VAL  60          2HG1      VAL  60 -19.820  -1.103   4.351
  476   3HG1  VAL  60          3HG1      VAL  60 -19.727   0.652   4.571
  477   1HG2  VAL  60          1HG2      VAL  60 -17.077  -0.688   6.849
  478   2HG2  VAL  60          2HG2      VAL  60 -18.596   0.207   6.781
  479   3HG2  VAL  60          3HG2      VAL  60 -18.606  -1.535   6.508
  480    H    LEU  61           H        LEU  61 -15.039   0.220   4.624
  481    HA   LEU  61           HA       LEU  61 -13.552  -1.491   6.451
  482   1HB   LEU  61          1HB       LEU  61 -11.488  -1.437   5.125
  483   2HB   LEU  61          2HB       LEU  61 -12.724  -2.462   4.415
  484    HG   LEU  61           HG       LEU  61 -12.761   0.340   3.444
  485   1HD1  LEU  61          1HD1      LEU  61 -10.410  -1.486   2.842
  486   2HD1  LEU  61          2HD1      LEU  61 -10.801   0.000   1.954
  487   3HD1  LEU  61          3HD1      LEU  61 -10.343   0.087   3.664
  488   1HD2  LEU  61          1HD2      LEU  61 -14.161  -1.446   2.427
  489   2HD2  LEU  61          2HD2      LEU  61 -13.010  -0.782   1.263
  490   3HD2  LEU  61          3HD2      LEU  61 -12.692  -2.356   2.015
  491    H    THR  62           H        THR  62 -11.411  -0.305   7.035
  492    HA   THR  62           HA       THR  62 -11.874   2.631   7.208
  493    HB   THR  62           HB       THR  62 -11.368   0.763   9.561
  494    HG1  THR  62           HG1      THR  62 -13.717   2.016   8.600
  495   1HG2  THR  62          1HG2      THR  62 -12.036   3.742   9.391
  496   2HG2  THR  62          2HG2      THR  62 -11.918   2.785  10.885
  497   3HG2  THR  62          3HG2      THR  62 -10.477   3.046   9.887
  498    H    ILE  63           H        ILE  63 -10.093   3.575   6.465
  499    HA   ILE  63           HA       ILE  63  -7.481   2.207   6.677
  500    HB   ILE  63           HB       ILE  63  -8.193   4.761   5.215
  501   1HG1  ILE  63          1HG1      ILE  63  -7.973   1.890   4.189
  502   2HG1  ILE  63          2HG1      ILE  63  -9.453   2.859   4.269
  503   1HG2  ILE  63          1HG2      ILE  63  -5.754   4.316   5.921
  504   2HG2  ILE  63          2HG2      ILE  63  -5.806   2.889   4.881
  505   3HG2  ILE  63          3HG2      ILE  63  -6.022   4.512   4.195
  506   1HD1  ILE  63          1HD1      ILE  63  -8.468   4.492   2.682
  507   2HD1  ILE  63          2HD1      ILE  63  -7.038   3.439   2.509
  508   3HD1  ILE  63          3HD1      ILE  63  -8.626   2.856   2.019
  509    H    VAL  64           H        VAL  64  -6.385   2.548   8.485
  510    HA   VAL  64           HA       VAL  64  -6.656   4.973  10.119
  511    HB   VAL  64           HB       VAL  64  -4.774   2.585  10.364
  512   1HG1  VAL  64          1HG1      VAL  64  -5.558   4.777  12.340
  513   2HG1  VAL  64          2HG1      VAL  64  -4.564   3.354  12.718
  514   3HG1  VAL  64          3HG1      VAL  64  -3.961   4.570  11.588
  515   1HG2  VAL  64          1HG2      VAL  64  -7.447   3.116  11.707
  516   2HG2  VAL  64          2HG2      VAL  64  -7.093   1.815  10.550
  517   3HG2  VAL  64          3HG2      VAL  64  -6.314   1.821  12.138
  518    H    VAL  65           H        VAL  65  -5.999   6.553   8.529
  519    HA   VAL  65           HA       VAL  65  -3.258   6.417   7.426
  520    HB   VAL  65           HB       VAL  65  -5.340   8.637   7.252
  521   1HG1  VAL  65          1HG1      VAL  65  -2.755   8.110   5.701
  522   2HG1  VAL  65          2HG1      VAL  65  -3.923   9.403   5.358
  523   3HG1  VAL  65          3HG1      VAL  65  -3.004   9.424   6.866
  524   1HG2  VAL  65          1HG2      VAL  65  -4.642   6.366   5.350
  525   2HG2  VAL  65          2HG2      VAL  65  -6.214   6.666   6.136
  526   3HG2  VAL  65          3HG2      VAL  65  -5.611   7.782   4.906
  527    H    ASP  66           H        ASP  66  -2.124   6.278   9.414
  528    HA   ASP  66           HA       ASP  66  -1.156   6.943  11.333
  529   1HB   ASP  66          1HB       ASP  66  -0.007   8.412   9.752
  530   2HB   ASP  66          2HB       ASP  66  -1.255   9.654   9.943
  531    H    GLY  67           H        GLY  67  -3.236   6.339  12.360
  532   1HA   GLY  67          1HA       GLY  67  -4.524   6.741  14.231
  533   2HA   GLY  67          2HA       GLY  67  -4.168   8.469  14.148
  534    H    LYS  68           H        LYS  68  -5.032   9.064  11.512
  535    HA   LYS  68           HA       LYS  68  -7.786   9.496  12.074
  536   1HB   LYS  68          1HB       LYS  68  -6.220   9.939   9.505
  537   2HB   LYS  68          2HB       LYS  68  -7.855  10.528   9.848
  538   1HG   LYS  68          1HG       LYS  68  -6.997  11.826  11.785
  539   2HG   LYS  68          2HG       LYS  68  -5.363  11.221  11.472
  540   1HD   LYS  68          1HD       LYS  68  -5.525  13.438  10.605
  541   2HD   LYS  68          2HD       LYS  68  -5.364  12.312   9.248
  542   1HE   LYS  68          1HE       LYS  68  -7.764  12.509   8.752
  543   2HE   LYS  68          2HE       LYS  68  -8.022  13.471  10.223
  544   1HZ   LYS  68          1HZ       LYS  68  -6.382  14.265   7.921
  545   2HZ   LYS  68          2HZ       LYS  68  -7.892  14.824   8.275
  546   3HZ   LYS  68          3HZ       LYS  68  -6.631  15.161   9.282
  547    H    GLU  69           H        GLU  69  -9.217   7.877  12.086
  548    HA   GLU  69           HA       GLU  69  -9.173   5.593  10.305
  549   1HB   GLU  69          1HB       GLU  69 -11.200   6.655  12.323
  550   2HB   GLU  69          2HB       GLU  69 -11.378   5.141  11.424
  551   1HG   GLU  69          1HG       GLU  69  -9.232   4.328  12.384
  552   2HG   GLU  69          2HG       GLU  69  -9.123   5.798  13.365
  553    H    ILE  70           H        ILE  70  -9.155   6.705   8.224
  554    HA   ILE  70           HA       ILE  70 -11.563   8.165   7.409
  555    HB   ILE  70           HB       ILE  70  -9.258   7.110   5.733
  556   1HG1  ILE  70          1HG1      ILE  70  -9.774   9.849   6.992
  557   2HG1  ILE  70          2HG1      ILE  70  -8.465   8.728   7.395
  558   1HG2  ILE  70          1HG2      ILE  70 -11.388   7.517   4.472
  559   2HG2  ILE  70          2HG2      ILE  70 -11.434   9.168   5.121
  560   3HG2  ILE  70          3HG2      ILE  70 -10.131   8.659   4.026
  561   1HD1  ILE  70          1HD1      ILE  70  -7.631   8.943   5.024
  562   2HD1  ILE  70          2HD1      ILE  70  -8.786  10.279   4.811
  563   3HD1  ILE  70          3HD1      ILE  70  -7.509  10.403   6.028
  564    H    LYS  71           H        LYS  71 -13.384   6.959   7.404
  565    HA   LYS  71           HA       LYS  71 -13.496   4.142   6.774
  566   1HB   LYS  71          1HB       LYS  71 -15.669   6.255   6.937
  567   2HB   LYS  71          2HB       LYS  71 -15.932   4.503   6.815
  568   1HG   LYS  71          1HG       LYS  71 -14.621   4.202   8.939
  569   2HG   LYS  71          2HG       LYS  71 -14.562   5.960   9.124
  570   1HD   LYS  71          1HD       LYS  71 -17.088   4.250   8.992
  571   2HD   LYS  71          2HD       LYS  71 -16.352   4.908  10.462
  572   1HE   LYS  71          1HE       LYS  71 -16.699   7.228   9.568
  573   2HE   LYS  71          2HE       LYS  71 -17.553   6.535   8.172
  574   1HZ   LYS  71          1HZ       LYS  71 -18.357   6.243  10.975
  575   2HZ   LYS  71          2HZ       LYS  71 -19.056   7.233   9.859
  576   3HZ   LYS  71          3HZ       LYS  71 -19.140   5.598   9.675
  577    H    VAL  72           H        VAL  72 -13.644   3.205   4.792
  578    HA   VAL  72           HA       VAL  72 -14.606   4.792   2.484
  579    HB   VAL  72           HB       VAL  72 -12.852   4.063   1.047
  580   1HG1  VAL  72          1HG1      VAL  72 -12.323   6.087   2.425
  581   2HG1  VAL  72          2HG1      VAL  72 -11.460   5.036   3.569
  582   3HG1  VAL  72          3HG1      VAL  72 -10.897   5.187   1.901
  583   1HG2  VAL  72          1HG2      VAL  72 -11.768   2.462   3.384
  584   2HG2  VAL  72          2HG2      VAL  72 -12.395   1.853   1.823
  585   3HG2  VAL  72          3HG2      VAL  72 -10.894   2.771   1.872
  586    H    LYS  73           H        LYS  73 -15.290   3.472   0.696
  587    HA   LYS  73           HA       LYS  73 -16.402   0.830   1.552
  588   1HB   LYS  73          1HB       LYS  73 -17.223   2.719  -0.689
  589   2HB   LYS  73          2HB       LYS  73 -17.897   1.109  -0.368
  590   1HG   LYS  73          1HG       LYS  73 -18.540   1.886   1.943
  591   2HG   LYS  73          2HG       LYS  73 -17.934   3.491   1.525
  592   1HD   LYS  73          1HD       LYS  73 -20.321   3.490   1.304
  593   2HD   LYS  73          2HD       LYS  73 -19.611   3.646  -0.313
  594   1HE   LYS  73          1HE       LYS  73 -20.078   1.272  -0.781
  595   2HE   LYS  73          2HE       LYS  73 -20.605   1.014   0.895
  596   1HZ   LYS  73          1HZ       LYS  73 -21.907   2.766  -1.068
  597   2HZ   LYS  73          2HZ       LYS  73 -22.426   1.271  -0.607
  598   3HZ   LYS  73          3HZ       LYS  73 -22.413   2.509   0.480
  599    H    ALA  74           H        ALA  74 -14.582   2.519  -0.985
  600    HA   ALA  74           HA       ALA  74 -13.084   1.862  -2.491
  601   1HB   ALA  74          1HB       ALA  74 -12.280   0.155  -0.781
  602   2HB   ALA  74          2HB       ALA  74 -13.279  -1.045  -1.619
  603   3HB   ALA  74          3HB       ALA  74 -11.968  -0.233  -2.482
  604    H    GLN  75           H        GLN  75 -13.123   1.196  -4.651
  605    HA   GLN  75           HA       GLN  75 -15.456  -0.376  -5.607
  606   1HB   GLN  75          1HB       GLN  75 -14.653   2.359  -6.697
  607   2HB   GLN  75          2HB       GLN  75 -15.830   1.241  -7.416
  608   1HG   GLN  75          1HG       GLN  75 -17.115   1.352  -5.220
  609   2HG   GLN  75          2HG       GLN  75 -16.038   2.672  -4.733
  610   1HE2  GLN  75          2HE2      GLN  75 -15.764   4.200  -7.023
  611   2HE2  GLN  75          1HE2      GLN  75 -17.330   4.808  -7.515
  612    H    ASP  76           H        ASP  76 -12.807   1.511  -7.166
  613    HA   ASP  76           HA       ASP  76 -12.099  -0.838  -8.762
  614   1HB   ASP  76          1HB       ASP  76 -12.221   1.335  -9.826
  615   2HB   ASP  76          2HB       ASP  76 -11.001   1.984  -8.726
  616    H    VAL  77           H        VAL  77 -11.405  -2.240  -7.186
  617    HA   VAL  77           HA       VAL  77  -8.788  -1.721  -5.862
  618    HB   VAL  77           HB       VAL  77  -9.159  -4.045  -4.958
  619   1HG1  VAL  77          1HG1      VAL  77 -11.078  -1.795  -4.237
  620   2HG1  VAL  77          2HG1      VAL  77 -10.835  -3.237  -3.239
  621   3HG1  VAL  77          3HG1      VAL  77  -9.481  -2.141  -3.532
  622   1HG2  VAL  77          1HG2      VAL  77 -11.020  -4.791  -6.542
  623   2HG2  VAL  77          2HG2      VAL  77 -11.335  -4.977  -4.827
  624   3HG2  VAL  77          3HG2      VAL  77 -12.083  -3.637  -5.715
  625    H    GLN  78           H        GLN  78  -7.135  -1.875  -7.324
  626    HA   GLN  78           HA       GLN  78  -7.359  -3.755  -9.568
  627   1HB   GLN  78          1HB       GLN  78  -6.427  -1.367  -9.679
  628   2HB   GLN  78          2HB       GLN  78  -4.993  -1.989  -8.876
  629   1HG   GLN  78          1HG       GLN  78  -4.624  -1.978 -11.268
  630   2HG   GLN  78          2HG       GLN  78  -4.711  -3.659 -10.726
  631   1HE2  GLN  78          2HE2      GLN  78  -7.060  -1.081 -11.769
  632   2HE2  GLN  78          1HE2      GLN  78  -7.941  -2.116 -12.866
  633    H    ARG  79           H        ARG  79  -7.657  -5.366  -7.739
  634    HA   ARG  79           HA       ARG  79  -5.094  -6.484  -6.738
  635   1HB   ARG  79          1HB       ARG  79  -6.380  -7.649  -5.084
  636   2HB   ARG  79          2HB       ARG  79  -6.777  -5.932  -5.064
  637   1HG   ARG  79          1HG       ARG  79  -8.763  -7.045  -4.672
  638   2HG   ARG  79          2HG       ARG  79  -8.898  -6.402  -6.302
  639   1HD   ARG  79          1HD       ARG  79  -7.878  -9.226  -6.053
  640   2HD   ARG  79          2HD       ARG  79  -9.519  -8.978  -5.495
  641    HE   ARG  79           HE       ARG  79  -8.517  -8.753  -8.252
  642   1HH1  ARG  79          1HH2      ARG  79 -11.183  -7.928  -6.069
  643   2HH1  ARG  79          2HH2      ARG  79 -12.375  -7.814  -7.333
  644   1HH2  ARG  79          1HH1      ARG  79 -10.053  -8.558  -9.921
  645   2HH2  ARG  79          2HH1      ARG  79 -11.705  -8.126  -9.562
  646    H    HIS  80           H        HIS  80  -4.947  -8.892  -6.743
  647    HA   HIS  80           HA       HIS  80  -6.323 -10.130  -9.074
  648   1HB   HIS  80          1HB       HIS  80  -3.943  -9.297  -9.491
  649   2HB   HIS  80          2HB       HIS  80  -3.421 -10.569  -8.381
  650    HD1  HIS  80           HD1      HIS  80  -4.758 -13.101  -9.287
  651    HD2  HIS  80           HD2      HIS  80  -3.706 -10.019 -11.947
  652    HE1  HIS  80           HE1      HIS  80  -4.640 -14.150 -11.611
  653    HA   PRO  81           HA       PRO  81  -6.807 -13.134  -5.671
  654   1HB   PRO  81          1HB       PRO  81  -8.646 -14.785  -6.774
  655   2HB   PRO  81          2HB       PRO  81  -9.054 -13.101  -6.331
  656   1HG   PRO  81          1HG       PRO  81  -8.249 -14.138  -9.066
  657   2HG   PRO  81          2HG       PRO  81  -9.683 -13.153  -8.658
  658   1HD   PRO  81          1HD       PRO  81  -7.350 -12.072  -9.590
  659   2HD   PRO  81          2HD       PRO  81  -8.368 -11.212  -8.394
  660    H    TYR  82           H        TYR  82  -6.567 -15.550  -5.484
  661    HA   TYR  82           HA       TYR  82  -5.510 -17.487  -5.742
  662   1HB   TYR  82          1HB       TYR  82  -4.893 -16.922  -8.657
  663   2HB   TYR  82          2HB       TYR  82  -5.053 -18.462  -7.840
  664    HD1  TYR  82           HD1      TYR  82  -6.650 -16.300 -10.064
  665    HD2  TYR  82           HD2      TYR  82  -7.498 -18.746  -6.612
  666    HE1  TYR  82           HE1      TYR  82  -9.040 -16.363 -10.694
  667    HE2  TYR  82           HE2      TYR  82  -9.891 -18.797  -7.244
  668    HH   TYR  82           HH       TYR  82 -11.480 -18.157  -8.786
  669    H    LYS  83           H        LYS  83  -3.601 -15.403  -7.957
  670    HA   LYS  83           HA       LYS  83  -1.151 -15.985  -6.417
  671   1HB   LYS  83          1HB       LYS  83   0.003 -14.731  -8.201
  672   2HB   LYS  83          2HB       LYS  83  -0.825 -16.201  -8.732
  673   1HG   LYS  83          1HG       LYS  83  -2.585 -14.954  -9.792
  674   2HG   LYS  83          2HG       LYS  83  -2.073 -13.438  -9.032
  675   1HD   LYS  83          1HD       LYS  83  -1.417 -13.453 -11.349
  676   2HD   LYS  83          2HD       LYS  83   0.006 -13.419 -10.296
  677   1HE   LYS  83          1HE       LYS  83   0.382 -15.831 -10.681
  678   2HE   LYS  83          2HE       LYS  83  -1.108 -15.927 -11.643
  679   1HZ   LYS  83          1HZ       LYS  83   1.266 -14.327 -12.297
  680   2HZ   LYS  83          2HZ       LYS  83   0.843 -15.757 -12.996
  681   3HZ   LYS  83          3HZ       LYS  83  -0.107 -14.426 -13.205
  682    HA   PRO  84           HA       PRO  84  -1.886 -12.112  -4.317
  683   1HB   PRO  84          1HB       PRO  84   0.407 -11.817  -2.885
  684   2HB   PRO  84          2HB       PRO  84  -0.754 -13.137  -2.571
  685   1HG   PRO  84          1HG       PRO  84   1.777 -13.293  -4.229
  686   2HG   PRO  84          2HG       PRO  84   1.245 -14.392  -2.925
  687   1HD   PRO  84          1HD       PRO  84   0.793 -14.940  -5.570
  688   2HD   PRO  84          2HD       PRO  84  -0.390 -15.383  -4.299
  689    H    LYS  85           H        LYS  85  -2.064 -10.636  -6.015
  690    HA   LYS  85           HA       LYS  85   0.268  -8.854  -6.226
  691   1HB   LYS  85          1HB       LYS  85  -1.325  -9.865  -8.609
  692   2HB   LYS  85          2HB       LYS  85  -0.456  -8.334  -8.631
  693   1HG   LYS  85          1HG       LYS  85   0.825 -11.060  -8.173
  694   2HG   LYS  85          2HG       LYS  85   0.798 -10.137  -9.680
  695   1HD   LYS  85          1HD       LYS  85   1.946  -8.220  -8.355
  696   2HD   LYS  85          2HD       LYS  85   2.214  -9.419  -7.082
  697   1HE   LYS  85          1HE       LYS  85   4.203  -9.361  -8.355
  698   2HE   LYS  85          2HE       LYS  85   3.389 -10.876  -8.780
  699   1HZ   LYS  85          1HZ       LYS  85   3.337  -8.377 -10.338
  700   2HZ   LYS  85          2HZ       LYS  85   4.239  -9.708 -10.691
  701   3HZ   LYS  85          3HZ       LYS  85   2.595  -9.783 -10.771
  702    H    LEU  86           H        LEU  86  -0.220  -6.786  -6.024
  703    HA   LEU  86           HA       LEU  86  -3.014  -5.865  -6.057
  704   1HB   LEU  86          1HB       LEU  86  -2.502  -6.752  -3.789
  705   2HB   LEU  86          2HB       LEU  86  -1.129  -5.656  -3.659
  706    HG   LEU  86           HG       LEU  86  -2.668  -3.712  -3.760
  707   1HD1  LEU  86          1HD1      LEU  86  -4.765  -5.890  -4.022
