*HEADER    METAL TRANSPORT                         09-JUN-04   1TL5              
*TITLE     SOLUTION STRUCTURE OF APOHAH1                                         
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: COPPER TRANSPORT PROTEIN ATOX1;                            
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 SYNONYM: METAL TRANSPORT PROTEIN ATX1;                               
*COMPND   5 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 GENE: ATOX1, HAH1;                                                   
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   7 EXPRESSION_SYSTEM_STRAIN: BL21(DE3)PLYSS;                            
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   9 EXPRESSION_SYSTEM_PLASMID: PET20B+                                   
*KEYWDS    COPPER PROTEIN, COPPER CHAPERONE, MENKES, WILSON                      
*EXPDTA    NMR, 30 STRUCTURES                                                    
*AUTHOR    I.ANASTASSOPOULOU, L.BANCI, I.BERTINI, F.CANTINI, E.KATSARI,          
*AUTHOR   2 A.ROSATO                                                             
*REVDAT   1   26-OCT-04 1TL5    0                                                
  2 PRO  
         HB2    43 GLU- QG      5.90                
         HB2    67 LEU  QQD     9.17                
         HB3    67 LEU  QQD     9.17                
         QG     67 LEU  QQD    10.17                
         HD2    45 GLU- HA      6.60                
  3 LYS+ 
         HN      3 LYS+ HG2     5.50                
         HN      3 LYS+ HG3     5.50                
         HN      3 LYS+ QG      4.65                
         HN      4 HIS  HN      6.20                
         HN     43 GLU- QG      7.30                
         HA      3 LYS+ HG2     3.70                
         HA      3 LYS+ HG3     3.70                
         HA      3 LYS+ QG      3.49                
         HA      3 LYS+ QD      7.20                
         HA      4 HIS  HN      3.20                
         HA     43 GLU- HA      2.90                
         HA     43 GLU- QB      7.48                
         HA     43 GLU- QG      6.90                
         QB      4 HIS  HN      6.18                
         HG2     4 HIS  HN      6.60                
         HG2    43 GLU- HA      5.40                
         HG2    43 GLU- HB2     7.55                
         HG2    43 GLU- HB3     7.55                
         HG2    43 GLU- QG      6.20                
         HG3     4 HIS  HN      6.60                
         HG3    43 GLU- HA      5.40                
         HG3    43 GLU- HB2     7.55                
         HG3    43 GLU- HB3     7.55                
         HG3    43 GLU- QG      6.20                
         QG     43 GLU- HA      5.13                
         QG     43 GLU- QB      5.91                
         QG     43 GLU- QG      6.04                
         QE     41 CYS  HB3     5.10                
         QE     43 GLU- QG      8.60                
  4 HIS  
         HN      4 HIS  HB2     3.60                
         HN      4 HIS  HB3     4.10                
         HN      4 HIS  HD2     4.70                
         HN      6 PHE  QD      8.60                
         HN      6 PHE  QE      8.60                
         HN     40 VAL  QG1     7.60                
         HN     42 ILE  HN      5.20                
         HN     42 ILE  HB      6.60                
         HN     43 GLU- HA      5.70                
         HA      5 GLU- HN      2.90                
         HA     64 TYR  QE      7.90                
         HA     67 LEU  QQD     7.67                
         HB2     5 GLU- HN      6.60                
         HB2     6 PHE  QD      6.80                
         HB2    51 LEU  QD1     7.60                
         HB2    52 LEU  QQD     8.07                
         HB2    64 TYR  QE      7.30                
         HB3     5 GLU- HN      3.80                
         HB3     6 PHE  QD      6.80                
         HB3     6 PHE  QE      8.60                
         HB3    51 LEU  QD1     7.60                
         HB3    64 TYR  QE      7.00                
  5 GLU- 
         HN      5 GLU- HB2     4.10                
         HN      5 GLU- HG2     3.70                
         HN      5 GLU- HG3     3.70                
         HN      5 GLU- QG      3.35                
         HN      6 PHE  HN      5.30                
         HN      6 PHE  QD      8.60                
         HN     64 TYR  QE      7.50                
         HN     65 LEU  HN      4.90                
         HN     65 LEU  QD2     7.60                
         HN     66 GLY  HN      3.70                
         HN     67 LEU  QQD     9.17                
         HA      5 GLU- HG2     4.20                
         HA      5 GLU- HG3     4.20                
         HA      6 PHE  HN      2.80                
         HA      6 PHE  QD      7.80                
         HA     41 CYS  HA      3.20                
         HA     42 ILE  HN      5.20                
         HA     65 LEU  QD2     7.60                
         HB2     6 PHE  HN      5.00                
         HB2    65 LEU  QD1     6.80                
         HB3     5 GLU- QG      2.75                
         HB3     6 PHE  HN      3.50                
         HB3     6 PHE  HA      6.20                
         HB3     6 PHE  QD      8.60                
         HB3    41 CYS  HA      5.10                
         HB3    41 CYS  HB3     5.30                
         HB3    42 ILE  HN      6.40                
         HB3    65 LEU  HA      6.60                
         HB3    65 LEU  QB      5.60                
         HB3    65 LEU  QD1     6.20                
         HB3    65 LEU  QD2     5.80                
         HB3    66 GLY  HN      6.30                
         QG     41 CYS  HA      6.18                
         QG     41 CYS  HB3     6.18                
         QG     65 LEU  QD2     7.48                
  6 PHE  
         HN      6 PHE  HB2     3.50                
         HN     39 LYS+ HA      5.50                
         HN     40 VAL  QG1     5.40                
         HN     41 CYS  HA      4.30                
         HN     65 LEU  QD2     7.60                
         HA      7 SER  HN      2.80                
         HA      7 SER  HB3     5.40                
         HA     64 TYR  HN      5.60                
         HA     64 TYR  HA      3.60                
         HA     65 LEU  HN      3.50                
         HA     65 LEU  QB      7.10                
         HA     65 LEU  HG      4.60                
         HA     65 LEU  QD2     7.60                
         HB2     7 SER  HN      5.10                
         HB2     8 VAL  QG2     5.10                
         HB2    40 VAL  HB      5.80                
         HB2    55 LEU  QQD     7.97                
         HB2    62 VAL  QG1     7.60                
         HB2    62 VAL  QG2     7.60                
         HB3     7 SER  HN      4.50                
         HB3     8 VAL  QG2     7.10                
         HB3    40 VAL  HB      4.70                
         HB3    42 ILE  QD1     7.60                
         HB3    55 LEU  QQD     8.07                
         HB3    62 VAL  QG1     7.60                
         HB3    62 VAL  QG2     7.60                
         HB3    62 VAL  QQG     6.85                
         HB3    63 SER  HN      6.60                
         QD      7 SER  HN      8.60                
         QD     41 CYS  HA      8.60                
         QD     42 ILE  HN      8.60                
         QD     42 ILE  HB      7.20                
         QD     42 ILE  QG2     9.60                
         QD     42 ILE  QD1     7.70                
         QD     51 LEU  HB3     7.10                
         QD     51 LEU  QD1     8.80                
         QD     51 LEU  QD2     9.60                
         QD     52 LEU  HA      8.10                
         QD     52 LEU  HB2     6.90                
         QD     52 LEU  HB3     8.50                
         QD     52 LEU  QD1     8.00                
         QD     52 LEU  QD2     8.00                
         QD     52 LEU  QQD     7.45                
         QD     55 LEU  QD1     9.60                
         QD     55 LEU  QD2     9.60                
         QD     55 LEU  QQD     8.88                
         QD     62 VAL  QQG    10.76                
         QD     64 TYR  HA      6.80                
         QD     64 TYR  QB      8.90                
         QD     64 TYR  QD     10.60                
         QD     64 TYR  QE     10.60                
         QD     65 LEU  HN      8.60                
         QD     65 LEU  QD2     9.60                
         QE     42 ILE  HB      6.70                
         QE     48 MET  HA      7.50                
         QE     48 MET  QG      8.98                
         QE     51 LEU  HN      8.60                
         QE     51 LEU  HB3     7.80                
         QE     51 LEU  HG      8.30                
         QE     51 LEU  QD1     7.80                
         QE     52 LEU  HN      7.50                
         QE     52 LEU  HA      8.60                
         QE     52 LEU  QQD    11.17                
         QE     55 LEU  QQD    11.17                
         QE     64 TYR  QB      9.60                
         QE     64 TYR  QD     10.60                
         QE     64 TYR  QE     10.60                
  7 SER  
         HN      7 SER  HB2     3.30                
         HN      7 SER  HB3     3.40                
         HN      8 VAL  HN      6.60                
         HN      8 VAL  QG2     7.60                
         HN     62 VAL  QQG     6.96                
         HN     63 SER  HN      3.90                
         HN     64 TYR  HA      6.60                
         HN     65 LEU  HN      4.80                
         HN     65 LEU  QB      7.60                
         HN     65 LEU  HG      3.90                
         HN     65 LEU  QD1     7.60                
         HN     65 LEU  QD2     5.00                
         HA      8 VAL  HN      2.90                
         HA      8 VAL  QG2     7.20                
         HA     39 LYS+ HA      3.20                
         HA     39 LYS+ HB2     6.30                
         HA     39 LYS+ HB3     5.90                
         HA     39 LYS+ HG2     6.60                
         HA     39 LYS+ HG3     6.60                
         HA     39 LYS+ QG      6.34                
         HA     40 VAL  HN      6.20                
         HA     65 LEU  QB      7.60                
         HA     65 LEU  QD1     6.00                
         HA     65 LEU  QD2     7.20                
         HB2     8 VAL  HN      5.80                
         HB2    62 VAL  QQG     9.16                
         HB2    63 SER  HN      6.60                
         HB2    63 SER  QB      6.58                
         HB2    65 LEU  HG      5.20                
         HB2    65 LEU  QD1     4.90                
         HB2    65 LEU  QD2     6.20                
         HB3     8 VAL  HN      5.10                
         HB3    62 VAL  QQG     8.76                
         HB3    63 SER  HN      4.50                
         HB3    65 LEU  QB      7.60                
         HB3    65 LEU  HG      5.90                
         HB3    65 LEU  QD1     5.50                
         HB3    65 LEU  QD2     5.80                
  8 VAL  
         HN      8 VAL  HB      3.50                
         HN      8 VAL  QG1     4.50                
         HN      8 VAL  QG2     3.80                
         HN     38 LYS+ HB2     6.60                
         HN     38 LYS+ HB3     4.90                
         HN     39 LYS+ HA      3.80                
         HN     39 LYS+ QG      5.88                
         HN     40 VAL  HN      6.60                
         HB     10 MET  HG2     4.70                
         HB     10 MET  HG3     4.70                
         HB     10 MET  QG      4.42                
         HB     38 LYS+ HN      5.50                
         HB     38 LYS+ HA      4.40                
         HB     38 LYS+ HB2     5.70                
         HB     38 LYS+ HB3     4.60                
         QG1     9 ASP- HN      4.40                
         QG1    10 MET  HN      7.60                
         QG1    10 MET  QB      8.60                
         QG1    10 MET  HG2     5.70                
         QG1    10 MET  HG3     5.70                
         QG1    10 MET  QG      5.48                
         QG1    39 LYS+ QG      8.48                
         QG1    40 VAL  QG2     7.50                
         QG1    55 LEU  QQD     9.97                
         QG1    60 LYS+ HA      7.60                
         QG1    60 LYS+ HB2     7.10                
         QG1    62 VAL  HA      7.60                
         QG1    62 VAL  HB      6.80                
         QG2     9 ASP- HN      5.80                
         QG2    39 LYS+ HA      6.10                
         QG2    40 VAL  HN      7.60                
         QG2    55 LEU  QD1     7.00                
         QG2    55 LEU  QD2     7.00                
         QG2    62 VAL  HA      6.40                
         QG2    63 SER  HN      7.60                
  9 ASP- 
         HN      9 ASP- HB2     3.20                
         HN      9 ASP- HB3     3.20                
         HN     10 MET  HN      6.40                
         HN     60 LYS+ HB2     6.60                
         HN     60 LYS+ HB3     6.60                
         HN     61 THR  HN      5.80                
         HN     61 THR  HB      6.00                
         HN     61 THR  QG2     7.60                
         HN     62 VAL  HA      5.10                
         HN     62 VAL  QQG     9.16                
         HA     10 MET  HN      3.30                
         HA     10 MET  QG      5.58                
         HA     38 LYS+ HB2     5.60                
         HA     38 LYS+ HB3     6.60                
         HA     38 LYS+ QE      6.80                
         HB2    10 MET  HN      6.60                
         HB2    61 THR  HN      5.60                
         HB2    61 THR  HB      4.60                
         HB2    61 THR  QG2     7.60                
