*HEADER    BIOSYNTHETIC PROTEIN                    11-MAR-03   1OR5              
*TITLE     SOLUTION STRUCTURE OF THE HOLO-FORM OF THE FRENOLICIN ACYL            
*TITLE    2 CARRIER PROTEIN, MINIMIZED MEAN STRUCTURE                            
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: ACYL CARRIER PROTEIN;                                      
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 SYNONYM: FREN N, FREN ACP;                                           
*COMPND   5 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: STREPTOMYCES ROSEOFULVUS;                       
*SOURCE   3 ORGANISM_COMMON: BACTERIA;                                           
*SOURCE   4 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   5 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   6 EXPRESSION_SYSTEM_STRAIN: BL21DE3;                                   
*SOURCE   7 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   8 EXPRESSION_SYSTEM_PLASMID: PET21C-FRENACP                            
*KEYWDS    ACYL CARRIER PROTEIN, ACP, BIOSYNTHESIS, FRENOLICIN, HOLO,            
*KEYWDS   2 POLYKETIDE SYNTHASE, PKS                                             
*EXPDTA    NMR                                                                   
*AUTHOR    Q.LI, C.KHOSLA, J.PUGLISI, C.W.LIU                                    
*REVDAT   1   01-JUL-03 1OR5    0                                                

  2 ALA  HN      3 LEU  HN      3.50                 
  2 ALA  HN      2 ALA  QB      5.00              
  2 ALA  HA      3 LEU  HN      4.20             
  2 ALA  QB      3 LEU  HN      5.00                 
  2 ALA  QB     76 ASN  QB      7.50 
  2 ALA  QB     76 ASN  QD2     7.50 
  3 LEU  HN      3 LEU  HB2     3.50                 
  3 LEU  HN      3 LEU  HB3     3.50                 
  3 LEU  HN      3 LEU  HG      5.00                 
  3 LEU  HN      3 LEU  QD1     6.00                 
  3 LEU  HN      3 LEU  QD2     6.00                 
  3 LEU  HN      3 LEU  QQD     6.00                 
  3 LEU  HN      4 THR  HN      5.00                 
  3 LEU  HN     75 VAL  QG1     6.00 
  3 LEU  HN     76 ASN  QD2     3.50 
  3 LEU  HA      3 LEU  HG      4.20 
  3 LEU  HA      3 LEU  QD1     5.00                 
  3 LEU  HA      3 LEU  QD2     5.00                 
  3 LEU  HA      4 THR  HN      3.50                 
  3 LEU  HB2     3 LEU  QD1     3.50 
  3 LEU  HB2     4 THR  HN      4.20                 
  3 LEU  HB2    53 TYR  HB2    10.00 
  3 LEU  HB3     3 LEU  QD1     5.00 
  3 LEU  HB3     3 LEU  QD2     3.50 
  3 LEU  HB3     4 THR  HN      4.20                 
  3 LEU  HB3    75 VAL  QG1     4.20 
  3 LEU  QB      3 LEU  HG      2.90                 
  3 LEU  QB      4 THR  HN      4.20                 
  3 LEU  HG      4 THR  HN      4.20                 
  3 LEU  HG      3 LEU  QD1     3.50 
  3 LEU  HG      7 ASP  HB3     4.20                                 
  3 LEU  HG     53 TYR  HB3    12.00 
  3 LEU  QD1     4 THR  HN      5.00   
  3 LEU  QD1     8 LEU  HA      7.50  
  3 LEU  QD1     8 LEU  HN      6.00 
  3 LEU  QD1    75 VAL  HB      5.00                 
  3 LEU  QD2     8 LEU  HA      7.50 
  3 LEU  QD2    72 LEU  HA      5.00 
  3 LEU  QD2    72 LEU  QD1     5.00 
  3 LEU  QD2    72 LEU  QD2     7.50 
  3 LEU  QD2    75 VAL  HB      5.00                 
  3 LEU  QD2     4 THR  HN      5.00    
  3 LEU  QD2     8 LEU  HN      6.00              
  3 LEU  QQD     7 ASP  HB2     5.00                 
  3 LEU  QQD     7 ASP  HB3     5.00                                                  
  3 LEU  QQD    49 LEU  QB      7.50 
  3 LEU  QQD    49 LEU  QQD     7.50 
  3 LEU  QQD    53 TYR  HE2    15.00                                                
  3 LEU  QQD    75 VAL  HB      5.00                 
  3 LEU  QQD    75 VAL  QQG     5.00                 
  4 THR  HN      4 THR  QG2     3.50                 
  4 THR  HN      5 VAL  HN      5.00                 
  4 THR  HN      6 ASP  HN      5.00                 
  4 THR  HN      7 ASP  HN      4.20               
  4 THR  HN      7 ASP  HB2     3.50                 
  4 THR  HN      7 ASP  HB3     4.20                                
  4 THR  HA      4 THR  QG2     4.20                 
  4 THR  HA      5 VAL  HN      3.50                 
  4 THR  HA      6 ASP  HN      5.00                 
  4 THR  HB      5 VAL  HN      5.00                 
  4 THR  HB      6 ASP  HN      6.00                 
  4 THR  QG2     5 VAL  HN      5.00                 
  4 THR  QG2     6 ASP  HA      7.50 
  4 THR  QG2     6 ASP  HN      5.00                 
  4 THR  QG2     6 ASP  HB2     7.50                 
  4 THR  QG2     7 ASP  HN      7.50                 
  4 THR  QG2     9 LYS  HN      7.50                
  5 VAL  HN      5 VAL  HB      2.90                 
  5 VAL  HN      5 VAL  QG1     5.00                 
  5 VAL  HN      5 VAL  QG2     4.20                 
  5 VAL  HN      6 ASP  HN      2.90                                 
  5 VAL  HN      8 LEU  HN      5.00 
  5 VAL  HN     72 LEU  QQD     5.00                 
  5 VAL  HA      5 VAL  QG1     5.00 
  5 VAL  HA      5 VAL  QG2     3.50 
  5 VAL  HA      6 ASP  HN      5.00 
  5 VAL  HA      8 LEU  HN      4.20                
  5 VAL  HA      8 LEU  HB2     5.00                 
  5 VAL  HA      8 LEU  HB3     3.50                 
  5 VAL  HA      8 LEU  HG      6.00                 
  5 VAL  HA      9 LYS  HN      4.20                 
  5 VAL  HA     72 LEU  QD2     3.50  
  5 VAL  HB      5 VAL  QG2     2.90 
  5 VAL  HB      6 ASP  HN      4.20                 
  5 VAL  QG1     6 ASP  HN      4.20                 
  5 VAL  QG1     6 ASP  HB2     7.00                 
  5 VAL  QG1     7 ASP  HN      6.00                 
  5 VAL  QG1     9 LYS  HN      6.00                 
  5 VAL  QG1     9 LYS  HA      6.50                
  5 VAL  QG1     9 LYS  HG3     7.50                 
  5 VAL  QG1     9 LYS  QD      6.00                 
  5 VAL  QG1     9 LYS  QE      7.50               
  5 VAL  QG1    72 LEU  QD2     6.00 
  5 VAL  QG1    25 ALA  HA      5.00 
  5 VAL  QG1    25 ALA  QB      7.50 
  5 VAL  QG2     6 ASP  HN      6.00                 
  5 VAL  QG2     8 LEU  HN      6.00                 
  5 VAL  QG2     9 LYS  HA      7.50                 
  5 VAL  QG2     9 LYS  HD3     7.50 
  5 VAL  QG2    24 LEU  HB3     5.00  
  5 VAL  QG2    69 ARG  HB2     7.50  
  5 VAL  QG2    72 LEU  QD2     5.00            
  6 ASP  HN      6 ASP  HB2     3.50                 
  6 ASP  HN      6 ASP  HB3     3.50                 
  6 ASP  HN      6 ASP  QB      3.50                 
  6 ASP  HN      7 ASP  HN      2.90                 
  6 ASP  HA      8 LEU  QD1     7.50 
  6 ASP  HA      9 LYS  HN      4.20                
  6 ASP  HA      9 LYS  HB2     4.20                 
  6 ASP  HA      9 LYS  HB3     3.50                 
  6 ASP  HA      9 LYS  QB      3.50                 
  6 ASP  HA      9 LYS  HG3     6.00                 
  6 ASP  HA      9 LYS  HD2     6.00                 
  6 ASP  HA      9 LYS  HD3     6.00                 
  6 ASP  HA      9 LYS  QD      6.00                 
  6 ASP  HA      9 LYS  QE      6.00                 
  6 ASP  QB      7 ASP  HN      4.20                 
  7 ASP  HN      7 ASP  HB2     3.50                 
  7 ASP  HN      7 ASP  HB3     3.50                 
  7 ASP  HN      8 LEU  HN      2.90                 
  7 ASP  HN      8 LEU  HB2     6.00      
  7 ASP  HA      7 ASP  HB2     3.50                 
  7 ASP  HA      7 ASP  HB3     2.90                 
  7 ASP  HA      8 LEU  HN      4.20  
  7 ASP  HA     10 LYS  HN      4.20               
  7 ASP  HA     10 LYS  QB      4.20                 
  7 ASP  HA     10 LYS  QG      6.00                 
  7 ASP  HA     10 LYS  QD      6.00                 
  7 ASP  HB2     8 LEU  HN      3.50                 
  7 ASP  HB3     8 LEU  HN      3.50                 
  8 LEU  HN      8 LEU  HB2     3.50                 
  8 LEU  HN      8 LEU  HB3     2.90                 
  8 LEU  HN      8 LEU  HG      5.00                 
  8 LEU  HN      8 LEU  QD2     6.00                
  8 LEU  HN      9 LYS  HN      2.90                 
  8 LEU  HN     10 LYS  HN      5.00                 
  8 LEU  HN     72 LEU  QD1     7.50 
  8 LEU  HA      8 LEU  HG      4.20                 
  8 LEU  HA      8 LEU  QD1     4.20                 
  8 LEU  HA      8 LEU  QD2     6.00                 
  8 LEU  HA      9 LYS  HN      5.00 
  8 LEU  HA     11 LEU  HB2     5.00                                
  8 LEU  HB2     9 LYS  HN      5.00                 
  8 LEU  HB2    12 LEU  QQD     7.50                              
  8 LEU  HB2    72 LEU  QQD     7.50 
  8 LEU  HB3     9 LYS  HN      5.00                 
  8 LEU  HB3    12 LEU  QQD     7.50                 
  8 LEU  HB3    72 LEU  QQD     7.50 
  8 LEU  HG      9 LYS  HN      5.00                 
  8 LEU  HG     45 THR  QG2     7.50 
  8 LEU  QD1     9 LYS  QD      7.50 
  8 LEU  QD1    11 LEU  HN      7.50 
  8 LEU  QD1    12 LEU  HN      5.00 
  8 LEU  QD2    42 LEU  QD1     7.50  
  8 LEU  QD2     9 LYS  HN      6.00                 
  8 LEU  QD2    32 PHE  HD2    12.00                 
  8 LEU  QQD    37 TYR  HE1    15.00 
  8 LEU  QQD    37 TYR  HE2    15.00 
  9 LYS  HN      9 LYS  HB2     3.50                 
  9 LYS  HN      9 LYS  HB3     3.50                 
  9 LYS  HN      9 LYS  QB      2.90                 
  9 LYS  HN      9 LYS  HG2     6.00                 
  9 LYS  HN      9 LYS  HG3     6.00                 
  9 LYS  HN      9 LYS  QD      6.00                 
  9 LYS  HN     10 LYS  HN      2.90                 
  9 LYS  HN     24 LEU  QD1     6.50  
  9 LYS  HN     24 LEU  QD2     6.00                 
  9 LYS  HA      9 LYS  HG2     4.20                 
  9 LYS  HA      9 LYS  HG3     4.20                 
  9 LYS  HA      9 LYS  QG      4.20                 
  9 LYS  HA      9 LYS  HD2     6.00                 
  9 LYS  HA      9 LYS  HD3     6.00                 
  9 LYS  HA      9 LYS  QD      6.00                 
  9 LYS  HA     10 LYS  HN      4.20 
  9 LYS  HA     11 LEU  HN      4.20                 
  9 LYS  HA     12 LEU  HN      3.50                 
  9 LYS  HA     12 LEU  QB      3.50                 
  9 LYS  HA     12 LEU  QQD     6.00  
  9 LYS  HB2     9 LYS  QE      6.00                 
  9 LYS  HB2    12 LEU  QD1     6.00 
  9 LYS  HB2    24 LEU  HB2     5.00  
  9 LYS  HB2    24 LEU  QD1     7.50 
  9 LYS  HB3     9 LYS  QE      6.00                 
  9 LYS  HB3    24 LEU  HN      6.00 
  9 LYS  QB      9 LYS  QE      6.00                 
  9 LYS  QB     10 LYS  HN      4.20                 
  9 LYS  QB     24 LEU  HN      6.00                 
  9 LYS  QB     24 LEU  QD1     7.50 
  9 LYS  QB     24 LEU  QD2     6.00                                
  9 LYS  QG     10 LYS  HN      6.00                 
  9 LYS  HG3    10 LYS  HA      6.00                 
  9 LYS  QG     24 LEU  HN      5.00 
  9 LYS  HD2    10 LYS  HN      6.00 
  9 LYS  HD2    25 ALA  HN      6.00 
  9 LYS  HD2    24 LEU  HN      6.00 
  9 LYS  HD2    24 LEU  QD2     5.50 
  9 LYS  HD3    10 LYS  HN      6.00                 
  9 LYS  HD3    24 LEU  HN      6.00 
  9 LYS  HD3    25 ALA  HN      6.00 
  9 LYS  QD     10 LYS  HN      6.00                
  9 LYS  QE     24 LEU  QD2     7.50 
 10 LYS  HN     10 LYS  QB      2.90                 
 10 LYS  HN     10 LYS  HG2     4.20                 
 10 LYS  HN     10 LYS  HG3     4.20                 
 10 LYS  HN     10 LYS  QG      4.20                 
 10 LYS  HN     10 LYS  QD      6.00                 
 10 LYS  HN     11 LEU  HN      2.90                 
 10 LYS  HN     24 LEU  QD2     7.50                 
 10 LYS  HA     10 LYS  HG2     4.20                 
 10 LYS  HA     10 LYS  HG3     3.50                 
 10 LYS  HA     10 LYS  QG      4.20                 
 10 LYS  HA     10 LYS  QD      6.00                 
 10 LYS  HA     11 LEU  HN      4.20               
 10 LYS  HA     12 LEU  HN      4.20                 
 10 LYS  HA     13 ALA  HN      3.50 
 10 LYS  HA     13 ALA  QB      4.20                 
 10 LYS  QB     10 LYS  QE      6.00                 
 10 LYS  QB     11 LEU  HN      4.20                 
 10 LYS  QB     13 ALA  QB      7.50 
 10 LYS  HG2    13 ALA  HN      6.00                 
 10 LYS  HG3    13 ALA  HN      6.00                 
 10 LYS  QG     11 LEU  HN      6.00                 
 10 LYS  QG     12 LEU  HN      6.00                 
 10 LYS  QD     11 LEU  HN      6.00                 
 11 LEU  HN     11 LEU  HB2     2.90               
 11 LEU  HN     11 LEU  HB3     3.50                 
 11 LEU  HN     11 LEU  QB      2.90                 
 11 LEU  HN     11 LEU  HG      5.00                 
 11 LEU  HN     11 LEU  QQD     6.00                 
 11 LEU  HN     12 LEU  HN      2.90                 
 11 LEU  HN     12 LEU  QQD     7.50  
 11 LEU  HA     11 LEU  HG      4.20                 
 11 LEU  HA     11 LEU  QD2     3.50 
 11 LEU  HA     12 LEU  HN      3.50                 
 11 LEU  HA     12 LEU  QD2     7.50 
 11 LEU  HA     14 GLU  HB2     3.50                
 11 LEU  HA     14 GLU  HB3     4.20                 
 11 LEU  HA     14 GLU  HG3     6.00                 
 11 LEU  HB2    12 LEU  HN      4.20                 
 11 LEU  HB3    12 LEU  HN      4.20                 
 11 LEU  HB3    12 LEU  QD1     7.50                
 11 LEU  QQD    12 LEU  HN      6.50                 
 11 LEU  QQD    15 THR  QG2     7.50 
 11 LEU  QQD    32 PHE  QB     15.00 
 11 LEU  QQD    37 TYR  QB     15.00      
 11 LEU  QQD    37 TYR  QE     15.00            
 12 LEU  HN     12 LEU  HB2     2.90                 
 12 LEU  HN     12 LEU  HB3     3.50                 
 12 LEU  HN     12 LEU  QB      3.50                 
 12 LEU  HN     12 LEU  HG      4.20                
 12 LEU  HN     12 LEU  QD1     5.00                 
 12 LEU  HN     12 LEU  QD2     5.00                 
 12 LEU  HN     12 LEU  QQD     5.00                
 12 LEU  HN     13 ALA  HN      2.90                                 
 12 LEU  HA     12 LEU  HG      3.50               
 12 LEU  HA     12 LEU  QD1     6.00                 
 12 LEU  HA     12 LEU  QD2     5.00                 
 12 LEU  HA     12 LEU  QQD     4.20                 
 12 LEU  HA     13 ALA  HN      4.20                 
 12 LEU  HA     15 THR  HN      5.00                 
 12 LEU  HA     15 THR  HB      4.20                 
 12 LEU  HA     15 THR  QG2     6.00                
 12 LEU  HA     45 THR  QG2     6.00 
 12 LEU  HB2    13 ALA  HN      3.50                 
 12 LEU  HB3    13 ALA  HN      4.20               