  708   2HD1  LEU  86          2HD1      LEU  86  -5.169  -4.246  -3.494
  709   3HD1  LEU  86          3HD1      LEU  86  -4.507  -4.502  -5.109
  710   1HD2  LEU  86          1HD2      LEU  86  -2.075  -4.794  -1.587
  711   2HD2  LEU  86          2HD2      LEU  86  -3.705  -4.095  -1.556
  712   3HD2  LEU  86          3HD2      LEU  86  -3.496  -5.846  -1.732
  713    H    GLN  87           H        GLN  87  -2.664  -4.466  -7.716
  714    HA   GLN  87           HA       GLN  87  -0.132  -3.103  -8.047
  715   1HB   GLN  87          1HB       GLN  87  -2.749  -2.725  -9.552
  716   2HB   GLN  87          2HB       GLN  87  -1.142  -2.220 -10.076
  717   1HG   GLN  87          1HG       GLN  87  -2.141  -5.086  -9.723
  718   2HG   GLN  87          2HG       GLN  87  -1.815  -4.255 -11.240
  719   1HE2  GLN  87          2HE2      GLN  87   0.529  -3.342 -11.428
  720   2HE2  GLN  87          1HE2      GLN  87   1.801  -4.416 -10.884
  721    H    HIS  88           H        HIS  88  -3.495  -2.055  -7.318
  722    HA   HIS  88           HA       HIS  88  -2.637   0.277  -5.830
  723   1HB   HIS  88          1HB       HIS  88  -2.276   0.941  -8.262
  724   2HB   HIS  88          2HB       HIS  88  -3.996   0.669  -8.536
  725    HD1  HIS  88           HD1      HIS  88  -5.554   2.745  -7.930
  726    HD2  HIS  88           HD2      HIS  88  -1.591   2.959  -6.499
  727    HE1  HIS  88           HE1      HIS  88  -5.236   5.079  -6.987
  728    H    ILE  89           H        ILE  89  -4.556   1.441  -4.977
  729    HA   ILE  89           HA       ILE  89  -7.171   0.312  -5.702
  730    HB   ILE  89           HB       ILE  89  -6.495   0.924  -2.799
  731   1HG1  ILE  89          1HG1      ILE  89  -7.198  -1.505  -2.451
  732   2HG1  ILE  89          2HG1      ILE  89  -6.855  -1.783  -4.160
  733   1HG2  ILE  89          1HG2      ILE  89  -9.008   0.059  -4.279
  734   2HG2  ILE  89          2HG2      ILE  89  -8.853  -0.053  -2.523
  735   3HG2  ILE  89          3HG2      ILE  89  -8.760   1.516  -3.309
  736   1HD1  ILE  89          1HD1      ILE  89  -4.802  -0.538  -2.271
  737   2HD1  ILE  89          2HD1      ILE  89  -5.067  -2.282  -2.315
  738   3HD1  ILE  89          3HD1      ILE  89  -4.515  -1.457  -3.771
  739    H    ASP  90           H        ASP  90  -8.532   1.869  -6.204
  740    HA   ASP  90           HA       ASP  90  -7.951   4.714  -5.497
  741   1HB   ASP  90          1HB       ASP  90  -9.715   3.446  -7.624
  742   2HB   ASP  90          2HB       ASP  90  -9.584   5.177  -7.313
  743    H    PHE  91           H        PHE  91  -8.601   4.268  -3.289
  744    HA   PHE  91           HA       PHE  91 -11.107   3.090  -2.596
  745   1HB   PHE  91          1HB       PHE  91  -9.316   4.982  -1.035
  746   2HB   PHE  91          2HB       PHE  91 -10.658   4.081  -0.357
  747    HD1  PHE  91           HD1      PHE  91 -10.579   1.535  -0.399
  748    HD2  PHE  91           HD2      PHE  91  -7.126   4.027  -1.032
  749    HE1  PHE  91           HE1      PHE  91  -9.102  -0.315   0.355
  750    HE2  PHE  91           HE2      PHE  91  -5.671   2.209  -0.186
  751    HZ   PHE  91           HZ       PHE  91  -6.646   0.029   0.479
  752    H    VAL  92           H        VAL  92 -12.987   4.145  -1.666
  753    HA   VAL  92           HA       VAL  92 -13.378   7.017  -2.378
  754    HB   VAL  92           HB       VAL  92 -15.343   4.749  -2.911
  755   1HG1  VAL  92          1HG1      VAL  92 -15.496   7.747  -3.467
  756   2HG1  VAL  92          2HG1      VAL  92 -16.676   6.536  -4.007
  757   3HG1  VAL  92          3HG1      VAL  92 -16.473   6.856  -2.282
  758   1HG2  VAL  92          1HG2      VAL  92 -13.673   6.445  -4.820
  759   2HG2  VAL  92          2HG2      VAL  92 -13.577   4.683  -4.598
  760   3HG2  VAL  92          3HG2      VAL  92 -15.021   5.406  -5.309
  761    H    ARG  93           H        ARG  93 -14.027   8.134  -0.625
  762    HA   ARG  93           HA       ARG  93 -14.297   6.967   1.898
  763   1HB   ARG  93          1HB       ARG  93 -15.212   9.680   0.889
  764   2HB   ARG  93          2HB       ARG  93 -15.313   9.163   2.580
  765   1HG   ARG  93          1HG       ARG  93 -12.815   8.666   2.498
  766   2HG   ARG  93          2HG       ARG  93 -12.783   9.512   0.935
  767   1HD   ARG  93          1HD       ARG  93 -13.775  11.519   2.056
  768   2HD   ARG  93          2HD       ARG  93 -13.777  10.625   3.594
  769    HE   ARG  93           HE       ARG  93 -11.154  10.717   2.370
  770   1HH1  ARG  93          1HH2      ARG  93 -13.426  12.557   4.395
  771   2HH1  ARG  93          2HH2      ARG  93 -12.180  13.543   5.115
  772   1HH2  ARG  93          1HH1      ARG  93  -9.531  12.027   3.329
  773   2HH2  ARG  93          2HH1      ARG  93  -9.961  13.238   4.508
  774    H    ALA  94           H        ALA  94 -15.945   6.503   3.285
  775    HA   ALA  94           HA       ALA  94 -18.491   5.659   2.116
  776   1HB   ALA  94          1HB       ALA  94 -17.284   4.266   3.781
  777   2HB   ALA  94          2HB       ALA  94 -17.433   5.570   4.975
  778   3HB   ALA  94          3HB       ALA  94 -18.889   4.750   4.368
  Start of MODEL    9
    1    H    MET   1           H        MET   1 -14.276  -0.337   8.137
    2    HA   MET   1           HA       MET   1 -14.829  -1.807  10.079
    3   1HB   MET   1          1HB       MET   1 -15.740  -3.534   7.769
    4   2HB   MET   1          2HB       MET   1 -15.145  -4.285   9.248
    5   1HG   MET   1          1HG       MET   1 -17.517  -4.160   9.273
    6   2HG   MET   1          2HG       MET   1 -16.842  -3.236  10.607
    7   1HE   MET   1          1HE       MET   1 -17.590  -0.853  11.183
    8   2HE   MET   1          2HE       MET   1 -16.494  -0.240   9.924
    9   3HE   MET   1          3HE       MET   1 -18.168   0.327   9.988
   10    H    PHE   2           H        PHE   2 -13.395  -3.343   7.132
   11    HA   PHE   2           HA       PHE   2 -11.269  -4.544   8.515
   12   1HB   PHE   2          1HB       PHE   2 -11.149  -3.604   5.642
   13   2HB   PHE   2          2HB       PHE   2 -10.190  -4.868   6.381
   14    HD1  PHE   2           HD1      PHE   2 -13.414  -4.023   4.858
   15    HD2  PHE   2           HD2      PHE   2 -11.216  -7.080   6.956
   16    HE1  PHE   2           HE1      PHE   2 -15.228  -5.638   4.398
   17    HE2  PHE   2           HE2      PHE   2 -12.996  -8.723   6.403
   18    HZ   PHE   2           HZ       PHE   2 -15.045  -7.983   5.207
   19    H    THR   3           H        THR   3  -9.392  -3.809   9.321
   20    HA   THR   3           HA       THR   3  -9.039  -0.917   9.446
   21    HB   THR   3           HB       THR   3  -7.611  -3.133  10.969
   22    HG1  THR   3           HG1      THR   3 -10.094  -1.859  11.428
   23   1HG2  THR   3          1HG2      THR   3  -6.654  -0.817  11.181
   24   2HG2  THR   3          2HG2      THR   3  -8.262  -0.244  11.695
   25   3HG2  THR   3          3HG2      THR   3  -7.369  -1.406  12.694
   26    H    ILE   4           H        ILE   4  -8.180  -0.558   7.272
   27    HA   ILE   4           HA       ILE   4  -5.681  -1.827   6.464
   28    HB   ILE   4           HB       ILE   4  -7.234   0.537   5.357
   29   1HG1  ILE   4          1HG1      ILE   4  -7.544  -0.942   3.396
   30   2HG1  ILE   4          2HG1      ILE   4  -6.765  -2.277   4.257
   31   1HG2  ILE   4          1HG2      ILE   4  -4.670  -0.755   4.341
   32   2HG2  ILE   4          2HG2      ILE   4  -5.673   0.363   3.398
   33   3HG2  ILE   4          3HG2      ILE   4  -4.869   0.932   4.852
   34   1HD1  ILE   4          1HD1      ILE   4  -9.281  -0.861   5.236
   35   2HD1  ILE   4          2HD1      ILE   4  -9.308  -2.277   4.181
   36   3HD1  ILE   4          3HD1      ILE   4  -8.617  -2.431   5.792
   37    H    ASN   5           H        ASN   5  -3.942  -1.430   7.741
   38    HA   ASN   5           HA       ASN   5  -3.386   1.092   9.037
   39   1HB   ASN   5          1HB       ASN   5  -2.414  -0.967   9.891
   40   2HB   ASN   5          2HB       ASN   5  -1.648  -1.306   8.331
   41   1HD2  ASN   5          2HD2      ASN   5  -1.828   1.462  10.683
   42   2HD2  ASN   5          1HD2      ASN   5  -0.116   1.821  10.616
   43    H    ALA   6           H        ALA   6  -2.644   2.922   8.069
   44    HA   ALA   6           HA       ALA   6  -1.039   2.771   5.586
   45   1HB   ALA   6          1HB       ALA   6  -3.415   2.931   4.876
   46   2HB   ALA   6          2HB       ALA   6  -3.600   4.390   5.878
   47   3HB   ALA   6          3HB       ALA   6  -2.506   4.399   4.479
   48    H    GLU   7           H        GLU   7  -0.414   5.057   4.957
   49    HA   GLU   7           HA       GLU   7  -0.037   6.959   7.142
   50   1HB   GLU   7          1HB       GLU   7   1.812   5.300   7.417
   51   2HB   GLU   7          2HB       GLU   7   2.271   5.519   5.723
   52   1HG   GLU   7          1HG       GLU   7   3.776   6.700   7.246
   53   2HG   GLU   7          2HG       GLU   7   2.955   7.850   6.195
   54    H    VAL   8           H        VAL   8   0.894   8.995   6.223
   55    HA   VAL   8           HA       VAL   8  -0.163   9.514   3.539
   56    HB   VAL   8           HB       VAL   8   0.456  11.842   3.983
   57   1HG1  VAL   8          1HG1      VAL   8  -1.742  10.939   4.651
   58   2HG1  VAL   8          2HG1      VAL   8  -1.092  10.553   6.261
   59   3HG1  VAL   8          3HG1      VAL   8  -1.197  12.239   5.724
   60   1HG2  VAL   8          1HG2      VAL   8   2.447  11.432   5.527
   61   2HG2  VAL   8          2HG2      VAL   8   1.266  12.611   6.111
   62   3HG2  VAL   8          3HG2      VAL   8   1.287  10.982   6.786
   63    H    ARG   9           H        ARG   9   1.642   7.655   3.109
   64    HA   ARG   9           HA       ARG   9   3.521   7.012   2.122
   65   1HB   ARG   9          1HB       ARG   9   2.308   8.160   0.338
   66   2HB   ARG   9          2HB       ARG   9   3.216   9.650   0.625
   67   1HG   ARG   9          1HG       ARG   9   5.215   8.741  -0.249
   68   2HG   ARG   9          2HG       ARG   9   4.736   7.077   0.109
   69   1HD   ARG   9          1HD       ARG   9   4.660   7.434  -2.283
   70   2HD   ARG   9          2HD       ARG   9   3.029   7.143  -1.649
   71    HE   ARG   9           HE       ARG   9   3.607   9.960  -1.742
   72   1HH1  ARG   9          1HH2      ARG   9   2.735   7.208  -3.803
   73   2HH1  ARG   9          2HH2      ARG   9   1.981   8.193  -5.031
   74   1HH2  ARG   9          1HH1      ARG   9   2.625  11.253  -3.364
   75   2HH2  ARG   9          2HH1      ARG   9   1.921  10.512  -4.779
   76    H    LYS  10           H        LYS  10   4.296   7.501   4.440
   77    HA   LYS  10           HA       LYS  10   7.014   8.502   4.101
   78   1HB   LYS  10          1HB       LYS  10   5.497  10.420   4.944
   79   2HB   LYS  10          2HB       LYS  10   5.415   9.570   6.475
   80   1HG   LYS  10          1HG       LYS  10   7.958  10.454   5.012
   81   2HG   LYS  10          2HG       LYS  10   7.154  11.420   6.234
   82   1HD   LYS  10          1HD       LYS  10   8.470   8.705   6.707
   83   2HD   LYS  10          2HD       LYS  10   9.163  10.269   7.088
   84   1HE   LYS  10          1HE       LYS  10   6.625   9.173   8.388
   85   2HE   LYS  10          2HE       LYS  10   8.247   9.173   9.084
   86   1HZ   LYS  10          1HZ       LYS  10   8.217  11.564   8.967
   87   2HZ   LYS  10          2HZ       LYS  10   6.692  11.545   8.336
   88   3HZ   LYS  10          3HZ       LYS  10   6.957  10.992   9.863
   89    H    GLU  11           H        GLU  11   6.710   6.034   4.004
   90    HA   GLU  11           HA       GLU  11   6.413   4.689   6.576
   91   1HB   GLU  11          1HB       GLU  11   7.028   2.679   5.338
   92   2HB   GLU  11          2HB       GLU  11   5.705   3.554   4.556
   93   1HG   GLU  11          1HG       GLU  11   7.252   4.452   2.857
   94   2HG   GLU  11          2HG       GLU  11   8.627   3.706   3.690
   95    H    GLN  12           H        GLN  12   8.060   3.774   7.803
   96    HA   GLN  12           HA       GLN  12  10.045   3.647   8.828
   97   1HB   GLN  12          1HB       GLN  12  10.541   3.017   6.096
   98   2HB   GLN  12          2HB       GLN  12  11.881   4.048   6.564
   99   1HG   GLN  12          1HG       GLN  12  10.922   1.514   7.975
  100   2HG   GLN  12          2HG       GLN  12  12.311   1.641   6.892
  101   1HE2  GLN  12          2HE2      GLN  12  11.526   1.437  10.112
  102   2HE2  GLN  12          1HE2      GLN  12  12.903   2.270  10.800
  103    H    GLY  13           H        GLY  13  12.519   4.925   8.578
  104   1HA   GLY  13          1HA       GLY  13  11.963   7.649   9.409
  105   2HA   GLY  13          2HA       GLY  13  13.542   6.878   9.180
  106    H    LYS  14           H        LYS  14  12.224   9.484   8.203
  107    HA   LYS  14           HA       LYS  14  12.569  10.918   6.561
  108   1HB   LYS  14          1HB       LYS  14  14.784   9.766   6.326
  109   2HB   LYS  14          2HB       LYS  14  14.099   8.815   4.997
  110   1HG   LYS  14          1HG       LYS  14  13.618  10.899   3.744
  111   2HG   LYS  14          2HG       LYS  14  14.209  11.855   5.112
  112   1HD   LYS  14          1HD       LYS  14  15.949  11.787   3.484
  113   2HD   LYS  14          2HD       LYS  14  16.463  10.800   4.861
  114   1HE   LYS  14          1HE       LYS  14  15.857   8.736   3.609
  115   2HE   LYS  14          2HE       LYS  14  15.253   9.727   2.265
  116   1HZ   LYS  14          1HZ       LYS  14  17.480  10.560   1.989
  117   2HZ   LYS  14          2HZ       LYS  14  18.025   9.629   3.235
  118   3HZ   LYS  14          3HZ       LYS  14  17.449   8.919   1.866
  119    H    GLY  15           H        GLY  15  12.013   7.776   4.871
  120   1HA   GLY  15          1HA       GLY  15   9.560   7.621   4.053
  121   2HA   GLY  15          2HA       GLY  15   9.958   9.080   3.138
  122    H    ALA  16           H        ALA  16   9.858   5.742   2.908
  123    HA   ALA  16           HA       ALA  16  12.172   5.265   1.253
  124   1HB   ALA  16          1HB       ALA  16  10.982   3.482   2.524
  125   2HB   ALA  16          2HB       ALA  16   9.577   3.696   1.452
  126   3HB   ALA  16          3HB       ALA  16  11.114   3.115   0.792
  127    H    SER  17           H        SER  17  12.284   5.055  -1.015
  128    HA   SER  17           HA       SER  17  10.033   5.447  -2.754
  129   1HB   SER  17          1HB       SER  17  10.437   7.821  -2.010
  130   2HB   SER  17          2HB       SER  17  12.095   7.699  -2.626
  131    HG   SER  17           HG       SER  17  10.581   8.636  -4.106
  132    H    ARG  18           H        ARG  18  10.896   5.684  -5.064
  133    HA   ARG  18           HA       ARG  18  11.884   4.590  -6.785
  134   1HB   ARG  18          1HB       ARG  18  14.366   5.494  -5.266
  135   2HB   ARG  18          2HB       ARG  18  14.336   4.942  -6.950
  136   1HG   ARG  18          1HG       ARG  18  12.739   6.745  -7.531
  137   2HG   ARG  18          2HG       ARG  18  12.842   7.369  -5.870
  138   1HD   ARG  18          1HD       ARG  18  15.245   7.764  -6.132
  139   2HD   ARG  18          2HD       ARG  18  15.215   7.031  -7.753
  140    HE   ARG  18           HE       ARG  18  13.322   9.141  -7.684
  141   1HH1  ARG  18          1HH2      ARG  18  16.840   8.675  -7.616
  142   2HH1  ARG  18          2HH2      ARG  18  17.185  10.188  -8.415
  143   1HH2  ARG  18          1HH1      ARG  18  13.786  11.121  -8.740
  144   2HH2  ARG  18          2HH1      ARG  18  15.439  11.586  -9.054
  145    H    ARG  19           H        ARG  19  10.919   2.726  -5.155
  146    HA   ARG  19           HA       ARG  19  12.477   0.423  -5.849
  147   1HB   ARG  19          1HB       ARG  19  13.738   1.064  -3.795
  148   2HB   ARG  19          2HB       ARG  19  12.232   1.049  -2.865
  149   1HG   ARG  19          1HG       ARG  19  11.961  -1.380  -3.377
  150   2HG   ARG  19          2HG       ARG  19  13.446  -1.329  -4.349
  151   1HD   ARG  19          1HD       ARG  19  14.731  -0.699  -2.321
  152   2HD   ARG  19          2HD       ARG  19  13.228  -0.732  -1.370
  153    HE   ARG  19           HE       ARG  19  13.582  -3.216  -2.748
  154   1HH1  ARG  19          1HH2      ARG  19  14.897  -1.405   0.006
  155   2HH1  ARG  19          2HH2      ARG  19  15.393  -2.837   0.872
  156   1HH2  ARG  19          1HH1      ARG  19  14.241  -5.086  -1.607
  157   2HH2  ARG  19          2HH1      ARG  19  15.017  -4.941  -0.052
  158    H    LEU  20           H        LEU  20  10.016   1.673  -3.565
  159    HA   LEU  20           HA       LEU  20   8.633  -0.681  -3.259
  160   1HB   LEU  20          1HB       LEU  20   6.860   0.648  -2.238
  161   2HB   LEU  20          2HB       LEU  20   8.479   1.107  -1.724