         HB3    10 MET  HN      6.20                
         HB3    61 THR  HN      5.50                
         HB3    61 THR  HB      5.70                
 10 MET  
         HN     10 MET  HG2     4.00                
         HN     10 MET  HG3     4.00                
         HN     10 MET  QG      3.61                
         HN     38 LYS+ HA      6.60                
         HN     38 LYS+ HB2     6.60                
         HN     38 LYS+ HB3     5.70                
         HN     38 LYS+ QE      7.60                
         HA     10 MET  HG2     4.30                
         HA     10 MET  HG3     4.30                
         HA     10 MET  QG      3.82                
         HA     11 THR  QG2     7.60                
         HA     15 CYS  HB2     6.10                
         HA     15 CYS  HB3     6.10                
         HA     15 CYS  QB      5.69                
         QB     11 THR  HB      7.60                
         QB     15 CYS  HB2     6.50                
         QB     15 CYS  HB3     6.50                
         QB     15 CYS  QB      6.24                
         QB     38 LYS+ HA      7.60                
         QB     38 LYS+ QE      6.90                
         HG2    15 CYS  HB2     6.25                
         HG2    15 CYS  HB3     6.25                
         HG2    33 ILE  QG2     7.60                
         HG3    15 CYS  HB2     6.25                
         HG3    15 CYS  HB3     6.25                
         HG3    33 ILE  QG2     7.60                
         QG     15 CYS  QB      4.98                
         QG     16 ALA  HA      6.58                
         QG     19 VAL  QG2     7.28                
         QG     38 LYS+ HA      6.58                
 11 THR  
         HN     12 CYS  HN      4.20                
         HN     15 CYS  HB2     6.10                
         HN     15 CYS  HB3     6.10                
         HN     15 CYS  QB      5.94                
         HA     11 THR  QG2     3.60                
         HA     12 CYS  HB2     5.30                
         HA     35 LEU  QQD     9.17                
         HB     12 CYS  HN      5.70                
         QG2    12 CYS  HN      7.60                
         QG2    12 CYS  HB2     7.10                
 12 CYS  
         HN     12 CYS  HB2     3.60                
         HN     15 CYS  HN      5.50                
         HN     15 CYS  HA      4.80                
         HN     15 CYS  QB      5.58                
         HN     16 ALA  HN      6.60                
         HA     35 LEU  QQD     8.47                
 14 GLY  
         HN     15 CYS  HN      6.60                
         HA1    16 ALA  HN      4.70                
         HA1    16 ALA  QB      5.30                
         HA1    35 LEU  QQD     7.27                
         HA2    16 ALA  QB      6.70                
         HA2    35 LEU  QQD     9.17                
 15 CYS  
         HN     15 CYS  QB      3.77                
         HN     16 ALA  HN      3.50                
         HN     17 GLU- HN      4.30                
         HA     15 CYS  QB      2.59                
         HA     18 ALA  QB      3.50                
         HA     19 VAL  HN      5.40                
         HA     60 LYS+ QE      7.28                
         HB2    16 ALA  HN      5.10                
         HB3    16 ALA  HN      5.10                
         QB     16 ALA  HN      4.54                
         QB     35 LEU  QQD     9.35                
 16 ALA  
         HN     16 ALA  QB      3.40                
         HN     17 GLU- HN      3.50                
         HN     17 GLU- HB3     6.60                
         HN     18 ALA  HN      4.40                
         HA     18 ALA  HN      4.30                
         HA     19 VAL  HN      4.40                
         HA     19 VAL  HB      3.30                
         HA     19 VAL  QG1     7.60                
         HA     33 ILE  HB      6.30                
         HA     33 ILE  QG2     5.60                
         HA     33 ILE  QG1     6.78                
         HA     33 ILE  QD1     6.60                
         QB     17 GLU- HN      3.50                
         QB     18 ALA  HN      6.00                
         QB     33 ILE  QG2     6.50                
         QB     33 ILE  QD1     7.60                
 17 GLU- 
         HN     17 GLU- HB2     3.60                
         HN     17 GLU- HB3     3.80                
         HN     17 GLU- HG2     4.10                
         HN     17 GLU- HG3     3.00                
         HN     18 ALA  HN      3.40                
         HN     18 ALA  QB      5.70                
         HN     19 VAL  HN      5.10                
         HA     17 GLU- HG2     3.00                
         HA     17 GLU- HG3     3.60                
         HB2    18 ALA  HN      3.90                
         HB3    17 GLU- HG3     3.00                
         HB3    18 ALA  HN      3.80                
         HG2    18 ALA  HN      6.60                
         HG3    18 ALA  HN      6.60                
 18 ALA  
         HN     18 ALA  QB      3.40                
         HN     19 VAL  QG2     7.60                
         HA     19 VAL  QG1     7.60                
         HA     19 VAL  QG2     6.40                
         QB     19 VAL  HN      3.40                
         QB     19 VAL  HA      4.60                
         QB     19 VAL  HB      7.60                
         QB     19 VAL  QG2     6.00                
         QB     20 SER  HN      7.40                
         QB     22 VAL  QG2     8.60                
         QB     58 THR  HA      6.60                
         QB     58 THR  HB      5.80                
         QB     58 THR  QG2     6.00                
 19 VAL  
         HN     19 VAL  HB      3.00                
         HN     19 VAL  QG1     4.60                
         HN     19 VAL  QG2     3.40                
         HN     20 SER  HN      3.10                
         HA     19 VAL  QG1     3.40                
         HA     19 VAL  QG2     3.40                
         HA     22 VAL  HN      5.10                
         HA     22 VAL  QG1     4.90                
         HA     23 LEU  HN      6.30                
         HA     55 LEU  QQD     9.17                
         HA     58 THR  QG2     4.90                
         HB     20 SER  HN      3.10                
         HB     33 ILE  QD1     5.50                
         HB     58 THR  QG2     7.60                
         QG1    20 SER  HN      5.10                
         QG1    20 SER  HA      7.50                
         QG1    20 SER  QB      7.78                
         QG1    22 VAL  HN      7.60                
         QG1    22 VAL  QG2     7.70                
         QG1    23 LEU  HN      7.60                
         QG1    23 LEU  HB2     7.60                
         QG1    23 LEU  HB3     7.60                
         QG1    23 LEU  QB      6.97                
         QG1    23 LEU  HG      6.30                
         QG1    23 LEU  QD1     7.30                
         QG1    23 LEU  QD2     5.70                
         QG1    31 TYR  QD      9.60                
         QG1    31 TYR  QE      9.60                
         QG1    33 ILE  QG1     4.28                
         QG1    33 ILE  QD1     5.80                
         QG1    55 LEU  QD1     8.00                
         QG1    55 LEU  QD2     8.00                
         QG1    55 LEU  QQD     7.07                
         QG1    58 THR  QG2     8.60                
         QG2    20 SER  HN      4.90                
         QG2    23 LEU  QD2     8.10                
         QG2    58 THR  HB      7.60                
         QG2    58 THR  QG2     6.20                
 20 SER  
         HN     20 SER  HB2     3.70                
         HN     20 SER  HB3     3.70                
         HN     20 SER  QB      3.44                
         HN     22 VAL  HN      6.00                
         HN     33 ILE  QD1     6.90                
         HA     23 LEU  HN      5.00                
         HA     23 LEU  HA      5.70                
         HA     23 LEU  HB2     4.70                
         HA     23 LEU  HB3     4.70                
         HA     23 LEU  QB      4.32                
         HA     23 LEU  QD2     6.70                
         HA     24 ASN  HN      5.60                
         HA     31 TYR  QD      8.60                
         HA     31 TYR  QE      8.20                
         HA     33 ILE  QD1     6.60                
         HB2    21 ARG+ HN      3.90                
         HB2    31 TYR  QE      8.60                
         HB3    21 ARG+ HN      3.90                
         HB3    31 TYR  QE      8.60                
         QB     21 ARG+ HN      3.46                
         QB     33 ILE  QG2     7.08                
         QB     33 ILE  QD1     6.18                
 21 ARG+ 
         HN     21 ARG+ HB2     3.50                
         HN     21 ARG+ HB3     3.60                
         HN     21 ARG+ HG2     3.50                
         HN     21 ARG+ HG3     3.10                
         HN     21 ARG+ QD      4.68                
         HN     22 VAL  HN      3.50                
         HN     22 VAL  QG1     5.90                
         HN     23 LEU  HN      6.30                
         HA     21 ARG+ HG2     3.90                
         HA     21 ARG+ QD      5.48                
         HA     24 ASN  HN      4.40                
         HA     24 ASN  HB2     3.70                
         HA     24 ASN  HB3     4.70                
         HB2    21 ARG+ QD      3.77                
         HB2    22 VAL  HN      4.30                
         HB3    21 ARG+ HG2     2.80                
         HB3    21 ARG+ QD      3.96                
         HB3    22 VAL  HN      4.50                
         HB3    22 VAL  QG1     7.00                
         HG2    22 VAL  HN      5.30                
         HG3    22 VAL  HN      6.60                
 22 VAL  
         HN     22 VAL  QG1     4.10                
         HN     22 VAL  QG2     4.20                
         HN     23 LEU  HN      3.50                
         HA     22 VAL  QG2     3.40                
         HA     24 ASN  HN      5.20                
         HA     24 ASN  HD21    6.60                
         HA     25 LYS+ HN      4.80                
         HA     25 LYS+ HB2     4.50                
         HA     25 LYS+ HB3     3.90                
         HA     25 LYS+ QE      7.00                
         HB     23 LEU  HN      6.30                
         QG1    23 LEU  HN      4.80                
         QG1    23 LEU  HG      6.80                
         QG1    23 LEU  QD1     7.90                
         QG1    24 ASN  HN      7.40                
         QG1    25 LYS+ HB2     5.60                
         QG1    55 LEU  HA      5.40                
         QG1    55 LEU  HB2     7.60                
         QG1    55 LEU  QQD     8.87                
         QG1    58 THR  HN      5.30                
         QG1    58 THR  HA      5.90                
         QG1    58 THR  QG2     5.90                
         QG2    23 LEU  HN      5.40                
         QG2    23 LEU  HA      5.10                
         QG2    23 LEU  QD2     7.20                
         QG2    25 LYS+ QG      6.00                
         QG2    55 LEU  HA      7.40                
         QG2    55 LEU  QQD     7.27                
 23 LEU  
         HN     23 LEU  QB      3.90                
         HN     23 LEU  HG      4.10                
         HN     23 LEU  QD1     4.60                
         HN     23 LEU  QD2     4.60                
         HN     24 ASN  HN      3.30                
         HA     23 LEU  HG      4.20                
         HA     23 LEU  QD1     3.40                
         HA     23 LEU  QD2     5.00                
         HA     25 LYS+ HN      6.60                
         HA     26 LEU  HN      4.10                
         HA     26 LEU  HB2     4.40                
         HA     26 LEU  HB3     3.50                
         HA     26 LEU  QD1     7.60                
         HA     29 VAL  QG1     6.70                
         HA     29 VAL  QG2     7.20                
         HA     54 THR  QG2     6.80                
         HA     55 LEU  HB3     5.70                
         HB2    23 LEU  QD2     3.70                
         HB2    24 ASN  HN      3.50                
         HB2    31 TYR  QD      8.60                
         HB3    23 LEU  QD2     3.70                
         HB3    24 ASN  HN      3.50                
         HB3    31 TYR  QD      8.60                
         QB     23 LEU  QD2     3.44                
         QB     31 TYR  QD      8.41                
         QB     31 TYR  QE      5.88                
         HG     24 ASN  HN      6.40                
         HG     29 VAL  QG1     6.20                
         HG     29 VAL  QG2     6.80                
         HG     55 LEU  QQD     8.67                
         QD1    24 ASN  HN      7.60                
         QD1    26 LEU  HG      4.60                
         QD1    29 VAL  HB      7.60                
         QD1    29 VAL  QG1     4.60                
         QD1    29 VAL  QG2     7.40                
         QD1    31 TYR  QD      9.60                
         QD1    31 TYR  QE      9.60                
         QD1    42 ILE  QG2     6.60                
         QD1    42 ILE  QD1     5.40                
         QD1    54 THR  HB      6.60                
         QD1    55 LEU  HN      7.60                
         QD1    55 LEU  HA      7.60                
         QD1    55 LEU  HB3     6.90                
         QD1    55 LEU  HG      6.40                
         QD1    55 LEU  QQD    10.17                
         QD2    24 ASN  HN      6.50                
         QD2    29 VAL  HB      7.60                
         QD2    29 VAL  QG1     7.20                
         QD2    29 VAL  QG2     8.10                
         QD2    31 TYR  HA      7.60                
         QD2    31 TYR  QB      7.20                
         QD2    31 TYR  QD      9.60                
         QD2    31 TYR  QE      9.60                
         QD2    42 ILE  QG2     7.60                