 12 LEU  QB     13 ALA  HN      3.50                 
 12 LEU  QB     37 TYR  HE2    15.00                 
 12 LEU  HG     13 ALA  HN      6.00                 
 12 LEU  HG     45 THR  QG2     7.50 
 12 LEU  QD1    37 TYR  HE2    15.00                 
 12 LEU  QD1    42 LEU  QD1     7.50                 
 12 LEU  QD1    42 LEU  QD2     7.50                 
 12 LEU  QD2    37 TYR  HB2    15.00 
 12 LEU  QD2    37 TYR  HE2    15.00                
 12 LEU  QD2    42 LEU  QD1     7.50                 
 12 LEU  QD2    42 LEU  QD2     7.50                 
 12 LEU  QQD    13 ALA  HN      7.50                 
 12 LEU  QQD    24 LEU  QQD     7.50 
 12 LEU  QQD    32 PHE  HD1    15.00                 
 12 LEU  QQD    32 PHE  HD2    15.00                 
 12 LEU  QQD    37 TYR  HE2    15.00                 
 12 LEU  QQD    37 TYR  HD2    15.00                 
 12 LEU  QQD    41 ALA  QB      7.50                 
 12 LEU  QQD    42 LEU  QQD     6.00                 
 12 LEU  QQD    45 THR  QG2     6.00                                               
 13 ALA  HN     13 ALA  QB      2.90                
 13 ALA  HA     14 GLU  HN      4.20                
 13 ALA  HA     16 ALA  HN      3.50                 
 13 ALA  HA     16 ALA  QB      4.20 
 13 ALA  HA     37 TYR  HE2    15.00                 
 13 ALA  QB     14 GLU  HB2     6.00 
 13 ALA  QB     14 GLU  HN      5.00               
 14 GLU  HN     14 GLU  HB2     3.50                 
 14 GLU  HN     14 GLU  HB3     3.50                 
 14 GLU  HN     14 GLU  QB      3.50                 
 14 GLU  HN     14 GLU  HG2     5.00                 
 14 GLU  HN     14 GLU  HG3     5.00                 
 14 GLU  HN     14 GLU  QG      5.00                                            
 14 GLU  HA     14 GLU  HG2     3.50                 
 14 GLU  HA     14 GLU  HG3     3.50                 
 14 GLU  HA     14 GLU  QG      2.90               
 14 GLU  HA     15 THR  HN      4.20 
 14 GLU  HA     16 ALA  HN      6.00                
 14 GLU  HA     37 TYR  HD1    15.00                 
 14 GLU  HB2    15 THR  HN      4.20                 
 14 GLU  HB3    15 THR  HN      4.20                 
 14 GLU  QB     15 THR  HN      4.20                 
 14 GLU  QB     32 PHE  HD1    15.00                 
 14 GLU  QG     15 THR  HN      6.00                               
 15 THR  HN     15 THR  HB      2.90                 
 15 THR  HN     15 THR  QG2     4.20               
 15 THR  HN     16 ALA  HN      2.90                 
 15 THR  HA     15 THR  HB      3.50                 
 15 THR  HA     15 THR  QG2     4.20 
 15 THR  HA     16 ALA  HN      4.20                 
 15 THR  HB     16 ALA  HN      5.00                 
 15 THR  HB     32 PHE  HN     15.00                 
 15 THR  QG2    16 ALA  HN      7.50                 
 15 THR  QG2    32 PHE  HD2    15.00 
 15 THR  QG2    41 ALA  QB      5.00 
 15 THR  QG2    44 GLU  HB2     6.00                 
 15 THR  QG2    44 GLU  HB3     6.00                
 15 THR  QG2    44 GLU  QB      6.00                 
 15 THR  QG2    44 GLU  HG2     7.50                 
 15 THR  QG2    44 GLU  HG3     7.50                 
 15 THR  QG2    45 THR  HN      3.50                 
 15 THR  QG2    45 THR  HA      5.00                 
 15 THR  QG2	45 THR  QG2     5.00 
 16 ALA  HN     16 ALA  QB      3.50                 
 16 ALA  HN     17 GLY  HN      5.00                 
 16 ALA  HA     17 GLY  HN      5.00                 
 16 ALA  HA     32 PHE  HD1    15.00                 
 16 ALA  HA     45 THR  HN      6.00 
 16 ALA  HA     45 THR  QG2     7.50 
 16 ALA  QB     17 GLY  HN      5.00 
 16 ALA  QB     18 GLU  HN      7.50 
 16 ALA  QB     18 GLU  QG      7.50   
 16 ALA  QB     37 TYR  HE2    15.00                 
 16 ALA  QB     37 TYR  HD2    15.00                 
 17 GLY  HN     18 GLU  HN      4.20 
 17 GLY  HA1    18 GLU  HN      3.50                 
 17 GLY  HA2    18 GLU  HN      4.20               
 18 GLU  HN     18 GLU  HB2     3.50                 
 18 GLU  HN     18 GLU  HB3     4.20                 
 18 GLU  HN     18 GLU  QG      3.50                
 18 GLU  HN     19 ASP  HN      3.50                               
 18 GLU  HA     18 GLU  HB2     3.50                 
 18 GLU  HA     18 GLU  HB3     3.50    
 18 GLU  HA     18 GLU  QG      5.00              
 18 GLU  HA     19 ASP  HN      3.50                                
 18 GLU  HB2    19 ASP  HN      5.00                 
 18 GLU  HB3    19 ASP  HN      5.00                 
 18 GLU  QG     19 ASP  HN      6.00                 
 18 GLU  QG     20 ASP  HN      6.00  
 19 ASP  HN     19 ASP  HB2     4.20                 
 19 ASP  HN     19 ASP  HB3     4.20                 
 19 ASP  HN     20 ASP  HN      5.00                 
 19 ASP  HN     21 SER  HN      5.00                 
 19 ASP  HB2    20 ASP  HN      5.00                 
 19 ASP  HB2    22 VAL  QG1     7.50 
 19 ASP  HB3    20 ASP  HN      5.00                 
 19 ASP  HB3    22 VAL  QG1     7.50 
 19 ASP  QB     20 ASP  HN      5.00                               
 20 ASP  HN     20 ASP  QB      4.20                 
 20 ASP  HN     22 VAL  HN      5.00                            
 20 ASP  HA     21 SER  HN      4.20 
 20 ASP  HB3    21 SER  HN      5.00 
 20 ASP  HB2    21 SER  HN      4.20 
 20 ASP  HB2    22 VAL  QG1     7.50 
 21 SER  HN     21 SER  HB2     4.20 
 21 SER  HN     21 SER  HB3     4.20 
 21 SER  HN     22 VAL  HB      6.00 
 21 SER  HN     22 VAL  HN      5.00                 
 21 SER  HN     22 VAL  QQG     6.00 
 21 SER  HN     23 ASP  HN      5.00                
 21 SER  HA     22 VAL  HN      4.20              
 21 SER  HA     23 ASP  HB3     6.00 
 21 SER  QB     22 VAL  HN      5.00 
 22 VAL  HN     22 VAL  HB      3.50         
 22 VAL  HN     22 VAL  QQG     5.00                 
 22 VAL  HN     23 ASP  HN      6.00                                 
 22 VAL  HA     22 VAL  QG1     4.20                 
 22 VAL  HA     22 VAL  QG2     4.20                 
 22 VAL  HA     23 ASP  HB3     6.00 
 22 VAL  HA     23 ASP  HN      3.50                 
 22 VAL  HB     23 ASP  HN      5.00                 
 22 VAL  QG1    37 TYR  HE2    20.00                 
 22 VAL  QG2    37 TYR  HE2    20.00                 
 22 VAL  QQG    23 ASP  HN      6.00                 
 22 VAL  QQG    23 ASP  HA      7.50                 
 23 ASP  HN     23 ASP  HB2     3.50                 
 23 ASP  HN     23 ASP  HB3     3.50                 
 23 ASP  HN     24 LEU  HN      6.00                 
 23 ASP  HA     24 LEU  HN      5.00                 
 23 ASP  HA     25 ALA  HN      6.00                 
 23 ASP  HB2    24 LEU  HN      5.00                 
 23 ASP  HB3    24 LEU  HN      4.20                 
 23 ASP  HB3    26 GLY  HN      6.00 
 23 ASP  QB     25 ALA  HN      6.00                 
 24 LEU  HN     24 LEU  HB2     2.90                 
 24 LEU  HN     24 LEU  HB3     4.20                 
 24 LEU  HN     24 LEU  HG      4.20                 
 24 LEU  HN     24 LEU  QD1     6.00                 
 24 LEU  HN     24 LEU  QD2     5.00                 
 24 LEU  HN     25 ALA  HN      3.50                                
 24 LEU  HN     25 ALA  QB      6.00 
 24 LEU  HA     24 LEU  HB2     3.50   
 24 LEU  HA     24 LEU  HB3     5.00              
 24 LEU  HA     24 LEU  HG      4.20                 
 24 LEU  HA     24 LEU  QD1     5.00                 
 24 LEU  HA     24 LEU  QD2     5.00                 
 24 LEU  HA     25 ALA  HN      4.20                 
 24 LEU  HA     26 GLY  HA1     6.00 
 24 LEU  HA     27 GLU  HB2     4.20                 
 24 LEU  HA     27 GLU  HB3     4.20                 
 24 LEU  HA     27 GLU  QB      4.20                 
 24 LEU  HA     27 GLU  QG      6.00                 
 24 LEU  HA     27 GLU  HN      6.00                 
 24 LEU  HB2    24 LEU  QD1     5.00                 
 24 LEU  HB2    24 LEU  QD2     3.50                 
 24 LEU  HB2    25 ALA  HN      3.50                 
 24 LEU  HB2    28 LEU  QD2     6.00                 
 24 LEU  HG     25 ALA  HN      6.00                                 
 24 LEU  QD1    25 ALA  HN      6.00                 
 24 LEU  QD2    25 ALA  HN      6.00                 
 24 LEU  QD2    26 GLY  HN      7.50                 
 24 LEU  QD2    32 PHE  HD1    15.00                 
 24 LEU  QD2    37 TYR  HE2    15.00                 
 24 LEU  QD2    68 PRO  QB      7.50 
 24 LEU  QD2    68 PRO  QG      7.50 
 24 LEU  QD2    69 ARG  HA      7.50                
 25 ALA  HN     25 ALA  QB      3.50                 
 25 ALA  HN     26 GLY  HN      3.50                                
 25 ALA  HN     27 GLU  HB2     6.00 
 25 ALA  HA     26 GLY  HN      5.00                 
 25 ALA  HA     27 GLU  HN      5.00                 
 25 ALA  HA     28 LEU  HG      5.00 
 25 ALA  HA     28 LEU  QD2     6.00                 
 25 ALA  QB     26 GLY  HN      5.00 
 26 GLY  HN     26 GLY  HA1     3.50                 
 26 GLY  HN     26 GLY  HA2     3.50                 
 26 GLY  HN     26 GLY  QA      2.90                 
 26 GLY  HN     27 GLU  HN      2.90                 
 26 GLY  HA2    27 GLU  HN      5.00                 
 27 GLU  HN     27 GLU  HB2     3.50                 
 27 GLU  HN     27 GLU  HB3     4.20                 
 27 GLU  HN     27 GLU  QB      3.50                 
 27 GLU  HN     27 GLU  QG      6.00                 
 27 GLU  HN     28 LEU  HN      4.20    
 27 GLU  HA     27 GLU  QG      6.00              
 27 GLU  HB2    28 LEU  HN      5.00 
 27 GLU  HB2    35 LEU  QD1     7.50                 
 27 GLU  HB2    35 LEU  QD2     7.50                 
 27 GLU  HB3    30 THR  HN      6.00 
 27 GLU  HB3    30 THR  HB      6.00 
 27 GLU  HB3    30 THR  QG2     7.50 
 27 GLU  HB3    35 LEU  QD1     7.00                 
 27 GLU  HB3    35 LEU  QD2     6.00                 
 27 GLU  QB     30 THR  HN      6.00                 
 27 GLU  QB     35 LEU  QQD     7.50                 
 27 GLU  QG     30 THR  QG2     6.00 
 28 LEU  HN     28 LEU  HB2     3.50                 
 28 LEU  HN     28 LEU  HB3     5.00                 
 28 LEU  HN     28 LEU  HG      5.00                 
 28 LEU  HN     28 LEU  QD1     5.00                 
 28 LEU  HN     28 LEU  QD2     6.00                 
 28 LEU  HN     29 ASP  HN      3.50                 
 28 LEU  HA     28 LEU  HG      4.20                 
 28 LEU  HA     28 LEU  QD1     5.00                 
 28 LEU  HA     28 LEU  QD2     4.20                 
 28 LEU  HA     29 ASP  HN      5.00 
 28 LEU  HA     30 THR  HN      5.00                 
 28 LEU  HA     30 THR  QG2     7.50 
 28 LEU  HA     67 THR  HB      5.00 
 28 LEU  HA     68 PRO  HG2     3.50 
 28 LEU  HA     69 ARG  QG      6.00 
 28 LEU  HB2    29 ASP  HN      4.20                 
 28 LEU  HB2    68 PRO  HG2     5.00 
 28 LEU  HB3    29 ASP  HN      4.20                 
 28 LEU  HB3    69 ARG  HB2     6.00                 
 28 LEU  HB3    69 ARG  HB3     6.00                 
 28 LEU  HB3    69 ARG  QB      6.00                 
 28 LEU  HB3    69 ARG  HN      3.50 
 28 LEU  QD1    29 ASP  HN      7.50 
 28 LEU  QD1    30 THR  HN      7.50    
 28 LEU  QD1    37 TYR  HE1    15.00                          
 28 LEU  QD1    69 ARG  HN      7.50                 
 28 LEU  QD2    29 ASP  HN      7.50                 
 28 LEU  QD2    67 THR  HB      7.50 
 28 LEU  QD2    68 PRO  QB      5.00 
 28 LEU  QD2    68 PRO  HG2     5.00 
 28 LEU  QD2    69 ARG  HN      5.00                 
 29 ASP  HN     29 ASP  HB2     3.50                 
 29 ASP  HN     29 ASP  HB3     5.00                   
 29 ASP  HN     29 ASP  QB      3.50                 
 29 ASP  HN     30 THR  HN      2.90                 
 29 ASP  HN     67 THR  QG2     7.50 
 29 ASP  HA     30 THR  HN      4.20                 
 29 ASP  HA     67 THR  QG2     7.50 
 29 ASP  HB2    30 THR  HN      4.20               
 29 ASP  HB3    30 THR  HN      4.20   
 29 ASP  HB3    37 TYR  HB3    15.00   
 29 ASP  HB3    67 THR  QG2     7.50               
 29 ASP  QB     30 THR  HN      4.20                 
 30 THR  HN     30 THR  HB      3.50                 
 30 THR  HN     30 THR  QG2     4.20 
 30 THR  HA     30 THR  QG2     4.20 
 30 THR  HA     31 PRO  HD2     5.00   
 30 THR  HA     31 PRO  HD3     5.00               
 30 THR  HB     35 LEU  QD2     5.00 
 30 THR  QG2    31 PRO  HD2     6.00  
 30 THR  QG2    31 PRO  HD3     6.00                
 30 THR  QG2    34 ASP  HN      7.50                 
 30 THR  QG2    34 ASP  HB2     7.50                 
 30 THR  QG2    34 ASP  HB3     7.00                 
 30 THR  QG2    34 ASP  QB      7.50  
 30 THR  QG2    35 LEU  HB2     7.50                
 30 THR  QG2    35 LEU  HN      6.00 
 30 THR  QG2    35 LEU  QD2     6.00 
 30 THR  QG2    68 PRO  HD3     7.50 
 31 PRO  HA     32 PHE  HN      3.50                 
 31 PRO  HA     67 THR  HN      5.00                 
 31 PRO  HA     67 THR  QG2     7.50                 
 31 PRO  HB2    33 VAL  HA      6.00 
 31 PRO  HB2    33 VAL  HN      5.00                 
 31 PRO  HB2    33 VAL  QQG     5.00                 
 31 PRO  HB2    34 ASP  HN      5.00    
 31 PRO  HB2    67 THR  QG2     7.50              
 31 PRO  HB3    33 VAL  HN      5.00                 
 31 PRO  HB3    33 VAL  QQG     6.50                 
 31 PRO  HB3    34 ASP  HN      5.00   
 31 PRO  HB3    67 THR  HA      4.20             
 31 PRO  QB     32 PHE  HN      5.00                 
 31 PRO  QB     33 VAL  HA      6.00                 
 31 PRO  QB     33 VAL  QQG     6.00                 
 31 PRO  QB     34 ASP  HN      5.00                 
 31 PRO  QB     35 LEU  QQD     7.50                 
 31 PRO  QB     67 THR  QG2     6.00                 
 31 PRO  HG2    33 VAL  QQG     7.20                 
 31 PRO  HG2    34 ASP  HB2     6.00                 
 31 PRO  HG2    34 ASP  HB3     6.00                 
 31 PRO  HG2    35 LEU  HN      6.00 
 31 PRO  HG3    32 PHE  HN      6.00 
 31 PRO  HG3    33 VAL  QQG     7.20                   
 31 PRO  HG3    33 VAL  HN      6.00 
 31 PRO  HG3    34 ASP  HA      6.00 
 31 PRO  HG3    34 ASP  HB2     6.00                 
 31 PRO  HG3    34 ASP  HB3     6.00                 
 31 PRO  HG3    34 ASP  HN      5.00 
 31 PRO  QG     32 PHE  HN      6.00                 
 31 PRO  QG     33 VAL  HN      6.00                 
 31 PRO  QG     33 VAL  QQG     6.50                 
 31 PRO  QG     34 ASP  HN      6.00                 
 31 PRO  QG     34 ASP  HA      6.00                 
 31 PRO  QG     34 ASP  QB      6.00                 
 31 PRO  HD2    34 ASP  HB3     6.00 
 31 PRO  HD2    67 THR  QG2     7.50                                  