  162    HG   LEU  20           HG       LEU  20   8.230   3.005  -3.580
  163   1HD1  LEU  20          1HD1      LEU  20   5.328   2.341  -2.883
  164   2HD1  LEU  20          2HD1      LEU  20   5.871   3.839  -3.660
  165   3HD1  LEU  20          3HD1      LEU  20   6.031   2.301  -4.504
  166   1HD2  LEU  20          1HD2      LEU  20   6.792   3.054  -0.895
  167   2HD2  LEU  20          2HD2      LEU  20   8.517   3.381  -1.168
  168   3HD2  LEU  20          3HD2      LEU  20   7.296   4.479  -1.830
  169    H    ARG  21           H        ARG  21   8.294   1.536  -5.971
  170    HA   ARG  21           HA       ARG  21   5.701   0.525  -6.782
  171   1HB   ARG  21          1HB       ARG  21   6.637   2.823  -7.275
  172   2HB   ARG  21          2HB       ARG  21   7.723   2.062  -8.442
  173   1HG   ARG  21          1HG       ARG  21   5.528   1.045  -9.483
  174   2HG   ARG  21          2HG       ARG  21   4.672   2.171  -8.421
  175   1HD   ARG  21          1HD       ARG  21   4.883   3.196 -10.578
  176   2HD   ARG  21          2HD       ARG  21   5.992   4.053  -9.485
  177    HE   ARG  21           HE       ARG  21   7.418   1.935 -10.710
  178   1HH1  ARG  21          1HH2      ARG  21   5.876   4.982 -11.675
  179   2HH1  ARG  21          2HH2      ARG  21   6.912   5.217 -13.059
  180   1HH2  ARG  21          1HH1      ARG  21   8.770   2.249 -12.527
  181   2HH2  ARG  21          2HH1      ARG  21   8.570   3.653 -13.545
  182    H    ALA  22           H        ALA  22   6.457  -1.754  -6.476
  183    HA   ALA  22           HA       ALA  22   7.041  -3.057  -8.995
  184   1HB   ALA  22          1HB       ALA  22   9.119  -3.152  -6.755
  185   2HB   ALA  22          2HB       ALA  22   9.093  -4.210  -8.183
  186   3HB   ALA  22          3HB       ALA  22   9.347  -2.466  -8.375
  187    H    ALA  23           H        ALA  23   7.284  -3.572  -5.418
  188    HA   ALA  23           HA       ALA  23   5.009  -5.368  -5.406
  189   1HB   ALA  23          1HB       ALA  23   7.796  -6.547  -5.010
  190   2HB   ALA  23          2HB       ALA  23   6.265  -7.361  -4.619
  191   3HB   ALA  23          3HB       ALA  23   6.647  -6.948  -6.299
  192    H    ASN  24           H        ASN  24   8.034  -5.035  -3.459
  193    HA   ASN  24           HA       ASN  24   6.734  -5.265  -0.973
  194   1HB   ASN  24          1HB       ASN  24   9.118  -5.690  -1.299
  195   2HB   ASN  24          2HB       ASN  24   9.396  -3.992  -1.722
  196   1HD2  ASN  24          2HD2      ASN  24  10.973  -3.884   0.012
  197   2HD2  ASN  24          1HD2      ASN  24  10.445  -3.734   1.677
  198    H    LYS  25           H        LYS  25   5.154  -3.912  -0.354
  199    HA   LYS  25           HA       LYS  25   3.923  -2.121   0.149
  200   1HB   LYS  25          1HB       LYS  25   6.424  -0.409  -0.250
  201   2HB   LYS  25          2HB       LYS  25   4.896   0.155   0.391
  202   1HG   LYS  25          1HG       LYS  25   6.457  -2.119   1.703
  203   2HG   LYS  25          2HG       LYS  25   6.754  -0.419   2.055
  204   1HD   LYS  25          1HD       LYS  25   4.357  -0.116   2.675
  205   2HD   LYS  25          2HD       LYS  25   4.110  -1.852   2.398
  206   1HE   LYS  25          1HE       LYS  25   5.858  -2.330   4.143
  207   2HE   LYS  25          2HE       LYS  25   5.952  -0.586   4.462
  208   1HZ   LYS  25          1HZ       LYS  25   3.575  -0.694   4.990
  209   2HZ   LYS  25          2HZ       LYS  25   3.620  -2.339   4.804
  210   3HZ   LYS  25          3HZ       LYS  25   4.495  -1.624   5.995
  211    H    PHE  26           H        PHE  26   2.678  -0.399  -0.947
  212    HA   PHE  26           HA       PHE  26   3.418   0.224  -3.671
  213   1HB   PHE  26          1HB       PHE  26   1.659  -0.904  -4.826
  214   2HB   PHE  26          2HB       PHE  26   2.485  -2.120  -3.877
  215    HD1  PHE  26           HD1      PHE  26  -0.652  -0.455  -4.557
  216    HD2  PHE  26           HD2      PHE  26   1.407  -2.898  -1.663
  217    HE1  PHE  26           HE1      PHE  26  -2.785  -0.856  -3.382
  218    HE2  PHE  26           HE2      PHE  26  -0.756  -3.401  -0.559
  219    HZ   PHE  26           HZ       PHE  26  -2.860  -2.389  -1.418
  220    HA   PRO  27           HA       PRO  27   0.933   3.653  -2.481
  221   1HB   PRO  27          1HB       PRO  27   0.523   4.969  -4.836
  222   2HB   PRO  27          2HB       PRO  27   2.144   4.795  -4.105
  223   1HG   PRO  27          1HG       PRO  27   0.907   3.052  -6.257
  224   2HG   PRO  27          2HG       PRO  27   2.509   3.850  -6.286
  225   1HD   PRO  27          1HD       PRO  27   2.231   1.258  -5.529
  226   2HD   PRO  27          2HD       PRO  27   3.385   2.338  -4.688
  227    H    ALA  28           H        ALA  28  -1.191   4.433  -2.400
  228    HA   ALA  28           HA       ALA  28  -3.255   3.437  -4.235
  229   1HB   ALA  28          1HB       ALA  28  -3.414   3.050  -1.221
  230   2HB   ALA  28          2HB       ALA  28  -4.754   2.816  -2.355
  231   3HB   ALA  28          3HB       ALA  28  -3.323   1.763  -2.448
  232    H    ILE  29           H        ILE  29  -5.308   4.719  -3.837
  233    HA   ILE  29           HA       ILE  29  -4.680   7.475  -2.861
  234    HB   ILE  29           HB       ILE  29  -5.775   6.577  -5.536
  235   1HG1  ILE  29          1HG1      ILE  29  -3.421   8.377  -4.764
  236   2HG1  ILE  29          2HG1      ILE  29  -3.282   6.693  -5.268
  237   1HG2  ILE  29          1HG2      ILE  29  -7.171   8.476  -4.720
  238   2HG2  ILE  29          2HG2      ILE  29  -5.691   9.430  -4.498
  239   3HG2  ILE  29          3HG2      ILE  29  -6.196   8.883  -6.113
  240   1HD1  ILE  29          1HD1      ILE  29  -4.345   7.332  -7.475
  241   2HD1  ILE  29          2HD1      ILE  29  -4.154   9.035  -6.984
  242   3HD1  ILE  29          3HD1      ILE  29  -2.732   8.001  -7.156
  243    H    ILE  30           H        ILE  30  -6.317   8.610  -1.986
  244    HA   ILE  30           HA       ILE  30  -8.969   7.268  -1.648
  245    HB   ILE  30           HB       ILE  30  -7.664   9.364   0.118
  246   1HG1  ILE  30          1HG1      ILE  30  -8.081   6.377   0.576
  247   2HG1  ILE  30          2HG1      ILE  30  -6.534   7.225   0.408
  248   1HG2  ILE  30          1HG2      ILE  30 -10.166   9.489  -0.036
  249   2HG2  ILE  30          2HG2      ILE  30 -10.257   7.786   0.456
  250   3HG2  ILE  30          3HG2      ILE  30  -9.618   9.026   1.560
  251   1HD1  ILE  30          1HD1      ILE  30  -7.150   8.596   2.453
  252   2HD1  ILE  30          2HD1      ILE  30  -8.522   7.483   2.696
  253   3HD1  ILE  30          3HD1      ILE  30  -6.876   6.874   2.747
  254    H    TYR  31           H        TYR  31 -10.117   7.986  -3.339
  255    HA   TYR  31           HA       TYR  31 -10.147  10.797  -4.199
  256   1HB   TYR  31          1HB       TYR  31 -11.897   8.422  -4.930
  257   2HB   TYR  31          2HB       TYR  31 -11.938  10.003  -5.699
  258    HD1  TYR  31           HD1      TYR  31 -10.459  10.504  -7.521
  259    HD2  TYR  31           HD2      TYR  31  -9.781   6.978  -5.121
  260    HE1  TYR  31           HE1      TYR  31  -8.800   9.681  -9.169
  261    HE2  TYR  31           HE2      TYR  31  -8.027   6.261  -6.677
  262    HH   TYR  31           HH       TYR  31  -7.289   6.455  -8.855
  263    H    GLY  32           H        GLY  32 -12.401  11.874  -4.233
  264   1HA   GLY  32          1HA       GLY  32 -14.284  11.108  -2.143
  265   2HA   GLY  32          2HA       GLY  32 -13.246  12.479  -1.700
  266    H    GLY  33           H        GLY  33 -13.268  14.393  -3.114
  267   1HA   GLY  33          1HA       GLY  33 -15.119  14.822  -5.203
  268   2HA   GLY  33          2HA       GLY  33 -15.921  15.247  -3.677
  269    H    LYS  34           H        LYS  34 -15.136  17.025  -2.444
  270    HA   LYS  34           HA       LYS  34 -13.814  19.108  -3.911
  271   1HB   LYS  34          1HB       LYS  34 -15.489  19.542  -2.159
  272   2HB   LYS  34          2HB       LYS  34 -14.392  18.893  -0.925
  273   1HG   LYS  34          1HG       LYS  34 -12.744  20.659  -1.427
  274   2HG   LYS  34          2HG       LYS  34 -13.753  21.236  -2.771
  275   1HD   LYS  34          1HD       LYS  34 -15.538  21.861  -1.171
  276   2HD   LYS  34          2HD       LYS  34 -14.585  21.192   0.164
  277   1HE   LYS  34          1HE       LYS  34 -14.356  23.622   0.121
  278   2HE   LYS  34          2HE       LYS  34 -12.799  22.858  -0.240
  279   1HZ   LYS  34          1HZ       LYS  34 -14.659  23.971  -2.229
  280   2HZ   LYS  34          2HZ       LYS  34 -13.279  24.694  -1.693
  281   3HZ   LYS  34          3HZ       LYS  34 -13.190  23.295  -2.554
  282    H    GLU  35           H        GLU  35 -12.810  16.956  -1.206
  283    HA   GLU  35           HA       GLU  35 -10.103  17.834  -1.057
  284   1HB   GLU  35          1HB       GLU  35 -11.416  15.170  -0.371
  285   2HB   GLU  35          2HB       GLU  35  -9.737  15.582   0.010
  286   1HG   GLU  35          1HG       GLU  35 -10.461  17.482   1.381
  287   2HG   GLU  35          2HG       GLU  35 -12.158  17.152   0.997
  288    H    ALA  36           H        ALA  36  -8.476  17.530  -2.436
  289    HA   ALA  36           HA       ALA  36  -8.716  16.266  -4.945
  290   1HB   ALA  36          1HB       ALA  36  -6.252  17.054  -3.321
  291   2HB   ALA  36          2HB       ALA  36  -6.237  16.669  -5.052
  292   3HB   ALA  36          3HB       ALA  36  -7.134  18.084  -4.471
  293    HA   PRO  37           HA       PRO  37  -7.939  12.037  -3.925
  294   1HB   PRO  37          1HB       PRO  37  -6.788  11.024  -6.191
  295   2HB   PRO  37          2HB       PRO  37  -8.469  11.603  -6.106
  296   1HG   PRO  37          1HG       PRO  37  -6.042  13.143  -7.059
  297   2HG   PRO  37          2HG       PRO  37  -7.595  12.911  -7.916
  298   1HD   PRO  37          1HD       PRO  37  -7.135  15.139  -6.463
  299   2HD   PRO  37          2HD       PRO  37  -8.734  14.351  -6.406
  300    H    LEU  38           H        LEU  38  -6.476  12.699  -2.183
  301    HA   LEU  38           HA       LEU  38  -3.655  12.833  -2.607
  302   1HB   LEU  38          1HB       LEU  38  -3.385  13.031  -0.286
  303   2HB   LEU  38          2HB       LEU  38  -4.762  13.992  -0.791
  304    HG   LEU  38           HG       LEU  38  -5.166  13.079   1.337
  305   1HD1  LEU  38          1HD1      LEU  38  -7.126  13.208  -0.156
  306   2HD1  LEU  38          2HD1      LEU  38  -6.896  11.492  -0.571
  307   3HD1  LEU  38          3HD1      LEU  38  -7.288  11.959   1.090
  308   1HD2  LEU  38          1HD2      LEU  38  -3.637  11.081   1.172
  309   2HD2  LEU  38          2HD2      LEU  38  -5.169  10.841   2.028
  310   3HD2  LEU  38          3HD2      LEU  38  -4.980  10.207   0.396
  311    H    ALA  39           H        ALA  39  -2.020  11.442  -1.720
  312    HA   ALA  39           HA       ALA  39  -2.631   8.612  -2.364
  313   1HB   ALA  39          1HB       ALA  39  -1.061   9.789  -3.841
  314   2HB   ALA  39          2HB       ALA  39  -0.029  10.167  -2.442
  315   3HB   ALA  39          3HB       ALA  39  -0.261   8.478  -2.951
  316    H    ILE  40           H        ILE  40  -1.686   6.941  -1.210
  317    HA   ILE  40           HA       ILE  40  -0.339   7.409   1.363
  318    HB   ILE  40           HB       ILE  40  -1.890   5.764   2.448
  319   1HG1  ILE  40          1HG1      ILE  40  -3.716   6.252   0.045
  320   2HG1  ILE  40          2HG1      ILE  40  -2.784   4.773   0.324
  321   1HG2  ILE  40          1HG2      ILE  40  -2.110   8.262   2.738
  322   2HG2  ILE  40          2HG2      ILE  40  -3.403   8.233   1.522
  323   3HG2  ILE  40          3HG2      ILE  40  -3.585   7.348   3.048
  324   1HD1  ILE  40          1HD1      ILE  40  -3.998   4.481   2.505
  325   2HD1  ILE  40          2HD1      ILE  40  -5.009   5.869   2.065
  326   3HD1  ILE  40          3HD1      ILE  40  -5.042   4.410   1.066
  327    H    GLU  41           H        GLU  41   0.373   5.188   2.227
  328    HA   GLU  41           HA       GLU  41   1.099   3.344  -0.021
  329   1HB   GLU  41          1HB       GLU  41   2.641   4.201   2.449
  330   2HB   GLU  41          2HB       GLU  41   3.040   2.736   1.549
  331   1HG   GLU  41          1HG       GLU  41   2.926   5.521   0.326
  332   2HG   GLU  41          2HG       GLU  41   4.407   4.710   0.871
  333    H    LEU  42           H        LEU  42   0.495   1.321   0.137
  334    HA   LEU  42           HA       LEU  42  -0.736   0.279   2.658
  335   1HB   LEU  42          1HB       LEU  42  -1.557   0.216  -0.234
  336   2HB   LEU  42          2HB       LEU  42  -1.797  -1.253   0.715
  337    HG   LEU  42           HG       LEU  42  -3.181  -0.150   2.325
  338   1HD1  LEU  42          1HD1      LEU  42  -2.563   2.409   0.818
  339   2HD1  LEU  42          2HD1      LEU  42  -3.963   2.210   1.900
  340   3HD1  LEU  42          3HD1      LEU  42  -2.329   2.065   2.547
  341   1HD2  LEU  42          1HD2      LEU  42  -4.125  -0.975   0.120
  342   2HD2  LEU  42          2HD2      LEU  42  -5.090   0.262   0.933
  343   3HD2  LEU  42          3HD2      LEU  42  -4.073   0.692  -0.458
  344    H    ASP  43           H        ASP  43  -0.583  -2.008   2.932
  345    HA   ASP  43           HA       ASP  43   2.197  -2.806   2.546
  346   1HB   ASP  43          1HB       ASP  43   1.153  -2.658   4.781
  347   2HB   ASP  43          2HB       ASP  43   0.034  -3.953   4.334
  348    H    HIS  44           H        HIS  44   2.855  -4.315   1.155
  349    HA   HIS  44           HA       HIS  44   0.973  -5.940  -0.374
  350   1HB   HIS  44          1HB       HIS  44   2.938  -4.788  -1.346
  351   2HB   HIS  44          2HB       HIS  44   4.009  -5.843  -0.426
  352    HD1  HIS  44           HD1      HIS  44   3.530  -8.616  -1.073
  353    HD2  HIS  44           HD2      HIS  44   2.475  -5.568  -3.765
  354    HE1  HIS  44           HE1      HIS  44   3.400  -9.698  -3.395
  355    H    ASP  45           H        ASP  45   0.281  -6.825   1.823
  356    HA   ASP  45           HA       ASP  45   0.661  -9.569   1.843
  357   1HB   ASP  45          1HB       ASP  45   2.827  -9.501   2.841
  358   2HB   ASP  45          2HB       ASP  45   2.387  -8.173   3.920
  359    H    LYS  46           H        LYS  46   0.475  -7.144   4.488
  360    HA   LYS  46           HA       LYS  46  -1.580  -8.470   5.837
  361   1HB   LYS  46          1HB       LYS  46   0.033  -6.818   6.741
  362   2HB   LYS  46          2HB       LYS  46  -0.875  -5.510   5.984
  363   1HG   LYS  46          1HG       LYS  46  -2.829  -5.955   7.282
  364   2HG   LYS  46          2HG       LYS  46  -2.190  -7.473   7.924
  365   1HD   LYS  46          1HD       LYS  46  -0.703  -4.877   8.441
  366   2HD   LYS  46          2HD       LYS  46  -2.169  -5.252   9.351
  367   1HE   LYS  46          1HE       LYS  46  -0.225  -5.958  10.619
  368   2HE   LYS  46          2HE       LYS  46  -1.224  -7.350  10.179
  369   1HZ   LYS  46          1HZ       LYS  46   1.230  -6.523   8.788
  370   2HZ   LYS  46          2HZ       LYS  46   1.124  -7.742   9.891
  371   3HZ   LYS  46          3HZ       LYS  46   0.329  -7.862   8.457
  372    H    VAL  47           H        VAL  47  -1.771  -5.693   3.560
  373    HA   VAL  47           HA       VAL  47  -4.598  -5.359   3.765
  374    HB   VAL  47           HB       VAL  47  -2.707  -4.632   1.492
  375   1HG1  VAL  47          1HG1      VAL  47  -5.571  -3.772   2.087
  376   2HG1  VAL  47          2HG1      VAL  47  -4.497  -3.008   0.898
  377   3HG1  VAL  47          3HG1      VAL  47  -4.997  -4.678   0.666
  378   1HG2  VAL  47          1HG2      VAL  47  -3.830  -3.009   3.827
  379   2HG2  VAL  47          2HG2      VAL  47  -2.148  -3.546   3.675
  380   3HG2  VAL  47          3HG2      VAL  47  -2.804  -2.387   2.520
  381    H    MET  48           H        MET  48  -2.558  -7.200   1.431
  382    HA   MET  48           HA       MET  48  -4.535  -8.335  -0.178
  383   1HB   MET  48          1HB       MET  48  -2.434  -8.773  -0.945
  384   2HB   MET  48          2HB       MET  48  -1.752  -9.025   0.643
  385   1HG   MET  48          1HG       MET  48  -1.668 -11.013  -0.721
  386   2HG   MET  48          2HG       MET  48  -2.564 -11.278   0.762
  387   1HE   MET  48          1HE       MET  48  -2.927 -10.396  -3.035
  388   2HE   MET  48          2HE       MET  48  -4.606 -10.881  -3.380
  389   3HE   MET  48          3HE       MET  48  -4.281  -9.451  -2.378
  390    H    ASN  49           H        ASN  49  -3.299  -9.609   2.939
  391    HA   ASN  49           HA       ASN  49  -4.964 -11.887   3.044
  392   1HB   ASN  49          1HB       ASN  49  -3.805 -10.266   5.343
  393   2HB   ASN  49          2HB       ASN  49  -4.407 -11.928   5.441
  394   1HD2  ASN  49          2HD2      ASN  49  -1.653 -10.800   5.967