         QD2    42 ILE  HG12    6.10                
         QD2    42 ILE  HG13    6.90                
         QD2    42 ILE  QD1     6.20                
         QD2    51 LEU  QD2     8.60                
         QD2    55 LEU  HN      7.60                
         QD2    55 LEU  HA      7.60                
         QD2    55 LEU  HB3     6.90                
         QD2    55 LEU  HG      5.30                
         QD2    55 LEU  QD1     8.60                
         QD2    55 LEU  QD2     8.60                
         QD2    55 LEU  QQD     7.46                
 24 ASN  
         HN     24 ASN  HB2     3.40                
         HN     24 ASN  HB3     3.40                
         HN     24 ASN  HD21    4.00                
         HN     25 LYS+ HN      3.30                
         HN     26 LEU  HN      6.20                
         HN     29 VAL  QG1     7.40                
         HN     31 TYR  QE      8.60                
         HA     24 ASN  HD21    4.00                
         HA     29 VAL  QG1     7.00                
         HA     31 TYR  QE      8.60                
         HB2    25 LYS+ HN      5.00                
         HB3    24 ASN  HD22    4.10                
         HB3    25 LYS+ HN      5.40                
         HB3    29 VAL  QG1     6.50                
         HD21   29 VAL  QG1     7.60                
 25 LYS+ 
         HN     25 LYS+ HB2     3.50                
         HN     25 LYS+ HB3     3.70                
         HN     25 LYS+ QG      5.60                
         HN     25 LYS+ QD      7.60                
         HN     26 LEU  HN      3.30                
         HN     27 GLY  HN      4.30                
         HA     25 LYS+ QD      4.80                
         HB2    25 LYS+ QE      5.00                
         HB2    26 LEU  HN      4.30                
         HB3    25 LYS+ QE      5.40                
         HB3    26 LEU  HN      3.40                
 26 LEU  
         HN     26 LEU  HB2     3.00                
         HN     26 LEU  HB3     2.80                
         HN     26 LEU  HG      4.70                
         HN     26 LEU  QD1     5.50                
         HN     26 LEU  QD2     5.00                
         HN     27 GLY  HN      3.30                
         HN     29 VAL  QG1     5.70                
         HA     26 LEU  QD1     4.60                
         HA     26 LEU  QD2     3.40                
         HA     54 THR  QG2     6.80                
         HB2    26 LEU  HG      3.00                
         HB2    27 GLY  HN      3.90                
         HB2    27 GLY  HA2     5.50                
         HB2    29 VAL  QG1     5.30                
         HB3    27 GLY  HN      4.00                
         HG     27 GLY  HN      5.00                
         HG     46 HIS  HD2     6.30                
         HG     46 HIS  HE1     6.40                
         HG     54 THR  HN      5.60                
         QD1    27 GLY  HN      6.30                
         QD1    29 VAL  QG1     5.30                
         QD1    29 VAL  QG2     7.60                
         QD1    46 HIS  QB      8.60                
         QD1    46 HIS  HD2     6.80                
         QD1    46 HIS  HE1     7.60                
         QD1    54 THR  HN      6.90                
         QD2    27 GLY  HN      6.90                
         QD2    46 HIS  HD2     7.60                
         QD2    46 HIS  HE1     7.60                
         QD2    51 LEU  HA      5.80                
         QD2    51 LEU  QD2     5.80                
 27 GLY  
         HN     28 GLY  HN      6.60                
         HN     29 VAL  QG1     5.10                
         HA1    29 VAL  HN      5.20                
         HA1    29 VAL  QG1     7.10                
         HA2    29 VAL  QG1     6.50                
 28 GLY  
         HN     29 VAL  HN      4.70                
 29 VAL  
         HN     29 VAL  QG1     3.80                
         HN     29 VAL  QG2     4.90                
         HN     30 LYS+ HN      6.60                
         HA     29 VAL  QG2     3.70                
         HA     44 SER  HB2     5.10                
         HA     44 SER  HB3     5.10                
         HA     44 SER  QB      4.87                
         HA     46 HIS  HD2     6.60                
         HB     30 LYS+ HN      4.70                
         HB     31 TYR  QD      8.10                
         HB     31 TYR  QE      8.60                
         HB     42 ILE  QG2     5.80                
         HB     42 ILE  QD1     7.60                
         HB     44 SER  QB      7.48                
         HB     46 HIS  HD2     6.60                
         QG1    30 LYS+ HN      7.60                
         QG1    30 LYS+ QE      8.60                
         QG1    31 TYR  QB      8.60                
         QG1    31 TYR  QD      8.20                
         QG1    31 TYR  QE      8.60                
         QG1    46 HIS  HD2     7.60                
         QG2    30 LYS+ HN      7.30                
         QG2    31 TYR  QD      9.60                
         QG2    31 TYR  QE      9.60                
         QG2    44 SER  QB      6.68                
         QG2    46 HIS  HN      7.60                
         QG2    46 HIS  HD2     5.20                
         QG2    46 HIS  HE1     7.60                
         QG2    51 LEU  QD2     7.50                
 30 LYS+ 
         HN     30 LYS+ QB      3.86                
         HN     30 LYS+ HG2     5.90                
         HN     30 LYS+ HG3     5.90                
         HN     30 LYS+ QG      5.54                
         HN     30 LYS+ QD      7.60                
         HN     31 TYR  QD      8.60                
         HN     42 ILE  QG2     6.90                
         HN     43 GLU- HN      4.70                
         HN     44 SER  QB      7.48                
         HA     30 LYS+ QG      3.85                
         HA     30 LYS+ QD      7.60                
         HA     31 TYR  HN      3.10                
         HA     31 TYR  QD      8.60                
         HA     31 TYR  QE      8.60                
         HB2    31 TYR  HN      4.50                
         HB3    31 TYR  HN      4.50                
         QB     31 TYR  HN      4.26                
         HG2    31 TYR  HN      6.60                
         HG3    31 TYR  HN      6.60                
         QG     31 TYR  HN      5.92                
         QD     31 TYR  HN      7.60                
         QD     33 ILE  QD1     7.40                
         QE     31 TYR  HN      7.60                
         QE     33 ILE  QD1     8.60                
 31 TYR  
         HN     31 TYR  QE      7.40                
         HN     32 ASP- HN      5.20                
         HN     33 ILE  QD1     7.60                
         HA     32 ASP- HN      3.20                
         HA     40 VAL  QG1     7.60                
         HA     42 ILE  HA      3.10                
         HA     42 ILE  QG2     7.60                
         HA     42 ILE  HG12    5.20                
         HA     42 ILE  HG13    6.60                
         HA     43 GLU- HN      3.90                
         QB     33 ILE  QG2     8.60                
         QB     33 ILE  HG12    6.80                
         QB     33 ILE  HG13    6.80                
         QB     33 ILE  QG1     6.50                
         QB     40 VAL  HB      7.60                
         QB     40 VAL  QG1     7.00                
         QB     40 VAL  QG2     8.60                
         QB     42 ILE  HA      5.90                
         QB     42 ILE  QG2     7.80                
         QB     42 ILE  HG12    5.40                
         QB     42 ILE  HG13    6.80                
         QB     42 ILE  QD1     8.60                
         QB     43 GLU- HN      7.10                
         QD     32 ASP- HN      8.60                
         QD     32 ASP- HA      8.60                
         QD     33 ILE  HN      8.60                
         QD     33 ILE  HB      8.60                
         QD     33 ILE  QG2     9.60                
         QD     33 ILE  HG12    7.20                
         QD     33 ILE  HG13    7.20                
         QD     33 ILE  QD1     9.00                
         QD     42 ILE  HA      8.60                
         QD     42 ILE  QG2     9.60                
         QE     33 ILE  QG1     9.48                
         QE     33 ILE  QD1     8.80                
 32 ASP- 
         HN     32 ASP- HB2     3.60                
         HN     32 ASP- HB3     3.60                
         HN     33 ILE  HN      5.00                
         HA     33 ILE  HN      3.30                
         HA     33 ILE  QD1     7.60                
         HB2    33 ILE  HN      5.60                
         HB2    41 CYS  HB2     4.80                
         HB2    41 CYS  HB3     5.50                
         HB3    33 ILE  HN      5.20                
         HB3    41 CYS  HN      5.10                
         HB3    41 CYS  HB2     5.80                
         HB3    41 CYS  HB3     5.60                
 33 ILE  
         HN     33 ILE  HB      3.70                
         HN     33 ILE  QG1     5.38                
         HN     33 ILE  QD1     5.60                
         HA     33 ILE  QG2     3.40                
         HA     33 ILE  HG12    3.50                
         HA     33 ILE  HG13    3.50                
         HA     33 ILE  QG1     3.09                
         HA     33 ILE  QD1     4.80                
         HA     34 ASP- HN      3.40                
         HA     40 VAL  HA      4.00                
         HA     40 VAL  QG1     7.60                
         HA     41 CYS  HN      5.20                
         HB     33 ILE  QD1     3.40                
         HB     34 ASP- HN      4.80                
         HB     40 VAL  HA      5.50                
         QG2    33 ILE  QD1     4.40                
         QG2    34 ASP- HN      6.00                
         QG2    35 LEU  HN      7.60                
         QG2    38 LYS+ HA      7.60                
         HG12   34 ASP- HN      5.50                
         HG13   34 ASP- HN      5.50                
         QD1    34 ASP- HN      7.60                
 34 ASP- 
         HN     34 ASP- HB2     3.90                
         HN     35 LEU  HN      5.60                
         HN     35 LEU  HA      6.60                
         HN     39 LYS+ HN      5.80                
         HN     40 VAL  HA      4.70                
         HN     41 CYS  HN      4.70                
         HA     35 LEU  HN      3.50                
         HA     35 LEU  HA      5.70                
         HA     36 PRO  HD2     6.00                
         HA     36 PRO  HD3     6.60                
         HB2    35 LEU  HN      5.10                
         HB2    39 LYS+ HN      5.80                
         HB2    39 LYS+ HB2     5.30                
         HB2    39 LYS+ HB3     5.30                
         HB3    35 LEU  HN      6.20                
         HB3    39 LYS+ HN      6.60                
         HB3    39 LYS+ HB2     4.50                
         HB3    39 LYS+ HB3     5.00                
 35 LEU  
         HN     35 LEU  HB2     3.80                
         HN     35 LEU  HB3     3.70                
         HN     35 LEU  QQD     5.57                
         HN     36 PRO  QG      7.48                
         HN     36 PRO  HD2     4.40                
         HN     36 PRO  HD3     4.60                
         HN     37 ASN  HN      6.60                
         HA     35 LEU  HG      4.10                
         HA     38 LYS+ HN      5.20                
         HA     38 LYS+ HA      5.20                
         HA     39 LYS+ HN      6.60                
         HB2    36 PRO  QG      6.68                
         HB2    36 PRO  HD2     5.00                
         HB2    36 PRO  HD3     4.70                
         HB3    35 LEU  HG      2.70                
         HB3    36 PRO  HD3     3.80                
         QQD    36 PRO  HD3     9.17                
 36 PRO  
         HA     38 LYS+ QG      7.60                
         HB2    37 ASN  QD2     7.47                
         HB3    37 ASN  HN      4.70                
         HB3    37 ASN  HD21    6.00                
         HB3    37 ASN  HD22    6.00                
         HB3    37 ASN  QD2     5.59                
         QG     37 ASN  HN      5.37                
         HD2    37 ASN  HN      4.50                
 37 ASN  
         HN     37 ASN  HB2     3.60                
         HN     37 ASN  HD21    4.70                
         HN     37 ASN  HD22    4.70                
         HN     37 ASN  QD2     4.28                
         HN     38 LYS+ HN      3.80                
         HN     39 LYS+ HN      5.10                
         HN     39 LYS+ QD      7.60                
         HB2    37 ASN  HD21    4.10                
         HB2    37 ASN  HD22    4.10                
         HB2    37 ASN  QD2     3.57                
         HB2    38 LYS+ HN      6.00                
         HB2    39 LYS+ HB2     5.40                
         HB3    38 LYS+ HN      6.60                
         HB3    39 LYS+ HB2     4.90                
         HB3    39 LYS+ HB3     5.70                
         HB3    39 LYS+ HG2     6.20                
         HB3    39 LYS+ HG3     6.20                
         HB3    39 LYS+ QG      5.70                
         HB3    39 LYS+ QD      6.00                
 38 LYS+ 
         HN     38 LYS+ QG      5.10                
         HN     39 LYS+ HN      4.90                
         HB3    38 LYS+ QE      5.30                
         HB3    39 LYS+ HN      4.70                
         HB3    39 LYS+ HA      4.90                
 39 LYS+ 
         HN     39 LYS+ HG2     5.40                
         HN     39 LYS+ HG3     5.40                
         HN     39 LYS+ QG      5.23                
         HN     40 VAL  HN      6.60                
         HA     39 LYS+ HG2     3.70                
         HA     39 LYS+ HG3     3.70                
         HA     39 LYS+ QD      5.80                
         HA     40 VAL  HN      3.10                