 31 PRO  HD3    67 THR  QG2     6.00                 
 31 PRO  QD     32 PHE  HN      6.00                 
 31 PRO  QD     34 ASP  QB      6.00                 
 32 PHE  HN     32 PHE  HB2     4.20                 
 32 PHE  HN     32 PHE  HB3     4.20                 
 32 PHE  HN     32 PHE  QB      3.50                 
 32 PHE  HN     32 PHE  HD1     5.00                 
 32 PHE  HN     33 VAL  HN      3.50                 
 32 PHE  HN     33 VAL  QQG     7.50                 
 32 PHE  HN     34 ASP  HN      6.00                 
 32 PHE  HN     41 ALA  HN     15.00                 
 32 PHE  HN     42 LEU  QQD    15.00                 
 32 PHE  HN     44 GLU  HN     15.00                 
 32 PHE  HN     67 THR  HA     15.00                 
 32 PHE  HN     67 THR  QG2    15.00                 
 32 PHE  HA     32 PHE  HD1     4.50                 
 32 PHE  HA     32 PHE  HD2     6.00                 
 32 PHE  HA     34 ASP  HN      5.00                 
 32 PHE  HA     35 LEU  HB2     6.00                 
 32 PHE  HA     35 LEU  HB3     6.00                 
 32 PHE  HA     35 LEU  QB      6.00                 
 32 PHE  HA     35 LEU  QQD     7.50                 
 32 PHE  HA     69 ARG  QB     12.00                 
 32 PHE  HA     72 LEU  HA     15.00                 
 32 PHE  HB2    32 PHE  HD1     5.00   
 32 PHE  HB2    32 PHE  HD2     5.00               
 32 PHE  HB2    33 VAL  HN      4.20                 
 32 PHE  HB2    37 TYR  HB2     4.20                 
 32 PHE  HB2    37 TYR  HB3     5.00                 
 32 PHE  HB2    40 LEU  HG     15.00 
 32 PHE  HB2    42 LEU  QD1    15.00                 
 32 PHE  HB2    42 LEU  QD2    15.00                 
 32 PHE  HB3    32 PHE  HD1     5.00 
 32 PHE  HB3    32 PHE  HD2     5.00                 
 32 PHE  HB3    33 VAL  HN      4.20                 
 32 PHE  HB3    37 TYR  HB2     6.00                 
 32 PHE  HB3    37 TYR  HB3     6.00                 
 32 PHE  HB3    42 LEU  QD1    15.00                 
 32 PHE  HB3    42 LEU  QD2    15.00                 
 32 PHE  QB     32 PHE  HD1     3.50                 
 32 PHE  QB     33 VAL  HN      4.20                 
 32 PHE  QB     33 VAL  HB      7.00                 
 32 PHE  QB     33 VAL  QQG     8.50                 
 32 PHE  QB     37 TYR  QB      6.00                 
 32 PHE  QB     42 LEU  QQD    15.00                 
 32 PHE  QB     43 LEU  QQD    15.00                               
 32 PHE  QB     67 THR  QG2    15.00                 
 32 PHE  QB     71 LEU  QB     15.00                 
 32 PHE  QB     71 LEU  QQD    15.00                 
 32 PHE  QB     73 ASP  QB     15.00                 
 32 PHE  HD1    35 LEU  QQD    10.00                 
 32 PHE  HD1    37 TYR  QB      6.00                 
 32 PHE  HD1    42 LEU  QD1    15.00                 
 32 PHE  HD1    42 LEU  QD2    15.00                 
 32 PHE  HD1    45 THR  QG2    15.00                 
 32 PHE  HD1    66 GLY  QA     15.00                 
 32 PHE  HD1    67 THR  HN     15.00                 
 32 PHE  HD1    67 THR  HA     15.00                 
 32 PHE  HD1    68 PRO  QD     15.00                 
 32 PHE  HD2    42 LEU  QQD    15.00                 
 32 PHE  HD2    64 ARG  QH2    15.00                 
 32 PHE  HD2    64 ARG  HE     15.00 
 32 PHE  HD2    65 LEU  QB     15.00                 
 32 PHE  HD2    68 PRO  HA     15.00                 
 32 PHE  HD2    68 PRO  QG     15.00 
 32 PHE  HD2    71 LEU  HN     15.00                 
 32 PHE  HD2    71 LEU  HB2    15.00                 
 32 PHE  HD2    71 LEU  HB3    15.00                 
 32 PHE  HD2    71 LEU  QB     15.00                 
 32 PHE  HD2    71 LEU  QD1    15.00                 
 32 PHE  HD2    71 LEU  QD2    15.00                 
 32 PHE  HZ     64 ARG  QH2    15.00 
 33 VAL  HN     33 VAL  HB      2.90                 
 33 VAL  HN     33 VAL  QQG     3.50 
 33 VAL  HN     34 ASP  HN      4.20                 
 33 VAL  HN     35 LEU  HN      6.00                 
 33 VAL  HA     33 VAL  QQG     3.50                 
 33 VAL  HA     34 ASP  HN      5.00 
 33 VAL  HA     35 LEU  HN      5.00                             
 33 VAL  HB     34 ASP  HN      4.20                 
 33 VAL  QQG    34 ASP  HN      5.00                 
 33 VAL  QQG    34 ASP  HA      6.50                 
 33 VAL  QQG    34 ASP  QB      7.50                 
 33 VAL  QQG    35 LEU  HN      7.00                 
 34 ASP  HN     34 ASP  HB2     3.50                 
 34 ASP  HN     34 ASP  HB3     3.50                 
 34 ASP  HN     35 LEU  HN      3.50                 
 34 ASP  HN     36 GLY  HN      6.00                 
 34 ASP  HA     35 LEU  HN      4.20                 
 34 ASP  HB2    35 LEU  HN      4.20                 
 34 ASP  HB3    35 LEU  HN      4.20                 
 34 ASP  QB     35 LEU  HN      4.20                                           
 35 LEU  HN     35 LEU  HB2     5.00                 
 35 LEU  HN     35 LEU  HB3     5.00                 
 35 LEU  HN     35 LEU  HG      5.00                 
 35 LEU  HN     35 LEU  QD1     6.00                 
 35 LEU  HN     35 LEU  QD2     6.00                 
 35 LEU  HN     35 LEU  QQD     6.00                 
 35 LEU  HN     36 GLY  HN      3.50                 
 35 LEU  HA     35 LEU  HG      4.20                 
 35 LEU  HA     35 LEU  QD1     7.50                 
 35 LEU  HA     35 LEU  QD2     7.50                 
 35 LEU  HA     35 LEU  QQD     7.50                 
 35 LEU  HA     36 GLY  HN      5.00 
 35 LEU  HB2    36 GLY  HN      5.00                 
 35 LEU  HB2    37 TYR  HE2     9.00                 
 35 LEU  HB2    37 TYR  HD2     6.00                 
 35 LEU  HB3    36 GLY  HN      5.00                 
 35 LEU  HB3    37 TYR  HE2    15.00                 
 35 LEU  HB3    37 TYR  HD2    15.00                 
 35 LEU  QB     37 TYR  HD2    15.00                 
 35 LEU  HG     36 GLY  HN      6.00                 
 35 LEU  QD1    36 GLY  HN      7.50                 
 35 LEU  QD1    68 PRO  HD3     7.50                 
 35 LEU  QD2    36 GLY  HN      7.00                 
 35 LEU  QD2    68 PRO  HD2     7.50                 
 35 LEU  QD2    68 PRO  HD3     7.50                 
 35 LEU  QQD    36 GLY  HN      7.50                 
 35 LEU  QQD    68 PRO  QD      7.50                 
 36 GLY  HN     37 TYR  HN      2.90                                
 36 GLY  HA1    37 TYR  HN      4.20                 
 36 GLY  HA2    37 TYR  HN      4.20                 
 37 TYR  HN     37 TYR  HB2     3.50                 
 37 TYR  HN     37 TYR  HB3     4.20                 
 37 TYR  HN     37 TYR  QB      4.20                 
 37 TYR  HN     37 TYR  HD2     5.00                 
 37 TYR  HN     38 ASP  HN      5.00                 
 37 TYR  HA     37 TYR  HD2     6.00    
 37 TYR  HA     38 ASP  HN      3.50            
 37 TYR  HA     41 ALA  QB     15.00                 
 37 TYR  HB2    37 TYR  HD2     4.20                 
 37 TYR  HB2    38 ASP  HN      5.00                                 
 37 TYR  HB2    42 LEU  QD1    15.00                 
 37 TYR  HB2    42 LEU  QD2    15.00                 
 37 TYR  HB3    37 TYR  QD      4.20                 
 37 TYR  HB3    38 ASP  HN      5.00                 
 37 TYR  HB3    41 ALA  QB     15.00                
 37 TYR  HB3    42 LEU  QD1    15.00                 
 37 TYR  HB3    42 LEU  QD2    15.00                 
 37 TYR  QB     41 ALA  QB     15.00                 
 37 TYR  QB     42 LEU  HG     15.00                 
 37 TYR  QB     42 LEU  QQD    15.00                 
 37 TYR  QB     44 GLU  QG     15.00 
 37 TYR  QB     69 ARG  QD     15.00                 
 37 TYR  HE1    69 ARG  QB     15.00                 
 37 TYR  HE1    69 ARG  QG     15.00                 
 37 TYR  HE1    69 ARG  HD2    15.00                 
 37 TYR  HE1    69 ARG  HD3    15.00                 
 37 TYR  HE1    69 ARG  QD     15.00                 
 37 TYR  HE1    69 ARG  HE     15.00                 
 37 TYR  HE2    43 LEU  QQD    15.00                 
 37 TYR  HE2    62 VAL  HA     20.00                 
 37 TYR  HD1    69 ARG  HE     15.00  
 37 TYR  HD2    41 ALA  QB     15.00                 
 37 TYR  HD2    42 LEU  QQD    15.00                 
 37 TYR  HD2    45 THR  QG2    15.00                 
 38 ASP  HN     38 ASP  HA      3.50                 
 38 ASP  HN     38 ASP  HB2     5.00                 
 38 ASP  HN     38 ASP  HB3     5.00                 
 38 ASP  HA     38 ASP  HB2     3.50                 
 38 ASP  HA     39 SER  HN      3.50     
 38 ASP  HA     41 ALA  QB      6.00          
 38 ASP  HB2    39 SER  HA      6.00 
 38 ASP  HB2    39 SER  HN      5.00                 
 38 ASP  HB3    39 SER  HA      6.00 
 38 ASP  HB3    39 SER  HN      5.00                 
 38 ASP  HB2    40 LEU  HN      6.00               	 
 39 SER  HN     39 SER  QB      4.20                 
 39 SER  HN     40 LEU  HN      4.20                 
 39 SER  HA     42 LEU  HN      4.20                 
 39 SER  HA     42 LEU  HB2     5.00                 
 39 SER  HA     42 LEU  HB3     5.00                 
 39 SER  HA     42 LEU  QB      5.00                 
 39 SER  HA     42 LEU  QQD     6.00              
 39 SER  HA     43 LEU  HN      4.20                 
 40 LEU  HN     40 LEU  HB2     3.50                 
 40 LEU  HN     40 LEU  HB3     3.50                 
 40 LEU  HN     40 LEU  HG      5.00                 
 40 LEU  HN     40 LEU  QD1     7.50                 
 40 LEU  HN     40 LEU  QD2     7.50                 
 40 LEU  HN     41 ALA  HN      3.50                 
 40 LEU  HN     42 LEU  HN      4.20                 
 40 LEU  HA     40 LEU  HB2     3.50                 
 40 LEU  HA     40 LEU  HB3     3.50                 
 40 LEU  HA     40 LEU  HG      3.50                 
 40 LEU  HA     40 LEU  QD1     3.50                 
 40 LEU  HA     40 LEU  QD2     5.00                 
 40 LEU  HA     43 LEU  HN      3.50                 
 40 LEU  HA     43 LEU  QB      4.20                 
 40 LEU  HA     43 LEU  HG      6.00                 
 40 LEU  HA     43 LEU  QQD     7.50                 
 40 LEU  HB2    41 ALA  HN      5.00               
 40 LEU  HB3    41 ALA  HN      5.00                            
 40 LEU  HG     44 GLU  HG2     6.00                 
 40 LEU  HG     44 GLU  HG3     6.00                 
 40 LEU  QD1    41 ALA  HN      7.50                 
 40 LEU  QD1    44 GLU  HG2     7.50                
 40 LEU  QD1    44 GLU  HG3     7.50                 
 40 LEU  QD1    44 GLU  QG      7.50                 
 40 LEU  QD2    41 ALA  HN      7.50                 
 41 ALA  HN     41 ALA  QB      2.90 
 41 ALA  HN     42 LEU  HN      3.50                 
 41 ALA  HA     42 LEU  HN      4.20              
 41 ALA  HA     42 LEU  HA      5.00 
 41 ALA  HA     44 GLU  HN      3.50                 
 41 ALA  HA     44 GLU  HB2     3.50                 
 41 ALA  HA     44 GLU  HB3     5.00                 
 41 ALA  HA     44 GLU  QB      5.00                 
 41 ALA  QB     42 LEU  HN      4.20                 
 41 ALA  QB     42 LEU  QQD     7.50                 
 41 ALA  QB     44 GLU  HN      6.00                 
 41 ALA  QB     45 THR  HN      6.00 
 42 LEU  HN     42 LEU  HB2     3.50                 
 42 LEU  HN     42 LEU  HB3     3.50                 
 42 LEU  HN     42 LEU  QB      4.20                 
 42 LEU  HN     42 LEU  HG      5.00                 
 42 LEU  HN     42 LEU  QD1     6.00                 
 42 LEU  HN     42 LEU  QD2     5.00                 
 42 LEU  HN     42 LEU  QQD     6.00                 
 42 LEU  HA     42 LEU  HG      4.20                 
 42 LEU  HA     42 LEU  QD1     6.00                 
 42 LEU  HA     42 LEU  QD2     6.00                 
 42 LEU  HA     42 LEU  QQD     4.20                 
 42 LEU  HA     44 GLU  HN      5.00                 
 42 LEU  HA     45 THR  HB      4.20 
 42 LEU  HA     45 THR  HN      3.50                 
 42 LEU  HA     45 THR  QG2     7.50 
 42 LEU  HA     46 ALA  HN      4.20                 
 42 LEU  HB2    43 LEU  HN      5.00                 
 42 LEU  HB2    43 LEU  QD2     6.00 
 42 LEU  HB3    43 LEU  HN      3.50                 
 42 LEU  QB     42 LEU  HG      2.90                 
 42 LEU  QB     43 LEU  HN      3.50                 
 42 LEU  QB     45 THR  QG2     7.50    
 42 LEU  QB     57 LEU  QQD     7.50                             
 42 LEU  QB     62 VAL  HA      6.00 
 42 LEU  HG     43 LEU  HN      6.00                 
 42 LEU  QD1    71 LEU  HA      7.50 
 42 LEU  QD1    71 LEU  QD1     5.00                
 42 LEU  QD1    71 LEU  QD2     6.00                 
 42 LEU  QD2    71 LEU  QD1     7.50                 
 42 LEU  QD2    71 LEU  QD2     7.50 
 42 LEU  QQD    43 LEU  HN      6.50                 
 42 LEU  QQD    44 GLU  HN      7.50                 
 42 LEU  QQD    62 VAL  QG1     7.50                
 43 LEU  HN     43 LEU  HB2     3.50                 
 43 LEU  HN     43 LEU  HB3     3.50                 
 43 LEU  HN     43 LEU  HG      4.50                 
 43 LEU  HN     43 LEU  QD1     6.00                 
 43 LEU  HN     43 LEU  QD2     6.00                 
 43 LEU  HN     43 LEU  QQD     6.00                 
 43 LEU  HN     44 GLU  HN      2.90                 
 43 LEU  HN     45 THR  HN      5.00               
 43 LEU  HN     62 VAL  QQG     7.50 
 43 LEU  HA     43 LEU  HG      4.20                 
 43 LEU  HA     43 LEU  QD1     4.20                 
 43 LEU  HA     43 LEU  QD2     4.20                 
 43 LEU  HA     43 LEU  QQD     4.20                 
 43 LEU  HA     46 ALA  HN      3.50                 
 43 LEU  HA     46 ALA  QB      3.50                 
 43 LEU  HA     62 VAL  QQG     7.50 
 43 LEU  HB2    44 GLU  HN      3.50                 
 43 LEU  HB3    44 GLU  HN      4.20                 
 43 LEU  QB     43 LEU  HG      2.90                 
 43 LEU  QB     44 GLU  HN      4.20                 
 43 LEU  QQD    44 GLU  HN      7.50                                
 43 LEU  QQD    61 THR  HN      7.50 
 44 GLU  HN     44 GLU  HB2     3.50                 
 44 GLU  HN     44 GLU  HB3     3.50                 
 44 GLU  HN     44 GLU  QB      4.00                 
 44 GLU  HN     44 GLU  HG2     4.20                 
 44 GLU  HN     44 GLU  HG3     4.20                 
 44 GLU  HN     44 GLU  QG      4.20                 
 44 GLU  HN     45 THR  HN      2.90                 
 44 GLU  HN     46 ALA  HN      4.20                                
 44 GLU  HA     44 GLU  HB2     2.97                 
 44 GLU  HA     44 GLU  HB3     2.97                 
 44 GLU  HA     44 GLU  HG2     3.50                 
 44 GLU  HA     44 GLU  HG3     3.50   