  395   2HD2  ASN  49          1HD2      ASN  49  -0.574 -11.648   4.880
  396    H    MET  50           H        MET  50  -5.522  -8.545   4.260
  397    HA   MET  50           HA       MET  50  -8.125  -9.070   5.361
  398   1HB   MET  50          1HB       MET  50  -6.784  -6.514   4.399
  399   2HB   MET  50          2HB       MET  50  -8.384  -6.565   5.145
  400   1HG   MET  50          1HG       MET  50  -7.505  -7.470   7.191
  401   2HG   MET  50          2HG       MET  50  -5.893  -7.658   6.493
  402   1HE   MET  50          1HE       MET  50  -4.884  -6.508   8.611
  403   2HE   MET  50          2HE       MET  50  -5.332  -4.887   9.184
  404   3HE   MET  50          3HE       MET  50  -6.497  -6.225   9.305
  405    H    GLN  51           H        GLN  51  -6.999  -8.310   2.052
  406    HA   GLN  51           HA       GLN  51  -9.550  -7.516   1.100
  407   1HB   GLN  51          1HB       GLN  51  -7.156  -8.496  -0.478
  408   2HB   GLN  51          2HB       GLN  51  -8.637  -7.819  -1.144
  409   1HG   GLN  51          1HG       GLN  51  -7.737  -5.955   0.833
  410   2HG   GLN  51          2HG       GLN  51  -6.295  -6.506  -0.017
  411   1HE2  GLN  51          2HE2      GLN  51  -9.557  -6.012  -1.491
  412   2HE2  GLN  51          1HE2      GLN  51  -9.010  -4.735  -2.556
  413    H    ALA  52           H        ALA  52  -7.727 -10.510   0.444
  414    HA   ALA  52           HA       ALA  52  -8.293 -12.587  -0.107
  415   1HB   ALA  52          1HB       ALA  52  -9.483 -12.585   2.033
  416   2HB   ALA  52          2HB       ALA  52 -10.980 -12.063   1.237
  417   3HB   ALA  52          3HB       ALA  52 -10.266 -13.633   0.836
  418    H    LYS  53           H        LYS  53 -11.476 -10.972  -0.637
  419    HA   LYS  53           HA       LYS  53 -11.232 -11.189  -3.513
  420   1HB   LYS  53          1HB       LYS  53 -12.010 -13.495  -2.380
  421   2HB   LYS  53          2HB       LYS  53 -13.592 -12.766  -2.444
  422   1HG   LYS  53          1HG       LYS  53 -11.608 -13.213  -4.734
  423   2HG   LYS  53          2HG       LYS  53 -13.034 -14.193  -4.376
  424   1HD   LYS  53          1HD       LYS  53 -14.517 -12.287  -4.939
  425   2HD   LYS  53          2HD       LYS  53 -13.097 -11.264  -5.239
  426   1HE   LYS  53          1HE       LYS  53 -13.971 -12.034  -7.350
  427   2HE   LYS  53          2HE       LYS  53 -12.380 -12.760  -7.070
  428   1HZ   LYS  53          1HZ       LYS  53 -14.970 -14.083  -6.622
  429   2HZ   LYS  53          2HZ       LYS  53 -13.973 -14.333  -7.907
  430   3HZ   LYS  53          3HZ       LYS  53 -13.488 -14.770  -6.397
  431    H    ALA  54           H        ALA  54 -14.483 -11.204  -3.128
  432    HA   ALA  54           HA       ALA  54 -14.690  -8.411  -3.534
  433   1HB   ALA  54          1HB       ALA  54 -16.213 -10.036  -4.557
  434   2HB   ALA  54          2HB       ALA  54 -16.841 -10.485  -2.955
  435   3HB   ALA  54          3HB       ALA  54 -17.119  -8.851  -3.595
  436    H    GLU  55           H        GLU  55 -15.313 -10.490  -0.791
  437    HA   GLU  55           HA       GLU  55 -16.556  -9.478   1.217
  438   1HB   GLU  55          1HB       GLU  55 -15.021 -11.371   1.285
  439   2HB   GLU  55          2HB       GLU  55 -13.618 -10.294   1.264
  440   1HG   GLU  55          1HG       GLU  55 -14.316  -9.359   3.455
  441   2HG   GLU  55          2HG       GLU  55 -15.695 -10.474   3.487
  442    H    PHE  56           H        PHE  56 -13.323  -8.178   0.494
  443    HA   PHE  56           HA       PHE  56 -12.892  -6.313   2.381
  444   1HB   PHE  56          1HB       PHE  56 -11.497  -7.042   0.406
  445   2HB   PHE  56          2HB       PHE  56 -12.360  -5.916  -0.597
  446    HD1  PHE  56           HD1      PHE  56 -11.376  -3.776  -0.909
  447    HD2  PHE  56           HD2      PHE  56 -10.492  -5.977   2.697
  448    HE1  PHE  56           HE1      PHE  56  -9.498  -2.238  -0.424
  449    HE2  PHE  56           HE2      PHE  56  -8.625  -4.429   3.181
  450    HZ   PHE  56           HZ       PHE  56  -8.094  -2.580   1.599
  451    H    TYR  57           H        TYR  57 -14.444  -5.455  -0.762
  452    HA   TYR  57           HA       TYR  57 -15.257  -2.838   0.308
  453   1HB   TYR  57          1HB       TYR  57 -15.989  -2.433  -2.021
  454   2HB   TYR  57          2HB       TYR  57 -14.278  -2.784  -1.816
  455    HD1  TYR  57           HD1      TYR  57 -13.236  -4.728  -2.802
  456    HD2  TYR  57           HD2      TYR  57 -17.494  -4.121  -3.113
  457    HE1  TYR  57           HE1      TYR  57 -13.343  -6.395  -4.632
  458    HE2  TYR  57           HE2      TYR  57 -17.592  -5.775  -4.955
  459    HH   TYR  57           HH       TYR  57 -16.394  -7.196  -6.317
  460    H    SER  58           H        SER  58 -16.685  -5.989   0.046
  461    HA   SER  58           HA       SER  58 -19.401  -5.216  -0.278
  462   1HB   SER  58          1HB       SER  58 -18.268  -7.606   1.233
  463   2HB   SER  58          2HB       SER  58 -19.924  -7.410   0.644
  464    HG   SER  58           HG       SER  58 -18.563  -8.623  -0.771
  465    H    GLU  59           H        GLU  59 -17.517  -5.923   2.734
  466    HA   GLU  59           HA       GLU  59 -19.802  -4.944   4.338
  467   1HB   GLU  59          1HB       GLU  59 -17.321  -6.494   5.141
  468   2HB   GLU  59          2HB       GLU  59 -18.721  -6.134   6.165
  469   1HG   GLU  59          1HG       GLU  59 -20.185  -7.404   4.614
  470   2HG   GLU  59          2HG       GLU  59 -18.771  -7.833   3.636
  471    H    VAL  60           H        VAL  60 -18.100  -2.926   3.022
  472    HA   VAL  60           HA       VAL  60 -17.372  -0.873   3.455
  473    HB   VAL  60           HB       VAL  60 -18.356  -1.342   6.297
  474   1HG1  VAL  60          1HG1      VAL  60 -17.762   1.245   4.817
  475   2HG1  VAL  60          2HG1      VAL  60 -18.647   1.124   6.349
  476   3HG1  VAL  60          3HG1      VAL  60 -16.955   0.644   6.290
  477   1HG2  VAL  60          1HG2      VAL  60 -19.744  -0.160   3.859
  478   2HG2  VAL  60          2HG2      VAL  60 -20.139  -1.714   4.624
  479   3HG2  VAL  60          3HG2      VAL  60 -20.403  -0.208   5.506
  480    H    LEU  61           H        LEU  61 -15.637   0.443   4.360
  481    HA   LEU  61           HA       LEU  61 -13.339  -1.211   5.328
  482   1HB   LEU  61          1HB       LEU  61 -13.662   0.633   2.933
  483   2HB   LEU  61          2HB       LEU  61 -12.064   0.159   3.548
  484    HG   LEU  61           HG       LEU  61 -14.104  -1.948   2.817
  485   1HD1  LEU  61          1HD1      LEU  61 -12.278  -0.427   0.918
  486   2HD1  LEU  61          2HD1      LEU  61 -13.063  -1.975   0.539
  487   3HD1  LEU  61          3HD1      LEU  61 -14.051  -0.535   0.865
  488   1HD2  LEU  61          1HD2      LEU  61 -11.899  -2.390   4.041
  489   2HD2  LEU  61          2HD2      LEU  61 -12.134  -3.280   2.532
  490   3HD2  LEU  61          3HD2      LEU  61 -11.072  -1.850   2.574
  491    H    THR  62           H        THR  62 -11.525   0.040   6.127
  492    HA   THR  62           HA       THR  62 -12.085   2.817   7.013
  493    HB   THR  62           HB       THR  62 -11.212   0.560   8.879
  494    HG1  THR  62           HG1      THR  62 -13.234   0.760   9.774
  495   1HG2  THR  62          1HG2      THR  62 -11.941   3.475   9.403
  496   2HG2  THR  62          2HG2      THR  62 -11.580   2.254  10.643
  497   3HG2  THR  62          3HG2      THR  62 -10.315   2.774   9.522
  498    H    ILE  63           H        ILE  63 -10.317   3.984   6.326
  499    HA   ILE  63           HA       ILE  63  -7.650   2.657   6.257
  500    HB   ILE  63           HB       ILE  63  -8.278   5.498   5.444
  501   1HG1  ILE  63          1HG1      ILE  63  -9.588   4.277   3.940
  502   2HG1  ILE  63          2HG1      ILE  63  -8.116   4.713   3.094
  503   1HG2  ILE  63          1HG2      ILE  63  -5.931   3.630   4.923
  504   2HG2  ILE  63          2HG2      ILE  63  -6.117   5.258   4.249
  505   3HG2  ILE  63          3HG2      ILE  63  -5.945   5.043   5.990
  506   1HD1  ILE  63          1HD1      ILE  63  -7.226   2.401   3.439
  507   2HD1  ILE  63          2HD1      ILE  63  -8.761   1.953   4.229
  508   3HD1  ILE  63          3HD1      ILE  63  -8.749   2.445   2.536
  509    H    VAL  64           H        VAL  64  -6.589   2.644   8.133
  510    HA   VAL  64           HA       VAL  64  -6.850   4.847  10.104
  511    HB   VAL  64           HB       VAL  64  -5.244   2.258  10.143
  512   1HG1  VAL  64          1HG1      VAL  64  -5.734   4.341  12.315
  513   2HG1  VAL  64          2HG1      VAL  64  -4.895   2.796  12.534
  514   3HG1  VAL  64          3HG1      VAL  64  -4.172   4.050  11.523
  515   1HG2  VAL  64          1HG2      VAL  64  -7.830   3.101  11.523
  516   2HG2  VAL  64          2HG2      VAL  64  -7.640   1.810  10.313
  517   3HG2  VAL  64          3HG2      VAL  64  -6.894   1.647  11.914
  518    H    VAL  65           H        VAL  65  -6.043   6.537   8.838
  519    HA   VAL  65           HA       VAL  65  -3.201   6.366   7.944
  520    HB   VAL  65           HB       VAL  65  -4.601   7.061   6.198
  521   1HG1  VAL  65          1HG1      VAL  65  -6.584   7.895   7.394
  522   2HG1  VAL  65          2HG1      VAL  65  -5.689   9.351   7.889
  523   3HG1  VAL  65          3HG1      VAL  65  -5.998   9.035   6.179
  524   1HG2  VAL  65          1HG2      VAL  65  -2.400   8.154   6.448
  525   2HG2  VAL  65          2HG2      VAL  65  -3.579   9.185   5.618
  526   3HG2  VAL  65          3HG2      VAL  65  -3.170   9.501   7.314
  527    H    ASP  66           H        ASP  66  -1.960   6.664   9.667
  528    HA   ASP  66           HA       ASP  66  -1.169   7.352  11.643
  529   1HB   ASP  66          1HB       ASP  66  -0.544   9.266  10.227
  530   2HB   ASP  66          2HB       ASP  66  -2.064  10.082  10.622
  531    H    GLY  67           H        GLY  67  -3.278   6.070  12.255
  532   1HA   GLY  67          1HA       GLY  67  -4.642   5.758  14.082
  533   2HA   GLY  67          2HA       GLY  67  -4.426   7.443  14.557
  534    H    LYS  68           H        LYS  68  -5.328   8.753  12.202
  535    HA   LYS  68           HA       LYS  68  -8.031   8.935  12.888
  536   1HB   LYS  68          1HB       LYS  68  -6.524  10.713  11.953
  537   2HB   LYS  68          2HB       LYS  68  -6.734   9.996  10.347
  538   1HG   LYS  68          1HG       LYS  68  -9.200  10.356  10.539
  539   2HG   LYS  68          2HG       LYS  68  -8.954  11.055  12.157
  540   1HD   LYS  68          1HD       LYS  68  -7.409  12.765  11.089
  541   2HD   LYS  68          2HD       LYS  68  -7.918  12.159   9.506
  542   1HE   LYS  68          1HE       LYS  68  -9.715  13.376  11.665
  543   2HE   LYS  68          2HE       LYS  68  -9.175  14.184  10.185
  544   1HZ   LYS  68          1HZ       LYS  68 -10.370  12.551   8.921
  545   2HZ   LYS  68          2HZ       LYS  68 -10.883  11.798  10.295
  546   3HZ   LYS  68          3HZ       LYS  68 -11.378  13.332   9.961
  547    H    GLU  69           H        GLU  69  -9.694   7.660  12.387
  548    HA   GLU  69           HA       GLU  69  -9.668   5.703  10.246
  549   1HB   GLU  69          1HB       GLU  69 -11.811   6.635  12.200
  550   2HB   GLU  69          2HB       GLU  69 -12.037   5.367  10.988
  551   1HG   GLU  69          1HG       GLU  69 -10.155   4.078  12.000
  552   2HG   GLU  69          2HG       GLU  69 -10.010   5.317  13.259
  553    H    ILE  70           H        ILE  70  -9.577   6.713   8.242
  554    HA   ILE  70           HA       ILE  70 -11.778   8.562   7.459
  555    HB   ILE  70           HB       ILE  70  -9.471   7.395   5.872
  556   1HG1  ILE  70          1HG1      ILE  70  -8.659   8.983   7.544
  557   2HG1  ILE  70          2HG1      ILE  70  -8.498   9.609   5.905
  558   1HG2  ILE  70          1HG2      ILE  70 -11.627   9.404   5.110
  559   2HG2  ILE  70          2HG2      ILE  70 -10.135   9.134   4.182
  560   3HG2  ILE  70          3HG2      ILE  70 -11.306   7.826   4.379
  561   1HD1  ILE  70          1HD1      ILE  70 -10.515  11.039   6.268
  562   2HD1  ILE  70          2HD1      ILE  70 -10.622  10.424   7.936
  563   3HD1  ILE  70          3HD1      ILE  70  -9.214  11.361   7.419
  564    H    LYS  71           H        LYS  71 -13.650   7.491   7.442
  565    HA   LYS  71           HA       LYS  71 -13.906   4.686   6.999
  566   1HB   LYS  71          1HB       LYS  71 -15.457   6.523   8.238
  567   2HB   LYS  71          2HB       LYS  71 -16.224   6.591   6.664
  568   1HG   LYS  71          1HG       LYS  71 -17.474   4.874   7.417
  569   2HG   LYS  71          2HG       LYS  71 -16.086   3.847   7.050
  570   1HD   LYS  71          1HD       LYS  71 -16.792   5.149   9.728
  571   2HD   LYS  71          2HD       LYS  71 -16.950   3.435   9.313
  572   1HE   LYS  71          1HE       LYS  71 -14.482   3.279   9.051
  573   2HE   LYS  71          2HE       LYS  71 -14.316   4.978   9.526
  574   1HZ   LYS  71          1HZ       LYS  71 -15.326   4.427  11.621
  575   2HZ   LYS  71          2HZ       LYS  71 -15.416   2.838  11.199
  576   3HZ   LYS  71          3HZ       LYS  71 -13.951   3.565  11.388
  577    H    VAL  72           H        VAL  72 -14.111   3.584   5.077
  578    HA   VAL  72           HA       VAL  72 -14.737   5.078   2.581
  579    HB   VAL  72           HB       VAL  72 -12.887   3.623   1.524
  580   1HG1  VAL  72          1HG1      VAL  72 -12.172   5.963   3.324
  581   2HG1  VAL  72          2HG1      VAL  72 -11.113   5.283   2.076
  582   3HG1  VAL  72          3HG1      VAL  72 -12.643   6.033   1.612
  583   1HG2  VAL  72          1HG2      VAL  72 -12.573   2.325   3.706
  584   2HG2  VAL  72          2HG2      VAL  72 -11.106   2.865   2.884
  585   3HG2  VAL  72          3HG2      VAL  72 -11.716   3.720   4.328
  586    H    LYS  73           H        LYS  73 -15.125   3.708   0.759
  587    HA   LYS  73           HA       LYS  73 -16.688   1.278   1.482
  588   1HB   LYS  73          1HB       LYS  73 -18.007   3.438   1.195
  589   2HB   LYS  73          2HB       LYS  73 -17.439   3.489  -0.475
  590   1HG   LYS  73          1HG       LYS  73 -19.660   2.629  -0.417
  591   2HG   LYS  73          2HG       LYS  73 -18.601   1.300  -0.898
  592   1HD   LYS  73          1HD       LYS  73 -18.696   0.334   1.347
  593   2HD   LYS  73          2HD       LYS  73 -19.564   1.744   1.977
  594   1HE   LYS  73          1HE       LYS  73 -20.619  -0.175  -0.153
  595   2HE   LYS  73          2HE       LYS  73 -21.004  -0.259   1.575
  596   1HZ   LYS  73          1HZ       LYS  73 -21.959   1.929   1.416
  597   2HZ   LYS  73          2HZ       LYS  73 -21.654   1.983  -0.204
  598   3HZ   LYS  73          3HZ       LYS  73 -22.708   0.870   0.399
  599    H    ALA  74           H        ALA  74 -14.608   2.934  -0.789
  600    HA   ALA  74           HA       ALA  74 -13.163   2.091  -2.288
  601   1HB   ALA  74          1HB       ALA  74 -13.422  -0.252  -1.437
  602   2HB   ALA  74          2HB       ALA  74 -14.724  -0.472  -2.639
  603   3HB   ALA  74          3HB       ALA  74 -13.082  -0.102  -3.162
  604    H    GLN  75           H        GLN  75 -13.176   1.657  -4.676
  605    HA   GLN  75           HA       GLN  75 -15.709   2.244  -6.061
  606   1HB   GLN  75          1HB       GLN  75 -14.825   4.409  -5.483
  607   2HB   GLN  75          2HB       GLN  75 -13.255   4.051  -6.206
  608   1HG   GLN  75          1HG       GLN  75 -15.887   4.058  -7.760
  609   2HG   GLN  75          2HG       GLN  75 -14.874   5.492  -7.555
  610   1HE2  GLN  75          2HE2      GLN  75 -15.510   3.011  -9.703
  611   2HE2  GLN  75          1HE2      GLN  75 -13.955   2.957 -10.515
  612    H    ASP  76           H        ASP  76 -12.134   1.956  -6.567
  613    HA   ASP  76           HA       ASP  76 -12.661  -0.517  -8.105
  614   1HB   ASP  76          1HB       ASP  76 -10.952   1.820  -9.058
  615   2HB   ASP  76          2HB       ASP  76 -10.615   0.163  -9.555
  616    H    VAL  77           H        VAL  77 -11.063  -2.038  -7.959
  617    HA   VAL  77           HA       VAL  77  -8.894  -1.593  -5.994
  618    HB   VAL  77           HB       VAL  77  -9.416  -3.753  -4.915
  619   1HG1  VAL  77          1HG1      VAL  77 -10.171  -1.581  -3.933
  620   2HG1  VAL  77          2HG1      VAL  77 -11.742  -1.796  -4.727
  621   3HG1  VAL  77          3HG1      VAL  77 -11.202  -2.942  -3.489
  622   1HG2  VAL  77          1HG2      VAL  77 -12.047  -3.649  -6.464
  623   2HG2  VAL  77          2HG2      VAL  77 -10.842  -4.957  -6.505
  624   3HG2  VAL  77          3HG2      VAL  77 -11.738  -4.645  -5.034
  625    H    GLN  78           H        GLN  78  -7.218  -1.694  -7.476
  626    HA   GLN  78           HA       GLN  78  -7.300  -3.747  -9.565