         HA     40 VAL  QG2     7.60                
         HB2    40 VAL  HN      5.20                
         HB3    40 VAL  HN      4.50                
         HG2    40 VAL  HN      6.40                
         HG3    40 VAL  HN      6.40                
         QG     40 VAL  HN      5.55                
         QD     40 VAL  HN      7.10                
 40 VAL  
         HN     40 VAL  HB      4.10                
         HN     40 VAL  QG1     4.00                
         HN     40 VAL  QG2     3.80                
         HN     41 CYS  HN      5.90                
         HA     41 CYS  HN      3.20                
         HA     41 CYS  HB2     5.70                
         HB     41 CYS  HN      4.30                
         HB     55 LEU  QQD     9.17                
         QG1    41 CYS  HN      4.70                
         QG1    42 ILE  HN      7.60                
         QG1    55 LEU  QQD     8.77                
         QG2    41 CYS  HN      4.90                
 41 CYS  
         HN     42 ILE  HN      6.00                
         HN     42 ILE  HG12    6.60                
         HA     42 ILE  HN      3.30                
         HA     42 ILE  HA      4.90                
         HB2    42 ILE  HN      6.00                
         HB3    42 ILE  HN      4.80                
 42 ILE  
         HN     42 ILE  HG12    4.00                
         HN     42 ILE  HG13    3.80                
         HN     42 ILE  QD1     6.00                
         HA     42 ILE  QG2     3.60                
         HA     42 ILE  HG12    3.40                
         HA     42 ILE  HG13    4.10                
         HA     43 GLU- HN      2.70                
         HA     43 GLU- HB2     5.90                
         HA     43 GLU- HB3     5.90                
         HB     42 ILE  HG13    2.90                
         HB     43 GLU- HN      4.00                
         QG2    42 ILE  QD1     4.40                
         QG2    43 GLU- HN      4.60                
         QG2    43 GLU- HA      7.60                
         QG2    44 SER  HN      7.60                
         QG2    44 SER  HB2     5.00                
         QG2    44 SER  HB3     5.00                
         QG2    44 SER  QB      4.77                
         QG2    51 LEU  QD1     8.10                
         QG2    51 LEU  QD2     6.00                
         HG12   51 LEU  QD1     5.60                
         QD1    44 SER  QB      8.48                
         QD1    55 LEU  QQD     7.47                
 43 GLU- 
         HN     43 GLU- HB2     3.20                
         HN     43 GLU- HB3     3.20                
         HN     43 GLU- QG      5.60                
         HN     44 SER  HN      4.70                
         HA     43 GLU- QG      4.00                
         HA     44 SER  HN      2.80                
         QG     44 SER  HN      5.80                
 44 SER  
         HN     46 HIS  HN      4.50                
         HB2    46 HIS  HN      5.10                
         HB2    46 HIS  HD2     6.40                
         HB2    51 LEU  QD1     7.40                
         HB2    51 LEU  QD2     7.60                
         HB3    46 HIS  HN      5.10                
         HB3    46 HIS  HD2     6.40                
         HB3    51 LEU  QD1     7.40                
         HB3    51 LEU  QD2     7.60                
         QB     46 HIS  HN      4.78                
         QB     46 HIS  HD2     5.90                
         QB     51 LEU  QD1     6.68                
         QB     51 LEU  QD2     7.45                
 45 GLU- 
         HN     45 GLU- QG      4.88                
         HN     46 HIS  HN      3.90                
         HA     45 GLU- HG2     3.70                
         HA     45 GLU- HG3     3.70                
         HA     45 GLU- QG      3.44                
         QG     46 HIS  HN      7.48                
 46 HIS  
         HN     46 HIS  QB      3.90                
         HN     46 HIS  HD2     4.60                
         HN     47 SER  HN      6.60                
         HN     51 LEU  QD2     7.60                
         HA     46 HIS  HD2     6.60                
         HA     47 SER  HN      2.90                
         QB     47 SER  HN      4.60                
         QB     50 THR  HB      5.90                
         QB     50 THR  QG2     6.30                
         QB     51 LEU  HG      6.40                
         QB     51 LEU  QD1     7.60                
         QB     51 LEU  QD2     7.00                
         HD2    50 THR  QG2     7.60                
         HD2    51 LEU  QD1     7.60                
         HD2    51 LEU  QD2     7.10                
         HE1    50 THR  QG2     7.60                
 47 SER  
         HN     47 SER  HB2     3.20                
         HN     47 SER  HB3     3.90                
         HN     48 MET  HN      5.50                
         HN     50 THR  HN      6.30                
         HN     50 THR  HB      4.60                
         HA     47 SER  HB2     2.70                
         HA     48 MET  HN      3.30                
         HA     48 MET  QB      6.70                
         HA     48 MET  QG      7.08                
         HA     49 ASP- HN      4.20                
         HB3    48 MET  HN      4.50                
         HB3    49 ASP- HN      4.00                
         HB3    49 ASP- QB      7.30                
 48 MET  
         HN     48 MET  QG      4.18                
         HN     49 ASP- HN      3.60                
         HA     48 MET  HG2     3.90                
         HA     48 MET  HG3     3.90                
         HA     48 MET  QG      3.28                
         HA     51 LEU  HN      4.40                
         HA     51 LEU  HB2     3.60                
         HA     51 LEU  HB3     5.90                
         HA     51 LEU  QD1     5.20                
         HA     52 LEU  HN      5.70                
         QB     55 LEU  QQD     9.97                
         HG2    49 ASP- HN      5.10                
         HG2    64 TYR  QE      8.60                
         HG3    49 ASP- HN      5.10                
         HG3    64 TYR  QE      8.60                
         QG     49 ASP- HN      4.29                
 49 ASP- 
         HN     49 ASP- QB      3.80                
         HN     50 THR  HN      3.40                
         HN     50 THR  HB      5.10                
         HA     50 THR  HN      3.40                
         HA     52 LEU  HN      4.10                
         HA     52 LEU  HB2     3.50                
         HA     52 LEU  HB3     4.10                
         HA     52 LEU  QQD     7.37                
         HA     53 ALA  HN      4.40                
 50 THR  
         HN     50 THR  HB      3.00                
         HN     50 THR  QG2     4.80                
         HN     51 LEU  HN      4.70                
         HN     51 LEU  HG      5.00                
         HN     52 LEU  HN      5.60                
         HA     50 THR  QG2     3.50                
         HA     52 LEU  HN      6.10                
         HA     53 ALA  QB      4.50                
         HB     51 LEU  HN      3.50                
         QG2    51 LEU  HN      5.80                
 51 LEU  
         HN     51 LEU  HB2     3.40                
         HN     51 LEU  HG      2.60                
         HN     51 LEU  QD1     4.90                
         HN     51 LEU  QD2     4.30                
         HN     52 LEU  HN      3.60                
         HA     51 LEU  HG      4.10                
         HA     51 LEU  QD1     4.70                
         HA     51 LEU  QD2     3.40                
         HA     54 THR  HN      4.50                
         HA     54 THR  HB      3.40                
         HA     54 THR  QG2     5.80                
         HA     55 LEU  HN      5.90                
         HB2    51 LEU  QD1     3.50                
         HB2    52 LEU  HN      3.80                
         HB3    52 LEU  HN      5.00                
         HB3    52 LEU  HA      5.50                
         HB3    54 THR  HB      5.70                
         HB3    55 LEU  HB2     5.70                
         HB3    55 LEU  HB3     5.40                
         HG     52 LEU  HN      4.20                
         QD1    52 LEU  HN      5.30                
         QD2    52 LEU  HN      7.60                
         QD2    54 THR  HB      7.60                
 52 LEU  
         HN     52 LEU  HB2     3.80                
         HN     52 LEU  HB3     3.50                
         HN     52 LEU  HG      5.10                
         HN     52 LEU  QD1     5.30                
         HN     52 LEU  QD2     5.30                
         HN     52 LEU  QQD     4.56                
         HN     53 ALA  HN      3.60                
         HN     53 ALA  QB      6.00                
         HN     54 THR  HN      6.20                
         HA     52 LEU  HG      3.40                
         HA     52 LEU  QD1     4.70                
         HA     52 LEU  QD2     4.70                
         HA     52 LEU  QQD     4.02                
         HA     55 LEU  HN      4.00                
         HA     55 LEU  QQD     7.67                
         HA     56 LYS+ HN      5.10                
         HB2    52 LEU  HG      2.70                
         HB2    53 ALA  HN      3.80                
         HB3    53 ALA  HN      3.20                
         HB3    55 LEU  QQD     9.17                
         HG     53 ALA  HN      6.50                
         QD1    64 TYR  HN      7.60                
         QD2    64 TYR  HN      7.60                
         QQD    53 ALA  HN      8.07                
         QQD    53 ALA  HA      8.67                
         QQD    63 SER  HA      8.17                
         QQD    64 TYR  HN      6.58                
         QQD    64 TYR  HA      9.17                
         QQD    64 TYR  QB      8.57                
 53 ALA  
         HN     53 ALA  QB      3.40                
         HN     54 THR  HN      3.70                
         HN     55 LEU  HN      6.00                
         HA     54 THR  HN      3.50                
         HA     56 LYS+ HN      4.20                
         HA     56 LYS+ HB2     3.40                
         HA     56 LYS+ HB3     4.00                
         HA     56 LYS+ HG3     4.50                
         QB     54 THR  HN      3.40                
         QB     54 THR  HA      5.30                
         QB     55 LEU  HN      6.40                
 54 THR  
         HN     54 THR  HB      2.80                
         HN     54 THR  QG2     4.50                
         HN     55 LEU  HN      3.20                
         HA     54 THR  QG2     3.50                
         HA     57 LYS+ HG2     5.40                
         HA     57 LYS+ HG3     4.80                
         HA     57 LYS+ QD      6.10                
         HA     57 LYS+ QE      7.00                
         HB     55 LEU  HN      3.40                
         QG2    55 LEU  HN      5.00                
         QG2    55 LEU  QD1     7.50                
         QG2    55 LEU  QD2     7.50                
         QG2    55 LEU  QQD     7.08                
         QG2    57 LYS+ QE      7.50                
 55 LEU  
         HN     55 LEU  HB2     3.80                
         HN     55 LEU  HB3     3.60                
         HN     55 LEU  HG      2.80                
         HN     55 LEU  QD1     4.30                
         HN     55 LEU  QD2     4.30                
         HN     56 LYS+ HN      4.90                
         HA     55 LEU  HG      3.70                
         HA     55 LEU  QD1     4.90                
         HA     55 LEU  QD2     4.90                
         HA     55 LEU  QQD     4.29                
         HA     56 LYS+ HA      6.20                
         HA     62 VAL  QQG     9.16                
         HB2    55 LEU  HG      3.00                
         HB2    56 LYS+ HN      3.80                
         HB3    55 LEU  QD1     3.60                
         HB3    55 LEU  QD2     3.60                
         HB3    55 LEU  QQD     3.13                
         HB3    56 LYS+ HN      5.50                
         HB3    56 LYS+ HA      5.90                
         HG     56 LYS+ HN      6.60                
         QD1    56 LYS+ HN      7.60                
         QD1    62 VAL  QG1    10.54                
         QD1    62 VAL  QG2    10.54                
         QD2    56 LYS+ HN      7.60                
         QD2    62 VAL  QG1    10.54                
         QD2    62 VAL  QG2    10.54                
         QQD    58 THR  QG2    10.17                
         QQD    62 VAL  QQG     8.53                
 56 LYS+ 
         HN     56 LYS+ HB2     3.70                
         HN     56 LYS+ HB3     4.10                
         HN     56 LYS+ HG2     4.50                
         HN     56 LYS+ HG3     3.90                
         HN     57 LYS+ HN      4.80                
         HA     56 LYS+ HG2     3.40                
         HA     56 LYS+ HG3     3.10                
         HA     56 LYS+ QD      4.80                
         HA     58 THR  HN      5.00                
         HA     58 THR  HG1     6.60                
         HA     59 GLY  HN      5.50                
         HA     62 VAL  QG1     6.80                
         HA     62 VAL  QG2     6.80                
         HA     62 VAL  QQG     5.94                
         HB2    57 LYS+ HN      5.00                
         HB3    57 LYS+ HN      3.80                
         HB3    62 VAL  QQG     8.46                
         HG2    62 VAL  QQG     6.96                
         HG3    57 LYS+ HN      6.60                
         QD     57 LYS+ HN      7.60                
         QD     57 LYS+ HB2     7.30                
 57 LYS+ 
         HN     57 LYS+ HB2     3.80                
         HN     57 LYS+ HB3     4.20                
         HN     57 LYS+ HG2     3.90                
         HN     57 LYS+ HG3     3.10                
         HN     57 LYS+ QD      5.80                
         HN     58 THR  HN      4.60                
         HN     58 THR  QG2     7.60                