 44 GLU  HA     45 THR  HN      4.20              
 44 GLU  HA     47 ALA  HN      4.20                 
 44 GLU  HA     47 ALA  HB2     5.00     
 44 GLU  HA     48 VAL  QQG     7.50             
 44 GLU  HB2    45 THR  HN      5.00                 
 44 GLU  HB3    45 THR  HN      5.00                 
 44 GLU  HG2    45 THR  HN      6.00     
 44 GLU  HG2    47 ALA  QB      6.00             
 44 GLU  HG3    45 THR  HN      6.00                 
 45 THR  HN     45 THR  HA      2.90                 
 45 THR  HN     45 THR  HB      3.50                 
 45 THR  HN     45 THR  QG2     3.50 
 45 THR  HN     46 ALA  HN      2.90                 
 45 THR  HN     46 ALA  QB      6.00 
 45 THR  HN     47 ALA  HN      5.00                                
 45 THR  HA     45 THR  QG2     4.20                 
 45 THR  HA     46 ALA  HN      3.50                                
 45 THR  HA     48 VAL  HN      3.50 
 45 THR  HA     48 VAL  HB      3.50 
 45 THR  HB     46 ALA  HN      4.20                 
 45 THR  QG2    46 ALA  HN      3.50                 
 45 THR  QG2    46 ALA  HA      6.00                 
 45 THR  QG2    46 ALA  QB      6.00 
 45 THR  QG2    47 ALA  HN      6.00                 
 45 THR  QG2    49 LEU  HB2     7.50 
 45 THR  QG2    49 LEU  HG      7.50                 
 46 ALA  HN     46 ALA  QB      2.90 
 46 ALA  HN     47 ALA  HN      2.90                 
 46 ALA  HA     47 ALA  HN      4.20                 
 46 ALA  HA     49 LEU  HN      3.50                 
 46 ALA  HA     49 LEU  HB2     4.20                 
 46 ALA  HA     49 LEU  HB3     4.20                 
 46 ALA  HA     49 LEU  QB      4.20                 
 46 ALA  HA     49 LEU  HG      6.00                 
 46 ALA  HA     49 LEU  QQD     6.00                
 46 ALA  QB     47 ALA  HN      5.00 
 46 ALA  QB     62 VAL  QQG     7.50                 
 47 ALA  HN     47 ALA  QB      2.90                                 
 47 ALA  HN     48 VAL  HA      6.00 
 47 ALA  HN     48 VAL  QG2     6.00 
 47 ALA  HN     49 LEU  HB3     6.00 
 47 ALA  HN     49 LEU  QD2     7.50 
 47 ALA  HA     47 ALA  HB2     2.90                 
 47 ALA  HA     47 ALA  HB3     2.90                 
 47 ALA  HA     49 LEU  HB2     6.00 
 47 ALA  HA     50 GLN  HN      3.50                 
 47 ALA  HA     50 GLN  QB      4.20             
 47 ALA  HA     50 GLN  HE21    6.00                 
 47 ALA  QB     48 VAL  HN      3.50                 
 47 ALA  QB     48 VAL  HB      6.00 
 47 ALA  QB     48 VAL  QG1     7.50       
 47 ALA  QB     48 VAL  QG2     7.50           
 48 VAL  HN     48 VAL  HB      3.50                 
 48 VAL  HN     48 VAL  QG1     6.00                 
 48 VAL  HN     48 VAL  QG2     3.50                
 48 VAL  HN     48 VAL  QQG     4.20                 
 48 VAL  HN     49 LEU  HN      2.90                 
 48 VAL  HN     50 GLN  HN      5.00                 
 48 VAL  HA     48 VAL  QG1     6.00 
 48 VAL  HA     48 VAL  QG2     3.50   
 48 VAL  HA     49 LEU  HN      5.00               
 48 VAL  HA     51 GLN  HN      3.50                 
 48 VAL  HA     51 GLN  QB      3.50                 
 48 VAL  HA     51 GLN  HG2     6.00                 
 48 VAL  HA     51 GLN  HG3     6.00                 
 48 VAL  HA     51 GLN  QG      6.00                 
 48 VAL  HA     52 ARG  HN      5.00 
 48 VAL  HB     49 LEU  HN      3.50                 
 48 VAL  QG1    49 LEU  HN      6.00    
 48 VAL  QG1    49 LEU  HA      6.00              
 48 VAL  QG1    52 ARG  HD2     5.00                 
 48 VAL  QG1    52 ARG  HD3     5.00                
 48 VAL  QG2    49 LEU  HN      6.00                 
 48 VAL  QG2    52 ARG  HD2     7.50                 
 48 VAL  QG2    52 ARG  HD3     7.50                 
 48 VAL  QQG    49 LEU  HN      6.00                 
 48 VAL  QQG    49 LEU  HA      6.70                 
 48 VAL  QQG    52 ARG  HN      7.00                 
 48 VAL  QQG    52 ARG  QD      7.00                 
 48 VAL  QQG    52 ARG  HE      7.50                 
 49 LEU  HN     49 LEU  HB2     3.50                 
 49 LEU  HN     49 LEU  HB3     3.50                 
 49 LEU  HN     49 LEU  QB      2.90                 
 49 LEU  HN     49 LEU  HG      5.00                 
 49 LEU  HN     49 LEU  QD1     6.00                 
 49 LEU  HN     49 LEU  QD2     6.00                 
 49 LEU  HN     50 GLN  HN      3.50                 
 49 LEU  HA     49 LEU  QD1     3.50                
 49 LEU  HA     49 LEU  QD2     6.00                 
 49 LEU  HA     49 LEU  QQD     6.00                                 
 49 LEU  HA     53 TYR  HB3     7.50 
 49 LEU  HA     52 ARG  HE      6.00 
 49 LEU  HB2    50 GLN  HN      5.00                 
 49 LEU  HB2    50 GLN  HG2     6.00 
 49 LEU  HB3    50 GLN  HN      5.00   
 49 LEU  HB3    55 ILE  QG2     7.50                              
 49 LEU  HG     50 GLN  HN      6.00   
 49 LEU  HG     55 ILE  HB      5.00               
 49 LEU  QD1    74 GLU  HB3     7.50                
 49 LEU  QQD    50 GLN  HN      7.50                 
 49 LEU  QQD    53 TYR  QB     15.00                 
 49 LEU  QQD    53 TYR  HE1    15.00                
 49 LEU  QQD    53 TYR  HD2    15.00                 
 49 LEU  QQD    55 ILE  QG2     7.50                                
 49 LEU  QQD    74 GLU  QG      7.50                 
 49 LEU  QQD    75 VAL  HN      7.10                 
 50 GLN  HN     50 GLN  QB      3.50 
 50 GLN  HN     50 GLN  HG2     5.00                 
 50 GLN  HN     50 GLN  HG3     5.00                 
 50 GLN  HN     50 GLN  HE21    6.00                 
 50 GLN  HN     50 GLN  HE22    6.00                 
 50 GLN  HN     51 GLN  HN      2.90                 
 50 GLN  HN     55 ILE  HN      6.00                 
 50 GLN  HA     50 GLN  HG2     5.00                 
 50 GLN  HA     50 GLN  HG3     5.00                 
 50 GLN  HA     51 GLN  HN      3.50                 
 50 GLN  HA     55 ILE  HN      3.50                 
 50 GLN  QB     50 GLN  HE22    5.00 
 50 GLN  QB     51 GLN  HN      5.00                 
 50 GLN  QB     55 ILE  HN      6.00                 
 50 GLN  QB     56 ALA  HA      6.00                 
 50 GLN  QB     56 ALA  QB      6.00                 
 50 GLN  QB     57 LEU  HN      6.00                                 
 50 GLN  HG2    51 GLN  HN      6.00                 
 50 GLN  HG2    56 ALA  HA      6.00 
 50 GLN  HG2    56 ALA  QB      7.50   
 50 GLN  HG3    51 GLN  HN      6.00                
 50 GLN  HG3    56 ALA  HA      6.00                                                              
 50 GLN  HG3    56 ALA  QB      7.50 
 50 GLN  QG     50 GLN  HE21    6.00 
 50 GLN  QG     50 GLN  HE22    6.00 
 50 GLN  HE21   56 ALA  QB      6.00                                              
 50 GLN  HE22   56 ALA  QB      6.00                                
 50 GLN  QE2    55 ILE  HB      6.00 
 50 GLN  QE2    56 ALA  QB      6.00                                 
 51 GLN  HN     51 GLN  QB      2.90                 
 51 GLN  HN     51 GLN  HG2     3.50                 
 51 GLN  HN     51 GLN  HG3     3.50                 
 51 GLN  HN     51 GLN  QG      4.20                 
 51 GLN  HN     52 ARG  HN      2.90                 
 51 GLN  HA     51 GLN  HG2     4.20                 
 51 GLN  HA     51 GLN  HG3     4.20     
 51 GLN  HA     52 ARG  HN      3.50             
 51 GLN  QB     52 ARG  HN      4.20                             
 51 GLN  HG2    51 GLN  HE21    6.00 
 51 GLN  HG2    51 GLN  HE22    5.00 
 51 GLN  HG3    51 GLN  HE22    6.00 
 51 GLN  QG     52 ARG  HN      6.00                 
 51 GLN  QG     53 TYR  HA     10.00 
 52 ARG  HN     52 ARG  HB2     3.50                 
 52 ARG  HN     52 ARG  HB3     5.00                 
 52 ARG  HN     52 ARG  HG2     6.00                 
 52 ARG  HN     52 ARG  HG3     6.00                 
 52 ARG  HN     52 ARG  QG      6.00                 
 52 ARG  HN     53 TYR  HN      3.50                              
 52 ARG  HA     52 ARG  HB2     3.50                
 52 ARG  HA     52 ARG  HB3     3.50                 
 52 ARG  HA     52 ARG  HG2     4.20                 
 52 ARG  HA     52 ARG  HG3     4.20                 
 52 ARG  HA     52 ARG  QG      5.00               
 52 ARG  HA     53 TYR  HN      4.20                 
 52 ARG  HB2    52 ARG  HD2     4.20                 
 52 ARG  HB2    52 ARG  HD3     4.20                 
 52 ARG  HB2    52 ARG  QD      4.20                 
 52 ARG  HB2    52 ARG  HE      6.00                 
 52 ARG  HB2    52 ARG  QH2     6.00                 
 52 ARG  HB2    53 TYR  HN      5.00               
 52 ARG  HB3    52 ARG  QG      2.90                 
 52 ARG  HB3    52 ARG  HD2     4.20                 
 52 ARG  HB3    52 ARG  HD3     4.20                 
 52 ARG  HB3    52 ARG  QD      4.20                 
 52 ARG  HB3    52 ARG  HE      4.20                 
 52 ARG  HB3    53 TYR  HE2    15.00 
 52 ARG  HB3    53 TYR  HN      5.00                 
 52 ARG  HG2    52 ARG  HE      5.00                 
 52 ARG  HG2    53 TYR  HN      6.00                 
 52 ARG  HG3    52 ARG  HE      5.00                 
 52 ARG  HG3    53 TYR  HN      6.00                 
 52 ARG  QG     52 ARG  HE      4.20                 
 52 ARG  QG     52 ARG  QH2     6.00                 
 52 ARG  QG     53 TYR  HN      6.00                 
 52 ARG  HD2    52 ARG  HE      6.00 
 52 ARG  HD3    52 ARG  HE      6.00 
 52 ARG  HD2    53 TYR  HE2     9.00                 
 52 ARG  HD3    53 TYR  HE2     9.00                 
 52 ARG  QD     53 TYR  HN      6.00                 
 52 ARG  QD     53 TYR  HE2     6.00                 
 52 ARG  HE     52 ARG  HH21    5.00 
 52 ARG  HE     53 TYR  HN      6.00                              
 52 ARG  HE     75 VAL  QQG     7.50                 
 53 TYR  HN     53 TYR  HB2     3.50                 
 53 TYR  HN     53 TYR  HB3     3.50                                 
 53 TYR  HN     54 GLY  HN      2.90                
 53 TYR  HN     55 ILE  HN      6.00                 
 53 TYR  HA     53 TYR  HD1     6.00                                
 53 TYR  HA     53 TYR  HD2     6.00                 
 53 TYR  HB2    53 TYR  HD2     5.00                 
 53 TYR  HB2    54 GLY  HN      6.00                 
 53 TYR  HB2    55 ILE  HN      6.00                 
 53 TYR  HB2    55 ILE  HB      6.00                 
 53 TYR  HB2    55 ILE  HG12    6.00                 
 53 TYR  HB2    55 ILE  HG13    6.00                 
 53 TYR  HB2    55 ILE  QD1     5.00                                 
 53 TYR  HB2    55 ILE  QG2     7.50                 
 53 TYR  HB3    53 TYR  QD      5.00                 
 53 TYR  HB3    54 GLY  HN      6.00                 
 53 TYR  HB3    55 ILE  HN      6.00                 
 53 TYR  HB3    55 ILE  HB      6.00                 
 53 TYR  HB3    55 ILE  HG12    6.00                 
 53 TYR  HB3    55 ILE  HG13    6.00                              
 53 TYR  HB3    55 ILE  QG2     7.50                 
 53 TYR  QB     54 GLY  HN      4.20                 
 53 TYR  QB     55 ILE  HN      6.20                                             
 53 TYR  QB     75 VAL  QQG     8.69                 
 54 GLY  QA     55 ILE  HN      3.50 
 54 GLY  QA     55 ILE  HB      6.00 
 54 GLY  QA     55 ILE  HG12    6.00 
 54 GLY  HN     55 ILE  HN      2.90                 
 55 ILE  HN     55 ILE  HB      3.50                                 
 55 ILE  HN     55 ILE  HG12    6.00                 
 55 ILE  HN     55 ILE  HG13    6.00                 
 55 ILE  HN     55 ILE  QG2     6.00                 
 55 ILE  HN     55 ILE  QD1     6.00                                
 55 ILE  HN     56 ALA  HN      6.00                 
 55 ILE  HA     55 ILE  HG12    2.90                 
 55 ILE  HA     55 ILE  HG13    4.20                 
 55 ILE  HA     55 ILE  QG1     4.20  
 55 ILE  HA     55 ILE  QG2     3.50                                
 55 ILE  HA     55 ILE  QD1     6.00                 
 55 ILE  HA     56 ALA  QB      6.00 
 55 ILE  HA     56 ALA  HN      3.50                 
 55 ILE  HB     56 ALA  HN      4.20   
 55 ILE  HB     56 ALA  HA      5.00               
 55 ILE  HB     58 THR  QG2     7.50 
 55 ILE  HB     75 VAL  QQG     6.00                 
 55 ILE  QG2    55 ILE  HG12    5.00                 
 55 ILE  QG2    55 ILE  HG13    5.00                 
 55 ILE  QG2    56 ALA  HN      6.00  
 55 ILE  QG2    58 THR  QG2     7.50   
 55 ILE  QG2    57 LEU  HB3     7.50                           
 55 ILE  QG2    75 VAL  HA      7.50                 
 55 ILE  QG2    75 VAL  HB      7.50                 
 55 ILE  HG12   55 ILE  QD1     2.90                 
 55 ILE  HG13   55 ILE  QD1     2.90     
 55 ILE  HG13   56 ALA  HN      6.00            
 55 ILE  QG1    55 ILE  QD1     2.90                 
 55 ILE  QG1    56 ALA  HN      6.00                 
 55 ILE  QD1    56 ALA  HN      6.00                 
 55 ILE  QD1    75 VAL  HA      4.20                                 
 56 ALA  HN     56 ALA  QB      3.50 
 56 ALA  HN     57 LEU  HN      3.50                 
 56 ALA  HN     75 VAL  QQG     7.50                 
 56 ALA  HA     57 LEU  HN      2.90                 
 56 ALA  QB     57 LEU  HN      5.00 
 57 LEU  HN     57 LEU  HB2     5.00                 
 57 LEU  HN     57 LEU  HB3     5.00                 
 57 LEU  HN     57 LEU  QB      3.50                 
 57 LEU  HN     57 LEU  QD1     6.00                 
 57 LEU  HN     57 LEU  QD2     6.00                 
 57 LEU  HN     57 LEU  QQD     6.00                 
 57 LEU  HA     57 LEU  QD1     6.00                 
 57 LEU  HA     57 LEU  QD2     5.00    
 57 LEU  HA     58 THR  HN      3.50              
 57 LEU  QD1    76 ASN  HN      7.50 
 57 LEU  QQD    61 THR  HB      7.50 
 57 LEU  QQD    61 THR  QG2     6.00                 
 57 LEU  QQD    70 GLU  QB      7.50 
 58 THR  HN     58 THR  HB      4.20                 
 58 THR  HN     58 THR  QG2     5.00               
 58 THR  HN     61 THR  QG2     7.50 
 58 THR  HA     58 THR  QG2     3.50                 
 58 THR  HA     59 ASP  HN      3.50                 
 58 THR  HA     60 GLU  HN      5.00                            
 58 THR  HB     59 ASP  HN      5.00                                
 58 THR  HB     60 GLU  HN      6.00 
 58 THR  QG2    59 ASP  HN      5.00                 
 58 THR  QG2    60 GLU  HN      7.50                 
 58 THR  QG2    61 THR  HN      7.50 
 59 ASP  HN     60 GLU  HN      3.50                 
 59 ASP  HN     59 ASP  QB      4.20 
 59 ASP  HA     60 GLU  HN      5.00 
 59 ASP  HA     62 VAL  HN      4.20                 
 59 ASP  HA     62 VAL  HB      3.50                 
 59 ASP  HA     62 VAL  QQG     7.50                 