  627   1HB   GLN  78          1HB       GLN  78  -6.506  -1.405  -9.982
  628   2HB   GLN  78          2HB       GLN  78  -5.092  -1.750  -8.985
  629   1HG   GLN  78          1HG       GLN  78  -4.466  -2.059 -11.262
  630   2HG   GLN  78          2HG       GLN  78  -4.536  -3.668 -10.535
  631   1HE2  GLN  78          2HE2      GLN  78  -6.119  -5.173 -11.284
  632   2HE2  GLN  78          1HE2      GLN  78  -7.116  -4.839 -12.684
  633    H    ARG  79           H        ARG  79  -7.506  -5.329  -7.790
  634    HA   ARG  79           HA       ARG  79  -4.922  -6.227  -6.616
  635   1HB   ARG  79          1HB       ARG  79  -6.204  -7.415  -5.027
  636   2HB   ARG  79          2HB       ARG  79  -6.899  -5.795  -5.113
  637   1HG   ARG  79          1HG       ARG  79  -8.725  -6.647  -6.588
  638   2HG   ARG  79          2HG       ARG  79  -8.070  -8.287  -6.454
  639   1HD   ARG  79          1HD       ARG  79  -9.124  -6.560  -4.200
  640   2HD   ARG  79          2HD       ARG  79  -9.915  -7.983  -4.865
  641    HE   ARG  79           HE       ARG  79  -7.655  -7.846  -3.002
  642   1HH1  ARG  79          1HH2      ARG  79  -9.361  -9.978  -5.278
  643   2HH1  ARG  79          2HH2      ARG  79  -8.813 -11.440  -4.488
  644   1HH2  ARG  79          1HH1      ARG  79  -6.857  -9.788  -2.069
  645   2HH2  ARG  79          2HH1      ARG  79  -7.401 -11.329  -2.682
  646    H    HIS  80           H        HIS  80  -5.291  -8.858  -6.294
  647    HA   HIS  80           HA       HIS  80  -6.423 -10.080  -8.664
  648   1HB   HIS  80          1HB       HIS  80  -4.101  -9.425  -9.359
  649   2HB   HIS  80          2HB       HIS  80  -3.459 -10.463  -8.084
  650    HD1  HIS  80           HD1      HIS  80  -4.231 -13.176  -8.414
  651    HD2  HIS  80           HD2      HIS  80  -4.733 -10.518 -11.635
  652    HE1  HIS  80           HE1      HIS  80  -4.647 -14.605 -10.507
  653    HA   PRO  81           HA       PRO  81  -7.131 -12.736  -5.150
  654   1HB   PRO  81          1HB       PRO  81  -8.591 -14.762  -6.281
  655   2HB   PRO  81          2HB       PRO  81  -9.212 -13.108  -6.026
  656   1HG   PRO  81          1HG       PRO  81  -8.096 -14.281  -8.580
  657   2HG   PRO  81          2HG       PRO  81  -9.571 -13.308  -8.359
  658   1HD   PRO  81          1HD       PRO  81  -7.209 -12.215  -9.201
  659   2HD   PRO  81          2HD       PRO  81  -8.348 -11.315  -8.154
  660    H    TYR  82           H        TYR  82  -6.218 -14.701  -8.073
  661    HA   TYR  82           HA       TYR  82  -5.472 -16.886  -6.457
  662   1HB   TYR  82          1HB       TYR  82  -4.543 -16.512  -9.307
  663   2HB   TYR  82          2HB       TYR  82  -4.860 -18.005  -8.443
  664    HD1  TYR  82           HD1      TYR  82  -6.024 -16.456 -11.138
  665    HD2  TYR  82           HD2      TYR  82  -7.537 -17.620  -7.265
  666    HE1  TYR  82           HE1      TYR  82  -8.331 -16.365 -12.008
  667    HE2  TYR  82           HE2      TYR  82  -9.845 -17.525  -8.146
  668    HH   TYR  82           HH       TYR  82 -10.568 -16.648 -11.542
  669    H    LYS  83           H        LYS  83  -3.227 -14.970  -8.546
  670    HA   LYS  83           HA       LYS  83  -1.036 -15.457  -6.630
  671   1HB   LYS  83          1HB       LYS  83   0.335 -14.133  -8.153
  672   2HB   LYS  83          2HB       LYS  83  -0.389 -15.548  -8.929
  673   1HG   LYS  83          1HG       LYS  83  -1.941 -14.203 -10.163
  674   2HG   LYS  83          2HG       LYS  83  -1.612 -12.766  -9.177
  675   1HD   LYS  83          1HD       LYS  83  -0.575 -12.500 -11.306
  676   2HD   LYS  83          2HD       LYS  83   0.660 -12.613 -10.042
  677   1HE   LYS  83          1HE       LYS  83   1.105 -14.967 -10.668
  678   2HE   LYS  83          2HE       LYS  83  -0.201 -14.907 -11.870
  679   1HZ   LYS  83          1HZ       LYS  83   2.240 -13.274 -11.904
  680   2HZ   LYS  83          2HZ       LYS  83   1.944 -14.587 -12.852
  681   3HZ   LYS  83          3HZ       LYS  83   1.035 -13.224 -13.027
  682    HA   PRO  84           HA       PRO  84  -2.003 -11.426  -4.785
  683   1HB   PRO  84          1HB       PRO  84   0.207 -10.993  -3.260
  684   2HB   PRO  84          2HB       PRO  84  -0.932 -12.319  -2.882
  685   1HG   PRO  84          1HG       PRO  84   1.663 -12.510  -4.437
  686   2HG   PRO  84          2HG       PRO  84   1.132 -13.529  -3.067
  687   1HD   PRO  84          1HD       PRO  84   0.795 -14.273  -5.689
  688   2HD   PRO  84          2HD       PRO  84  -0.390 -14.712  -4.423
  689    H    LYS  85           H        LYS  85  -1.421  -9.211  -5.188
  690    HA   LYS  85           HA       LYS  85   1.054  -8.573  -6.504
  691   1HB   LYS  85          1HB       LYS  85  -0.261  -9.487  -8.439
  692   2HB   LYS  85          2HB       LYS  85  -1.499  -8.269  -8.145
  693   1HG   LYS  85          1HG       LYS  85  -0.079  -7.577  -9.952
  694   2HG   LYS  85          2HG       LYS  85   0.185  -6.471  -8.606
  695   1HD   LYS  85          1HD       LYS  85   2.037  -8.828  -8.709
  696   2HD   LYS  85          2HD       LYS  85   2.141  -7.732 -10.090
  697   1HE   LYS  85          1HE       LYS  85   2.535  -5.806  -8.626
  698   2HE   LYS  85          2HE       LYS  85   2.436  -6.838  -7.189
  699   1HZ   LYS  85          1HZ       LYS  85   4.406  -7.167  -9.326
  700   2HZ   LYS  85          2HZ       LYS  85   4.679  -6.400  -7.898
  701   3HZ   LYS  85          3HZ       LYS  85   4.329  -8.015  -7.913
  702    H    LEU  86           H        LEU  86  -2.295  -7.206  -6.371
  703    HA   LEU  86           HA       LEU  86  -3.034  -5.132  -5.833
  704   1HB   LEU  86          1HB       LEU  86  -0.896  -5.381  -3.674
  705   2HB   LEU  86          2HB       LEU  86  -2.114  -4.111  -3.745
  706    HG   LEU  86           HG       LEU  86  -2.865  -7.053  -3.613
  707   1HD1  LEU  86          1HD1      LEU  86  -2.519  -5.014  -1.367
  708   2HD1  LEU  86          2HD1      LEU  86  -3.276  -6.598  -1.198
  709   3HD1  LEU  86          3HD1      LEU  86  -1.551  -6.485  -1.610
  710   1HD2  LEU  86          1HD2      LEU  86  -4.638  -5.431  -4.401
  711   2HD2  LEU  86          2HD2      LEU  86  -5.016  -6.168  -2.842
  712   3HD2  LEU  86          3HD2      LEU  86  -4.396  -4.502  -2.915
  713    H    GLN  87           H        GLN  87  -2.368  -4.324  -7.889
  714    HA   GLN  87           HA       GLN  87   0.161  -2.913  -8.156
  715   1HB   GLN  87          1HB       GLN  87  -2.380  -2.750  -9.826
  716   2HB   GLN  87          2HB       GLN  87  -0.799  -2.063 -10.239
  717   1HG   GLN  87          1HG       GLN  87   0.169  -4.408 -10.055
  718   2HG   GLN  87          2HG       GLN  87  -1.492  -5.019  -9.948
  719   1HE2  GLN  87          2HE2      GLN  87  -2.974  -3.905 -11.804
  720   2HE2  GLN  87          1HE2      GLN  87  -2.266  -4.005 -13.401
  721    H    HIS  88           H        HIS  88  -3.261  -1.984  -7.543
  722    HA   HIS  88           HA       HIS  88  -2.475   0.396  -6.083
  723   1HB   HIS  88          1HB       HIS  88  -2.268   1.060  -8.530
  724   2HB   HIS  88          2HB       HIS  88  -3.981   0.679  -8.723
  725    HD1  HIS  88           HD1      HIS  88  -5.666   2.595  -7.938
  726    HD2  HIS  88           HD2      HIS  88  -1.612   3.190  -6.943
  727    HE1  HIS  88           HE1      HIS  88  -5.457   4.986  -7.104
  728    H    ILE  89           H        ILE  89  -4.425   1.481  -5.187
  729    HA   ILE  89           HA       ILE  89  -6.994   0.072  -5.519
  730    HB   ILE  89           HB       ILE  89  -5.768   0.715  -2.805
  731   1HG1  ILE  89          1HG1      ILE  89  -4.927  -1.440  -3.752
  732   2HG1  ILE  89          2HG1      ILE  89  -5.835  -1.593  -2.257
  733   1HG2  ILE  89          1HG2      ILE  89  -8.548  -0.136  -3.642
  734   2HG2  ILE  89          2HG2      ILE  89  -7.945  -0.377  -1.992
  735   3HG2  ILE  89          3HG2      ILE  89  -8.078   1.258  -2.666
  736   1HD1  ILE  89          1HD1      ILE  89  -6.959  -2.183  -5.024
  737   2HD1  ILE  89          2HD1      ILE  89  -6.370  -3.376  -3.874
  738   3HD1  ILE  89          3HD1      ILE  89  -7.800  -2.417  -3.473
  739    H    ASP  90           H        ASP  90  -8.692   1.434  -5.571
  740    HA   ASP  90           HA       ASP  90  -8.157   4.367  -5.352
  741   1HB   ASP  90          1HB       ASP  90  -9.921   2.803  -7.274
  742   2HB   ASP  90          2HB       ASP  90  -9.776   4.557  -7.207
  743    H    PHE  91           H        PHE  91  -8.916   4.571  -3.224
  744    HA   PHE  91           HA       PHE  91 -11.470   3.388  -2.448
  745   1HB   PHE  91          1HB       PHE  91  -9.578   5.223  -0.960
  746   2HB   PHE  91          2HB       PHE  91 -11.019   4.488  -0.279
  747    HD1  PHE  91           HD1      PHE  91  -7.499   4.066  -0.831
  748    HD2  PHE  91           HD2      PHE  91 -11.194   1.913  -0.239
  749    HE1  PHE  91           HE1      PHE  91  -6.235   2.134   0.041
  750    HE2  PHE  91           HE2      PHE  91  -9.915  -0.024   0.638
  751    HZ   PHE  91           HZ       PHE  91  -7.443   0.077   0.785
  752    H    VAL  92           H        VAL  92 -13.283   4.568  -1.683
  753    HA   VAL  92           HA       VAL  92 -13.390   7.494  -2.112
  754    HB   VAL  92           HB       VAL  92 -15.347   5.433  -3.192
  755   1HG1  VAL  92          1HG1      VAL  92 -15.889   8.381  -2.631
  756   2HG1  VAL  92          2HG1      VAL  92 -16.886   7.352  -3.679
  757   3HG1  VAL  92          3HG1      VAL  92 -16.764   6.982  -1.961
  758   1HG2  VAL  92          1HG2      VAL  92 -13.540   6.296  -4.714
  759   2HG2  VAL  92          2HG2      VAL  92 -15.156   6.797  -5.241
  760   3HG2  VAL  92          3HG2      VAL  92 -14.108   7.950  -4.400
  761    H    ARG  93           H        ARG  93 -14.474   8.531  -0.452
  762    HA   ARG  93           HA       ARG  93 -14.615   7.129   2.010
  763   1HB   ARG  93          1HB       ARG  93 -15.430   9.930   1.223
  764   2HB   ARG  93          2HB       ARG  93 -15.789   9.256   2.811
  765   1HG   ARG  93          1HG       ARG  93 -13.802  10.304   3.251
  766   2HG   ARG  93          2HG       ARG  93 -13.307   8.632   3.020
  767   1HD   ARG  93          1HD       ARG  93 -11.728  10.041   1.885
  768   2HD   ARG  93          2HD       ARG  93 -12.666   9.223   0.644
  769    HE   ARG  93           HE       ARG  93 -13.645  11.228   0.015
  770   1HH1  ARG  93          1HH2      ARG  93 -11.741  11.761   2.994
  771   2HH1  ARG  93          2HH2      ARG  93 -11.990  13.493   2.951
  772   1HH2  ARG  93          1HH1      ARG  93 -13.991  13.519   0.075
  773   2HH2  ARG  93          2HH1      ARG  93 -13.243  14.456   1.356
  774    H    ALA  94           H        ALA  94 -16.304   6.480   3.293
  775    HA   ALA  94           HA       ALA  94 -18.767   5.669   1.954
  776   1HB   ALA  94          1HB       ALA  94 -17.669   4.229   3.630
  777   2HB   ALA  94          2HB       ALA  94 -17.883   5.488   4.865
  778   3HB   ALA  94          3HB       ALA  94 -19.301   4.688   4.153
  Start of MODEL   10
    1    H    MET   1           H        MET   1 -14.853  -2.122   7.666
    2    HA   MET   1           HA       MET   1 -14.255  -2.170  10.548
    3   1HB   MET   1          1HB       MET   1 -15.168  -4.214   8.493
    4   2HB   MET   1          2HB       MET   1 -14.522  -4.713  10.057
    5   1HG   MET   1          1HG       MET   1 -16.893  -4.704  10.115
    6   2HG   MET   1          2HG       MET   1 -16.269  -3.529  11.265
    7   1HE   MET   1          1HE       MET   1 -17.287  -1.187  11.492
    8   2HE   MET   1          2HE       MET   1 -16.117  -0.715  10.243
    9   3HE   MET   1          3HE       MET   1 -17.810  -0.215  10.101
   10    H    PHE   2           H        PHE   2 -12.944  -3.616   7.517
   11    HA   PHE   2           HA       PHE   2 -10.588  -4.707   8.609
   12   1HB   PHE   2          1HB       PHE   2 -11.085  -3.525   5.846
   13   2HB   PHE   2          2HB       PHE   2  -9.708  -4.525   6.284
   14    HD1  PHE   2           HD1      PHE   2 -10.425  -6.836   7.551
   15    HD2  PHE   2           HD2      PHE   2 -12.809  -4.661   4.679
   16    HE1  PHE   2           HE1      PHE   2 -11.620  -8.922   6.954
   17    HE2  PHE   2           HE2      PHE   2 -13.950  -6.769   4.048
   18    HZ   PHE   2           HZ       PHE   2 -13.367  -8.896   5.193
   19    H    THR   3           H        THR   3  -9.003  -3.699   9.679
   20    HA   THR   3           HA       THR   3  -8.731  -0.774   9.507
   21    HB   THR   3           HB       THR   3  -7.565  -2.818  11.429
   22    HG1  THR   3           HG1      THR   3  -9.912  -2.473  11.371
   23   1HG2  THR   3          1HG2      THR   3  -7.718   0.231  11.570
   24   2HG2  THR   3          2HG2      THR   3  -7.164  -0.839  12.870
   25   3HG2  THR   3          3HG2      THR   3  -6.222  -0.712  11.377
   26    H    ILE   4           H        ILE   4  -7.694  -0.491   7.534
   27    HA   ILE   4           HA       ILE   4  -5.174  -1.804   6.866
   28    HB   ILE   4           HB       ILE   4  -6.831   0.417   5.628
   29   1HG1  ILE   4          1HG1      ILE   4  -6.877  -1.140   3.698
   30   2HG1  ILE   4          2HG1      ILE   4  -5.969  -2.336   4.628
   31   1HG2  ILE   4          1HG2      ILE   4  -4.124  -0.588   4.665
   32   2HG2  ILE   4          2HG2      ILE   4  -5.237   0.477   3.775
   33   3HG2  ILE   4          3HG2      ILE   4  -4.477   1.053   5.248
   34   1HD1  ILE   4          1HD1      ILE   4  -8.725  -1.263   5.368
   35   2HD1  ILE   4          2HD1      ILE   4  -8.407  -2.771   4.490
   36   3HD1  ILE   4          3HD1      ILE   4  -7.864  -2.623   6.154
   37    H    ASN   5           H        ASN   5  -3.374  -1.323   7.954
   38    HA   ASN   5           HA       ASN   5  -2.884   1.218   9.288
   39   1HB   ASN   5          1HB       ASN   5  -1.008  -1.054   8.494
   40   2HB   ASN   5          2HB       ASN   5  -0.591   0.306   9.547
   41   1HD2  ASN   5          2HD2      ASN   5  -2.129   0.606  11.509
   42   2HD2  ASN   5          1HD2      ASN   5  -2.610  -0.862  12.332
   43    H    ALA   6           H        ALA   6  -2.092   3.062   8.312
   44    HA   ALA   6           HA       ALA   6  -0.569   2.882   5.820
   45   1HB   ALA   6          1HB       ALA   6  -2.921   2.853   5.028
   46   2HB   ALA   6          2HB       ALA   6  -3.245   4.333   5.962
   47   3HB   ALA   6          3HB       ALA   6  -2.121   4.369   4.589
   48    H    GLU   7           H        GLU   7  -0.038   5.135   5.036
   49    HA   GLU   7           HA       GLU   7   0.109   7.239   7.070
   50   1HB   GLU   7          1HB       GLU   7   2.054   5.662   7.491
   51   2HB   GLU   7          2HB       GLU   7   2.616   5.990   5.844
   52   1HG   GLU   7          1HG       GLU   7   2.835   8.422   6.461
   53   2HG   GLU   7          2HG       GLU   7   2.313   8.018   8.103
   54    H    VAL   8           H        VAL   8   0.605   9.277   6.041
   55    HA   VAL   8           HA       VAL   8  -0.017   9.684   3.311
   56    HB   VAL   8           HB       VAL   8   1.203  11.848   3.565
   57   1HG1  VAL   8          1HG1      VAL   8  -1.176  11.634   4.138
   58   2HG1  VAL   8          2HG1      VAL   8  -0.752  11.189   5.801
   59   3HG1  VAL   8          3HG1      VAL   8  -0.358  12.804   5.189
   60   1HG2  VAL   8          1HG2      VAL   8   2.973  11.142   5.163
   61   2HG2  VAL   8          2HG2      VAL   8   2.057  12.539   5.742
   62   3HG2  VAL   8          3HG2      VAL   8   1.745  10.939   6.431
   63    H    ARG   9           H        ARG   9   1.257   9.959   1.441
   64    HA   ARG   9           HA       ARG   9   3.286   7.974   1.288
   65   1HB   ARG   9          1HB       ARG   9   1.658   8.399  -0.481
   66   2HB   ARG   9          2HB       ARG   9   2.405   9.968  -0.825
   67   1HG   ARG   9          1HG       ARG   9   4.524   8.817  -1.464
   68   2HG   ARG   9          2HG       ARG   9   3.846   7.270  -0.960
   69   1HD   ARG   9          1HD       ARG   9   3.729   7.385  -3.337
   70   2HD   ARG   9          2HD       ARG   9   2.079   7.487  -2.696
   71    HE   ARG   9           HE       ARG   9   3.179  10.116  -3.020
   72   1HH1  ARG   9          1HH2      ARG   9   1.943   7.420  -4.964
   73   2HH1  ARG   9          2HH2      ARG   9   1.519   8.425  -6.326
   74   1HH2  ARG   9          1HH1      ARG   9   2.633  11.427  -4.810
   75   2HH2  ARG   9          2HH1      ARG   9   1.913  10.724  -6.235
   76    H    LYS  10           H        LYS  10   4.881   8.661   2.736
   77    HA   LYS  10           HA       LYS  10   6.965  10.303   1.406
   78   1HB   LYS  10          1HB       LYS  10   6.001  10.394   4.273
   79   2HB   LYS  10          2HB       LYS  10   7.711  10.670   3.951
   80   1HG   LYS  10          1HG       LYS  10   5.730  12.248   2.313