         HA     57 LYS+ HG2     2.40                
         HA     57 LYS+ HG3     3.20                
         HA     57 LYS+ QD      4.80                
         HA     59 GLY  HN      5.60                
         HB2    57 LYS+ HG3     2.40                
         HB2    57 LYS+ QE      4.70                
         HB2    58 THR  HN      4.20                
         HB3    57 LYS+ HG2     2.70                
         HB3    57 LYS+ QE      4.90                
         HB3    58 THR  HN      4.20                
 58 THR  
         HN     58 THR  HB      3.80                
         HN     58 THR  QG2     3.40                
         HN     58 THR  HG1     3.20                
         HN     59 GLY  HN      4.30                
         HN     59 GLY  QA      5.58                
         HA     58 THR  QG2     3.40                
         HB     59 GLY  HN      5.40                
         HB     60 LYS+ HN      4.20                
         HB     60 LYS+ HB2     5.00                
         HB     60 LYS+ HG2     6.60                
         HB     60 LYS+ HG3     6.60                
         QG2    59 GLY  HN      6.70                
         QG2    59 GLY  QA      6.88                
         QG2    60 LYS+ HN      7.60                
         HG1    59 GLY  HN      5.10                
         HG1    59 GLY  QA      7.48                
         HG1    60 LYS+ HD2     6.20                
         HG1    60 LYS+ HD3     6.20                
         HG1    60 LYS+ QD      5.79                
         HG1    62 VAL  QQG     9.16                
 59 GLY  
         HN     60 LYS+ HN      3.30                
         HN     60 LYS+ HB2     5.60                
 60 LYS+ 
         HN     60 LYS+ HB2     3.80                
         HN     60 LYS+ HG2     4.00                
         HN     60 LYS+ HG3     4.20                
         HN     60 LYS+ HD2     6.30                
         HN     60 LYS+ HD3     6.30                
         HN     60 LYS+ QD      5.99                
         HN     61 THR  HN      6.60                
         HN     61 THR  HA      5.70                
         HA     60 LYS+ HG2     4.20                
         HA     60 LYS+ HG3     4.10                
         HA     60 LYS+ HD2     4.30                
         HA     60 LYS+ HD3     4.30                
         HA     60 LYS+ QD      3.87                
         HA     61 THR  HN      2.90                
         HA     62 VAL  QQG     9.16                
         HB2    61 THR  HN      4.10                
         HB3    60 LYS+ QE      4.88                
         HB3    61 THR  HN      3.60                
         HB3    61 THR  HA      5.00                
         HB3    61 THR  HB      6.10                
         HB3    62 VAL  HN      4.00                
         HB3    62 VAL  QG1     7.60                
         HB3    62 VAL  QG2     7.60                
         HG2    61 THR  HN      6.60                
         HG3    60 LYS+ HE2     3.80                
         HG3    60 LYS+ HE3     3.80                
         HG3    60 LYS+ QE      3.45                
 61 THR  
         HN     61 THR  HB      3.30                
         HN     61 THR  QG2     4.20                
         HN     62 VAL  HN      5.80                
         HA     61 THR  QG2     3.40                
         HA     62 VAL  HN      3.50                
         HA     62 VAL  HA      6.60                
         HA     62 VAL  QQG     8.96                
         HB     62 VAL  HN      4.20                
         HB     62 VAL  QQG     6.96                
         QG2    62 VAL  HN      5.80                
         QG2    62 VAL  HA      7.60                
 62 VAL  
         HN     62 VAL  HB      3.50                
         HN     62 VAL  QQG     4.15                
         HN     63 SER  HN      5.20                
         HA     63 SER  HN      2.60                
         HB     63 SER  HN      5.10                
         QG1    63 SER  HN      5.70                
         QG2    63 SER  HN      5.70                
         QQG    63 SER  HN      4.85                
 63 SER  
         HA     64 TYR  HN      3.50                
         HB2    64 TYR  HN      4.90                
         HB2    65 LEU  QD1     7.60                
         HB3    64 TYR  HN      4.90                
         HB3    65 LEU  QD1     7.60                
         QB     65 LEU  QD1     7.16                
 64 TYR  
         HA     65 LEU  HN      3.40                
         HA     66 GLY  HN      5.80                
         QD     65 LEU  HN      7.90                
         QD     66 GLY  HN      8.60                
         QE     65 LEU  HN      8.60                
         QE     65 LEU  QD2     9.60                
         QE     66 GLY  HN      7.30                
         QE     66 GLY  HA1     8.00                
         QE     66 GLY  HA2     8.60                
         QE     67 LEU  HN      8.60                
 65 LEU  
         HN     65 LEU  HG      4.20                
         HN     65 LEU  QD2     4.30                
         HN     66 GLY  HN      3.20                
         HA     65 LEU  HG      4.10                
         HA     65 LEU  QD1     4.10                
         HA     65 LEU  QD2     4.70                
         QB     66 GLY  HN      4.80                
         HG     66 GLY  HN      6.60                
         QD2    66 GLY  HN      7.60                
 66 GLY  
         HN     67 LEU  HN      6.60                
         HA1    67 LEU  HN      3.60                
         HA2    67 LEU  HN      3.50                
 67 LEU  
         HN     67 LEU  HG      3.70                
         HN     67 LEU  QD1     6.30                
         HN     67 LEU  QD2     6.30                
         HN     67 LEU  QQD     5.95                
         HA     67 LEU  HG      3.90                
         HA     67 LEU  QD1     6.10                
         HA     67 LEU  QD2     6.10                
         QB     68 GLU- HN      4.80                
         HG     68 GLU- HN      4.30                
         QD1    68 GLU- HN      7.40                
         QD2    68 GLU- HN      7.40                
         QQD    68 GLU- HN      6.64                
         QQD    68 GLU- HA      8.17                
 68 GLU- 
         HN     68 GLU- HB2     3.20                
         HN     68 GLU- HB3     3.20                
         HN     68 GLU- QG      6.70                

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    MET   1           H1       MET   1  -8.949 -13.404   7.540
    2   2H    MET   1           H2       MET   1  -7.881 -12.922   8.726
    3   3H    MET   1           H3       MET   1  -9.190 -11.988   8.369
    4    HA   MET   1           HA       MET   1  -7.136 -11.127   7.500
    5   1HB   MET   1          2HB       MET   1  -6.098 -13.348   7.216
    6   2HB   MET   1          3HB       MET   1  -7.152 -13.685   5.844
    7   1HG   MET   1          2HG       MET   1  -6.197 -11.804   4.598
    8   2HG   MET   1          3HG       MET   1  -5.188 -11.358   5.974
    9   1HE   MET   1          1HE       MET   1  -2.551 -14.258   6.034
   10   2HE   MET   1          2HE       MET   1  -3.100 -12.755   6.805
   11   3HE   MET   1          3HE       MET   1  -4.050 -14.253   6.981
   12    HA   PRO   2           HA       PRO   2 -10.320  -9.952   4.364
   13   1HB   PRO   2          2HB       PRO   2  -9.991  -7.293   4.431
   14   2HB   PRO   2          3HB       PRO   2 -10.871  -8.119   5.759
   15   1HG   PRO   2          2HG       PRO   2  -7.980  -7.194   5.695
   16   2HG   PRO   2          3HG       PRO   2  -9.163  -6.969   7.011
   17   1HD   PRO   2          2HD       PRO   2  -7.277  -8.988   6.923
   18   2HD   PRO   2          3HD       PRO   2  -8.849  -9.179   7.761
   19    H    LYS   3           H        LYS   3  -9.999  -8.667   2.353
   20    HA   LYS   3           HA       LYS   3  -7.156  -8.188   1.575
   21   1HB   LYS   3          2HB       LYS   3  -7.911  -9.962   0.187
   22   2HB   LYS   3          3HB       LYS   3  -9.467  -9.211  -0.096
   23   1HG   LYS   3          2HG       LYS   3  -8.408  -7.421  -1.407
   24   2HG   LYS   3          3HG       LYS   3  -6.796  -8.082  -1.042
   25   1HD   LYS   3          2HD       LYS   3  -7.267 -10.119  -2.239
   26   2HD   LYS   3          3HD       LYS   3  -8.968  -9.691  -2.466
   27   1HE   LYS   3          2HE       LYS   3  -6.674  -8.017  -3.597
   28   2HE   LYS   3          3HE       LYS   3  -7.437  -9.340  -4.494
   29   1HZ   LYS   3          1HZ       LYS   3  -9.543  -8.183  -4.361
   30   2HZ   LYS   3          2HZ       LYS   3  -8.978  -7.025  -3.465
   31   3HZ   LYS   3          3HZ       LYS   3  -8.418  -7.134  -5.004
   32    H    HIS   4           H        HIS   4  -6.790  -6.181   0.559
   33    HA   HIS   4           HA       HIS   4  -9.048  -4.317   0.234
   34   1HB   HIS   4          2HB       HIS   4  -6.549  -3.768   1.915
   35   2HB   HIS   4          3HB       HIS   4  -7.632  -2.513   1.323
   36    HD1  HIS   4           1HD      HIS   4 -10.208  -2.619   2.279
   37    HD2  HIS   4           2HD      HIS   4  -7.295  -5.017   4.149
   38    HE1  HIS   4           1HE      HIS   4 -11.145  -3.277   4.590
   39    H    GLU   5           H        GLU   5  -8.583  -2.590  -1.200
   40    HA   GLU   5           HA       GLU   5  -6.091  -2.832  -2.803
   41   1HB   GLU   5          2HB       GLU   5  -8.951  -2.412  -3.769
   42   2HB   GLU   5          3HB       GLU   5  -7.513  -2.130  -4.740
   43   1HG   GLU   5          2HG       GLU   5  -6.900  -4.581  -3.895
   44   2HG   GLU   5          3HG       GLU   5  -8.633  -4.688  -3.578
   45    H    PHE   6           H        PHE   6  -5.205  -1.048  -3.654
   46    HA   PHE   6           HA       PHE   6  -6.209   1.649  -2.948
   47   1HB   PHE   6          2HB       PHE   6  -3.396   0.506  -2.455
   48   2HB   PHE   6          3HB       PHE   6  -3.863   2.167  -2.173
   49    HD1  PHE   6           HD1      PHE   6  -4.552   2.823   0.018
   50    HD2  PHE   6           HD2      PHE   6  -4.384  -1.365  -1.005
   51    HE1  PHE   6           HE1      PHE   6  -4.912   2.215   2.393
   52    HE2  PHE   6           HE2      PHE   6  -4.877  -1.958   1.341
   53    HZ   PHE   6           HZ       PHE   6  -5.117  -0.172   3.057
   54    H    SER   7           H        SER   7  -5.864   3.100  -4.475
   55    HA   SER   7           HA       SER   7  -4.380   2.374  -6.918
   56   1HB   SER   7          2HB       SER   7  -5.933   4.797  -5.925
   57   2HB   SER   7          3HB       SER   7  -5.000   4.762  -7.389
   58    HG   SER   7           HG       SER   7  -6.298   3.146  -8.220
   59    H    VAL   8           H        VAL   8  -2.374   3.424  -7.463
   60    HA   VAL   8           HA       VAL   8  -1.096   5.146  -5.433
   61    HB   VAL   8           HB       VAL   8   0.112   2.720  -6.882
   62   1HG1  VAL   8          1HG1      VAL   8   1.805   4.410  -6.609
   63   2HG1  VAL   8          2HG1      VAL   8   1.267   4.775  -4.949
   64   3HG1  VAL   8          3HG1      VAL   8   2.068   3.234  -5.326
   65   1HG2  VAL   8          1HG2      VAL   8  -1.271   1.929  -5.005
   66   2HG2  VAL   8          2HG2      VAL   8   0.419   1.859  -4.505
   67   3HG2  VAL   8          3HG2      VAL   8  -0.604   3.180  -3.938
   68    H    ASP   9           H        ASP   9   0.764   6.338  -6.639
   69    HA   ASP   9           HA       ASP   9   0.487   6.140  -9.565
   70   1HB   ASP   9          2HB       ASP   9  -0.632   8.286  -8.762
   71   2HB   ASP   9          3HB       ASP   9   0.997   8.867  -8.355
   72    H    MET  10           H        MET  10   2.215   4.836  -9.773
   73    HA   MET  10           HA       MET  10   4.657   5.338  -8.302
   74   1HB   MET  10          2HB       MET  10   4.094   3.372 -10.563
   75   2HB   MET  10          3HB       MET  10   5.589   3.487  -9.623
   76   1HG   MET  10          2HG       MET  10   4.442   1.757  -8.596
   77   2HG   MET  10          3HG       MET  10   4.121   3.117  -7.524
   78   1HE   MET  10          1HE       MET  10   1.023   0.610  -7.519
   79   2HE   MET  10          2HE       MET  10   2.672   0.127  -7.947
   80   3HE   MET  10          3HE       MET  10   2.397   1.221  -6.567
   81    H    THR  11           H        THR  11   4.972   7.484  -8.909
   82    HA   THR  11           HA       THR  11   5.323   8.289 -11.638
   83    HB   THR  11           HB       THR  11   6.435  10.226  -9.873
   84    HG1  THR  11           1HG      THR  11   4.108   9.024  -8.724
   85   1HG2  THR  11          1HG2      THR  11   4.923  10.693 -11.759
   86   2HG2  THR  11          2HG2      THR  11   3.577   9.928 -10.887
   87   3HG2  THR  11          3HG2      THR  11   4.312  11.418 -10.258
   88    H    CYS  12           H        CYS  12   7.418   6.747  -9.370
   89    HA   CYS  12           HA       CYS  12   9.407   6.572 -11.481
   90   1HB   CYS  12          2HB       CYS  12  10.396   8.351 -10.068
   91   2HB   CYS  12          3HB       CYS  12  10.095   7.380  -8.606
   92    HG   CYS  12           HG       CYS  12  12.621   7.272  -9.120
   93    H    GLY  13           H        GLY  13  10.414   4.414 -11.240
   94   1HA   GLY  13          2HA       GLY  13   8.894   2.325 -10.205
   95   2HA   GLY  13          3HA       GLY  13  10.652   2.270 -10.433
   96    H    GLY  14           H        GLY  14  11.417   4.257  -8.570
   97   1HA   GLY  14          2HA       GLY  14  11.670   2.830  -6.184
   98   2HA   GLY  14          3HA       GLY  14  11.949   4.572  -6.373
   99    H    CYS  15           H        CYS  15   8.890   4.768  -7.210
  100    HA   CYS  15           HA       CYS  15   7.716   5.396  -4.709
  101   1HB   CYS  15          2HB       CYS  15   6.479   4.534  -7.306
  102   2HB   CYS  15          3HB       CYS  15   5.569   5.052  -5.869
  103    HG   CYS  15           HG       CYS  15   6.544   7.366  -5.581
  104    H    ALA  16           H        ALA  16   7.893   2.337  -6.593
  105    HA   ALA  16           HA       ALA  16   6.108   0.866  -4.890
  106   1HB   ALA  16          1HB       ALA  16   6.619   0.149  -7.197
  107   2HB   ALA  16          2HB       ALA  16   8.320  -0.130  -6.749
  108   3HB   ALA  16          3HB       ALA  16   7.041  -1.122  -6.030
  109    H    GLU  17           H        GLU  17   9.677   1.293  -4.941