 59 ASP  QB     60 GLU  HN      5.00                 
 59 ASP  QB     60 GLU  HB3     6.00 
 59 ASP  QB     62 VAL  QQG     7.50                 
 60 GLU  HN     60 GLU  HB2     3.50                 
 60 GLU  HN     60 GLU  HB3     3.50                 
 60 GLU  HN     60 GLU  QG      5.00                 
 60 GLU  HN     61 THR  HB      6.00 
 60 GLU  HN     61 THR  HN      3.50                  
 60 GLU  HA     60 GLU  QG      3.50               
 60 GLU  HA     61 THR  HN      5.00 
 60 GLU  HA     63 GLY  HN      4.20                
 60 GLU  HB2    61 THR  HN      5.00                 
 60 GLU  HB3    61 THR  HN      3.50                 
 60 GLU  QG     61 THR  HN      6.00                 
 60 GLU  QG     61 THR  QG2     6.00                 
 60 GLU  QG     62 VAL  HN      6.00 
 61 THR  HA     61 THR  QG2     5.00 
 61 THR  HA     63 GLY  HN      3.50 
 61 THR  HA     64 ARG  HG3     5.00 
 61 THR  HA     64 ARG  QH2     6.00 
 61 THR  HN     61 THR  HB      3.50                 
 61 THR  HN     61 THR  QG2     3.50 
 61 THR  HN     62 VAL  HN      3.50                 
 61 THR  HB     62 VAL  HN      5.00                 
 61 THR  HB     65 LEU  QD2     7.50 
 61 THR  QG2    62 VAL  HN      6.00                 
 62 VAL  HN     62 VAL  HB      2.90                 
 62 VAL  HN     62 VAL  QQG     5.00 
 62 VAL  HN     63 GLY  HN      3.50                 
 62 VAL  HA     62 VAL  HB      3.50 
 62 VAL  HA     62 VAL  QQG     6.00 
 62 VAL  HA     65 LEU  QQD     7.50   
 62 VAL  HA     63 GLY  HN      5.00               
 62 VAL  HB     62 VAL  QQG     6.00 
 62 VAL  HB     63 GLY  HN      4.20                 
 62 VAL  QQG    63 GLY  HN      6.50     
 62 VAL  QQG    71 LEU  QQD     7.50                             
 63 GLY  QA     65 LEU  HN      6.00                 
 64 ARG  HN     64 ARG  HB2     4.20               
 64 ARG  HN     64 ARG  HB3     3.50                 
 64 ARG  HN     64 ARG  QB      3.50                
 64 ARG  HN     64 ARG  HG2     6.00                 
 64 ARG  HN     64 ARG  HG3     6.00   
 64 ARG  HN     65 LEU  QD1     7.50                           
 64 ARG  HA     64 ARG  HG2     6.00                 
 64 ARG  HA     64 ARG  HG3     6.00                 
 64 ARG  HA     64 ARG  QD      6.00                 
 64 ARG  HA     64 ARG  HE      6.00                 
 64 ARG  HB2    64 ARG  HE      6.00                 
 64 ARG  HB2    65 LEU  HN      5.00                                
 64 ARG  HB3    64 ARG  HE      6.00                 
 64 ARG  HG2    65 LEU  QD1     7.50 
 64 ARG  QB     64 ARG  QD      4.20                              
 64 ARG  QB     64 ARG  HE      6.00                                
 64 ARG  QG     64 ARG  HE      6.00      
 64 ARG  HD3    64 ARG  HE      3.50            
 65 LEU  HN     65 LEU  HB2     5.00 
 65 LEU  HN     65 LEU  QD1     7.50                 
 65 LEU  HN     65 LEU  QD2     7.50                 
 65 LEU  HN     65 LEU  QQD     7.50                 
 65 LEU  HN     67 THR  HN      6.00     
 65 LEU  HA     65 LEU  QD1     7.50            
 65 LEU  HA     66 GLY  HN      4.20               
 65 LEU  QB     66 GLY  HN      5.00                 
 65 LEU  QQD    66 GLY  HN      7.50                 
 66 GLY  HN     67 THR  HN      3.50                 
 66 GLY  HA1    67 THR  HN      4.20               
 66 GLY  HA2    67 THR  HN      3.50                                 
 66 GLY  QA     67 THR  QG2     7.50 
 67 THR  HA     68 PRO  HD2     3.50 
 67 THR  HN     67 THR  HB      4.20                 
 67 THR  HN     67 THR  QG2     3.50                 
 67 THR  HN     70 GLU  HN      6.00                 
 67 THR  HN     70 GLU  QB      5.00                 
 67 THR  HN     70 GLU  QG      6.00                 
 67 THR  HA     67 THR  QG2     3.50 
 67 THR  HA     68 PRO  HD3     3.50 
 67 THR  HB     68 PRO  HD2     3.50 
 67 THR  HB     68 PRO  HD3     3.50 
 67 THR  HB     68 PRO  HG2     5.00 
 67 THR  HB     69 ARG  HN      5.00                 
 67 THR  QG2    68 PRO  QG      7.50 
 67 THR  QG2    68 PRO  HD2     7.50 
 67 THR  QG2    69 ARG  HD3     7.50 
 67 THR  QG2    70 GLU  HN      6.00                 
 67 THR  QG2    70 GLU  QB      6.00                 
 68 PRO  HA     68 PRO  QG      5.00 
 68 PRO  HA     69 ARG  HN      5.00 
 68 PRO  HA     71 LEU  HB3     5.00 
 68 PRO  QB     69 ARG  HN      6.00                 
 68 PRO  QG     69 ARG  HN      3.50                 
 68 PRO  QD     69 ARG  HN      5.00                 
 69 ARG  HN     69 ARG  HB2     5.00                 
 69 ARG  HN     69 ARG  HB3     3.50             
 69 ARG  HN     69 ARG  QB      3.50                 
 69 ARG  HN     69 ARG  QG      3.50 
 69 ARG  HN     69 ARG  HD2     6.00                
 69 ARG  HN     70 GLU  HN      3.50                 
 69 ARG  HN     72 LEU  QD1     7.50                 
 69 ARG  HN     72 LEU  QD2     7.50                 
 69 ARG  HN     72 LEU  QQD     7.50                 
 69 ARG  HA     70 GLU  HN      5.00 
 69 ARG  HA     72 LEU  HN      3.50                 
 69 ARG  HA     72 LEU  HB2     5.00                 
 69 ARG  HA     72 LEU  HB3     4.20                 
 69 ARG  HA     72 LEU  QB      4.20                 
 69 ARG  HA     72 LEU  QD1     6.00                 
 69 ARG  HA     72 LEU  QD2     6.00                 
 69 ARG  HA     72 LEU  QQD     4.20                 
 69 ARG  HA     73 ASP  HN      5.00                 
 69 ARG  HB2    69 ARG  HE      6.00                 
 69 ARG  HB2    70 GLU  HN      4.20                 
 69 ARG  HB3    69 ARG  HE      6.00                 
 69 ARG  HB3    70 GLU  HN      5.00                 
 69 ARG  QB     70 GLU  HN      4.20                 
 69 ARG  QG     69 ARG  HE      5.00 
 69 ARG  QG     70 GLU  HN      3.50                                 
 69 ARG  HD2    69 ARG  HE      3.50 
 69 ARG  HD3    69 ARG  HE      5.00 
 70 GLU  HN     70 GLU  QB      2.90 
 70 GLU  HN     70 GLU  HG2     4.20                 
 70 GLU  HN     70 GLU  HG3     4.20                 
 70 GLU  HN     70 GLU  QG      4.20                 
 70 GLU  HN     71 LEU  HN      2.90                 
 70 GLU  HN     72 LEU  HN      4.20                 
 70 GLU  HN     72 LEU  QD1     7.50 
 70 GLU  HN     72 LEU  QD2     7.50 
 70 GLU  HA     70 GLU  HG2     4.20                 
 70 GLU  HA     70 GLU  HG3     4.20                 
 70 GLU  HA     71 LEU  HN      3.50 
 70 GLU  HA     73 ASP  HN      5.00                 
 70 GLU  HA     73 ASP  HB2     3.50                 
 70 GLU  HA     73 ASP  HB3     2.90                 
 70 GLU  HA     73 ASP  QB      4.20                 
 70 GLU  QB     71 LEU  HN      4.20                 
 71 LEU  HN     71 LEU  HB2     3.50                 
 71 LEU  HN     71 LEU  HB3     3.50                 
 71 LEU  HN     71 LEU  QB      2.90                 
 71 LEU  HN     71 LEU  HG      6.00                 
 71 LEU  HN     71 LEU  QQD     6.00                 
 71 LEU  HN     72 LEU  HN      2.90                 
 71 LEU  HA     71 LEU  HG      4.20               
 71 LEU  HA     72 LEU  HN      5.00 
 71 LEU  HA     74 GLU  HA      6.00 
 71 LEU  HB2    72 LEU  HN      5.00                 
 71 LEU  HB3    72 LEU  HN      5.00                 
 71 LEU  HG     72 LEU  HN      6.00                 
 71 LEU  QQD    72 LEU  HN      7.00                 
 71 LEU  QQD    72 LEU  HA      6.50                 
 71 LEU  QQD    74 GLU  HN      7.50 
 71 LEU  QQD    74 GLU  HB2     7.50 
 71 LEU  QQD    74 GLU  HB3     7.50 
 71 LEU  QQD    74 GLU  HG2     7.50 
 71 LEU  QQD    74 GLU  HG3     7.50 
 71 LEU  QD1    75 VAL  HN      7.50 
 72 LEU  HN     72 LEU  HB2     4.20               
 72 LEU  HN     72 LEU  HB3     3.50                 
 72 LEU  HN     72 LEU  QB      2.90                 
 72 LEU  HN     72 LEU  HG      3.50                 
 72 LEU  HN     72 LEU  QD1     6.00                 
 72 LEU  HN     72 LEU  QD2     6.00                 
 72 LEU  HA     72 LEU  HG      4.20                 
 72 LEU  HA     73 ASP  HN      5.00 
 72 LEU  HA     75 VAL  HN      3.50                 
 72 LEU  HA     75 VAL  HB      3.50                 
 72 LEU  HA     75 VAL  QQG     7.50                 
 72 LEU  HB2    73 ASP  HN      5.00                 
 72 LEU  HB2    75 VAL  HB      6.00 
 72 LEU  HB2    76 ASN  HD21    5.00 
 72 LEU  HB2    76 ASN  HD22    5.00 
 72 LEU  HB3    73 ASP  HN      4.20                 
 72 LEU  QB     73 ASP  HN      4.20                 
 72 LEU  HG     73 ASP  HN      3.50                 
 72 LEU  QQD    73 ASP  HN      7.50                 
 72 LEU  QQD    75 VAL  HB      7.50                 
 72 LEU  QD1    76 ASN  QD2     7.50 
 72 LEU  QD2    76 ASN  QD2     7.50 
 73 ASP  HN     73 ASP  HB2     3.50                 
 73 ASP  HN     73 ASP  HB3     3.50                 
 73 ASP  HN     74 GLU  HN      2.90                
 73 ASP  HN     75 VAL  HN      5.00 
 73 ASP  HN     74 GLU  HB3     6.00 
 73 ASP  HA     73 ASP  HB2     3.50                 
 73 ASP  HA     73 ASP  HB3     3.50                 
 73 ASP  HA     76 ASN  HN      3.50                 
 73 ASP  HA     76 ASN  QB      3.50                 
 73 ASP  HB2    74 GLU  HN      5.00                 
 73 ASP  HB3    74 GLU  HN      5.00                 
 74 GLU  HN     74 GLU  HB2     2.90                 
 74 GLU  HN     74 GLU  HB3     3.50                 
 74 GLU  HN     74 GLU  HG2     6.00                 
 74 GLU  HN     74 GLU  HG3     6.00                 
 74 GLU  HN     75 VAL  HN      2.90               
 74 GLU  HA     75 VAL  HN      4.20               
 74 GLU  HA     77 THR  HB      3.50  
 74 GLU  HA     77 THR  HN      5.00                                
 74 GLU  HB2    75 VAL  HN      5.00                 
 74 GLU  HB3    75 VAL  HN      3.50                 
 74 GLU  QG     75 VAL  HN      6.00                 
 75 VAL  HN     75 VAL  HB      2.90                 
 75 VAL  HN     75 VAL  QG1     5.00                 
 75 VAL  HN     75 VAL  QG2     3.50                 
 75 VAL  HN     75 VAL  QQG     4.20                 
 75 VAL  HN     77 THR  HN      5.00                 
 75 VAL  HA     75 VAL  HB      3.50    
 75 VAL  HA     75 VAL  QG1     3.50 
 75 VAL  HA     75 VAL  QG2     5.00              
 75 VAL  HA     76 ASN  HN      3.50                 
 75 VAL  HA     77 THR  HN      5.00                 
 75 VAL  HA     78 THR  HB      5.00                 
 75 VAL  HB     76 ASN  HN      3.50                 
 75 VAL  QG1    76 ASN  HN      6.00                 
 75 VAL  QG2    76 ASN  HN      5.00                 
 75 VAL  QQG    76 ASN  HN      6.00                 
 76 ASN  HN     76 ASN  QB      2.90 
 76 ASN  HN     77 THR  HN      2.90                 
 76 ASN  HA     77 THR  HN      3.50 
 76 ASN  QB     76 ASN  HD21    3.50 
 76 ASN  QB     76 ASN  HD22    5.00 
 76 ASN  QB     77 THR  HN      4.20                                
 77 THR  HN     77 THR  HB      3.50                 
 77 THR  HN     77 THR  QG2     5.00                 
 77 THR  HN     78 THR  HN      3.50                 
 77 THR  HA     78 THR  HN      4.20               
 77 THR  HB     78 THR  HN      5.00 
 77 THR  QG2    78 THR  HN      5.00              
 78 THR  HN     78 THR  HB      3.50                 
 78 THR  HA     78 THR  QG2     4.20 
 78 THR  HA     79 PRO  QD      3.50 
 78 THR  HB     79 PRO  QD      6.00  
 78 THR  QG2    79 PRO  HB3     7.50 
 78 THR  QG2    79 PRO  QD      7.50 
 79 PRO  HA     80 ALA  HN      5.00               
 79 PRO  HB2    80 ALA  HN      5.00                 
 79 PRO  HB3    80 ALA  HN      5.00                 
 79 PRO  QB     80 ALA  HN      5.00                 
 79 PRO  HG2    80 ALA  HN      5.00                 
 80 ALA  HN     80 ALA  HA      2.90                 
 80 ALA  HN     80 ALA  QB      5.00                                 
 80 ALA  HN     81 THR  HN      3.50                 
 80 ALA  HN     82 ALA  HN      5.00                             
 80 ALA  HA     81 THR  HN      3.50             
 80 ALA  QB     81 THR  HN      7.50                
 80 ALA  QB     82 ALA  HN      7.50 
 81 THR  HN     81 THR  HB      4.20 
 81 THR  HN     81 THR  QG2     7.50 
 81 THR  HN     82 ALA  HN      3.50                 
 81 THR  HA     82 ALA  HN      4.20              
 81 THR  HB     82 ALA  HN      6.00  
 82 ALA  HN     82 ALA  QB      3.50                
3       LEU     PHI     -160    -80 
4       THR     PHI     -160    -80 
5       VAL     PHI     -90     -20 
6       ASP     PHI     -160    -80 
8       LEU     PHI     -90     -20 
9       LYS     PHI     -90     -20 
10      LYS     PHI     -90     -20 
11      LEU     PHI     -90     -20 
14      GLU     PHI     -90     -20 
16      ALA     PHI     -90     -20 
18      GLU     PHI     -180    -60 
19      ASP     PHI     -170    -70 
20      ASP     PHI     -180    -60 
23      ASP     PHI     -180    -60 
24      LEU     PHI     -90     -20 
25      ALA     PHI     -90     -20 
26      GLY     PHI     -180    -60 
29      ASP     PHI     -90     -20 
30      THR     PHI     -90     -20 
32      PHE     PHI     -90     -20 
33      VAL     PHI     -90     -20 
34      ASP     PHI     -180    -60 
35      LEU     PHI     -180    -60 
36      GLY     PHI     -160    -80 
39      SER     PHI     -90     -20 
41      ALA     PHI     -90     -20 
44      GLU     PHI     -180    -60 
45      THR     PHI     -90     -20 
46      ALA     PHI     -180    -60 
47      ALA     PHI     -90     -20 
49      LEU     PHI     -90     -20 
51      GLN     PHI     -90     -20 
52      ARG     PHI     -90     -20 
55      ILE     PHI     -160    -80 
56      ALA     PHI     -160    -80 
57      LEU     PHI     -170    -70 
59      ASP     PHI     -90     -20 
60      GLU     PHI     -90     -20 
67      THR     PHI     -170    -70 
69      ARG     PHI     -90     -20 
71      LEU     PHI     -160    -80 
72      LEU     PHI     -90     -20 
73      ASP     PHI     -90     -20 
75      VAL     PHI     -90     -20 
77      THR     PHI     -180    -60  


  Entry H atom name         Submitted Coord H atom name
    1    H    SER   1           HN       SER   1   1.884   0.000   0.829
    2    HA   SER   1           HA       SER   1   2.661   0.918  -1.229
    3   1HB   SER   1          2HB       SER   1   3.534  -1.197  -2.281
    4   2HB   SER   1          3HB       SER   1   3.773  -1.123  -0.547
    5    HG   SER   1           HG       SER   1   2.738  -2.986  -0.453
    6    H    ALA   2           HN       ALA   2   0.799   2.025  -2.240
    7    HA   ALA   2           HA       ALA   2  -1.043   0.504  -3.798
    8   1HB   ALA   2          1HB       ALA   2  -2.174   2.452  -3.766