   81   2HG   LYS  10          2HG       LYS  10   5.931  12.655   4.016
   82   1HD   LYS  10          1HD       LYS  10   7.391  14.028   2.632
   83   2HD   LYS  10          2HD       LYS  10   8.312  13.024   3.760
   84   1HE   LYS  10          1HE       LYS  10   8.892  11.462   1.931
   85   2HE   LYS  10          2HE       LYS  10   7.901  12.410   0.796
   86   1HZ   LYS  10          1HZ       LYS  10  10.270  13.372   2.238
   87   2HZ   LYS  10          2HZ       LYS  10  10.234  12.914   0.656
   88   3HZ   LYS  10          3HZ       LYS  10   9.383  14.239   1.150
   89    H    GLU  11           H        GLU  11   8.531   8.984   0.851
   90    HA   GLU  11           HA       GLU  11   9.575   6.949   2.645
   91   1HB   GLU  11          1HB       GLU  11   7.768   6.290   0.398
   92   2HB   GLU  11          2HB       GLU  11   9.351   5.553   0.168
   93   1HG   GLU  11          1HG       GLU  11   7.817   5.300   2.785
   94   2HG   GLU  11          2HG       GLU  11   7.595   4.205   1.423
   95    H    GLN  12           H        GLN  12  11.640   6.249   1.966
   96    HA   GLN  12           HA       GLN  12  13.740   6.579   1.315
   97   1HB   GLN  12          1HB       GLN  12  12.988   5.767  -0.768
   98   2HB   GLN  12          2HB       GLN  12  12.407   7.338  -1.309
   99   1HG   GLN  12          1HG       GLN  12  15.333   7.003  -0.570
  100   2HG   GLN  12          2HG       GLN  12  14.742   6.365  -2.106
  101   1HE2  GLN  12          2HE2      GLN  12  13.325   7.921  -3.431
  102   2HE2  GLN  12          1HE2      GLN  12  13.895   9.574  -3.539
  103    H    GLY  13           H        GLY  13  12.241   9.474  -0.253
  104   1HA   GLY  13          1HA       GLY  13  12.928  11.421   1.540
  105   2HA   GLY  13          2HA       GLY  13  14.426  11.195   0.619
  106    H    LYS  14           H        LYS  14  14.518  11.825  -1.551
  107    HA   LYS  14           HA       LYS  14  12.561  13.858  -2.336
  108   1HB   LYS  14          1HB       LYS  14  15.165  12.909  -3.588
  109   2HB   LYS  14          2HB       LYS  14  14.147  14.208  -4.221
  110   1HG   LYS  14          1HG       LYS  14  14.412  15.434  -2.019
  111   2HG   LYS  14          2HG       LYS  14  15.463  14.123  -1.477
  112   1HD   LYS  14          1HD       LYS  14  17.031  15.625  -2.136
  113   2HD   LYS  14          2HD       LYS  14  16.893  14.679  -3.616
  114   1HE   LYS  14          1HE       LYS  14  15.534  17.367  -3.030
  115   2HE   LYS  14          2HE       LYS  14  17.005  17.140  -3.986
  116   1HZ   LYS  14          1HZ       LYS  14  15.713  15.824  -5.527
  117   2HZ   LYS  14          2HZ       LYS  14  14.338  16.145  -4.671
  118   3HZ   LYS  14          3HZ       LYS  14  15.157  17.371  -5.401
  119    H    GLY  15           H        GLY  15  10.995  13.624  -3.858
  120   1HA   GLY  15          1HA       GLY  15   9.873  12.793  -5.694
  121   2HA   GLY  15          2HA       GLY  15  11.091  11.530  -5.912
  122    H    ALA  16           H        ALA  16  11.159  10.060  -3.776
  123    HA   ALA  16           HA       ALA  16  10.266   8.484  -2.509
  124   1HB   ALA  16          1HB       ALA  16   8.939  10.299  -1.431
  125   2HB   ALA  16          2HB       ALA  16   7.592   9.952  -2.540
  126   3HB   ALA  16          3HB       ALA  16   8.137   8.718  -1.400
  127    H    SER  17           H        SER  17   8.860   6.605  -2.495
  128    HA   SER  17           HA       SER  17   8.277   4.730  -3.535
  129   1HB   SER  17          1HB       SER  17   6.139   5.992  -3.738
  130   2HB   SER  17          2HB       SER  17   6.600   6.472  -5.386
  131    HG   SER  17           HG       SER  17   5.285   4.563  -5.259
  132    H    ARG  18           H        ARG  18  10.716   5.400  -4.149
  133    HA   ARG  18           HA       ARG  18  11.119   4.832  -7.067
  134   1HB   ARG  18          1HB       ARG  18  12.813   6.275  -4.992
  135   2HB   ARG  18          2HB       ARG  18  13.418   5.841  -6.591
  136   1HG   ARG  18          1HG       ARG  18  10.928   7.561  -6.254
  137   2HG   ARG  18          2HG       ARG  18  12.552   8.248  -6.225
  138   1HD   ARG  18          1HD       ARG  18  11.460   6.581  -8.530
  139   2HD   ARG  18          2HD       ARG  18  11.458   8.353  -8.461
  140    HE   ARG  18           HE       ARG  18  14.089   7.592  -7.942
  141   1HH1  ARG  18          1HH2      ARG  18  11.812   7.291 -10.651
  142   2HH1  ARG  18          2HH2      ARG  18  13.065   7.299 -11.864
  143   1HH2  ARG  18          1HH1      ARG  18  15.717   7.610  -9.540
  144   2HH2  ARG  18          2HH1      ARG  18  15.298   7.484 -11.229
  145    H    ARG  19           H        ARG  19  10.482   2.913  -4.826
  146    HA   ARG  19           HA       ARG  19  12.706   1.053  -5.152
  147   1HB   ARG  19          1HB       ARG  19  13.453   2.671  -3.334
  148   2HB   ARG  19          2HB       ARG  19  12.036   2.213  -2.402
  149   1HG   ARG  19          1HG       ARG  19  13.787   0.957  -1.504
  150   2HG   ARG  19          2HG       ARG  19  12.925  -0.216  -2.509
  151   1HD   ARG  19          1HD       ARG  19  14.630   0.079  -4.296
  152   2HD   ARG  19          2HD       ARG  19  15.398   1.365  -3.338
  153    HE   ARG  19           HE       ARG  19  15.162  -1.188  -1.947
  154   1HH1  ARG  19          1HH2      ARG  19  17.221   0.702  -4.147
  155   2HH1  ARG  19          2HH2      ARG  19  18.682  -0.127  -3.682
  156   1HH2  ARG  19          1HH1      ARG  19  17.087  -2.269  -1.365
  157   2HH2  ARG  19          2HH1      ARG  19  18.604  -1.829  -2.105
  158    H    LEU  20           H        LEU  20  10.033   1.774  -2.869
  159    HA   LEU  20           HA       LEU  20   9.240  -0.823  -2.358
  160   1HB   LEU  20          1HB       LEU  20   7.193   0.175  -1.479
  161   2HB   LEU  20          2HB       LEU  20   8.644   1.046  -0.993
  162    HG   LEU  20           HG       LEU  20   7.916   2.514  -3.198
  163   1HD1  LEU  20          1HD1      LEU  20   5.326   1.465  -1.972
  164   2HD1  LEU  20          2HD1      LEU  20   5.450   2.845  -3.076
  165   3HD1  LEU  20          3HD1      LEU  20   5.851   1.218  -3.641
  166   1HD2  LEU  20          1HD2      LEU  20   6.844   2.783  -0.363
  167   2HD2  LEU  20          2HD2      LEU  20   8.399   3.401  -0.964
  168   3HD2  LEU  20          3HD2      LEU  20   6.882   4.086  -1.571
  169    H    ARG  21           H        ARG  21   8.308   1.232  -5.045
  170    HA   ARG  21           HA       ARG  21   6.085   0.118  -6.135
  171   1HB   ARG  21          1HB       ARG  21   6.986   0.844  -8.316
  172   2HB   ARG  21          2HB       ARG  21   7.198   2.056  -7.046
  173   1HG   ARG  21          1HG       ARG  21   9.573   1.403  -6.780
  174   2HG   ARG  21          2HG       ARG  21   9.377   0.144  -8.014
  175   1HD   ARG  21          1HD       ARG  21   8.804   1.846  -9.675
  176   2HD   ARG  21          2HD       ARG  21   9.018   3.126  -8.468
  177    HE   ARG  21           HE       ARG  21  11.382   2.157  -8.190
  178   1HH1  ARG  21          1HH2      ARG  21   9.730   2.296 -11.356
  179   2HH1  ARG  21          2HH2      ARG  21  11.225   2.247 -12.248
  180   1HH2  ARG  21          1HH1      ARG  21  13.295   2.112  -9.392
  181   2HH2  ARG  21          2HH1      ARG  21  13.250   2.157 -11.136
  182    H    ALA  22           H        ALA  22   9.264  -1.440  -6.033
  183    HA   ALA  22           HA       ALA  22   8.936  -3.391  -8.033
  184   1HB   ALA  22          1HB       ALA  22  11.064  -2.913  -6.918
  185   2HB   ALA  22          2HB       ALA  22  10.428  -3.539  -5.382
  186   3HB   ALA  22          3HB       ALA  22  10.651  -4.632  -6.767
  187    H    ALA  23           H        ALA  23   8.118  -3.597  -4.505
  188    HA   ALA  23           HA       ALA  23   5.904  -5.366  -4.911
  189   1HB   ALA  23          1HB       ALA  23   8.509  -6.666  -3.984
  190   2HB   ALA  23          2HB       ALA  23   6.902  -7.411  -3.873
  191   3HB   ALA  23          3HB       ALA  23   7.603  -7.062  -5.456
  192    H    ASN  24           H        ASN  24   8.579  -4.739  -2.594
  193    HA   ASN  24           HA       ASN  24   7.003  -5.269  -0.275
  194   1HB   ASN  24          1HB       ASN  24   9.663  -3.821  -0.608
  195   2HB   ASN  24          2HB       ASN  24   8.968  -4.344   0.936
  196   1HD2  ASN  24          2HD2      ASN  24  11.417  -5.262   0.514
  197   2HD2  ASN  24          1HD2      ASN  24  11.412  -6.943   0.028
  198    H    LYS  25           H        LYS  25   5.261  -4.037   0.097
  199    HA   LYS  25           HA       LYS  25   3.910  -2.325   0.600
  200   1HB   LYS  25          1HB       LYS  25   6.230  -0.362   0.401
  201   2HB   LYS  25          2HB       LYS  25   4.610  -0.055   1.007
  202   1HG   LYS  25          1HG       LYS  25   4.964  -1.383   2.958
  203   2HG   LYS  25          2HG       LYS  25   6.447  -2.103   2.307
  204   1HD   LYS  25          1HD       LYS  25   6.950  -0.400   3.988
  205   2HD   LYS  25          2HD       LYS  25   7.609   0.035   2.401
  206   1HE   LYS  25          1HE       LYS  25   5.770   1.632   2.032
  207   2HE   LYS  25          2HE       LYS  25   4.998   1.128   3.549
  208   1HZ   LYS  25          1HZ       LYS  25   7.638   2.399   3.295
  209   2HZ   LYS  25          2HZ       LYS  25   6.251   3.151   3.763
  210   3HZ   LYS  25          3HZ       LYS  25   6.907   1.970   4.707
  211    H    PHE  26           H        PHE  26   2.789  -0.507  -0.539
  212    HA   PHE  26           HA       PHE  26   3.644   0.031  -3.261
  213   1HB   PHE  26          1HB       PHE  26   1.941  -1.083  -4.426
  214   2HB   PHE  26          2HB       PHE  26   2.514  -2.288  -3.296
  215    HD1  PHE  26           HD1      PHE  26   1.174  -2.411  -0.972
  216    HD2  PHE  26           HD2      PHE  26  -0.348  -0.636  -4.603
  217    HE1  PHE  26           HE1      PHE  26  -1.075  -2.246   0.043
  218    HE2  PHE  26           HE2      PHE  26  -2.599  -0.499  -3.586
  219    HZ   PHE  26           HZ       PHE  26  -2.970  -1.281  -1.263
  220    HA   PRO  27           HA       PRO  27   1.195   3.586  -2.199
  221   1HB   PRO  27          1HB       PRO  27   0.931   4.884  -4.563
  222   2HB   PRO  27          2HB       PRO  27   2.537   4.612  -3.820
  223   1HG   PRO  27          1HG       PRO  27   1.198   2.944  -5.974
  224   2HG   PRO  27          2HG       PRO  27   2.850   3.625  -5.992
  225   1HD   PRO  27          1HD       PRO  27   2.328   1.054  -5.204
  226   2HD   PRO  27          2HD       PRO  27   3.622   2.030  -4.454
  227    H    ALA  28           H        ALA  28  -0.952   4.321  -2.155
  228    HA   ALA  28           HA       ALA  28  -2.920   3.304  -4.105
  229   1HB   ALA  28          1HB       ALA  28  -3.027   1.696  -2.197
  230   2HB   ALA  28          2HB       ALA  28  -3.303   3.076  -1.108
  231   3HB   ALA  28          3HB       ALA  28  -4.501   2.679  -2.345
  232    H    ILE  29           H        ILE  29  -5.010   4.580  -3.838
  233    HA   ILE  29           HA       ILE  29  -4.460   7.344  -2.855
  234    HB   ILE  29           HB       ILE  29  -5.507   6.504  -5.569
  235   1HG1  ILE  29          1HG1      ILE  29  -3.066   8.171  -4.782
  236   2HG1  ILE  29          2HG1      ILE  29  -3.001   6.476  -5.262
  237   1HG2  ILE  29          1HG2      ILE  29  -6.782   8.471  -4.700
  238   2HG2  ILE  29          2HG2      ILE  29  -5.246   9.324  -4.454
  239   3HG2  ILE  29          3HG2      ILE  29  -5.788   8.874  -6.084
  240   1HD1  ILE  29          1HD1      ILE  29  -4.015   7.106  -7.479
  241   2HD1  ILE  29          2HD1      ILE  29  -3.778   8.813  -7.027
  242   3HD1  ILE  29          3HD1      ILE  29  -2.386   7.734  -7.164
  243    H    ILE  30           H        ILE  30  -6.104   8.369  -1.912
  244    HA   ILE  30           HA       ILE  30  -8.726   6.984  -1.657
  245    HB   ILE  30           HB       ILE  30  -7.574   9.245   0.012
  246   1HG1  ILE  30          1HG1      ILE  30  -7.838   6.277   0.683
  247   2HG1  ILE  30          2HG1      ILE  30  -6.322   7.143   0.394
  248   1HG2  ILE  30          1HG2      ILE  30 -10.048   9.232  -0.133
  249   2HG2  ILE  30          2HG2      ILE  30 -10.076   7.525   0.352
  250   3HG2  ILE  30          3HG2      ILE  30  -9.532   8.785   1.478
  251   1HD1  ILE  30          1HD1      ILE  30  -6.851   8.651   2.335
  252   2HD1  ILE  30          2HD1      ILE  30  -8.227   7.588   2.725
  253   3HD1  ILE  30          3HD1      ILE  30  -6.590   6.953   2.766
  254    H    TYR  31           H        TYR  31 -10.440   7.823  -2.599
  255    HA   TYR  31           HA       TYR  31 -10.413  10.572  -3.770
  256   1HB   TYR  31          1HB       TYR  31 -11.884   8.048  -4.642
  257   2HB   TYR  31          2HB       TYR  31 -12.085   9.639  -5.355
  258    HD1  TYR  31           HD1      TYR  31  -9.477   6.962  -4.780
  259    HD2  TYR  31           HD2      TYR  31 -10.756  10.308  -7.193
  260    HE1  TYR  31           HE1      TYR  31  -7.825   6.361  -6.485
  261    HE2  TYR  31           HE2      TYR  31  -9.106   9.664  -8.925
  262    HH   TYR  31           HH       TYR  31  -7.312   6.598  -8.740
  263    H    GLY  32           H        GLY  32 -12.825  11.331  -3.993
  264   1HA   GLY  32          1HA       GLY  32 -14.799  10.327  -2.210
  265   2HA   GLY  32          2HA       GLY  32 -13.926  11.642  -1.403
  266    H    GLY  33           H        GLY  33 -13.659  13.687  -2.740
  267   1HA   GLY  33          1HA       GLY  33 -14.981  14.790  -4.748
  268   2HA   GLY  33          2HA       GLY  33 -16.363  14.445  -3.687
  269    H    LYS  34           H        LYS  34 -14.944  14.818  -1.195
  270    HA   LYS  34           HA       LYS  34 -15.413  17.471  -0.576
  271   1HB   LYS  34          1HB       LYS  34 -15.061  15.512   1.012
  272   2HB   LYS  34          2HB       LYS  34 -13.341  15.608   0.655
  273   1HG   LYS  34          1HG       LYS  34 -13.294  16.833   2.540
  274   2HG   LYS  34          2HG       LYS  34 -13.701  18.174   1.476
  275   1HD   LYS  34          1HD       LYS  34 -15.619  16.512   3.177
  276   2HD   LYS  34          2HD       LYS  34 -15.064  18.160   3.506
  277   1HE   LYS  34          1HE       LYS  34 -16.170  18.912   1.369
  278   2HE   LYS  34          2HE       LYS  34 -16.840  17.272   1.191
  279   1HZ   LYS  34          1HZ       LYS  34 -17.943  17.556   3.277
  280   2HZ   LYS  34          2HZ       LYS  34 -17.335  19.081   3.442
  281   3HZ   LYS  34          3HZ       LYS  34 -18.383  18.738   2.217
  282    H    GLU  35           H        GLU  35 -12.333  15.956  -1.581
  283    HA   GLU  35           HA       GLU  35 -11.276  18.535  -2.500
  284   1HB   GLU  35          1HB       GLU  35 -10.643  18.160  -0.043
  285   2HB   GLU  35          2HB       GLU  35  -9.708  16.756  -0.573
  286   1HG   GLU  35          1HG       GLU  35  -8.265  18.240  -1.937
  287   2HG   GLU  35          2HG       GLU  35  -9.287  19.631  -1.521
  288    H    ALA  36           H        ALA  36  -9.209  18.081  -3.750
  289    HA   ALA  36           HA       ALA  36  -9.446  16.044  -5.663
  290   1HB   ALA  36          1HB       ALA  36  -8.082  18.068  -5.969
  291   2HB   ALA  36          2HB       ALA  36  -6.975  17.545  -4.678
  292   3HB   ALA  36          3HB       ALA  36  -7.070  16.628  -6.194
  293    HA   PRO  37           HA       PRO  37  -8.213  12.471  -3.442
  294   1HB   PRO  37          1HB       PRO  37  -7.045  10.862  -5.355
  295   2HB   PRO  37          2HB       PRO  37  -8.787  11.241  -5.311
  296   1HG   PRO  37          1HG       PRO  37  -6.642  12.634  -6.932
  297   2HG   PRO  37          2HG       PRO  37  -8.200  11.978  -7.522
  298   1HD   PRO  37          1HD       PRO  37  -7.952  14.591  -6.918
  299   2HD   PRO  37          2HD       PRO  37  -9.428  13.707  -6.429
  300    H    LEU  38           H        LEU  38  -6.401  11.280  -2.547
  301    HA   LEU  38           HA       LEU  38  -3.738  12.491  -2.936
  302   1HB   LEU  38          1HB       LEU  38  -3.430  12.935  -0.583
  303   2HB   LEU  38          2HB       LEU  38  -4.677  13.929  -1.312
  304    HG   LEU  38           HG       LEU  38  -5.219  13.376   0.923
  305   1HD1  LEU  38          1HD1      LEU  38  -7.069  13.571  -0.780
  306   2HD1  LEU  38          2HD1      LEU  38  -7.208  11.796  -0.723
  307   3HD1  LEU  38          3HD1      LEU  38  -7.475  12.755   0.736
  308   1HD2  LEU  38          1HD2      LEU  38  -4.028  11.171   1.079
  309   2HD2  LEU  38          2HD2      LEU  38  -5.621  11.247   1.855
  310   3HD2  LEU  38          3HD2      LEU  38  -5.446  10.421   0.307
  311    H    ALA  39           H        ALA  39  -1.995  11.359  -2.027
  312    HA   ALA  39           HA       ALA  39  -2.473   8.473  -2.366
  313   1HB   ALA  39          1HB       ALA  39  -1.013   9.649  -3.957