  110    HA   GLU  17           HA       GLU  17  10.197  -0.362  -2.669
  111   1HB   GLU  17          2HB       GLU  17  11.663   2.098  -3.740
  112   2HB   GLU  17          3HB       GLU  17  12.106   1.241  -2.280
  113   1HG   GLU  17          2HG       GLU  17  12.083  -0.917  -3.803
  114   2HG   GLU  17          3HG       GLU  17  12.237   0.255  -5.124
  115    H    ALA  18           H        ALA  18   9.272   3.108  -2.912
  116    HA   ALA  18           HA       ALA  18   9.615   3.671  -0.147
  117   1HB   ALA  18          1HB       ALA  18   7.615   4.949  -2.064
  118   2HB   ALA  18          2HB       ALA  18   8.183   5.614  -0.524
  119   3HB   ALA  18          3HB       ALA  18   9.319   5.416  -1.874
  120    H    VAL  19           H        VAL  19   6.666   2.729  -1.948
  121    HA   VAL  19           HA       VAL  19   4.984   2.574   0.345
  122    HB   VAL  19           HB       VAL  19   4.766   1.289  -2.404
  123   1HG1  VAL  19          1HG1      VAL  19   2.296   1.198  -1.776
  124   2HG1  VAL  19          2HG1      VAL  19   3.322  -0.009  -0.985
  125   3HG1  VAL  19          3HG1      VAL  19   2.781   1.448  -0.099
  126   1HG2  VAL  19          1HG2      VAL  19   3.180   3.132  -2.814
  127   2HG2  VAL  19          2HG2      VAL  19   3.417   3.740  -1.164
  128   3HG2  VAL  19          3HG2      VAL  19   4.740   3.809  -2.340
  129    H    SER  20           H        SER  20   6.818  -0.004  -1.399
  130    HA   SER  20           HA       SER  20   6.026  -2.148   0.249
  131   1HB   SER  20          2HB       SER  20   7.317  -2.405  -1.872
  132   2HB   SER  20          3HB       SER  20   8.707  -1.586  -1.147
  133    HG   SER  20           HG       SER  20   8.957  -3.838  -1.125
  134    H    ARG  21           H        ARG  21   8.891  -0.025   0.646
  135    HA   ARG  21           HA       ARG  21   9.793  -1.176   3.039
  136   1HB   ARG  21          2HB       ARG  21  10.170   1.589   1.844
  137   2HB   ARG  21          3HB       ARG  21  11.032   1.015   3.282
  138   1HG   ARG  21          2HG       ARG  21  12.026  -0.829   2.068
  139   2HG   ARG  21          3HG       ARG  21  11.083  -0.505   0.627
  140   1HD   ARG  21          2HD       ARG  21  12.154   1.685   0.339
  141   2HD   ARG  21          3HD       ARG  21  13.169   1.424   1.752
  142    HE   ARG  21           HE       ARG  21  13.521   0.339  -0.967
  143   1HH1  ARG  21          2HH2      ARG  21  14.272  -0.358   2.401
  144   2HH1  ARG  21          1HH2      ARG  21  15.730  -1.237   2.023
  145   1HH2  ARG  21          2HH1      ARG  21  15.256  -0.716  -1.482
  146   2HH2  ARG  21          1HH1      ARG  21  16.344  -1.488  -0.328
  147    H    VAL  22           H        VAL  22   7.528   1.724   2.634
  148    HA   VAL  22           HA       VAL  22   7.291   2.075   5.382
  149    HB   VAL  22           HB       VAL  22   6.515   3.575   3.375
  150   1HG1  VAL  22          1HG1      VAL  22   3.870   2.272   4.164
  151   2HG1  VAL  22          2HG1      VAL  22   4.089   3.671   3.096
  152   3HG1  VAL  22          3HG1      VAL  22   4.651   2.102   2.581
  153   1HG2  VAL  22          1HG2      VAL  22   6.575   4.236   5.679
  154   2HG2  VAL  22          2HG2      VAL  22   5.030   4.771   4.962
  155   3HG2  VAL  22          3HG2      VAL  22   5.061   3.343   6.018
  156    H    LEU  23           H        LEU  23   5.291  -0.058   3.194
  157    HA   LEU  23           HA       LEU  23   3.578  -0.863   5.324
  158   1HB   LEU  23          2HB       LEU  23   4.281  -2.094   2.651
  159   2HB   LEU  23          3HB       LEU  23   3.380  -2.984   3.868
  160    HG   LEU  23           HG       LEU  23   1.830  -2.188   2.393
  161   1HD1  LEU  23          1HD1      LEU  23   1.502  -0.375   4.816
  162   2HD1  LEU  23          2HD1      LEU  23   0.250  -1.102   3.803
  163   3HD1  LEU  23          3HD1      LEU  23   1.239  -2.133   4.844
  164   1HD2  LEU  23          1HD2      LEU  23   3.002  -0.399   1.407
  165   2HD2  LEU  23          2HD2      LEU  23   1.406   0.170   1.941
  166   3HD2  LEU  23          3HD2      LEU  23   2.857   0.589   2.887
  167    H    ASN  24           H        ASN  24   6.527  -2.432   4.019
  168    HA   ASN  24           HA       ASN  24   6.817  -4.566   5.799
  169   1HB   ASN  24          2HB       ASN  24   8.333  -4.454   4.023
  170   2HB   ASN  24          3HB       ASN  24   8.705  -2.761   4.308
  171   1HD2  ASN  24          1HD2      ASN  24  10.015  -2.127   6.023
  172   2HD2  ASN  24          2HD2      ASN  24  11.223  -3.253   6.686
  173    H    LYS  25           H        LYS  25   7.760  -1.155   6.290
  174    HA   LYS  25           HA       LYS  25   8.995  -1.468   8.816
  175   1HB   LYS  25          2HB       LYS  25   7.866   0.792   7.201
  176   2HB   LYS  25          3HB       LYS  25   7.913   1.074   8.927
  177   1HG   LYS  25          2HG       LYS  25  10.329   0.032   7.415
  178   2HG   LYS  25          3HG       LYS  25   9.962   1.761   7.523
  179   1HD   LYS  25          2HD       LYS  25   9.987   1.740   9.942
  180   2HD   LYS  25          3HD       LYS  25  10.238   0.002  10.022
  181   1HE   LYS  25          2HE       LYS  25  12.184   1.977   8.727
  182   2HE   LYS  25          3HE       LYS  25  12.290   1.443  10.411
  183   1HZ   LYS  25          1HZ       LYS  25  13.731   0.161   9.027
  184   2HZ   LYS  25          2HZ       LYS  25  12.557  -0.808   9.643
  185   3HZ   LYS  25          3HZ       LYS  25  12.488  -0.328   8.069
  186    H    LEU  26           H        LEU  26   5.574  -1.242   7.959
  187    HA   LEU  26           HA       LEU  26   4.618  -0.655  10.554
  188   1HB   LEU  26          2HB       LEU  26   3.403  -0.672   8.302
  189   2HB   LEU  26          3HB       LEU  26   3.197  -2.393   8.466
  190    HG   LEU  26           HG       LEU  26   1.324  -0.753   9.119
  191   1HD1  LEU  26          1HD1      LEU  26   1.982  -3.018  11.024
  192   2HD1  LEU  26          2HD1      LEU  26   0.384  -2.312  10.710
  193   3HD1  LEU  26          3HD1      LEU  26   1.226  -3.199   9.425
  194   1HD2  LEU  26          1HD2      LEU  26   1.202  -0.011  11.413
  195   2HD2  LEU  26          2HD2      LEU  26   2.717  -0.809  11.829
  196   3HD2  LEU  26          3HD2      LEU  26   2.717   0.605  10.751
  197    H    GLY  27           H        GLY  27   5.408  -3.716   8.916
  198   1HA   GLY  27          2HA       GLY  27   6.398  -5.039  11.038
  199   2HA   GLY  27          3HA       GLY  27   4.655  -5.228  11.322
  200    H    GLY  28           H        GLY  28   3.396  -6.632  10.019
  201   1HA   GLY  28          2HA       GLY  28   4.976  -8.625   8.414
  202   2HA   GLY  28          3HA       GLY  28   3.917  -9.060   9.767
  203    H    VAL  29           H        VAL  29   3.764  -6.825   7.009
  204    HA   VAL  29           HA       VAL  29   0.947  -7.611   6.501
  205    HB   VAL  29           HB       VAL  29   1.052  -5.370   7.101
  206   1HG1  VAL  29          1HG1      VAL  29   3.349  -4.812   7.037
  207   2HG1  VAL  29          2HG1      VAL  29   3.427  -4.978   5.275
  208   3HG1  VAL  29          3HG1      VAL  29   2.471  -3.679   6.021
  209   1HG2  VAL  29          1HG2      VAL  29   0.217  -4.214   5.197
  210   2HG2  VAL  29          2HG2      VAL  29   0.964  -5.368   4.076
  211   3HG2  VAL  29          3HG2      VAL  29  -0.348  -5.888   5.158
  212    H    LYS  30           H        LYS  30   0.638  -8.986   4.820
  213    HA   LYS  30           HA       LYS  30   2.499  -9.048   2.541
  214   1HB   LYS  30          2HB       LYS  30   1.534 -11.114   3.079
  215   2HB   LYS  30          3HB       LYS  30  -0.092 -10.433   3.140
  216   1HG   LYS  30          2HG       LYS  30   0.219 -11.752   1.088
  217   2HG   LYS  30          3HG       LYS  30  -0.152 -10.092   0.735
  218   1HD   LYS  30          2HD       LYS  30   1.556 -10.802  -0.794
  219   2HD   LYS  30          3HD       LYS  30   2.219  -9.571   0.241
  220   1HE   LYS  30          2HE       LYS  30   3.854 -11.301  -0.080
  221   2HE   LYS  30          3HE       LYS  30   3.334 -11.398   1.608
  222   1HZ   LYS  30          1HZ       LYS  30   3.421 -13.560   0.522
  223   2HZ   LYS  30          2HZ       LYS  30   1.875 -13.204   0.966
  224   3HZ   LYS  30          3HZ       LYS  30   2.329 -13.066  -0.610
  225    H    TYR  31           H        TYR  31   2.529  -7.255   1.544
  226    HA   TYR  31           HA       TYR  31   0.101  -6.067   0.292
  227   1HB   TYR  31          2HB       TYR  31   1.483  -4.055  -0.087
  228   2HB   TYR  31          3HB       TYR  31   1.222  -4.386   1.623
  229    HD1  TYR  31           HD1      TYR  31   3.730  -4.497  -1.124
  230    HD2  TYR  31           HD2      TYR  31   3.043  -5.109   3.059
  231    HE1  TYR  31           HE1      TYR  31   6.169  -4.782  -0.757
  232    HE2  TYR  31           HE2      TYR  31   5.494  -5.250   3.459
  233    HH   TYR  31           HH       TYR  31   7.821  -4.544   0.881
  234    H    ASP  32           H        ASP  32   0.238  -5.780  -1.956
  235    HA   ASP  32           HA       ASP  32   2.434  -7.130  -3.448
  236   1HB   ASP  32          2HB       ASP  32  -0.566  -7.541  -3.408
  237   2HB   ASP  32          3HB       ASP  32   0.402  -8.067  -4.774
  238    H    ILE  33           H        ILE  33   3.092  -5.781  -5.069
  239    HA   ILE  33           HA       ILE  33   1.543  -3.273  -5.503
  240    HB   ILE  33           HB       ILE  33   4.483  -3.806  -6.028
  241   1HG1  ILE  33          2HG1      ILE  33   4.353  -1.995  -3.908
  242   2HG1  ILE  33          3HG1      ILE  33   3.101  -3.153  -3.471
  243   1HG2  ILE  33          1HG2      ILE  33   2.860  -1.243  -5.882
  244   2HG2  ILE  33          2HG2      ILE  33   4.617  -1.341  -6.107
  245   3HG2  ILE  33          3HG2      ILE  33   3.543  -1.978  -7.351
  246   1HD1  ILE  33          1HD1      ILE  33   5.965  -3.886  -4.248
  247   2HD1  ILE  33          2HD1      ILE  33   5.367  -3.699  -2.598
  248   3HD1  ILE  33          3HD1      ILE  33   4.721  -5.000  -3.623
  249    H    ASP  34           H        ASP  34   0.631  -2.914  -7.436
  250    HA   ASP  34           HA       ASP  34   1.674  -4.292  -9.869
  251   1HB   ASP  34          2HB       ASP  34  -0.691  -4.804  -9.348
  252   2HB   ASP  34          3HB       ASP  34  -1.066  -3.073  -9.391
  253    H    LEU  35           H        LEU  35   3.125  -2.930 -10.731
  254    HA   LEU  35           HA       LEU  35   2.923  -0.034 -10.445
  255   1HB   LEU  35          2HB       LEU  35   4.881  -1.733 -12.039
  256   2HB   LEU  35          3HB       LEU  35   4.864   0.027 -11.945
  257    HG   LEU  35           HG       LEU  35   4.923  -0.389  -9.320
  258   1HD1  LEU  35          1HD1      LEU  35   6.345  -2.321  -8.733
  259   2HD1  LEU  35          2HD1      LEU  35   4.798  -2.864  -9.387
  260   3HD1  LEU  35          3HD1      LEU  35   6.253  -2.911 -10.404
  261   1HD2  LEU  35          1HD2      LEU  35   7.403  -0.242  -9.440
  262   2HD2  LEU  35          2HD2      LEU  35   7.333  -0.679 -11.158
  263   3HD2  LEU  35          3HD2      LEU  35   6.614   0.845 -10.590
  264    HA   PRO  36           HA       PRO  36   2.096  -0.146 -15.184
  265   1HB   PRO  36          2HB       PRO  36   0.608  -2.330 -16.147
  266   2HB   PRO  36          3HB       PRO  36   2.356  -2.062 -16.357
  267   1HG   PRO  36          2HG       PRO  36   0.963  -3.735 -14.279
  268   2HG   PRO  36          3HG       PRO  36   2.431  -4.134 -15.211
  269   1HD   PRO  36          2HD       PRO  36   2.608  -3.294 -12.700
  270   2HD   PRO  36          3HD       PRO  36   3.762  -2.652 -13.901
  271    H    ASN  37           H        ASN  37  -0.328  -1.942 -13.173
  272    HA   ASN  37           HA       ASN  37  -2.495  -0.243 -14.255
  273   1HB   ASN  37          2HB       ASN  37  -2.580  -2.423 -12.147
  274   2HB   ASN  37          3HB       ASN  37  -3.958  -1.576 -12.829
  275   1HD2  ASN  37          1HD2      ASN  37  -1.859  -4.280 -13.267
  276   2HD2  ASN  37          2HD2      ASN  37  -2.344  -4.667 -14.918
  277    H    LYS  38           H        LYS  38  -0.116   0.145 -11.834
  278    HA   LYS  38           HA       LYS  38   0.207   1.647 -10.318
  279   1HB   LYS  38          2HB       LYS  38  -2.052   3.183 -11.656
  280   2HB   LYS  38          3HB       LYS  38  -0.831   3.823 -10.547
  281   1HG   LYS  38          2HG       LYS  38   0.976   3.218 -12.114
  282   2HG   LYS  38          3HG       LYS  38  -0.186   2.473 -13.207
  283   1HD   LYS  38          2HD       LYS  38   0.444   4.621 -14.066
  284   2HD   LYS  38          3HD       LYS  38  -1.277   4.615 -13.637
  285   1HE   LYS  38          2HE       LYS  38  -0.831   5.878 -11.584
  286   2HE   LYS  38          3HE       LYS  38   0.923   5.724 -11.822
  287   1HZ   LYS  38          1HZ       LYS  38   0.814   7.178 -13.636
  288   2HZ   LYS  38          2HZ       LYS  38  -0.851   7.209 -13.643
  289   3HZ   LYS  38          3HZ       LYS  38  -0.006   7.869 -12.410
  290    H    LYS  39           H        LYS  39  -0.861  -0.385  -9.185
  291    HA   LYS  39           HA       LYS  39  -2.659   0.757  -7.145
  292   1HB   LYS  39          2HB       LYS  39  -3.170  -1.915  -8.545
  293   2HB   LYS  39          3HB       LYS  39  -4.016  -1.321  -7.121
  294   1HG   LYS  39          2HG       LYS  39  -4.652   0.740  -8.642
  295   2HG   LYS  39          3HG       LYS  39  -4.129  -0.306  -9.963
  296   1HD   LYS  39          2HD       LYS  39  -6.431  -0.720  -9.843
  297   2HD   LYS  39          3HD       LYS  39  -5.722  -2.094  -8.975
  298   1HE   LYS  39          2HE       LYS  39  -6.153  -0.814  -6.791
  299   2HE   LYS  39          3HE       LYS  39  -6.944   0.440  -7.757
  300   1HZ   LYS  39          1HZ       LYS  39  -8.532  -1.081  -6.825
  301   2HZ   LYS  39          2HZ       LYS  39  -8.540  -1.301  -8.456
  302   3HZ   LYS  39          3HZ       LYS  39  -7.815  -2.373  -7.438
  303    H    VAL  40           H        VAL  40  -2.637  -0.463  -5.114
  304    HA   VAL  40           HA       VAL  40  -0.679  -2.638  -4.884
  305    HB   VAL  40           HB       VAL  40  -1.176  -0.120  -3.258
  306   1HG1  VAL  40          1HG1      VAL  40  -1.795  -1.739  -1.688
  307   2HG1  VAL  40          2HG1      VAL  40  -0.386  -2.779  -2.056
  308   3HG1  VAL  40          3HG1      VAL  40  -0.161  -1.191  -1.269