    9   2HB   ALA   2          2HB       ALA   2  -0.881   3.087  -2.720
   10   3HB   ALA   2          3HB       ALA   2  -0.804   3.336  -4.481
   11    H    LEU   3           HN       LEU   3   1.547   2.915  -4.661
   12    HA   LEU   3           HA       LEU   3   1.728   1.548  -7.251
   13   1HB   LEU   3          2HB       LEU   3   1.068   3.812  -7.508
   14   2HB   LEU   3          3HB       LEU   3   2.300   4.380  -6.399
   15    HG   LEU   3           HG       LEU   3   3.360   2.924  -8.736
   16   1HD1  LEU   3          1HD1      LEU   3   2.264   5.680  -9.264
   17   2HD1  LEU   3          2HD1      LEU   3   2.859   4.462 -10.417
   18   3HD1  LEU   3          3HD1      LEU   3   1.304   4.216  -9.587
   19   1HD2  LEU   3          1HD2      LEU   3   4.297   5.636  -8.339
   20   2HD2  LEU   3          2HD2      LEU   3   4.288   4.727  -6.808
   21   3HD2  LEU   3          3HD2      LEU   3   5.176   4.092  -8.215
   22    H    THR   4           HN       THR   4   3.706   0.754  -7.985
   23    HA   THR   4           HA       THR   4   5.954   1.034  -6.107
   24    HB   THR   4           HB       THR   4   5.020  -1.152  -5.658
   25    HG1  THR   4           HG1      THR   4   7.012  -2.032  -6.088
   26   1HG2  THR   4          1HG2      THR   4   4.426  -2.756  -7.372
   27   2HG2  THR   4          2HG2      THR   4   3.627  -1.235  -7.841
   28   3HG2  THR   4          3HG2      THR   4   5.127  -1.741  -8.655
   29    H    VAL   5           HN       VAL   5   8.064   0.227  -7.213
   30    HA   VAL   5           HA       VAL   5   8.459   1.901  -9.426
   31    HB   VAL   5           HB       VAL   5  10.041   0.896  -7.569
   32   1HG1  VAL   5          1HG1      VAL   5  10.041  -1.399  -8.066
   33   2HG1  VAL   5          2HG1      VAL   5  10.184  -1.116  -9.817
   34   3HG1  VAL   5          3HG1      VAL   5  11.575  -0.810  -8.750
   35   1HG2  VAL   5          1HG2      VAL   5  10.627   1.829 -10.354
   36   2HG2  VAL   5          2HG2      VAL   5  10.974   2.605  -8.790
   37   3HG2  VAL   5          3HG2      VAL   5  11.975   1.244  -9.349
   38    H    ASP   6           HN       ASP   6   6.977  -1.172  -9.155
   39    HA   ASP   6           HA       ASP   6   7.878  -2.192 -11.635
   40   1HB   ASP   6          2HB       ASP   6   6.479  -3.170  -9.402
   41   2HB   ASP   6          3HB       ASP   6   5.265  -3.176 -10.665
   42    HD2  ASP   6           HD2      ASP   6   6.852  -5.638  -9.496
   43    H    ASP   7           HN       ASP   7   4.744  -0.840 -10.344
   44    HA   ASP   7           HA       ASP   7   3.511  -0.812 -12.850
   45   1HB   ASP   7          2HB       ASP   7   2.922   0.014 -10.098
   46   2HB   ASP   7          3HB       ASP   7   2.309   1.194 -11.239
   47    HD2  ASP   7           HD2      ASP   7   0.113   0.007 -12.569
   48    H    LEU   8           HN       LEU   8   5.666   1.366 -11.061
   49    HA   LEU   8           HA       LEU   8   5.027   3.680 -12.627
   50   1HB   LEU   8          2HB       LEU   8   5.714   3.812 -10.279
   51   2HB   LEU   8          3HB       LEU   8   7.274   3.125 -10.685
   52    HG   LEU   8           HG       LEU   8   7.191   5.631 -10.350
   53   1HD1  LEU   8          1HD1      LEU   8   8.812   6.088 -12.061
   54   2HD1  LEU   8          2HD1      LEU   8   9.033   4.412 -11.503
   55   3HD1  LEU   8          3HD1      LEU   8   8.220   4.734 -13.054
   56   1HD2  LEU   8          1HD2      LEU   8   5.031   5.937 -11.589
   57   2HD2  LEU   8          2HD2      LEU   8   6.333   7.056 -12.060
   58   3HD2  LEU   8          3HD2      LEU   8   5.931   5.670 -13.102
   59    H    LYS   9           HN       LYS   9   7.652   1.206 -12.478
   60    HA   LYS   9           HA       LYS   9   9.337   2.309 -14.346
   61   1HB   LYS   9          2HB       LYS   9  10.123   0.483 -13.099
   62   2HB   LYS   9          3HB       LYS   9   8.745  -0.522 -13.501
   63   1HG   LYS   9          2HG       LYS   9   9.487  -0.606 -15.883
   64   2HG   LYS   9          3HG       LYS   9  10.852   0.425 -15.501
   65   1HD   LYS   9          2HD       LYS   9  12.041  -1.437 -14.995
   66   2HD   LYS   9          3HD       LYS   9  11.004  -1.665 -13.601
   67   1HE   LYS   9          2HE       LYS   9   9.344  -2.790 -15.323
   68   2HE   LYS   9          3HE       LYS   9  10.751  -2.907 -16.359
   69   1HZ   LYS   9          1HZ       LYS   9  10.439  -4.104 -13.666
   70   2HZ   LYS   9          2HZ       LYS   9  10.670  -4.892 -15.072
   71    H    LYS  10           HN       LYS  10   6.619  -0.039 -14.899
   72    HA   LYS  10           HA       LYS  10   6.848  -0.162 -17.637
   73   1HB   LYS  10          2HB       LYS  10   4.928  -1.367 -17.546
   74   2HB   LYS  10          3HB       LYS  10   5.306  -1.382 -15.835
   75   1HG   LYS  10          2HG       LYS  10   3.817   0.562 -15.452
   76   2HG   LYS  10          3HG       LYS  10   3.495   0.685 -17.171
   77   1HD   LYS  10          2HD       LYS  10   2.907  -1.873 -15.627
   78   2HD   LYS  10          3HD       LYS  10   1.747  -0.562 -15.695
   79   1HE   LYS  10          2HE       LYS  10   1.842  -0.662 -18.224
   80   2HE   LYS  10          3HE       LYS  10   2.913  -2.043 -18.100
   81   1HZ   LYS  10          1HZ       LYS  10   0.954  -3.172 -18.119
   82   2HZ   LYS  10          2HZ       LYS  10   0.888  -2.827 -16.529
   83    H    LEU  11           HN       LEU  11   5.401   2.344 -15.542
   84    HA   LEU  11           HA       LEU  11   4.149   3.706 -17.705
   85   1HB   LEU  11          2HB       LEU  11   3.987   3.731 -14.950
   86   2HB   LEU  11          3HB       LEU  11   4.762   5.262 -15.307
   87    HG   LEU  11           HG       LEU  11   2.183   4.361 -16.611
   88   1HD1  LEU  11          1HD1      LEU  11   1.712   6.470 -14.772
   89   2HD1  LEU  11          2HD1      LEU  11   1.081   4.806 -14.742
   90   3HD1  LEU  11          3HD1      LEU  11   2.605   5.196 -13.909
   91   1HD2  LEU  11          1HD2      LEU  11   2.070   6.384 -17.636
   92   2HD2  LEU  11          2HD2      LEU  11   2.953   7.224 -16.339
   93   3HD2  LEU  11          3HD2      LEU  11   3.841   6.241 -17.528
   94    H    LEU  12           HN       LEU  12   7.359   3.666 -16.198
   95    HA   LEU  12           HA       LEU  12   8.202   6.153 -17.232
   96   1HB   LEU  12          2HB       LEU  12   9.457   3.780 -15.953
   97   2HB   LEU  12          3HB       LEU  12  10.503   4.846 -16.870
   98    HG   LEU  12           HG       LEU  12   8.685   5.801 -14.644
   99   1HD1  LEU  12          1HD1      LEU  12  11.505   4.757 -14.563
  100   2HD1  LEU  12          2HD1      LEU  12  10.944   5.976 -13.394
  101   3HD1  LEU  12          3HD1      LEU  12  10.131   4.396 -13.491
  102   1HD2  LEU  12          1HD2      LEU  12   9.583   7.379 -16.505
  103   2HD2  LEU  12          2HD2      LEU  12   9.716   7.868 -14.798
  104   3HD2  LEU  12          3HD2      LEU  12  11.137   7.217 -15.651
  105    H    ALA  13           HN       ALA  13   8.522   2.731 -18.367
  106    HA   ALA  13           HA       ALA  13   9.995   3.377 -20.664
  107   1HB   ALA  13          1HB       ALA  13   8.117   1.029 -20.558
  108   2HB   ALA  13          2HB       ALA  13   9.793   1.117 -21.149
  109   3HB   ALA  13          3HB       ALA  13   9.466   1.105 -19.400
  110    H    GLU  14           HN       GLU  14   6.496   2.402 -20.392
  111    HA   GLU  14           HA       GLU  14   5.674   2.817 -22.847
  112   1HB   GLU  14          2HB       GLU  14   4.437   2.588 -20.384
  113   2HB   GLU  14          3HB       GLU  14   3.892   4.173 -20.895
  114   1HG   GLU  14          2HG       GLU  14   3.574   2.736 -23.234
  115   2HG   GLU  14          3HG       GLU  14   3.263   1.492 -22.038
  116    HE2  GLU  14           HE2      GLU  14   1.258   1.781 -23.128
  117    H    THR  15           HN       THR  15   6.308   5.443 -20.451
  118    HA   THR  15           HA       THR  15   5.567   7.491 -22.336
  119    HB   THR  15           HB       THR  15   6.493   7.271 -19.472
  120    HG1  THR  15           HG1      THR  15   4.267   7.501 -19.783
  121   1HG2  THR  15          1HG2      THR  15   7.859   9.139 -19.861
  122   2HG2  THR  15          2HG2      THR  15   6.944   9.628 -21.307
  123   3HG2  THR  15          3HG2      THR  15   6.285   9.951 -19.685
  124    H    ALA  16           HN       ALA  16   8.679   6.647 -20.663
  125    HA   ALA  16           HA       ALA  16  10.232   8.299 -22.269
  126   1HB   ALA  16          1HB       ALA  16  10.832   7.234 -20.055
  127   2HB   ALA  16          2HB       ALA  16  11.075   5.702 -20.929
  128   3HB   ALA  16          3HB       ALA  16  12.096   7.112 -21.302
  129    H    GLY  17           HN       GLY  17  10.330   4.674 -22.383
  130   1HA   GLY  17          1HA       GLY  17   9.651   3.624 -24.502
  131   2HA   GLY  17          2HA       GLY  17  10.520   4.902 -25.328
  132    H    GLU  18           HN       GLU  18  11.190   2.634 -22.555
  133    HA   GLU  18           HA       GLU  18  13.683   2.001 -23.933
  134   1HB   GLU  18          2HB       GLU  18  13.161   2.447 -20.973
  135   2HB   GLU  18          3HB       GLU  18  14.566   1.561 -21.531
  136   1HG   GLU  18          2HG       GLU  18  14.860   3.695 -23.134
  137   2HG   GLU  18          3HG       GLU  18  13.891   4.480 -21.903
  138    HE2  GLU  18           HE2      GLU  18  17.570   4.441 -21.244
  139    H    ASP  19           HN       ASP  19  12.253   0.287 -24.937
  140    HA   ASP  19           HA       ASP  19  11.617  -1.819 -23.048
  141   1HB   ASP  19          2HB       ASP  19  10.482  -2.830 -25.135
  142   2HB   ASP  19          3HB       ASP  19   9.760  -1.379 -24.470
  143    HD2  ASP  19           HD2      ASP  19   9.752  -0.287 -27.746
  144    H    ASP  20           HN       ASP  20  14.234  -1.869 -23.088
  145    HA   ASP  20           HA       ASP  20  14.890  -3.983 -24.942
  146   1HB   ASP  20          2HB       ASP  20  16.309  -1.319 -24.688
  147   2HB   ASP  20          3HB       ASP  20  17.246  -2.746 -25.083
  148    HD2  ASP  20           HD2      ASP  20  17.615  -2.787 -26.985
  149    H    SER  21           HN       SER  21  15.916  -1.802 -22.226
  150    HA   SER  21           HA       SER  21  16.516  -4.059 -20.622
  151   1HB   SER  21          2HB       SER  21  18.634  -3.096 -22.203
  152   2HB   SER  21          3HB       SER  21  18.913  -2.354 -20.640
  153    HG   SER  21           HG       SER  21  18.291  -5.156 -20.804
  154    H    VAL  22           HN       VAL  22  14.572  -2.334 -20.077
  155    HA   VAL  22           HA       VAL  22  15.675  -0.161 -18.473
  156    HB   VAL  22           HB       VAL  22  13.920   0.353 -20.082
  157   1HG1  VAL  22          1HG1      VAL  22  11.592  -0.489 -19.671
  158   2HG1  VAL  22          2HG1      VAL  22  12.736  -1.736 -20.226
  159   3HG1  VAL  22          3HG1      VAL  22  12.273  -1.652 -18.509
  160   1HG2  VAL  22          1HG2      VAL  22  12.378   1.531 -18.567
  161   2HG2  VAL  22          2HG2      VAL  22  12.973   0.555 -17.203
  162   3HG2  VAL  22          3HG2      VAL  22  14.068   1.686 -18.033
  163    H    ASP  23           HN       ASP  23  16.507  -2.374 -17.283
  164    HA   ASP  23           HA       ASP  23  14.493  -3.418 -15.556
  165   1HB   ASP  23          2HB       ASP  23  17.249  -4.047 -16.325
  166   2HB   ASP  23          3HB       ASP  23  17.073  -4.122 -14.584
  167    HD2  ASP  23           HD2      ASP  23  15.133  -4.931 -17.227
  168    H    LEU  24           HN       LEU  24  13.813  -1.622 -14.226
  169    HA   LEU  24           HA       LEU  24  15.678   0.131 -13.024
  170   1HB   LEU  24          2HB       LEU  24  12.746  -0.379 -12.858
  171   2HB   LEU  24          3HB       LEU  24  13.499   0.529 -11.561
  172    HG   LEU  24           HG       LEU  24  14.393   2.134 -13.256
  173   1HD1  LEU  24          1HD1      LEU  24  13.372   0.131 -15.083
  174   2HD1  LEU  24          2HD1      LEU  24  12.680   1.734 -15.431
  175   3HD1  LEU  24          3HD1      LEU  24  14.447   1.517 -15.389
  176   1HD2  LEU  24          1HD2      LEU  24  12.630   3.313 -12.615
  177   2HD2  LEU  24          2HD2      LEU  24  11.678   2.570 -13.922
  178   3HD2  LEU  24          3HD2      LEU  24  11.705   1.824 -12.306
  179    H    ALA  25           HN       ALA  25  13.975  -2.866 -11.996
  180    HA   ALA  25           HA       ALA  25  14.501  -2.871  -9.335
  181   1HB   ALA  25          1HB       ALA  25  13.605  -4.672 -11.266
  182   2HB   ALA  25          2HB       ALA  25  15.048  -5.466 -10.590
  183   3HB   ALA  25          3HB       ALA  25  13.714  -4.978  -9.516
  184    H    GLY  26           HN       GLY  26  16.776  -3.109 -12.024
  185   1HA   GLY  26          1HA       GLY  26  18.947  -3.712 -10.110
  186   2HA   GLY  26          2HA       GLY  26  18.967  -4.092 -11.821
  187    H    GLU  27           HN       GLU  27  17.773  -1.040 -10.310
  188    HA   GLU  27           HA       GLU  27  20.006   0.463 -10.481
  189   1HB   GLU  27          2HB       GLU  27  18.952  -0.129 -13.148
  190   2HB   GLU  27          3HB       GLU  27  18.949   1.597 -12.845
  191   1HG   GLU  27          2HG       GLU  27  21.216   1.721 -12.991
  192   2HG   GLU  27          3HG       GLU  27  21.433   0.392 -11.869
  193    HE2  GLU  27           HE2      GLU  27  23.130  -0.284 -14.404
  194    H    LEU  28           HN       LEU  28  18.833   1.253  -8.628
  195    HA   LEU  28           HA       LEU  28  16.562   2.968  -9.362
  196   1HB   LEU  28          2HB       LEU  28  17.071   1.574  -6.731
  197   2HB   LEU  28          3HB       LEU  28  15.717   2.624  -7.102
  198    HG   LEU  28           HG       LEU  28  16.106   0.261  -8.876
  199   1HD1  LEU  28          1HD1      LEU  28  15.184  -1.326  -7.370
  200   2HD1  LEU  28          2HD1      LEU  28  16.553  -0.556  -6.532
  201   3HD1  LEU  28          3HD1      LEU  28  14.885  -0.083  -6.130
  202   1HD2  LEU  28          1HD2      LEU  28  13.457   0.674  -7.797
  203   2HD2  LEU  28          2HD2      LEU  28  14.122   2.195  -8.439
  204   3HD2  LEU  28          3HD2      LEU  28  14.028   0.754  -9.481
  205    H    ASP  29           HN       ASP  29  19.209   2.549  -6.904
  206    HA   ASP  29           HA       ASP  29  19.189   5.060  -5.930
  207   1HB   ASP  29          2HB       ASP  29  20.865   2.815  -5.785
  208   2HB   ASP  29          3HB       ASP  29  21.929   4.056  -6.415
  209    HD2  ASP  29           HD2      ASP  29  22.355   3.988  -2.990