  314   2HB   ALA  39          2HB       ALA  39   0.066  10.110  -2.621
  315   3HB   ALA  39          3HB       ALA  39  -0.147   8.396  -3.049
  316    H    ILE  40           H        ILE  40  -1.488   6.906  -1.116
  317    HA   ILE  40           HA       ILE  40  -0.171   7.617   1.430
  318    HB   ILE  40           HB       ILE  40  -1.689   5.944   2.566
  319   1HG1  ILE  40          1HG1      ILE  40  -3.556   6.380   0.188
  320   2HG1  ILE  40          2HG1      ILE  40  -2.546   4.942   0.378
  321   1HG2  ILE  40          1HG2      ILE  40  -1.932   8.422   2.816
  322   2HG2  ILE  40          2HG2      ILE  40  -3.164   8.401   1.539
  323   3HG2  ILE  40          3HG2      ILE  40  -3.434   7.538   3.064
  324   1HD1  ILE  40          1HD1      ILE  40  -3.653   4.454   2.552
  325   2HD1  ILE  40          2HD1      ILE  40  -4.713   5.851   2.290
  326   3HD1  ILE  40          3HD1      ILE  40  -4.778   4.478   1.177
  327    H    GLU  41           H        GLU  41   0.807   5.734   2.440
  328    HA   GLU  41           HA       GLU  41   1.555   3.548   0.539
  329   1HB   GLU  41          1HB       GLU  41   3.010   4.838   2.887
  330   2HB   GLU  41          2HB       GLU  41   3.472   3.257   2.253
  331   1HG   GLU  41          1HG       GLU  41   3.358   5.813   0.631
  332   2HG   GLU  41          2HG       GLU  41   4.837   5.100   1.294
  333    H    LEU  42           H        LEU  42   1.287   1.478   1.158
  334    HA   LEU  42           HA       LEU  42   0.674   0.751   3.900
  335   1HB   LEU  42          1HB       LEU  42  -1.324  -0.668   2.966
  336   2HB   LEU  42          2HB       LEU  42  -1.575   0.957   3.563
  337    HG   LEU  42           HG       LEU  42  -1.109   0.458   0.598
  338   1HD1  LEU  42          1HD1      LEU  42  -3.753   0.357   2.092
  339   2HD1  LEU  42          2HD1      LEU  42  -3.565   0.366   0.328
  340   3HD1  LEU  42          3HD1      LEU  42  -2.959  -1.004   1.271
  341   1HD2  LEU  42          1HD2      LEU  42  -1.900   2.765   2.312
  342   2HD2  LEU  42          2HD2      LEU  42  -1.245   2.743   0.659
  343   3HD2  LEU  42          3HD2      LEU  42  -2.974   2.501   0.954
  344    H    ASP  43           H        ASP  43   0.902  -1.467   4.281
  345    HA   ASP  43           HA       ASP  43   3.051  -2.577   2.744
  346   1HB   ASP  43          1HB       ASP  43   1.510  -3.693   5.114
  347   2HB   ASP  43          2HB       ASP  43   3.041  -4.320   4.483
  348    H    HIS  44           H        HIS  44   3.143  -4.394   1.506
  349    HA   HIS  44           HA       HIS  44   0.623  -5.479   0.413
  350   1HB   HIS  44          1HB       HIS  44   2.461  -4.682  -1.049
  351   2HB   HIS  44          2HB       HIS  44   3.525  -5.919  -0.384
  352    HD1  HIS  44           HD1      HIS  44   2.623  -8.541  -0.893
  353    HD2  HIS  44           HD2      HIS  44   0.946  -5.361  -3.075
  354    HE1  HIS  44           HE1      HIS  44   1.499  -9.574  -2.952
  355    H    ASP  45           H        ASP  45   0.252  -6.377   2.702
  356    HA   ASP  45           HA       ASP  45   0.986  -9.205   2.708
  357   1HB   ASP  45          1HB       ASP  45   2.946  -8.342   3.836
  358   2HB   ASP  45          2HB       ASP  45   1.971  -7.328   4.899
  359    H    LYS  46           H        LYS  46  -0.016  -7.105   5.416
  360    HA   LYS  46           HA       LYS  46  -2.050  -8.782   6.331
  361   1HB   LYS  46          1HB       LYS  46  -1.785  -5.756   6.606
  362   2HB   LYS  46          2HB       LYS  46  -2.871  -6.793   7.551
  363   1HG   LYS  46          1HG       LYS  46  -0.927  -8.024   8.473
  364   2HG   LYS  46          2HG       LYS  46   0.174  -7.036   7.504
  365   1HD   LYS  46          1HD       LYS  46   0.182  -6.172   9.729
  366   2HD   LYS  46          2HD       LYS  46  -0.608  -4.987   8.677
  367   1HE   LYS  46          1HE       LYS  46  -2.830  -5.713   9.501
  368   2HE   LYS  46          2HE       LYS  46  -2.066  -6.996  10.463
  369   1HZ   LYS  46          1HZ       LYS  46  -0.946  -5.266  11.698
  370   2HZ   LYS  46          2HZ       LYS  46  -1.720  -4.102  10.818
  371   3HZ   LYS  46          3HZ       LYS  46  -2.585  -5.113  11.785
  372    H    VAL  47           H        VAL  47  -2.225  -6.018   4.117
  373    HA   VAL  47           HA       VAL  47  -4.961  -5.707   3.838
  374    HB   VAL  47           HB       VAL  47  -4.467  -4.647   1.694
  375   1HG1  VAL  47          1HG1      VAL  47  -4.043  -3.458   3.836
  376   2HG1  VAL  47          2HG1      VAL  47  -2.350  -3.987   3.793
  377   3HG1  VAL  47          3HG1      VAL  47  -2.976  -2.922   2.529
  378   1HG2  VAL  47          1HG2      VAL  47  -1.663  -5.806   2.028
  379   2HG2  VAL  47          2HG2      VAL  47  -2.798  -6.108   0.704
  380   3HG2  VAL  47          3HG2      VAL  47  -2.093  -4.503   0.899
  381    H    MET  48           H        MET  48  -2.848  -8.009   2.064
  382    HA   MET  48           HA       MET  48  -4.612  -8.799   0.086
  383   1HB   MET  48          1HB       MET  48  -2.672 -10.654   1.536
  384   2HB   MET  48          2HB       MET  48  -3.310 -10.843  -0.097
  385   1HG   MET  48          1HG       MET  48  -1.331  -8.773   0.913
  386   2HG   MET  48          2HG       MET  48  -1.062 -10.060  -0.252
  387   1HE   MET  48          1HE       MET  48  -2.160 -10.041  -2.709
  388   2HE   MET  48          2HE       MET  48  -3.796  -9.633  -2.142
  389   3HE   MET  48          3HE       MET  48  -3.019  -8.657  -3.410
  390    H    ASN  49           H        ASN  49  -4.227 -10.273   3.319
  391    HA   ASN  49           HA       ASN  49  -6.240 -12.251   3.072
  392   1HB   ASN  49          1HB       ASN  49  -4.457 -12.266   4.775
  393   2HB   ASN  49          2HB       ASN  49  -5.142 -10.819   5.528
  394   1HD2  ASN  49          2HD2      ASN  49  -5.478 -11.870   7.545
  395   2HD2  ASN  49          1HD2      ASN  49  -6.722 -13.085   7.756
  396    H    MET  50           H        MET  50  -6.326  -8.915   4.431
  397    HA   MET  50           HA       MET  50  -9.007  -9.008   5.330
  398   1HB   MET  50          1HB       MET  50  -7.212  -6.674   4.565
  399   2HB   MET  50          2HB       MET  50  -8.829  -6.491   5.251
  400   1HG   MET  50          1HG       MET  50  -8.126  -7.935   7.187
  401   2HG   MET  50          2HG       MET  50  -6.472  -7.880   6.573
  402   1HE   MET  50          1HE       MET  50  -5.029  -5.646   6.453
  403   2HE   MET  50          2HE       MET  50  -6.298  -4.734   5.593
  404   3HE   MET  50          3HE       MET  50  -5.576  -4.077   7.076
  405    H    GLN  51           H        GLN  51  -7.717  -8.088   2.079
  406    HA   GLN  51           HA       GLN  51 -10.195  -6.955   1.282
  407   1HB   GLN  51          1HB       GLN  51  -8.054  -8.071  -0.572
  408   2HB   GLN  51          2HB       GLN  51  -9.451  -7.049  -0.970
  409   1HG   GLN  51          1HG       GLN  51  -8.410  -5.435   0.867
  410   2HG   GLN  51          2HG       GLN  51  -6.938  -6.348   0.557
  411   1HE2  GLN  51          2HE2      GLN  51  -8.466  -6.326  -2.434
  412   2HE2  GLN  51          1HE2      GLN  51  -7.715  -4.877  -3.054
  413    H    ALA  52           H        ALA  52  -8.792 -10.108   0.283
  414    HA   ALA  52           HA       ALA  52  -9.704 -11.863  -0.806
  415   1HB   ALA  52          1HB       ALA  52 -10.552 -12.300   1.455
  416   2HB   ALA  52          2HB       ALA  52 -12.039 -11.399   1.098
  417   3HB   ALA  52          3HB       ALA  52 -11.673 -12.896   0.217
  418    H    LYS  53           H        LYS  53  -9.863  -9.608  -2.282
  419    HA   LYS  53           HA       LYS  53 -10.757  -8.713  -4.116
  420   1HB   LYS  53          1HB       LYS  53 -10.571 -11.100  -4.784
  421   2HB   LYS  53          2HB       LYS  53 -12.254 -11.356  -4.353
  422   1HG   LYS  53          1HG       LYS  53 -12.730  -9.388  -6.059
  423   2HG   LYS  53          2HG       LYS  53 -11.060  -9.666  -6.579
  424   1HD   LYS  53          1HD       LYS  53 -11.649 -12.081  -6.984
  425   2HD   LYS  53          2HD       LYS  53 -13.316 -11.727  -6.487
  426   1HE   LYS  53          1HE       LYS  53 -13.483 -10.043  -8.332
  427   2HE   LYS  53          2HE       LYS  53 -11.853 -10.497  -8.865
  428   1HZ   LYS  53          1HZ       LYS  53 -12.675 -12.719  -9.227
  429   2HZ   LYS  53          2HZ       LYS  53 -14.185 -12.281  -8.736
  430   3HZ   LYS  53          3HZ       LYS  53 -13.543 -11.626 -10.103
  431    H    ALA  54           H        ALA  54 -13.855 -10.326  -4.009
  432    HA   ALA  54           HA       ALA  54 -15.161  -7.832  -4.320
  433   1HB   ALA  54          1HB       ALA  54 -15.857  -9.909  -5.432
  434   2HB   ALA  54          2HB       ALA  54 -16.298 -10.617  -3.862
  435   3HB   ALA  54          3HB       ALA  54 -17.189  -9.211  -4.488
  436    H    GLU  55           H        GLU  55 -14.623  -9.855  -1.473
  437    HA   GLU  55           HA       GLU  55 -16.687  -8.856   0.197
  438   1HB   GLU  55          1HB       GLU  55 -13.938 -10.037   0.707
  439   2HB   GLU  55          2HB       GLU  55 -14.966  -9.467   2.025
  440   1HG   GLU  55          1HG       GLU  55 -15.301 -11.826   1.773
  441   2HG   GLU  55          2HG       GLU  55 -16.782 -10.987   1.314
  442    H    PHE  56           H        PHE  56 -13.727  -7.339  -0.941
  443    HA   PHE  56           HA       PHE  56 -13.655  -5.326   1.136
  444   1HB   PHE  56          1HB       PHE  56 -11.750  -6.394  -0.306
  445   2HB   PHE  56          2HB       PHE  56 -12.204  -5.237  -1.531
  446    HD1  PHE  56           HD1      PHE  56 -11.669  -5.223   2.224
  447    HD2  PHE  56           HD2      PHE  56 -10.635  -3.452  -1.576
  448    HE1  PHE  56           HE1      PHE  56  -9.968  -3.852   3.333
  449    HE2  PHE  56           HE2      PHE  56  -8.891  -2.098  -0.455
  450    HZ   PHE  56           HZ       PHE  56  -8.517  -2.318   1.994
  451    H    TYR  57           H        TYR  57 -16.181  -5.255   0.163
  452    HA   TYR  57           HA       TYR  57 -16.382  -2.497  -0.820
  453   1HB   TYR  57          1HB       TYR  57 -17.844  -4.815  -2.166
  454   2HB   TYR  57          2HB       TYR  57 -18.165  -3.107  -2.438
  455    HD1  TYR  57           HD1      TYR  57 -15.794  -1.753  -3.025
  456    HD2  TYR  57           HD2      TYR  57 -16.900  -5.786  -4.058
  457    HE1  TYR  57           HE1      TYR  57 -14.294  -1.668  -4.985
  458    HE2  TYR  57           HE2      TYR  57 -15.367  -5.719  -5.987
  459    HH   TYR  57           HH       TYR  57 -13.933  -4.441  -7.239
  460    H    SER  58           H        SER  58 -18.376  -5.407  -0.209
  461    HA   SER  58           HA       SER  58 -20.553  -3.941   0.879
  462   1HB   SER  58          1HB       SER  58 -20.740  -6.108  -0.305
  463   2HB   SER  58          2HB       SER  58 -19.921  -6.919   1.047
  464    HG   SER  58           HG       SER  58 -22.191  -7.036   1.216
  465    H    GLU  59           H        GLU  59 -17.997  -5.951   2.415
  466    HA   GLU  59           HA       GLU  59 -19.153  -5.849   5.016
  467   1HB   GLU  59          1HB       GLU  59 -16.329  -6.562   4.153
  468   2HB   GLU  59          2HB       GLU  59 -17.072  -6.929   5.721
  469   1HG   GLU  59          1HG       GLU  59 -18.879  -8.205   4.480
  470   2HG   GLU  59          2HG       GLU  59 -17.923  -8.017   2.999
  471    H    VAL  60           H        VAL  60 -17.399  -3.438   3.361
  472    HA   VAL  60           HA       VAL  60 -16.782  -1.405   3.896
  473    HB   VAL  60           HB       VAL  60 -17.686  -1.835   6.765
  474   1HG1  VAL  60          1HG1      VAL  60 -17.226   0.678   5.118
  475   2HG1  VAL  60          2HG1      VAL  60 -17.984   0.627   6.720
  476   3HG1  VAL  60          3HG1      VAL  60 -16.298   0.155   6.542
  477   1HG2  VAL  60          1HG2      VAL  60 -19.209  -0.888   4.310
  478   2HG2  VAL  60          2HG2      VAL  60 -19.584  -2.308   5.310
  479   3HG2  VAL  60          3HG2      VAL  60 -19.783  -0.689   5.980
  480    H    LEU  61           H        LEU  61 -14.969  -0.302   4.525
  481    HA   LEU  61           HA       LEU  61 -12.837  -1.743   5.999
  482   1HB   LEU  61          1HB       LEU  61 -11.342  -0.964   4.031
  483   2HB   LEU  61          2HB       LEU  61 -12.257  -2.454   3.870
  484    HG   LEU  61           HG       LEU  61 -13.609   0.020   2.859
  485   1HD1  LEU  61          1HD1      LEU  61 -11.205   0.174   2.047
  486   2HD1  LEU  61          2HD1      LEU  61 -11.508  -1.341   1.183
  487   3HD1  LEU  61          3HD1      LEU  61 -12.463   0.097   0.799
  488   1HD2  LEU  61          1HD2      LEU  61 -13.337  -2.811   1.754
  489   2HD2  LEU  61          2HD2      LEU  61 -14.731  -2.221   2.662
  490   3HD2  LEU  61          3HD2      LEU  61 -14.357  -1.531   1.087
  491    H    THR  62           H        THR  62 -11.030  -0.313   6.531
  492    HA   THR  62           HA       THR  62 -11.688   2.570   6.718
  493    HB   THR  62           HB       THR  62 -11.246   0.660   9.059
  494    HG1  THR  62           HG1      THR  62 -13.371   0.758   8.271
  495   1HG2  THR  62          1HG2      THR  62 -11.437   3.701   9.009
  496   2HG2  THR  62          2HG2      THR  62 -11.561   2.695  10.471
  497   3HG2  THR  62          3HG2      THR  62 -10.051   2.733   9.552
  498    H    ILE  63           H        ILE  63  -9.888   3.822   6.610
  499    HA   ILE  63           HA       ILE  63  -7.219   2.464   6.620
  500    HB   ILE  63           HB       ILE  63  -8.044   5.062   5.297
  501   1HG1  ILE  63          1HG1      ILE  63  -7.515   2.362   3.967
  502   2HG1  ILE  63          2HG1      ILE  63  -9.124   3.035   4.256
  503   1HG2  ILE  63          1HG2      ILE  63  -5.623   4.865   5.961
  504   2HG2  ILE  63          2HG2      ILE  63  -5.518   3.366   5.022
  505   3HG2  ILE  63          3HG2      ILE  63  -5.836   4.916   4.218
  506   1HD1  ILE  63          1HD1      ILE  63  -8.468   5.082   2.952
  507   2HD1  ILE  63          2HD1      ILE  63  -7.007   4.201   2.434
  508   3HD1  ILE  63          3HD1      ILE  63  -8.615   3.580   2.040
  509    H    VAL  64           H        VAL  64  -5.880   2.988   8.241
  510    HA   VAL  64           HA       VAL  64  -6.502   5.178  10.108
  511    HB   VAL  64           HB       VAL  64  -4.204   3.180  10.058
  512   1HG1  VAL  64          1HG1      VAL  64  -5.232   5.061  12.236
  513   2HG1  VAL  64          2HG1      VAL  64  -3.971   3.828  12.447
  514   3HG1  VAL  64          3HG1      VAL  64  -3.681   5.207  11.383
  515   1HG2  VAL  64          1HG2      VAL  64  -6.839   3.141  11.590
  516   2HG2  VAL  64          2HG2      VAL  64  -6.343   1.999  10.322
  517   3HG2  VAL  64          3HG2      VAL  64  -5.474   2.039  11.858
  518    H    VAL  65           H        VAL  65  -6.297   6.957   8.626
  519    HA   VAL  65           HA       VAL  65  -3.705   7.419   7.291
  520    HB   VAL  65           HB       VAL  65  -6.179   9.183   7.443
  521   1HG1  VAL  65          1HG1      VAL  65  -3.713   9.271   5.638
  522   2HG1  VAL  65          2HG1      VAL  65  -5.149  10.302   5.482
  523   3HG1  VAL  65          3HG1      VAL  65  -4.107  10.454   6.899
  524   1HG2  VAL  65          1HG2      VAL  65  -5.231   7.243   5.289
  525   2HG2  VAL  65          2HG2      VAL  65  -6.703   7.081   6.278
  526   3HG2  VAL  65          3HG2      VAL  65  -6.563   8.401   5.111
  527    H    ASP  66           H        ASP  66  -2.406   7.378   9.195
  528    HA   ASP  66           HA       ASP  66  -1.246   8.265  10.923
  529   1HB   ASP  66          1HB       ASP  66  -2.132  10.894   9.654
  530   2HB   ASP  66          2HB       ASP  66  -0.844  10.705  10.845
  531    H    GLY  67           H        GLY  67  -3.312   7.232  11.980
  532   1HA   GLY  67          1HA       GLY  67  -4.592   7.193  13.864
  533   2HA   GLY  67          2HA       GLY  67  -3.900   8.755  14.327
  534    H    LYS  68           H        LYS  68  -5.789   7.976  11.375
  535    HA   LYS  68           HA       LYS  68  -8.206   9.315  12.457
  536   1HB   LYS  68          1HB       LYS  68  -6.982   9.997   9.750
  537   2HB   LYS  68          2HB       LYS  68  -8.523  10.560  10.402
  538   1HG   LYS  68          1HG       LYS  68  -7.333  11.762  12.218
  539   2HG   LYS  68          2HG       LYS  68  -5.784  11.154  11.612
  540   1HD   LYS  68          1HD       LYS  68  -6.016  13.394  10.867
  541   2HD   LYS  68          2HD       LYS  68  -6.123  12.319   9.464
  542   1HE   LYS  68          1HE       LYS  68  -8.582  12.594   9.421
  543   2HE   LYS  68          2HE       LYS  68  -8.518  13.558  10.911
  544   1HZ   LYS  68          1HZ       LYS  68  -7.291  14.281   8.342
  545   2HZ   LYS  68          2HZ       LYS  68  -8.681  14.913   8.963