  309   1HG2  VAL  40          1HG2      VAL  40   1.321  -1.766  -3.770
  310   2HG2  VAL  40          2HG2      VAL  40   0.769  -0.419  -4.794
  311   3HG2  VAL  40          3HG2      VAL  40   1.234  -0.126  -3.106
  312    H    CYS  41           H        CYS  41  -1.566  -4.372  -3.913
  313    HA   CYS  41           HA       CYS  41  -4.248  -4.070  -2.690
  314   1HB   CYS  41          2HB       CYS  41  -4.968  -6.178  -3.440
  315   2HB   CYS  41          3HB       CYS  41  -4.466  -5.294  -4.893
  316    HG   CYS  41           HG       CYS  41  -3.891  -7.834  -5.070
  317    H    ILE  42           H        ILE  42  -4.528  -5.411  -0.831
  318    HA   ILE  42           HA       ILE  42  -2.021  -6.481   0.341
  319    HB   ILE  42           HB       ILE  42  -3.872  -4.517   1.764
  320   1HG1  ILE  42          2HG1      ILE  42  -1.194  -3.990   0.410
  321   2HG1  ILE  42          3HG1      ILE  42  -2.752  -3.211   0.090
  322   1HG2  ILE  42          1HG2      ILE  42  -2.598  -6.223   3.163
  323   2HG2  ILE  42          2HG2      ILE  42  -1.100  -5.479   2.561
  324   3HG2  ILE  42          3HG2      ILE  42  -2.250  -4.551   3.536
  325   1HD1  ILE  42          1HD1      ILE  42  -1.438  -1.661   1.324
  326   2HD1  ILE  42          2HD1      ILE  42  -2.669  -2.274   2.448
  327   3HD1  ILE  42          3HD1      ILE  42  -0.993  -2.869   2.537
  328    H    GLU  43           H        GLU  43  -2.390  -8.232   1.643
  329    HA   GLU  43           HA       GLU  43  -5.139  -8.819   2.523
  330   1HB   GLU  43          2HB       GLU  43  -4.812  -9.796   0.201
  331   2HB   GLU  43          3HB       GLU  43  -3.573 -10.858   0.881
  332   1HG   GLU  43          2HG       GLU  43  -5.258 -11.794   2.441
  333   2HG   GLU  43          3HG       GLU  43  -6.495 -10.706   1.798
  334    H    SER  44           H        SER  44  -4.400  -8.457   4.625
  335    HA   SER  44           HA       SER  44  -2.746 -10.488   5.839
  336   1HB   SER  44          2HB       SER  44  -1.400  -8.285   4.758
  337   2HB   SER  44          3HB       SER  44  -1.639  -7.789   6.434
  338    HG   SER  44           HG       SER  44  -0.436  -9.564   7.083
  339    H    GLU  45           H        GLU  45  -2.864 -10.208   8.248
  340    HA   GLU  45           HA       GLU  45  -5.501  -9.213   8.901
  341   1HB   GLU  45          2HB       GLU  45  -3.527 -10.550  10.775
  342   2HB   GLU  45          3HB       GLU  45  -5.283 -10.419  10.906
  343   1HG   GLU  45          2HG       GLU  45  -5.090 -11.620   8.453
  344   2HG   GLU  45          3HG       GLU  45  -3.630 -12.258   9.219
  345    H    HIS  46           H        HIS  46  -2.778  -7.410   8.714
  346    HA   HIS  46           HA       HIS  46  -3.007  -5.873  11.201
  347   1HB   HIS  46          2HB       HIS  46  -1.771  -5.305   8.485
  348   2HB   HIS  46          3HB       HIS  46  -1.878  -4.092   9.760
  349    HD1  HIS  46           1HD      HIS  46  -0.391  -4.527  12.008
  350    HD2  HIS  46           2HD      HIS  46   0.283  -6.935   8.641
  351    HE1  HIS  46           1HE      HIS  46   1.960  -5.483  12.251
  352    H    SER  47           H        SER  47  -4.584  -4.390  11.621
  353    HA   SER  47           HA       SER  47  -6.916  -4.258  10.105
  354   1HB   SER  47          2HB       SER  47  -6.798  -3.604  12.478
  355   2HB   SER  47          3HB       SER  47  -5.869  -2.152  12.034
  356    HG   SER  47           HG       SER  47  -8.111  -1.714  12.238
  357    H    MET  48           H        MET  48  -7.688  -3.031   8.476
  358    HA   MET  48           HA       MET  48  -6.301  -1.754   6.539
  359   1HB   MET  48          2HB       MET  48  -8.737  -2.411   6.631
  360   2HB   MET  48          3HB       MET  48  -9.037  -1.004   7.658
  361   1HG   MET  48          2HG       MET  48  -8.032   0.393   5.737
  362   2HG   MET  48          3HG       MET  48  -8.067  -1.109   4.804
  363   1HE   MET  48          1HE       MET  48 -10.109   1.743   6.529
  364   2HE   MET  48          2HE       MET  48 -11.792   1.254   6.228
  365   3HE   MET  48          3HE       MET  48 -10.808   0.349   7.393
  366    H    ASP  49           H        ASP  49  -7.810  -0.205   9.430
  367    HA   ASP  49           HA       ASP  49  -7.154   2.443   8.758
  368   1HB   ASP  49          2HB       ASP  49  -8.781   1.946  10.504
  369   2HB   ASP  49          3HB       ASP  49  -7.517   1.219  11.520
  370    H    THR  50           H        THR  50  -5.464   0.309  10.971
  371    HA   THR  50           HA       THR  50  -3.236   1.788  11.608
  372    HB   THR  50           HB       THR  50  -3.210  -1.201  10.984
  373    HG1  THR  50           1HG      THR  50  -3.766  -1.173  13.334
  374   1HG2  THR  50          1HG2      THR  50  -1.558  -1.306  12.803
  375   2HG2  THR  50          2HG2      THR  50  -1.002  -0.266  11.487
  376   3HG2  THR  50          3HG2      THR  50  -1.626   0.464  12.983
  377    H    LEU  51           H        LEU  51  -3.601  -0.337   8.707
  378    HA   LEU  51           HA       LEU  51  -1.022   0.331   7.613
  379   1HB   LEU  51          2HB       LEU  51  -3.532  -0.537   6.119
  380   2HB   LEU  51          3HB       LEU  51  -1.877  -0.502   5.494
  381    HG   LEU  51           HG       LEU  51  -2.957  -2.286   7.739
  382   1HD1  LEU  51          1HD1      LEU  51  -1.912  -2.876   4.959
  383   2HD1  LEU  51          2HD1      LEU  51  -2.477  -4.088   6.136
  384   3HD1  LEU  51          3HD1      LEU  51  -3.621  -2.919   5.450
  385   1HD2  LEU  51          1HD2      LEU  51  -0.133  -1.926   6.673
  386   2HD2  LEU  51          2HD2      LEU  51  -0.697  -1.799   8.355
  387   3HD2  LEU  51          3HD2      LEU  51  -0.660  -3.373   7.553
  388    H    LEU  52           H        LEU  52  -4.288   1.565   6.721
  389    HA   LEU  52           HA       LEU  52  -3.559   3.400   4.801
  390   1HB   LEU  52          2HB       LEU  52  -5.722   2.301   5.564
  391   2HB   LEU  52          3HB       LEU  52  -5.894   3.589   6.750
  392    HG   LEU  52           HG       LEU  52  -5.639   4.039   3.725
  393   1HD1  LEU  52          1HD1      LEU  52  -7.387   2.408   4.138
  394   2HD1  LEU  52          2HD1      LEU  52  -8.052   3.385   5.457
  395   3HD1  LEU  52          3HD1      LEU  52  -8.162   3.970   3.777
  396   1HD2  LEU  52          1HD2      LEU  52  -7.070   6.052   4.317
  397   2HD2  LEU  52          2HD2      LEU  52  -6.777   5.676   6.033
  398   3HD2  LEU  52          3HD2      LEU  52  -5.423   6.096   4.948
  399    H    ALA  53           H        ALA  53  -3.559   3.746   8.330
  400    HA   ALA  53           HA       ALA  53  -2.927   6.583   8.371
  401   1HB   ALA  53          1HB       ALA  53  -2.514   6.173  10.766
  402   2HB   ALA  53          2HB       ALA  53  -4.061   5.457  10.269
  403   3HB   ALA  53          3HB       ALA  53  -2.640   4.422  10.503
  404    H    THR  54           H        THR  54  -1.042   3.583   8.741
  405    HA   THR  54           HA       THR  54   1.454   4.860   9.159
  406    HB   THR  54           HB       THR  54   0.789   2.135   7.951
  407    HG1  THR  54           1HG      THR  54   0.081   2.341  10.024
  408   1HG2  THR  54          1HG2      THR  54   3.054   2.684   7.297
  409   2HG2  THR  54          2HG2      THR  54   3.434   3.269   8.940
  410   3HG2  THR  54          3HG2      THR  54   3.107   1.552   8.646
  411    H    LEU  55           H        LEU  55   0.205   3.402   6.120
  412    HA   LEU  55           HA       LEU  55   2.443   4.128   4.597
  413   1HB   LEU  55          2HB       LEU  55   1.289   3.395   2.707
  414   2HB   LEU  55          3HB       LEU  55   1.086   2.311   4.049
  415    HG   LEU  55           HG       LEU  55  -1.207   3.386   4.418
  416   1HD1  LEU  55          1HD1      LEU  55  -0.254   4.606   1.910
  417   2HD1  LEU  55          2HD1      LEU  55  -1.991   4.150   1.997
  418   3HD1  LEU  55          3HD1      LEU  55  -1.310   5.288   3.158
  419   1HD2  LEU  55          1HD2      LEU  55  -0.764   1.121   3.506
  420   2HD2  LEU  55          2HD2      LEU  55  -2.168   1.864   2.718
  421   3HD2  LEU  55          3HD2      LEU  55  -0.597   1.821   1.875
  422    H    LYS  56           H        LYS  56  -0.418   5.851   5.221
  423    HA   LYS  56           HA       LYS  56  -0.575   7.970   3.576
  424   1HB   LYS  56          2HB       LYS  56  -1.579   7.437   6.048
  425   2HB   LYS  56          3HB       LYS  56  -0.427   8.680   6.508
  426   1HG   LYS  56          2HG       LYS  56  -1.451  10.162   4.745
  427   2HG   LYS  56          3HG       LYS  56  -2.651   8.887   4.444
  428   1HD   LYS  56          2HD       LYS  56  -2.381   9.682   7.314
  429   2HD   LYS  56          3HD       LYS  56  -2.897  10.978   6.241
  430   1HE   LYS  56          2HE       LYS  56  -4.907   9.962   7.012
  431   2HE   LYS  56          3HE       LYS  56  -4.721   9.524   5.314
  432   1HZ   LYS  56          1HZ       LYS  56  -3.805   7.339   6.160
  433   2HZ   LYS  56          2HZ       LYS  56  -4.218   7.843   7.670
  434   3HZ   LYS  56          3HZ       LYS  56  -5.376   7.633   6.542
  435    H    LYS  57           H        LYS  57   1.920   7.535   6.075
  436    HA   LYS  57           HA       LYS  57   3.014  10.140   6.036
  437   1HB   LYS  57          2HB       LYS  57   4.188   7.449   6.763
  438   2HB   LYS  57          3HB       LYS  57   4.990   9.003   7.109
  439   1HG   LYS  57          2HG       LYS  57   2.919   9.683   8.389
  440   2HG   LYS  57          3HG       LYS  57   2.287   8.047   8.156
  441   1HD   LYS  57          2HD       LYS  57   4.869   8.779   9.611
  442   2HD   LYS  57          3HD       LYS  57   3.318   8.373  10.368
  443   1HE   LYS  57          2HE       LYS  57   3.419   6.117   9.194
  444   2HE   LYS  57          3HE       LYS  57   5.064   6.512   8.675
  445   1HZ   LYS  57          1HZ       LYS  57   5.050   5.195  10.659
  446   2HZ   LYS  57          2HZ       LYS  57   5.675   6.678  10.998
  447   3HZ   LYS  57          3HZ       LYS  57   4.141   6.298  11.466
  448    H    THR  58           H        THR  58   3.359   7.649   3.588
  449    HA   THR  58           HA       THR  58   5.883   8.565   2.524
  450    HB   THR  58           HB       THR  58   5.146   7.513   0.433
  451    HG1  THR  58           1HG      THR  58   2.747   6.851   1.800
  452   1HG2  THR  58          1HG2      THR  58   4.594   5.872   2.918
  453   2HG2  THR  58          2HG2      THR  58   4.921   5.218   1.294
  454   3HG2  THR  58          3HG2      THR  58   6.175   6.139   2.157
  455    H    GLY  59           H        GLY  59   2.568   9.788   2.351
  456   1HA   GLY  59          2HA       GLY  59   1.663  11.605   1.365
  457   2HA   GLY  59          3HA       GLY  59   3.292  12.315   1.389
  458    H    LYS  60           H        LYS  60   2.111   9.429  -0.397
  459    HA   LYS  60           HA       LYS  60   2.375  10.910  -2.989
  460   1HB   LYS  60          2HB       LYS  60   2.409   7.899  -2.657
  461   2HB   LYS  60          3HB       LYS  60   2.810   8.835  -4.083
  462   1HG   LYS  60          2HG       LYS  60   4.416   8.238  -1.619
  463   2HG   LYS  60          3HG       LYS  60   4.844   8.010  -3.303
  464   1HD   LYS  60          2HD       LYS  60   4.979  10.485  -1.593
  465   2HD   LYS  60          3HD       LYS  60   6.268   9.698  -2.447
  466   1HE   LYS  60          2HE       LYS  60   5.940  10.912  -4.345
  467   2HE   LYS  60          3HE       LYS  60   4.196  10.712  -4.312
  468   1HZ   LYS  60          1HZ       LYS  60   4.129  12.415  -2.548
  469   2HZ   LYS  60          2HZ       LYS  60   5.736  12.664  -2.734
  470   3HZ   LYS  60          3HZ       LYS  60   4.713  12.991  -3.982
  471    H    THR  61           H        THR  61   0.796   9.772  -4.667
  472    HA   THR  61           HA       THR  61  -1.836  10.080  -3.785
  473    HB   THR  61           HB       THR  61  -0.990   8.617  -6.298
  474    HG1  THR  61           1HG      THR  61  -0.608  11.393  -5.970
  475   1HG2  THR  61          1HG2      THR  61  -2.589  10.164  -7.359
  476   2HG2  THR  61          2HG2      THR  61  -3.375   9.284  -6.035
  477   3HG2  THR  61          3HG2      THR  61  -2.872  10.973  -5.801
  478    H    VAL  62           H        VAL  62  -0.622   7.990  -2.154
  479    HA   VAL  62           HA       VAL  62  -1.591   5.402  -3.125
  480    HB   VAL  62           HB       VAL  62   0.480   5.371  -2.041
  481   1HG1  VAL  62          1HG1      VAL  62   0.881   5.898   0.296
  482   2HG1  VAL  62          2HG1      VAL  62   0.431   7.345  -0.592
  483   3HG1  VAL  62          3HG1      VAL  62  -0.748   6.563   0.477
  484   1HG2  VAL  62          1HG2      VAL  62  -1.016   3.448  -1.728
  485   2HG2  VAL  62          2HG2      VAL  62   0.066   3.658  -0.345
  486   3HG2  VAL  62          3HG2      VAL  62  -1.637   4.152  -0.235
  487    H    SER  63           H        SER  63  -3.725   5.605  -3.363
  488    HA   SER  63           HA       SER  63  -5.429   6.796  -1.225
  489   1HB   SER  63          2HB       SER  63  -6.973   6.896  -3.389
  490   2HB   SER  63          3HB       SER  63  -5.724   8.118  -3.102
  491    HG   SER  63           HG       SER  63  -4.335   7.015  -4.514
  492    H    TYR  64           H        TYR  64  -7.368   5.660  -0.691
  493    HA   TYR  64           HA       TYR  64  -7.012   2.719  -0.866
  494   1HB   TYR  64          2HB       TYR  64  -6.957   3.576   1.343
  495   2HB   TYR  64          3HB       TYR  64  -8.318   4.655   1.053
  496    HD1  TYR  64           HD1      TYR  64  -7.497   0.980   1.060
  497    HD2  TYR  64           HD2      TYR  64 -10.507   4.019   1.608
  498    HE1  TYR  64           HE1      TYR  64  -9.122  -0.741   1.725
  499    HE2  TYR  64           HE2      TYR  64 -12.167   2.278   2.155
  500    HH   TYR  64           HH       TYR  64 -12.549   0.030   2.442
  501    H    LEU  65           H        LEU  65  -8.435   1.440  -2.004
  502    HA   LEU  65           HA       LEU  65 -11.251   2.106  -2.105
  503   1HB   LEU  65          2HB       LEU  65 -11.163   1.676  -4.677
  504   2HB   LEU  65          3HB       LEU  65 -11.066   3.286  -3.979
  505    HG   LEU  65           HG       LEU  65  -9.603   2.909  -5.849
  506   1HD1  LEU  65          1HD1      LEU  65  -7.712   3.476  -3.689
  507   2HD1  LEU  65          2HD1      LEU  65  -7.942   4.247  -5.256