  210    H    THR  30           HN       THR  30  20.569   3.784  -8.986
  211    HA   THR  30           HA       THR  30  22.125   6.043  -9.647
  212    HB   THR  30           HB       THR  30  20.900   3.709 -11.190
  213    HG1  THR  30           HG1      THR  30  23.206   3.149 -11.076
  214   1HG2  THR  30          1HG2      THR  30  23.034   5.653 -12.196
  215   2HG2  THR  30          2HG2      THR  30  22.276   4.316 -13.094
  216   3HG2  THR  30          3HG2      THR  30  21.328   5.768 -12.691
  217    HA   PRO  31           HA       PRO  31  18.973   8.776 -10.755
  218   1HB   PRO  31          2HB       PRO  31  20.545  10.832 -11.632
  219   2HB   PRO  31          3HB       PRO  31  20.158  10.575  -9.942
  220   1HG   PRO  31          2HG       PRO  31  22.691  10.032 -11.367
  221   2HG   PRO  31          3HG       PRO  31  22.412  10.188  -9.643
  222   1HD   PRO  31          2HD       PRO  31  22.799   7.751 -11.106
  223   2HD   PRO  31          3HD       PRO  31  22.405   7.901  -9.405
  224    H    PHE  32           HN       PHE  32  17.682   9.294 -12.479
  225    HA   PHE  32           HA       PHE  32  17.904   7.836 -14.721
  226   1HB   PHE  32          2HB       PHE  32  16.921  10.707 -14.241
  227   2HB   PHE  32          3HB       PHE  32  16.585   9.861 -15.738
  228    HD1  PHE  32           HD1      PHE  32  15.436   7.505 -15.453
  229    HD2  PHE  32           HD2      PHE  32  15.389  10.566 -12.513
  230    HE1  PHE  32           HE1      PHE  32  13.397   6.476 -14.413
  231    HE2  PHE  32           HE2      PHE  32  13.350   9.536 -11.474
  232    HZ   PHE  32           HZ       PHE  32  12.378   7.504 -12.436
  233    H    VAL  33           HN       VAL  33  19.232  11.181 -14.251
  234    HA   VAL  33           HA       VAL  33  20.197  11.602 -16.769
  235    HB   VAL  33           HB       VAL  33  20.151  13.265 -15.012
  236   1HG1  VAL  33          1HG1      VAL  33  22.611  12.534 -13.630
  237   2HG1  VAL  33          2HG1      VAL  33  21.023  12.992 -12.970
  238   3HG1  VAL  33          3HG1      VAL  33  21.343  11.302 -13.426
  239   1HG2  VAL  33          1HG2      VAL  33  22.195  12.914 -16.886
  240   2HG2  VAL  33          2HG2      VAL  33  21.767  14.421 -16.040
  241   3HG2  VAL  33          3HG2      VAL  33  23.039  13.362 -15.384
  242    H    ASP  34           HN       ASP  34  21.464   9.502 -14.177
  243    HA   ASP  34           HA       ASP  34  23.969   9.126 -15.358
  244   1HB   ASP  34          2HB       ASP  34  22.727   8.407 -12.977
  245   2HB   ASP  34          3HB       ASP  34  22.841   6.861 -13.793
  246    HD2  ASP  34           HD2      ASP  34  24.909   5.892 -13.676
  247    H    LEU  35           HN       LEU  35  20.920   7.131 -15.214
  248    HA   LEU  35           HA       LEU  35  21.831   5.073 -16.856
  249   1HB   LEU  35          2HB       LEU  35  19.026   6.068 -16.334
  250   2HB   LEU  35          3HB       LEU  35  19.427   4.547 -17.107
  251    HG   LEU  35           HG       LEU  35  20.860   4.495 -14.703
  252   1HD1  LEU  35          1HD1      LEU  35  18.992   4.857 -13.031
  253   2HD1  LEU  35          2HD1      LEU  35  19.722   6.323 -13.727
  254   3HD1  LEU  35          3HD1      LEU  35  18.141   5.753 -14.311
  255   1HD2  LEU  35          1HD2      LEU  35  18.984   2.941 -16.111
  256   2HD2  LEU  35          2HD2      LEU  35  19.974   2.462 -14.711
  257   3HD2  LEU  35          3HD2      LEU  35  18.339   3.120 -14.461
  258    H    GLY  36           HN       GLY  36  19.069   7.053 -17.979
  259   1HA   GLY  36          1HA       GLY  36  20.537   8.104 -20.236
  260   2HA   GLY  36          2HA       GLY  36  19.444   6.794 -20.638
  261    H    TYR  37           HN       TYR  37  17.296   7.206 -18.863
  262    HA   TYR  37           HA       TYR  37  15.610   8.814 -20.112
  263   1HB   TYR  37          2HB       TYR  37  16.145   8.020 -17.242
  264   2HB   TYR  37          3HB       TYR  37  14.964   9.297 -17.450
  265    HD1  TYR  37           HD1      TYR  37  12.810   8.485 -17.212
  266    HD2  TYR  37           HD2      TYR  37  15.680   6.112 -19.317
  267    HE1  TYR  37           HE1      TYR  37  11.022   6.745 -17.702
  268    HE2  TYR  37           HE2      TYR  37  13.883   4.380 -19.800
  269    HH   TYR  37           HH       TYR  37  11.666   3.704 -18.593
  270    H    ASP  38           HN       ASP  38  15.004  10.982 -20.254
  271    HA   ASP  38           HA       ASP  38  16.956  12.800 -19.089
  272   1HB   ASP  38          2HB       ASP  38  15.432  12.711 -21.657
  273   2HB   ASP  38          3HB       ASP  38  15.560  14.302 -20.934
  274    HD2  ASP  38           HD2      ASP  38  17.979  13.017 -23.323
  275    H    SER  39           HN       SER  39  16.053  14.924 -18.277
  276    HA   SER  39           HA       SER  39  14.037  14.646 -16.532
  277   1HB   SER  39          2HB       SER  39  13.846  17.203 -16.671
  278   2HB   SER  39          3HB       SER  39  15.443  16.559 -16.348
  279    HG   SER  39           HG       SER  39  16.123  17.566 -18.099
  280    H    LEU  40           HN       LEU  40  13.849  15.671 -19.982
  281    HA   LEU  40           HA       LEU  40  11.262  16.544 -20.087
  282   1HB   LEU  40          2HB       LEU  40  12.853  16.710 -21.908
  283   2HB   LEU  40          3HB       LEU  40  12.844  14.971 -22.122
  284    HG   LEU  40           HG       LEU  40  10.270  15.307 -22.534
  285   1HD1  LEU  40          1HD1      LEU  40  10.241  17.628 -23.907
  286   2HD1  LEU  40          2HD1      LEU  40   9.691  17.465 -22.222
  287   3HD1  LEU  40          3HD1      LEU  40  11.327  18.074 -22.569
  288   1HD2  LEU  40          1HD2      LEU  40  11.162  14.457 -24.403
  289   2HD2  LEU  40          2HD2      LEU  40  11.126  16.134 -24.999
  290   3HD2  LEU  40          3HD2      LEU  40  12.619  15.473 -24.291
  291    H    ALA  41           HN       ALA  41  12.359  13.151 -20.813
  292    HA   ALA  41           HA       ALA  41   9.970  11.958 -21.097
  293   1HB   ALA  41          1HB       ALA  41  11.539  10.229 -19.459
  294   2HB   ALA  41          2HB       ALA  41  11.406  10.237 -21.234
  295   3HB   ALA  41          3HB       ALA  41  12.669  11.201 -20.432
  296    H    LEU  42           HN       LEU  42  11.598  12.763 -17.966
  297    HA   LEU  42           HA       LEU  42   9.701  11.597 -16.312
  298   1HB   LEU  42          2HB       LEU  42  11.890  13.548 -16.085
  299   2HB   LEU  42          3HB       LEU  42  10.632  13.731 -14.877
  300    HG   LEU  42           HG       LEU  42  12.459  12.329 -14.070
  301   1HD1  LEU  42          1HD1      LEU  42  10.137  11.952 -13.278
  302   2HD1  LEU  42          2HD1      LEU  42   9.962  10.668 -14.499
  303   3HD1  LEU  42          3HD1      LEU  42  11.161  10.498 -13.194
  304   1HD2  LEU  42          1HD2      LEU  42  13.067  10.236 -15.029
  305   2HD2  LEU  42          2HD2      LEU  42  11.728  10.308 -16.200
  306   3HD2  LEU  42          3HD2      LEU  42  13.093  11.443 -16.337
  307    H    LEU  43           HN       LEU  43   9.966  15.034 -17.462
  308    HA   LEU  43           HA       LEU  43   7.721  16.006 -16.249
  309   1HB   LEU  43          2HB       LEU  43   9.302  16.681 -18.665
  310   2HB   LEU  43          3HB       LEU  43   7.706  17.395 -18.551
  311    HG   LEU  43           HG       LEU  43   9.380  18.911 -17.678
  312   1HD1  LEU  43          1HD1      LEU  43   8.068  18.041 -15.151
  313   2HD1  LEU  43          2HD1      LEU  43   8.158  19.648 -15.911
  314   3HD1  LEU  43          3HD1      LEU  43   7.019  18.432 -16.535
  315   1HD2  LEU  43          1HD2      LEU  43  10.036  16.873 -15.540
  316   2HD2  LEU  43          2HD2      LEU  43  11.003  17.105 -17.016
  317   3HD2  LEU  43          3HD2      LEU  43  10.826  18.438 -15.850
  318    H    GLU  44           HN       GLU  44   8.018  13.905 -19.114
  319    HA   GLU  44           HA       GLU  44   5.402  14.274 -20.002
  320   1HB   GLU  44          2HB       GLU  44   7.698  12.586 -20.638
  321   2HB   GLU  44          3HB       GLU  44   6.217  11.652 -20.720
  322   1HG   GLU  44          2HG       GLU  44   5.605  14.146 -21.951
  323   2HG   GLU  44          3HG       GLU  44   7.195  13.713 -22.547
  324    HE2  GLU  44           HE2      GLU  44   4.341  13.508 -23.641
  325    H    THR  45           HN       THR  45   6.842  11.366 -18.341
  326    HA   THR  45           HA       THR  45   4.361  10.227 -17.723
  327    HB   THR  45           HB       THR  45   6.687   9.141 -17.820
  328    HG1  THR  45           HG1      THR  45   5.544   7.663 -16.634
  329   1HG2  THR  45          1HG2      THR  45   6.889  10.730 -15.251
  330   2HG2  THR  45          2HG2      THR  45   7.588   9.094 -15.295
  331   3HG2  THR  45          3HG2      THR  45   8.164  10.338 -16.430
  332    H    ALA  46           HN       ALA  46   6.049  12.934 -16.323
  333    HA   ALA  46           HA       ALA  46   5.120  12.760 -13.704
  334   1HB   ALA  46          1HB       ALA  46   6.641  14.438 -13.804
  335   2HB   ALA  46          2HB       ALA  46   6.296  14.773 -15.518
  336   3HB   ALA  46          3HB       ALA  46   5.255  15.462 -14.250
  337    H    ALA  47           HN       ALA  47   3.732  14.483 -16.589
  338    HA   ALA  47           HA       ALA  47   1.440  15.370 -15.269
  339   1HB   ALA  47          1HB       ALA  47   1.184  16.396 -17.251
  340   2HB   ALA  47          2HB       ALA  47   2.612  15.514 -17.842
  341   3HB   ALA  47          3HB       ALA  47   0.985  14.835 -18.081
  342    H    VAL  48           HN       VAL  48   2.016  12.457 -17.361
  343    HA   VAL  48           HA       VAL  48  -0.538  11.428 -17.206
  344    HB   VAL  48           HB       VAL  48   2.140  10.037 -17.408
  345   1HG1  VAL  48          1HG1      VAL  48  -0.475   8.920 -17.095
  346   2HG1  VAL  48          2HG1      VAL  48   0.070   8.611 -18.761
  347   3HG1  VAL  48          3HG1      VAL  48   1.069   8.083 -17.385
  348   1HG2  VAL  48          1HG2      VAL  48   1.296  11.856 -19.131
  349   2HG2  VAL  48          2HG2      VAL  48   2.073  10.355 -19.688
  350   3HG2  VAL  48          3HG2      VAL  48   0.300  10.508 -19.729
  351    H    LEU  49           HN       LEU  49   2.107  11.464 -14.834
  352    HA   LEU  49           HA       LEU  49   1.060   9.418 -13.196
  353   1HB   LEU  49          2HB       LEU  49   3.413  10.226 -13.244
  354   2HB   LEU  49          3HB       LEU  49   2.890  11.711 -12.473
  355    HG   LEU  49           HG       LEU  49   2.023  10.280 -10.556
  356   1HD1  LEU  49          1HD1      LEU  49   3.552   8.165 -12.082
  357   2HD1  LEU  49          2HD1      LEU  49   3.188   8.044 -10.344
  358   3HD1  LEU  49          3HD1      LEU  49   1.861   8.127 -11.527
  359   1HD2  LEU  49          1HD2      LEU  49   4.688  11.153 -11.206
  360   2HD2  LEU  49          2HD2      LEU  49   3.857  11.117  -9.632
  361   3HD2  LEU  49          3HD2      LEU  49   4.755   9.688 -10.197
  362    H    GLN  50           HN       GLN  50   0.925  13.043 -13.001
  363    HA   GLN  50           HA       GLN  50  -0.847  12.941 -10.816
  364   1HB   GLN  50          2HB       GLN  50  -0.987  15.377 -11.101
  365   2HB   GLN  50          3HB       GLN  50   0.679  14.851 -11.237
  366   1HG   GLN  50          2HG       GLN  50   0.416  14.835 -13.760
  367   2HG   GLN  50          3HG       GLN  50  -1.198  15.488 -13.562
  368   1HE2  GLN  50          1HE2      GLN  50   2.132  16.053 -12.431
  369   2HE2  GLN  50          2HE2      GLN  50   2.115  17.781 -12.551
  370    H    GLN  51           HN       GLN  51  -1.209  12.503 -14.226
  371    HA   GLN  51           HA       GLN  51  -3.755  13.608 -14.531
  372   1HB   GLN  51          2HB       GLN  51  -2.158  11.529 -16.061
  373   2HB   GLN  51          3HB       GLN  51  -3.796  11.929 -16.539
  374   1HG   GLN  51          2HG       GLN  51  -2.393  14.407 -16.077
  375   2HG   GLN  51          3HG       GLN  51  -1.366  13.395 -17.074
  376   1HE2  GLN  51          1HE2      GLN  51  -2.864  15.840 -17.689
  377   2HE2  GLN  51          2HE2      GLN  51  -3.892  15.484 -19.037
  378    H    ARG  52           HN       ARG  52  -2.585  10.731 -12.954
  379    HA   ARG  52           HA       ARG  52  -5.117   9.404 -13.216
  380   1HB   ARG  52          2HB       ARG  52  -2.383   8.701 -12.188
  381   2HB   ARG  52          3HB       ARG  52  -3.723   7.865 -11.429
  382   1HG   ARG  52          2HG       ARG  52  -4.114   6.582 -13.274
  383   2HG   ARG  52          3HG       ARG  52  -4.026   7.958 -14.356
  384   1HD   ARG  52          2HD       ARG  52  -2.168   6.655 -15.025
  385   2HD   ARG  52          3HD       ARG  52  -1.436   7.850 -13.972
  386    HE   ARG  52           HE       ARG  52  -1.133   6.186 -12.284
  387   1HH1  ARG  52          HH1       ARG  52  -1.391   2.738 -12.614
  388   1HH2  ARG  52          1HH2      ARG  52  -2.576   3.221 -14.641
  389   2HH2  ARG  52          2HH2      ARG  52  -2.820   4.871 -15.108
  390    H    TYR  53           HN       TYR  53  -2.934  10.554 -10.531
  391    HA   TYR  53           HA       TYR  53  -5.208  10.502  -8.713
  392   1HB   TYR  53          2HB       TYR  53  -2.165  10.828  -8.623
  393   2HB   TYR  53          3HB       TYR  53  -3.107  11.291  -7.220
  394    HD1  TYR  53           HD1      TYR  53  -3.849   9.668  -5.663
  395    HD2  TYR  53           HD2      TYR  53  -2.337   8.415  -9.463
  396    HE1  TYR  53           HE1      TYR  53  -3.845   7.252  -4.872
  397    HE2  TYR  53           HE2      TYR  53  -2.337   6.003  -8.660
  398    HH   TYR  53           HH       TYR  53  -2.315   4.758  -6.708
  399    H    GLY  54           HN       GLY  54  -2.439  12.816  -8.956
  400   1HA   GLY  54          1HA       GLY  54  -3.389  15.045  -9.973
  401   2HA   GLY  54          2HA       GLY  54  -4.322  15.006  -8.490
  402    H    ILE  55           HN       ILE  55  -0.879  14.325  -9.472
  403    HA   ILE  55           HA       ILE  55  -0.065  15.849  -7.099
  404    HB   ILE  55           HB       ILE  55   1.496  13.777  -8.643
  405   1HG1  ILE  55          2HG1      ILE  55   0.203  13.383  -5.941
  406   2HG1  ILE  55          3HG1      ILE  55  -0.621  12.973  -7.432
  407   1HG2  ILE  55          1HG2      ILE  55   3.087  15.097  -7.597
  408   2HG2  ILE  55          2HG2      ILE  55   2.048  15.422  -6.189
  409   3HG2  ILE  55          3HG2      ILE  55   2.794  13.819  -6.393
  410   1HD1  ILE  55          1HD1      ILE  55   1.377  11.540  -8.072
  411   2HD1  ILE  55          2HD1      ILE  55   2.040  11.852  -6.450