  546   3HZ   LYS  68          3HZ       LYS  68  -7.244  15.184   9.720
  547    H    GLU  69           H        GLU  69  -9.691   7.726  12.311
  548    HA   GLU  69           HA       GLU  69  -9.445   5.497  10.467
  549   1HB   GLU  69          1HB       GLU  69 -11.629   6.353  12.407
  550   2HB   GLU  69          2HB       GLU  69 -11.652   4.878  11.424
  551   1HG   GLU  69          1HG       GLU  69  -9.574   4.094  12.496
  552   2HG   GLU  69          2HG       GLU  69  -9.524   5.564  13.490
  553    H    ILE  70           H        ILE  70  -9.438   6.541   8.405
  554    HA   ILE  70           HA       ILE  70 -11.841   7.979   7.503
  555    HB   ILE  70           HB       ILE  70  -9.442   6.969   5.934
  556   1HG1  ILE  70          1HG1      ILE  70  -8.550   8.503   7.509
  557   2HG1  ILE  70          2HG1      ILE  70  -8.690   9.345   5.973
  558   1HG2  ILE  70          1HG2      ILE  70 -11.627   8.974   5.240
  559   2HG2  ILE  70          2HG2      ILE  70 -10.173   8.646   4.266
  560   3HG2  ILE  70          3HG2      ILE  70 -11.381   7.385   4.511
  561   1HD1  ILE  70          1HD1      ILE  70 -10.813  10.432   6.826
  562   2HD1  ILE  70          2HD1      ILE  70 -10.506   9.664   8.402
  563   3HD1  ILE  70          3HD1      ILE  70  -9.352  10.832   7.746
  564    H    LYS  71           H        LYS  71 -13.581   6.633   7.620
  565    HA   LYS  71           HA       LYS  71 -13.616   3.878   6.796
  566   1HB   LYS  71          1HB       LYS  71 -15.741   5.970   7.352
  567   2HB   LYS  71          2HB       LYS  71 -16.153   4.413   6.631
  568   1HG   LYS  71          1HG       LYS  71 -16.508   4.288   8.982
  569   2HG   LYS  71          2HG       LYS  71 -15.208   3.188   8.511
  570   1HD   LYS  71          1HD       LYS  71 -13.523   4.775   9.355
  571   2HD   LYS  71          2HD       LYS  71 -14.790   5.937   9.788
  572   1HE   LYS  71          1HE       LYS  71 -14.440   3.122  10.939
  573   2HE   LYS  71          2HE       LYS  71 -13.925   4.623  11.722
  574   1HZ   LYS  71          1HZ       LYS  71 -16.191   5.333  11.773
  575   2HZ   LYS  71          2HZ       LYS  71 -16.692   3.918  11.090
  576   3HZ   LYS  71          3HZ       LYS  71 -15.985   3.911  12.577
  577    H    VAL  72           H        VAL  72 -13.957   2.991   4.832
  578    HA   VAL  72           HA       VAL  72 -14.510   4.694   2.470
  579    HB   VAL  72           HB       VAL  72 -12.612   3.342   1.340
  580   1HG1  VAL  72          1HG1      VAL  72 -11.920   5.470   3.390
  581   2HG1  VAL  72          2HG1      VAL  72 -10.854   4.918   2.091
  582   3HG1  VAL  72          3HG1      VAL  72 -12.370   5.725   1.690
  583   1HG2  VAL  72          1HG2      VAL  72 -12.314   1.771   3.315
  584   2HG2  VAL  72          2HG2      VAL  72 -10.831   2.510   2.691
  585   3HG2  VAL  72          3HG2      VAL  72 -11.564   3.112   4.189
  586    H    LYS  73           H        LYS  73 -14.781   3.325   0.520
  587    HA   LYS  73           HA       LYS  73 -16.083   0.681   1.046
  588   1HB   LYS  73          1HB       LYS  73 -17.011   3.042  -0.628
  589   2HB   LYS  73          2HB       LYS  73 -17.608   1.407  -0.917
  590   1HG   LYS  73          1HG       LYS  73 -17.839   2.760   1.803
  591   2HG   LYS  73          2HG       LYS  73 -19.043   2.922   0.514
  592   1HD   LYS  73          1HD       LYS  73 -19.293   0.422   0.451
  593   2HD   LYS  73          2HD       LYS  73 -18.162   0.296   1.804
  594   1HE   LYS  73          1HE       LYS  73 -20.433   0.120   2.615
  595   2HE   LYS  73          2HE       LYS  73 -19.697   1.610   3.235
  596   1HZ   LYS  73          1HZ       LYS  73 -21.530   1.407   0.942
  597   2HZ   LYS  73          2HZ       LYS  73 -21.939   1.914   2.454
  598   3HZ   LYS  73          3HZ       LYS  73 -20.897   2.805   1.545
  599    H    ALA  74           H        ALA  74 -14.429   2.814  -1.263
  600    HA   ALA  74           HA       ALA  74 -12.985   2.459  -2.903
  601   1HB   ALA  74          1HB       ALA  74 -11.960   0.674  -1.463
  602   2HB   ALA  74          2HB       ALA  74 -12.947  -0.530  -2.325
  603   3HB   ALA  74          3HB       ALA  74 -11.746   0.430  -3.200
  604    H    GLN  75           H        GLN  75 -12.745   1.788  -5.072
  605    HA   GLN  75           HA       GLN  75 -15.224   0.712  -6.348
  606   1HB   GLN  75          1HB       GLN  75 -13.652   3.236  -7.015
  607   2HB   GLN  75          2HB       GLN  75 -14.765   2.462  -8.150
  608   1HG   GLN  75          1HG       GLN  75 -15.524   3.473  -5.377
  609   2HG   GLN  75          2HG       GLN  75 -15.767   4.369  -6.879
  610   1HE2  GLN  75          2HE2      GLN  75 -16.947   2.970  -8.672
  611   2HE2  GLN  75          1HE2      GLN  75 -18.381   2.138  -8.105
  612    H    ASP  76           H        ASP  76 -12.143   1.971  -7.700
  613    HA   ASP  76           HA       ASP  76 -11.912  -0.490  -9.273
  614   1HB   ASP  76          1HB       ASP  76 -10.234   2.039  -9.322
  615   2HB   ASP  76          2HB       ASP  76 -10.165   0.697 -10.461
  616    H    VAL  77           H        VAL  77 -11.638  -1.801  -7.356
  617    HA   VAL  77           HA       VAL  77  -9.113  -1.754  -5.883
  618    HB   VAL  77           HB       VAL  77 -11.449  -3.698  -6.053
  619   1HG1  VAL  77          1HG1      VAL  77  -8.983  -3.830  -4.302
  620   2HG1  VAL  77          2HG1      VAL  77 -10.471  -4.750  -4.003
  621   3HG1  VAL  77          3HG1      VAL  77  -9.531  -5.050  -5.465
  622   1HG2  VAL  77          1HG2      VAL  77 -11.892  -1.500  -4.930
  623   2HG2  VAL  77          2HG2      VAL  77 -11.959  -2.859  -3.798
  624   3HG2  VAL  77          3HG2      VAL  77 -10.529  -1.812  -3.838
  625    H    GLN  78           H        GLN  78  -7.365  -2.030  -7.277
  626    HA   GLN  78           HA       GLN  78  -7.482  -4.046  -9.417
  627   1HB   GLN  78          1HB       GLN  78  -5.141  -2.285  -8.620
  628   2HB   GLN  78          2HB       GLN  78  -5.374  -3.185 -10.117
  629   1HG   GLN  78          1HG       GLN  78  -6.988  -0.779  -9.155
  630   2HG   GLN  78          2HG       GLN  78  -5.826  -0.819 -10.476
  631   1HE2  GLN  78          2HE2      GLN  78  -6.331  -2.299 -12.350
  632   2HE2  GLN  78          1HE2      GLN  78  -8.013  -2.509 -12.788
  633    H    ARG  79           H        ARG  79  -7.965  -5.577  -7.515
  634    HA   ARG  79           HA       ARG  79  -5.479  -6.699  -6.357
  635   1HB   ARG  79          1HB       ARG  79  -7.378  -6.225  -4.863
  636   2HB   ARG  79          2HB       ARG  79  -8.403  -7.361  -5.745
  637   1HG   ARG  79          1HG       ARG  79  -5.731  -8.322  -4.720
  638   2HG   ARG  79          2HG       ARG  79  -6.997  -8.030  -3.530
  639   1HD   ARG  79          1HD       ARG  79  -8.335  -9.740  -4.266
  640   2HD   ARG  79          2HD       ARG  79  -7.693  -9.735  -5.911
  641    HE   ARG  79           HE       ARG  79  -5.506 -10.514  -4.839
  642   1HH1  ARG  79          1HH2      ARG  79  -8.722 -11.665  -3.808
  643   2HH1  ARG  79          2HH2      ARG  79  -8.125 -13.252  -3.408
  644   1HH2  ARG  79          1HH1      ARG  79  -4.785 -12.564  -4.327
  645   2HH2  ARG  79          2HH1      ARG  79  -5.880 -13.767  -3.697
  646    H    HIS  80           H        HIS  80  -4.498  -8.278  -7.444
  647    HA   HIS  80           HA       HIS  80  -5.709  -9.619  -9.678
  648   1HB   HIS  80          1HB       HIS  80  -3.324  -8.981  -9.465
  649   2HB   HIS  80          2HB       HIS  80  -3.121 -10.184  -8.189
  650    HD1  HIS  80           HD1      HIS  80  -5.214 -11.909 -10.600
  651    HD2  HIS  80           HD2      HIS  80  -1.213 -10.621 -10.469
  652    HE1  HIS  80           HE1      HIS  80  -3.967 -13.201 -12.411
  653    HA   PRO  81           HA       PRO  81  -7.587 -12.529  -6.698
  654   1HB   PRO  81          1HB       PRO  81  -8.891 -14.221  -8.442
  655   2HB   PRO  81          2HB       PRO  81  -9.485 -12.615  -7.934
  656   1HG   PRO  81          1HG       PRO  81  -7.979 -13.299 -10.461
  657   2HG   PRO  81          2HG       PRO  81  -9.452 -12.307 -10.288
  658   1HD   PRO  81          1HD       PRO  81  -7.031 -11.160 -10.501
  659   2HD   PRO  81          2HD       PRO  81  -8.241 -10.504  -9.367
  660    H    TYR  82           H        TYR  82  -6.154 -13.925  -9.712
  661    HA   TYR  82           HA       TYR  82  -5.204 -16.312  -8.362
  662   1HB   TYR  82          1HB       TYR  82  -4.625 -15.129 -11.099
  663   2HB   TYR  82          2HB       TYR  82  -4.019 -16.680 -10.526
  664    HD1  TYR  82           HD1      TYR  82  -6.887 -14.928 -11.945
  665    HD2  TYR  82           HD2      TYR  82  -5.621 -18.539  -9.955
  666    HE1  TYR  82           HE1      TYR  82  -8.986 -16.049 -12.638
  667    HE2  TYR  82           HE2      TYR  82  -7.704 -19.666 -10.674
  668    HH   TYR  82           HH       TYR  82  -9.692 -19.465 -11.819
  669    H    LYS  83           H        LYS  83  -3.756 -15.986  -6.804
  670    HA   LYS  83           HA       LYS  83  -1.801 -15.766  -5.832
  671   1HB   LYS  83          1HB       LYS  83  -0.606 -14.686  -8.422
  672   2HB   LYS  83          2HB       LYS  83   0.265 -15.252  -7.004
  673   1HG   LYS  83          1HG       LYS  83  -0.789 -17.512  -7.268
  674   2HG   LYS  83          2HG       LYS  83  -1.542 -16.952  -8.777
  675   1HD   LYS  83          1HD       LYS  83   0.707 -16.455  -9.707
  676   2HD   LYS  83          2HD       LYS  83   1.449 -17.067  -8.209
  677   1HE   LYS  83          1HE       LYS  83   0.374 -19.290  -8.602
  678   2HE   LYS  83          2HE       LYS  83  -0.329 -18.673 -10.112
  679   1HZ   LYS  83          1HZ       LYS  83   1.891 -18.327 -10.925
  680   2HZ   LYS  83          2HZ       LYS  83   2.539 -18.909  -9.524
  681   3HZ   LYS  83          3HZ       LYS  83   1.662 -19.902 -10.502
  682    HA   PRO  84           HA       PRO  84  -2.290 -11.751  -4.262
  683   1HB   PRO  84          1HB       PRO  84  -0.194 -11.471  -2.499
  684   2HB   PRO  84          2HB       PRO  84  -1.545 -12.612  -2.259
  685   1HG   PRO  84          1HG       PRO  84   1.177 -13.204  -3.454
  686   2HG   PRO  84          2HG       PRO  84   0.332 -14.099  -2.156
  687   1HD   PRO  84          1HD       PRO  84   0.224 -14.936  -4.724
  688   2HD   PRO  84          2HD       PRO  84  -1.228 -15.016  -3.681
  689    H    LYS  85           H        LYS  85  -2.096 -10.040  -5.619
  690    HA   LYS  85           HA       LYS  85   0.443  -8.667  -5.725
  691   1HB   LYS  85          1HB       LYS  85   0.642 -10.215  -7.683
  692   2HB   LYS  85          2HB       LYS  85  -0.841  -9.537  -8.335
  693   1HG   LYS  85          1HG       LYS  85   1.100  -8.560  -9.416
  694   2HG   LYS  85          2HG       LYS  85   0.189  -7.332  -8.540
  695   1HD   LYS  85          1HD       LYS  85   2.584  -7.009  -8.357
  696   2HD   LYS  85          2HD       LYS  85   1.888  -7.253  -6.763
  697   1HE   LYS  85          1HE       LYS  85   3.124  -9.574  -8.319
  698   2HE   LYS  85          2HE       LYS  85   4.139  -8.421  -7.443
  699   1HZ   LYS  85          1HZ       LYS  85   2.987  -8.942  -5.442
  700   2HZ   LYS  85          2HZ       LYS  85   2.045 -10.060  -6.196
  701   3HZ   LYS  85          3HZ       LYS  85   3.670 -10.286  -6.100
  702    H    LEU  86           H        LEU  86  -0.427  -6.989  -4.680
  703    HA   LEU  86           HA       LEU  86  -2.912  -5.717  -5.639
  704   1HB   LEU  86          1HB       LEU  86  -1.894  -6.188  -3.099
  705   2HB   LEU  86          2HB       LEU  86  -1.404  -4.526  -3.364
  706    HG   LEU  86           HG       LEU  86  -3.799  -4.001  -3.967
  707   1HD1  LEU  86          1HD1      LEU  86  -4.492  -6.424  -4.447
  708   2HD1  LEU  86          2HD1      LEU  86  -4.375  -6.748  -2.723
  709   3HD1  LEU  86          3HD1      LEU  86  -5.553  -5.578  -3.327
  710   1HD2  LEU  86          1HD2      LEU  86  -2.698  -3.827  -1.600
  711   2HD2  LEU  86          2HD2      LEU  86  -4.464  -3.740  -1.708
  712   3HD2  LEU  86          3HD2      LEU  86  -3.666  -5.237  -1.196
  713    H    GLN  87           H        GLN  87  -2.525  -4.653  -7.470
  714    HA   GLN  87           HA       GLN  87  -0.023  -3.317  -8.035
  715   1HB   GLN  87          1HB       GLN  87  -2.756  -3.178  -9.382
  716   2HB   GLN  87          2HB       GLN  87  -1.269  -2.512 -10.059
  717   1HG   GLN  87          1HG       GLN  87  -1.727  -5.473  -9.436
  718   2HG   GLN  87          2HG       GLN  87  -1.975  -4.715 -11.010
  719   1HE2  GLN  87          2HE2      GLN  87  -0.342  -6.752 -11.164
  720   2HE2  GLN  87          1HE2      GLN  87   1.333  -6.252 -11.283
  721    H    HIS  88           H        HIS  88  -3.352  -2.224  -7.279
  722    HA   HIS  88           HA       HIS  88  -2.447   0.181  -5.938
  723   1HB   HIS  88          1HB       HIS  88  -2.272   0.788  -8.382
  724   2HB   HIS  88          2HB       HIS  88  -3.982   0.390  -8.571
  725    HD1  HIS  88           HD1      HIS  88  -5.683   2.335  -7.886
  726    HD2  HIS  88           HD2      HIS  88  -1.666   2.934  -6.739
  727    HE1  HIS  88           HE1      HIS  88  -5.522   4.698  -6.970
  728    H    ILE  89           H        ILE  89  -4.367   1.331  -5.023
  729    HA   ILE  89           HA       ILE  89  -6.963  -0.053  -5.310
  730    HB   ILE  89           HB       ILE  89  -5.802   0.764  -2.620
  731   1HG1  ILE  89          1HG1      ILE  89  -4.845  -1.409  -3.443
  732   2HG1  ILE  89          2HG1      ILE  89  -5.761  -1.499  -1.947
  733   1HG2  ILE  89          1HG2      ILE  89  -8.514  -0.348  -3.453
  734   2HG2  ILE  89          2HG2      ILE  89  -7.940  -0.298  -1.776
  735   3HG2  ILE  89          3HG2      ILE  89  -8.178   1.203  -2.682
  736   1HD1  ILE  89          1HD1      ILE  89  -6.967  -2.234  -4.648
  737   2HD1  ILE  89          2HD1      ILE  89  -6.207  -3.374  -3.537
  738   3HD1  ILE  89          3HD1      ILE  89  -7.653  -2.492  -3.030
  739    H    ASP  90           H        ASP  90  -8.370   1.373  -5.967
  740    HA   ASP  90           HA       ASP  90  -8.014   4.276  -5.419
  741   1HB   ASP  90          1HB       ASP  90  -9.855   2.764  -7.292
  742   2HB   ASP  90          2HB       ASP  90  -9.768   4.520  -7.131
  743    H    PHE  91           H        PHE  91  -8.522   4.096  -3.175
  744    HA   PHE  91           HA       PHE  91 -10.986   2.928  -2.223
  745   1HB   PHE  91          1HB       PHE  91  -9.135   4.961  -0.956
  746   2HB   PHE  91          2HB       PHE  91 -10.458   4.140  -0.148
  747    HD1  PHE  91           HD1      PHE  91 -10.376   1.642   0.184
  748    HD2  PHE  91           HD2      PHE  91  -6.963   3.947  -1.101
  749    HE1  PHE  91           HE1      PHE  91  -8.854  -0.010   1.236
  750    HE2  PHE  91           HE2      PHE  91  -5.453   2.268  -0.077
  751    HZ   PHE  91           HZ       PHE  91  -6.390   0.293   1.098
  752    H    VAL  92           H        VAL  92 -12.909   4.126  -1.530
  753    HA   VAL  92           HA       VAL  92 -12.962   7.005  -2.183
  754    HB   VAL  92           HB       VAL  92 -14.082   5.806  -4.048
  755   1HG1  VAL  92          1HG1      VAL  92 -16.203   5.082  -1.970
  756   2HG1  VAL  92          2HG1      VAL  92 -16.352   4.922  -3.719
  757   3HG1  VAL  92          3HG1      VAL  92 -15.160   3.946  -2.857
  758   1HG2  VAL  92          1HG2      VAL  92 -14.588   8.145  -3.472
  759   2HG2  VAL  92          2HG2      VAL  92 -16.015   7.307  -4.096
  760   3HG2  VAL  92          3HG2      VAL  92 -15.863   7.607  -2.355
  761    H    ARG  93           H        ARG  93 -13.749   8.213  -0.606
  762    HA   ARG  93           HA       ARG  93 -14.044   7.190   2.010
  763   1HB   ARG  93          1HB       ARG  93 -14.732   9.857   0.747
  764   2HB   ARG  93          2HB       ARG  93 -14.864   9.551   2.490
  765   1HG   ARG  93          1HG       ARG  93 -12.528   9.097   2.717
  766   2HG   ARG  93          2HG       ARG  93 -12.290   9.002   0.970
  767   1HD   ARG  93          1HD       ARG  93 -12.853  11.398   0.743
  768   2HD   ARG  93          2HD       ARG  93 -13.022  11.539   2.492
  769    HE   ARG  93           HE       ARG  93 -10.569  11.193   0.868
  770   1HH1  ARG  93          1HH2      ARG  93 -11.890  11.351   4.171
  771   2HH1  ARG  93          2HH2      ARG  93 -10.318  11.502   4.910
  772   1HH2  ARG  93          1HH1      ARG  93  -8.532  11.314   1.870
  773   2HH2  ARG  93          2HH1      ARG  93  -8.406  11.484   3.601
  774    H    ALA  94           H        ALA  94 -15.727   6.491   3.182
  775    HA   ALA  94           HA       ALA  94 -18.203   5.802   1.892
  776   1HB   ALA  94          1HB       ALA  94 -17.146   4.427   3.659
  777   2HB   ALA  94          2HB       ALA  94 -17.401   5.739   4.830
  778   3HB   ALA  94          3HB       ALA  94 -18.796   4.908   4.106