  412   3HD1  ILE  55          3HD1      ILE  55   0.501  10.975  -6.628
  413    H    ALA  56           HN       ALA  56   2.259  16.867  -7.488
  414    HA   ALA  56           HA       ALA  56   2.259  18.067 -10.169
  415   1HB   ALA  56          1HB       ALA  56   1.761  19.322  -7.608
  416   2HB   ALA  56          2HB       ALA  56   3.265  19.961  -8.314
  417   3HB   ALA  56          3HB       ALA  56   1.744  20.044  -9.235
  418    H    LEU  57           HN       LEU  57   3.765  15.932 -10.038
  419    HA   LEU  57           HA       LEU  57   6.352  16.614  -8.911
  420   1HB   LEU  57          2HB       LEU  57   5.022  14.306  -8.942
  421   2HB   LEU  57          3HB       LEU  57   5.866  14.124 -10.468
  422    HG   LEU  57           HG       LEU  57   7.423  14.881  -8.014
  423   1HD1  LEU  57          1HD1      LEU  57   7.702  12.585  -7.357
  424   2HD1  LEU  57          2HD1      LEU  57   5.964  12.970  -7.375
  425   3HD1  LEU  57          3HD1      LEU  57   6.680  12.026  -8.704
  426   1HD2  LEU  57          1HD2      LEU  57   9.113  14.687  -9.433
  427   2HD2  LEU  57          2HD2      LEU  57   8.727  12.962  -9.637
  428   3HD2  LEU  57          3HD2      LEU  57   8.007  14.170 -10.728
  429    H    THR  58           HN       THR  58   6.248  18.566 -10.505
  430    HA   THR  58           HA       THR  58   7.097  17.722 -13.183
  431    HB   THR  58           HB       THR  58   6.381  19.906 -13.870
  432    HG1  THR  58           HG1      THR  58   6.680  21.568 -12.417
  433   1HG2  THR  58          1HG2      THR  58   4.160  20.257 -12.900
  434   2HG2  THR  58          2HG2      THR  58   4.423  18.500 -13.012
  435   3HG2  THR  58          3HG2      THR  58   4.601  19.330 -11.447
  436    H    ASP  59           HN       ASP  59   8.690  19.712 -14.042
  437    HA   ASP  59           HA       ASP  59  11.124  19.025 -13.314
  438   1HB   ASP  59          2HB       ASP  59  10.025  21.045 -14.853
  439   2HB   ASP  59          3HB       ASP  59  10.839  21.979 -13.614
  440    HD2  ASP  59           HD2      ASP  59  12.195  22.397 -15.961
  441    H    GLU  60           HN       GLU  60   8.942  21.337 -11.633
  442    HA   GLU  60           HA       GLU  60  10.516  22.690 -10.006
  443   1HB   GLU  60          2HB       GLU  60   8.069  22.844  -9.949
  444   2HB   GLU  60          3HB       GLU  60   7.941  21.242  -9.251
  445   1HG   GLU  60          2HG       GLU  60   8.198  22.087  -7.164
  446   2HG   GLU  60          3HG       GLU  60   9.745  22.784  -7.603
  447    HE2  GLU  60           HE2      GLU  60   8.971  24.301  -6.184
  448    H    THR  61           HN       THR  61   9.088  19.551  -8.840
  449    HA   THR  61           HA       THR  61  11.241  19.298  -6.933
  450    HB   THR  61           HB       THR  61   8.890  18.763  -6.332
  451    HG1  THR  61           HG1      THR  61   9.475  16.434  -5.748
  452   1HG2  THR  61          1HG2      THR  61   8.066  17.927  -8.538
  453   2HG2  THR  61          2HG2      THR  61   9.202  16.560  -8.441
  454   3HG2  THR  61          3HG2      THR  61   7.858  16.686  -7.280
  455    H    VAL  62           HN       VAL  62  10.235  17.836 -10.039
  456    HA   VAL  62           HA       VAL  62  11.931  15.649  -9.988
  457    HB   VAL  62           HB       VAL  62  10.862  17.360 -12.233
  458   1HG1  VAL  62          1HG1      VAL  62  12.874  16.262 -13.048
  459   2HG1  VAL  62          2HG1      VAL  62  12.312  14.697 -12.413
  460   3HG1  VAL  62          3HG1      VAL  62  11.434  15.483 -13.747
  461   1HG2  VAL  62          1HG2      VAL  62  10.024  14.602 -11.281
  462   2HG2  VAL  62          2HG2      VAL  62   9.227  16.121 -10.805
  463   3HG2  VAL  62          3HG2      VAL  62   9.222  15.610 -12.510
  464    H    GLY  63           HN       GLY  63  12.650  19.033 -10.049
  465   1HA   GLY  63          1HA       GLY  63  15.128  18.867 -11.480
  466   2HA   GLY  63          2HA       GLY  63  14.525  20.210 -10.529
  467    H    ARG  64           HN       ARG  64  14.134  19.045  -7.991
  468    HA   ARG  64           HA       ARG  64  16.780  19.031  -7.092
  469   1HB   ARG  64          2HB       ARG  64  15.689  18.491  -4.847
  470   2HB   ARG  64          3HB       ARG  64  15.051  19.916  -5.641
  471   1HG   ARG  64          2HG       ARG  64  13.049  18.811  -6.307
  472   2HG   ARG  64          3HG       ARG  64  13.750  17.217  -6.117
  473   1HD   ARG  64          2HD       ARG  64  12.334  17.463  -4.213
  474   2HD   ARG  64          3HD       ARG  64  13.945  17.758  -3.588
  475    HE   ARG  64           HE       ARG  64  13.221  20.289  -4.212
  476   1HH1  ARG  64          HH1       ARG  64  10.796  21.223  -1.908
  477   1HH2  ARG  64          1HH2      ARG  64  10.419  18.870  -1.650
  478   2HH2  ARG  64          2HH2      ARG  64  11.363  17.753  -2.577
  479    H    LEU  65           HN       LEU  65  14.370  16.526  -7.884
  480    HA   LEU  65           HA       LEU  65  16.164  14.467  -6.839
  481   1HB   LEU  65          2HB       LEU  65  13.245  14.662  -7.364
  482   2HB   LEU  65          3HB       LEU  65  13.998  13.098  -7.601
  483    HG   LEU  65           HG       LEU  65  13.098  13.178  -5.389
  484   1HD1  LEU  65          1HD1      LEU  65  15.443  12.198  -5.838
  485   2HD1  LEU  65          2HD1      LEU  65  16.041  13.599  -4.917
  486   3HD1  LEU  65          3HD1      LEU  65  14.926  12.441  -4.152
  487   1HD2  LEU  65          1HD2      LEU  65  13.926  14.863  -3.715
  488   2HD2  LEU  65          2HD2      LEU  65  14.627  15.770  -5.077
  489   3HD2  LEU  65          3HD2      LEU  65  12.868  15.512  -4.991
  490    H    GLY  66           HN       GLY  66  16.334  12.441  -8.276
  491   1HA   GLY  66          1HA       GLY  66  16.054  12.870 -11.114
  492   2HA   GLY  66          2HA       GLY  66  17.713  12.945 -10.554
  493    H    THR  67           HN       THR  67  15.360  10.950  -8.802
  494    HA   THR  67           HA       THR  67  16.519   8.555 -10.064
  495    HB   THR  67           HB       THR  67  16.494   7.558  -7.746
  496    HG1  THR  67           HG1      THR  67  15.982  10.361  -7.058
  497   1HG2  THR  67          1HG2      THR  67  17.915  10.206  -7.413
  498   2HG2  THR  67          2HG2      THR  67  18.480   8.569  -7.001
  499   3HG2  THR  67          3HG2      THR  67  18.477   9.109  -8.697
  500    HA   PRO  68           HA       PRO  68  12.479   7.184 -10.500
  501   1HB   PRO  68          2HB       PRO  68  12.747   4.467 -10.382
  502   2HB   PRO  68          3HB       PRO  68  13.131   5.406 -11.811
  503   1HG   PRO  68          2HG       PRO  68  14.972   4.157  -9.863
  504   2HG   PRO  68          3HG       PRO  68  15.309   4.720 -11.488
  505   1HD   PRO  68          2HD       PRO  68  15.996   6.042  -9.037
  506   2HD   PRO  68          3HD       PRO  68  16.230   6.658 -10.661
  507    H    ARG  69           HN       ARG  69  14.047   5.401  -7.886
  508    HA   ARG  69           HA       ARG  69  11.803   4.639  -6.600
  509   1HB   ARG  69          2HB       ARG  69  13.242   4.724  -4.490
  510   2HB   ARG  69          3HB       ARG  69  13.972   3.874  -5.838
  511   1HG   ARG  69          2HG       ARG  69  15.374   5.787  -6.395
  512   2HG   ARG  69          3HG       ARG  69  14.505   6.826  -5.282
  513   1HD   ARG  69          2HD       ARG  69  15.313   5.489  -3.352
  514   2HD   ARG  69          3HD       ARG  69  16.111   4.365  -4.434
  515    HE   ARG  69           HE       ARG  69  17.287   6.666  -5.223
  516   1HH1  ARG  69          HH1       ARG  69  19.390   7.652  -2.640
  517   1HH2  ARG  69          1HH2      ARG  69  17.966   6.326  -1.241
  518   2HH2  ARG  69          2HH2      ARG  69  16.619   5.496  -1.946
  519    H    GLU  70           HN       GLU  70  13.390   7.843  -6.672
  520    HA   GLU  70           HA       GLU  70  11.894   8.879  -4.518
  521   1HB   GLU  70          2HB       GLU  70  13.715  10.024  -6.637
  522   2HB   GLU  70          3HB       GLU  70  12.726  11.121  -5.694
  523   1HG   GLU  70          2HG       GLU  70  14.433   8.993  -4.347
  524   2HG   GLU  70          3HG       GLU  70  15.112  10.543  -4.802
  525    HE2  GLU  70           HE2      GLU  70  14.754   9.516  -2.300
  526    H    LEU  71           HN       LEU  71  11.252   8.245  -7.879
  527    HA   LEU  71           HA       LEU  71   9.253  10.289  -8.149
  528   1HB   LEU  71          2HB       LEU  71  10.712   8.506  -9.844
  529   2HB   LEU  71          3HB       LEU  71   8.999   8.267 -10.127
  530    HG   LEU  71           HG       LEU  71  10.036   9.920 -11.649
  531   1HD1  LEU  71          1HD1      LEU  71   7.811  10.783  -9.807
  532   2HD1  LEU  71          2HD1      LEU  71   8.331  11.783 -11.185
  533   3HD1  LEU  71          3HD1      LEU  71   7.716  10.136 -11.462
  534   1HD2  LEU  71          1HD2      LEU  71  11.655  10.810  -9.940
  535   2HD2  LEU  71          2HD2      LEU  71  10.822  12.042 -10.918
  536   3HD2  LEU  71          3HD2      LEU  71  10.303  11.735  -9.244
  537    H    LEU  72           HN       LEU  72   9.468   6.867  -7.192
  538    HA   LEU  72           HA       LEU  72   6.595   6.581  -7.253
  539   1HB   LEU  72          2HB       LEU  72   6.941   4.348  -6.956
  540   2HB   LEU  72          3HB       LEU  72   8.388   4.816  -7.827
  541    HG   LEU  72           HG       LEU  72   9.411   5.053  -5.403
  542   1HD1  LEU  72          1HD1      LEU  72   7.668   2.764  -4.692
  543   2HD1  LEU  72          2HD1      LEU  72   8.398   4.024  -3.668
  544   3HD1  LEU  72          3HD1      LEU  72   6.926   4.380  -4.603
  545   1HD2  LEU  72          1HD2      LEU  72   9.076   2.204  -6.183
  546   2HD2  LEU  72          2HD2      LEU  72   9.741   3.310  -7.409
  547   3HD2  LEU  72          3HD2      LEU  72  10.548   3.140  -5.832
  548    H    ASP  73           HN       ASP  73   9.270   6.915  -4.858
  549    HA   ASP  73           HA       ASP  73   7.775   6.514  -2.608
  550   1HB   ASP  73          2HB       ASP  73  10.306   6.834  -2.827
  551   2HB   ASP  73          3HB       ASP  73  10.019   8.559  -2.928
  552    HD2  ASP  73           HD2      ASP  73   9.705   6.165   0.071
  553    H    GLU  74           HN       GLU  74   8.432   9.507  -4.545
  554    HA   GLU  74           HA       GLU  74   7.315  11.356  -2.907
  555   1HB   GLU  74          2HB       GLU  74   8.545  11.731  -5.100
  556   2HB   GLU  74          3HB       GLU  74   7.065  11.325  -5.945
  557   1HG   GLU  74          2HG       GLU  74   7.066  13.715  -5.791
  558   2HG   GLU  74          3HG       GLU  74   5.907  13.177  -4.591
  559    HE2  GLU  74           HE2      GLU  74   8.541  15.603  -3.537
  560    H    VAL  75           HN       VAL  75   5.658   9.467  -5.537
  561    HA   VAL  75           HA       VAL  75   3.110  10.518  -4.916
  562    HB   VAL  75           HB       VAL  75   3.940   8.027  -6.418
  563   1HG1  VAL  75          1HG1      VAL  75   1.717   7.599  -6.232
  564   2HG1  VAL  75          2HG1      VAL  75   1.304   9.297  -5.891
  565   3HG1  VAL  75          3HG1      VAL  75   1.611   8.774  -7.565
  566   1HG2  VAL  75          1HG2      VAL  75   3.172  10.707  -7.597
  567   2HG2  VAL  75          2HG2      VAL  75   4.856  10.274  -7.214
  568   3HG2  VAL  75          3HG2      VAL  75   3.939   9.318  -8.403
  569    H    ASN  76           HN       ASN  76   5.076   7.803  -3.733
  570    HA   ASN  76           HA       ASN  76   2.801   6.735  -2.333
  571   1HB   ASN  76          2HB       ASN  76   5.630   5.861  -2.896
  572   2HB   ASN  76          3HB       ASN  76   4.904   5.246  -1.425
  573   1HD2  ASN  76          1HD2      ASN  76   5.013   5.123  -4.843
  574   2HD2  ASN  76          2HD2      ASN  76   3.840   3.877  -5.115
  575    H    THR  77           HN       THR  77   3.940   9.474  -1.739
  576    HA   THR  77           HA       THR  77   4.572   9.008   1.091
  577    HB   THR  77           HB       THR  77   6.070  10.668  -0.977
  578    HG1  THR  77           HG1      THR  77   7.475   9.049  -0.427
  579   1HG2  THR  77          1HG2      THR  77   6.477  12.289   0.584
  580   2HG2  THR  77          2HG2      THR  77   5.489  11.428   1.788
  581   3HG2  THR  77          3HG2      THR  77   7.215  11.034   1.608
  582    H    THR  78           HN       THR  78   3.870  11.672  -1.276
  583    HA   THR  78           HA       THR  78   2.739  13.440   0.440
  584    HB   THR  78           HB       THR  78   2.038  12.678  -2.439
  585    HG1  THR  78           HG1      THR  78   3.522  14.823  -1.088
  586   1HG2  THR  78          1HG2      THR  78   1.156  15.020  -2.605
  587   2HG2  THR  78          2HG2      THR  78   0.166  14.035  -1.501
  588   3HG2  THR  78          3HG2      THR  78   1.340  15.201  -0.844
  589    HA   PRO  79           HA       PRO  79  -0.609  11.018   1.924
  590   1HB   PRO  79          2HB       PRO  79  -0.933  12.371   4.276
  591   2HB   PRO  79          3HB       PRO  79   0.147  11.002   4.099
  592   1HG   PRO  79          2HG       PRO  79   0.814  13.876   4.287
  593   2HG   PRO  79          3HG       PRO  79   1.855  12.489   4.536
  594   1HD   PRO  79          2HD       PRO  79   1.777  14.185   2.223
  595   2HD   PRO  79          3HD       PRO  79   2.735  12.731   2.425
  596    H    ALA  80           HN       ALA  80  -2.848  11.664   2.989
  597    HA   ALA  80           HA       ALA  80  -3.710  14.231   2.009
  598   1HB   ALA  80          1HB       ALA  80  -4.166  11.707   0.522
  599   2HB   ALA  80          2HB       ALA  80  -5.629  12.679   0.812
  600   3HB   ALA  80          3HB       ALA  80  -4.239  13.396  -0.037
  601    H    THR  81           HN       THR  81  -3.661  13.919   4.551
  602    HA   THR  81           HA       THR  81  -6.413  13.304   5.284
  603    HB   THR  81           HB       THR  81  -3.912  11.946   6.384
  604    HG1  THR  81           HG1      THR  81  -5.024  10.719   4.828
  605   1HG2  THR  81          1HG2      THR  81  -6.457  12.663   7.778
  606   2HG2  THR  81          2HG2      THR  81  -6.029  10.936   7.841
  607   3HG2  THR  81          3HG2      THR  81  -4.896  12.157   8.467
  608    H    ALA  82           HN       ALA  82  -3.205  14.249   6.702
  609    HA   ALA  82           HA       ALA  82  -2.667  15.893   8.085
  610   1HB   ALA  82          1HB       ALA  82  -4.287  18.042   7.557
  611   2HB   ALA  82          2HB       ALA  82  -2.872  17.583   6.578
  612   3HB   ALA  82          3HB       ALA  82  -4.503  17.073   6.079