  508   3HD1  LEU  65          3HD1      LEU  65  -9.100   4.559  -3.970
  509   1HD2  LEU  65          1HD2      LEU  65  -8.027   0.950  -4.227
  510   2HD2  LEU  65          2HD2      LEU  65  -9.015   0.616  -5.664
  511   3HD2  LEU  65          3HD2      LEU  65  -7.578   1.629  -5.802
  512    H    GLY  66           H        GLY  66 -11.113   0.090  -0.786
  513   1HA   GLY  66          2HA       GLY  66 -12.537  -1.794  -2.053
  514   2HA   GLY  66          3HA       GLY  66 -10.908  -2.396  -2.389
  515    H    LEU  67           H        LEU  67 -13.213  -3.404  -0.655
  516    HA   LEU  67           HA       LEU  67 -11.446  -4.431   1.386
  517   1HB   LEU  67          2HB       LEU  67 -12.939  -4.221   3.210
  518   2HB   LEU  67          3HB       LEU  67 -12.579  -2.604   2.617
  519    HG   LEU  67           HG       LEU  67 -15.166  -4.166   2.179
  520   1HD1  LEU  67          1HD1      LEU  67 -14.793  -3.412   4.496
  521   2HD1  LEU  67          2HD1      LEU  67 -14.531  -1.751   3.921
  522   3HD1  LEU  67          3HD1      LEU  67 -16.121  -2.523   3.733
  523   1HD2  LEU  67          1HD2      LEU  67 -16.057  -1.912   1.422
  524   2HD2  LEU  67          2HD2      LEU  67 -14.380  -1.339   1.325
  525   3HD2  LEU  67          3HD2      LEU  67 -14.951  -2.664   0.280
  526    H    GLU  68           H        GLU  68 -11.703  -6.638   1.479
  527    HA   GLU  68           HA       GLU  68 -14.033  -7.949   0.252
  528   1HB   GLU  68          2HB       GLU  68 -11.062  -7.770  -0.326
  529   2HB   GLU  68          3HB       GLU  68 -11.904  -9.265  -0.623
  530   1HG   GLU  68          2HG       GLU  68 -13.238  -8.235  -2.372
  531   2HG   GLU  68          3HG       GLU  68 -12.857  -6.604  -1.794
  Start of MODEL    2
    1   1H    MET   1           H1       MET   1  -8.056  -8.986   7.617
    2   2H    MET   1           H2       MET   1  -7.305  -9.978   8.686
    3   3H    MET   1           H3       MET   1  -6.507  -9.472   7.335
    4    HA   MET   1           HA       MET   1  -7.054 -11.661   7.044
    5   1HB   MET   1          2HB       MET   1  -8.721 -11.848   8.783
    6   2HB   MET   1          3HB       MET   1  -9.931 -11.031   7.817
    7   1HG   MET   1          2HG       MET   1  -9.764 -12.862   6.118
    8   2HG   MET   1          3HG       MET   1  -8.502 -13.626   7.103
    9   1HE   MET   1          1HE       MET   1  -9.753 -15.913   7.047
   10   2HE   MET   1          2HE       MET   1 -11.469 -16.110   7.474
   11   3HE   MET   1          3HE       MET   1 -11.017 -15.180   6.026
   12    HA   PRO   2           HA       PRO   2  -9.491 -10.496   3.119
   13   1HB   PRO   2          2HB       PRO   2 -10.819  -8.130   2.888
   14   2HB   PRO   2          3HB       PRO   2 -11.580  -9.571   3.624
   15   1HG   PRO   2          2HG       PRO   2 -10.184  -7.309   5.093
   16   2HG   PRO   2          3HG       PRO   2 -11.842  -7.932   5.371
   17   1HD   PRO   2          2HD       PRO   2  -9.847  -8.844   6.877
   18   2HD   PRO   2          3HD       PRO   2 -11.012 -10.008   6.183
   19    H    LYS   3           H        LYS   3  -8.856  -9.068   1.301
   20    HA   LYS   3           HA       LYS   3  -6.487  -7.450   1.908
   21   1HB   LYS   3          2HB       LYS   3  -5.877  -7.490  -0.288
   22   2HB   LYS   3          3HB       LYS   3  -6.653  -9.065  -0.035
   23   1HG   LYS   3          2HG       LYS   3  -8.798  -7.878  -0.811
   24   2HG   LYS   3          3HG       LYS   3  -7.775  -6.545  -1.306
   25   1HD   LYS   3          2HD       LYS   3  -8.466  -8.171  -3.172
   26   2HD   LYS   3          3HD       LYS   3  -6.767  -7.768  -3.063
   27   1HE   LYS   3          2HE       LYS   3  -7.125 -10.169  -3.478
   28   2HE   LYS   3          3HE       LYS   3  -6.203  -9.849  -2.022
   29   1HZ   LYS   3          1HZ       LYS   3  -8.890 -10.931  -2.325
   30   2HZ   LYS   3          2HZ       LYS   3  -7.662 -11.344  -1.249
   31   3HZ   LYS   3          3HZ       LYS   3  -8.643 -10.073  -0.950
   32    H    HIS   4           H        HIS   4  -6.264  -5.319   1.523
   33    HA   HIS   4           HA       HIS   4  -8.753  -3.683   1.215
   34   1HB   HIS   4          2HB       HIS   4  -6.071  -2.953   2.456
   35   2HB   HIS   4          3HB       HIS   4  -7.588  -2.063   2.590
   36    HD1  HIS   4           1HD      HIS   4  -5.765  -5.168   3.930
   37    HD2  HIS   4           2HD      HIS   4  -9.440  -3.182   4.305
   38    HE1  HIS   4           1HE      HIS   4  -6.892  -6.116   6.018
   39    H    GLU   5           H        GLU   5  -8.817  -2.675  -0.867
   40    HA   GLU   5           HA       GLU   5  -6.325  -2.762  -2.476
   41   1HB   GLU   5          2HB       GLU   5  -9.222  -2.192  -3.201
   42   2HB   GLU   5          3HB       GLU   5  -7.840  -1.896  -4.258
   43   1HG   GLU   5          2HG       GLU   5  -7.258  -4.422  -3.725
   44   2HG   GLU   5          3HG       GLU   5  -9.011  -4.513  -3.448
   45    H    PHE   6           H        PHE   6  -5.366  -0.979  -3.360
   46    HA   PHE   6           HA       PHE   6  -6.441   1.682  -2.708
   47   1HB   PHE   6          2HB       PHE   6  -3.574   0.681  -2.245
   48   2HB   PHE   6          3HB       PHE   6  -3.999   2.378  -2.249
   49    HD1  PHE   6           1HD      PHE   6  -4.706  -0.854  -0.451
   50    HD2  PHE   6           2HD      PHE   6  -4.451   3.442  -0.194
   51    HE1  PHE   6           1HE      PHE   6  -5.107  -0.968   1.983
   52    HE2  PHE   6           2HE      PHE   6  -4.822   3.317   2.236
   53    HZ   PHE   6           HZ       PHE   6  -5.191   1.114   3.342
   54    H    SER   7           H        SER   7  -6.026   3.204  -4.264
   55    HA   SER   7           HA       SER   7  -4.563   2.343  -6.729
   56   1HB   SER   7          2HB       SER   7  -6.857   3.414  -6.982
   57   2HB   SER   7          3HB       SER   7  -6.120   4.922  -6.383
   58    HG   SER   7           HG       SER   7  -4.599   4.654  -8.175
   59    H    VAL   8           H        VAL   8  -2.689   3.506  -7.310
   60    HA   VAL   8           HA       VAL   8  -1.428   5.176  -5.190
   61    HB   VAL   8           HB       VAL   8  -0.337   2.807  -6.818
   62   1HG1  VAL   8          1HG1      VAL   8   1.492   4.222  -6.287
   63   2HG1  VAL   8          2HG1      VAL   8   0.903   4.520  -4.630
   64   3HG1  VAL   8          3HG1      VAL   8   1.537   2.927  -5.106
   65   1HG2  VAL   8          1HG2      VAL   8  -0.257   1.680  -4.546
   66   2HG2  VAL   8          2HG2      VAL   8  -1.263   2.996  -3.924
   67   3HG2  VAL   8          3HG2      VAL   8  -1.882   1.905  -5.183
   68    H    ASP   9           H        ASP   9   0.527   6.384  -6.158
   69    HA   ASP   9           HA       ASP   9   0.565   6.304  -9.106
   70   1HB   ASP   9          2HB       ASP   9   0.116   8.609  -8.524
   71   2HB   ASP   9          3HB       ASP   9   1.468   8.627  -7.375
   72    H    MET  10           H        MET  10   2.353   5.435  -9.849
   73    HA   MET  10           HA       MET  10   4.825   5.384  -8.186
   74   1HB   MET  10          2HB       MET  10   4.002   3.311 -10.262
   75   2HB   MET  10          3HB       MET  10   5.568   3.439  -9.441
   76   1HG   MET  10          2HG       MET  10   3.803   3.540  -7.308
   77   2HG   MET  10          3HG       MET  10   2.971   2.440  -8.403
   78   1HE   MET  10          1HE       MET  10   4.562   0.340  -5.478
   79   2HE   MET  10          2HE       MET  10   3.994   2.022  -5.406
   80   3HE   MET  10          3HE       MET  10   3.055   0.811  -6.308
   81    H    THR  11           H        THR  11   5.541   7.352  -8.818
   82    HA   THR  11           HA       THR  11   5.383   8.282 -11.468
   83    HB   THR  11           HB       THR  11   7.429   9.447  -9.628
   84    HG1  THR  11           1HG      THR  11   4.706   9.345  -8.815
   85   1HG2  THR  11          1HG2      THR  11   4.861  10.574 -10.832
   86   2HG2  THR  11          2HG2      THR  11   6.144  11.502 -10.030
   87   3HG2  THR  11          3HG2      THR  11   6.478  10.676 -11.567
   88    H    CYS  12           H        CYS  12   7.760   6.407  -9.691
   89    HA   CYS  12           HA       CYS  12   9.215   5.811 -12.156
   90   1HB   CYS  12          2HB       CYS  12  10.627   7.580 -11.117
   91   2HB   CYS  12          3HB       CYS  12  10.548   6.735  -9.554
   92    HG   CYS  12           HG       CYS  12  11.808   5.702 -12.421
   93    H    GLY  13           H        GLY  13  10.080   3.598 -11.899
   94   1HA   GLY  13          2HA       GLY  13   8.526   1.755 -10.493
   95   2HA   GLY  13          3HA       GLY  13  10.186   1.470 -11.046
   96    H    GLY  14           H        GLY  14  11.495   3.426  -9.485
   97   1HA   GLY  14          2HA       GLY  14  12.150   2.198  -7.087
   98   2HA   GLY  14          3HA       GLY  14  12.362   3.922  -7.434
   99    H    CYS  15           H        CYS  15   9.270   4.132  -7.700
  100    HA   CYS  15           HA       CYS  15   8.547   5.033  -5.128
  101   1HB   CYS  15          2HB       CYS  15   7.311   5.571  -7.166
  102   2HB   CYS  15          3HB       CYS  15   6.779   3.875  -7.291
  103    HG   CYS  15           HG       CYS  15   5.833   3.954  -4.677
  104    H    ALA  16           H        ALA  16   8.482   1.777  -6.598
  105    HA   ALA  16           HA       ALA  16   6.950   0.320  -4.791
  106   1HB   ALA  16          1HB       ALA  16   9.588  -0.464  -6.101
  107   2HB   ALA  16          2HB       ALA  16   8.395  -1.580  -5.404
  108   3HB   ALA  16          3HB       ALA  16   7.972  -0.612  -6.828
  109    H    GLU  17           H        GLU  17  10.354   1.534  -4.364
  110    HA   GLU  17           HA       GLU  17  10.819   0.151  -1.907
  111   1HB   GLU  17          2HB       GLU  17  11.956   2.704  -3.110
  112   2HB   GLU  17          3HB       GLU  17  12.507   2.017  -1.596
  113   1HG   GLU  17          2HG       GLU  17  12.326  -0.031  -3.755
  114   2HG   GLU  17          3HG       GLU  17  13.420   1.296  -4.119
  115    H    ALA  18           H        ALA  18   9.196   3.274  -2.616
  116    HA   ALA  18           HA       ALA  18   9.239   4.220   0.105
  117   1HB   ALA  18          1HB       ALA  18   7.475   5.748  -0.610
  118   2HB   ALA  18          2HB       ALA  18   8.736   5.665  -1.860
  119   3HB   ALA  18          3HB       ALA  18   7.198   4.814  -2.092
  120    H    VAL  19           H        VAL  19   6.862   2.413  -1.830
  121    HA   VAL  19           HA       VAL  19   4.951   2.116   0.278
  122    HB   VAL  19           HB       VAL  19   5.229   0.337  -2.194
  123   1HG1  VAL  19          1HG1      VAL  19   2.808   0.126  -1.923
  124   2HG1  VAL  19          2HG1      VAL  19   3.669  -0.413  -0.479
  125   3HG1  VAL  19          3HG1      VAL  19   2.849   1.159  -0.467
  126   1HG2  VAL  19          1HG2      VAL  19   3.541   1.991  -3.156
  127   2HG2  VAL  19          2HG2      VAL  19   3.915   3.084  -1.815
  128   3HG2  VAL  19          3HG2      VAL  19   5.168   2.662  -3.001
  129    H    SER  20           H        SER  20   7.488  -0.083  -0.999
  130    HA   SER  20           HA       SER  20   6.874  -2.242   0.777
  131   1HB   SER  20          2HB       SER  20   8.211  -2.445  -1.338
  132   2HB   SER  20          3HB       SER  20   9.530  -1.530  -0.579
  133    HG   SER  20           HG       SER  20   9.821  -3.807  -0.424
  134    H    ARG  21           H        ARG  21   9.323   0.380   1.100
  135    HA   ARG  21           HA       ARG  21  10.270  -0.604   3.587
  136   1HB   ARG  21          2HB       ARG  21  10.386   2.179   2.392
  137   2HB   ARG  21          3HB       ARG  21  11.221   1.679   3.873
  138   1HG   ARG  21          2HG       ARG  21  12.427  -0.099   2.656
  139   2HG   ARG  21          3HG       ARG  21  11.606   0.319   1.157
  140   1HD   ARG  21          2HD       ARG  21  12.604   2.637   1.337
  141   2HD   ARG  21          3HD       ARG  21  13.534   2.036   2.733
  142    HE   ARG  21           HE       ARG  21  13.706   0.537   0.143
  143   1HH1  ARG  21          2HH2      ARG  21  15.294   2.903   2.242
  144   2HH1  ARG  21          1HH2      ARG  21  16.841   2.755   1.467
  145   1HH2  ARG  21          2HH1      ARG  21  15.678   0.522  -1.027
  146   2HH2  ARG  21          1HH1      ARG  21  17.082   1.293  -0.378
  147    H    VAL  22           H        VAL  22   7.623   1.888   2.923
  148    HA   VAL  22           HA       VAL  22   7.182   2.260   5.665
  149    HB   VAL  22           HB       VAL  22   6.404   3.619   3.569
  150   1HG1  VAL  22          1HG1      VAL  22   4.865   1.910   2.646
  151   2HG1  VAL  22          2HG1      VAL  22   3.883   1.997   4.130
  152   3HG1  VAL  22          3HG1      VAL  22   4.026   3.390   3.046
  153   1HG2  VAL  22          1HG2      VAL  22   6.210   4.332   5.836
  154   2HG2  VAL  22          2HG2      VAL  22   4.701   4.696   4.965
  155   3HG2  VAL  22          3HG2      VAL  22   4.766   3.308   6.083
  156    H    LEU  23           H        LEU  23   5.497  -0.147   3.414
  157    HA   LEU  23           HA       LEU  23   3.939  -1.095   5.605
  158   1HB   LEU  23          2HB       LEU  23   4.626  -2.219   2.889
  159   2HB   LEU  23          3HB       LEU  23   3.841  -3.215   4.086
  160    HG   LEU  23           HG       LEU  23   2.081  -2.514   2.936
  161   1HD1  LEU  23          1HD1      LEU  23   1.717  -1.893   5.394
  162   2HD1  LEU  23          2HD1      LEU  23   2.034  -0.209   4.921
  163   3HD1  LEU  23          3HD1      LEU  23   0.672  -1.088   4.224
  164   1HD2  LEU  23          1HD2      LEU  23   3.155   0.281   2.709
  165   2HD2  LEU  23          2HD2      LEU  23   3.134  -1.015   1.484
  166   3HD2  LEU  23          3HD2      LEU  23   1.607  -0.301   2.058
  167    H    ASN  24           H        ASN  24   7.147  -2.132   4.433
  168    HA   ASN  24           HA       ASN  24   7.538  -4.292   6.228
  169   1HB   ASN  24          2HB       ASN  24   9.131  -4.011   4.506
  170   2HB   ASN  24          3HB       ASN  24   9.349  -2.298   4.863
  171   1HD2  ASN  24          1HD2      ASN  24  10.440  -1.613   6.712
  172   2HD2  ASN  24          2HD2      ASN  24  11.690  -2.640   7.435
  173    H    LYS  25           H        LYS  25   7.968  -0.744   6.696
  174    HA   LYS  25           HA       LYS  25   8.923  -0.934   9.378
  175   1HB   LYS  25          2HB       LYS  25   7.553   1.219   7.744
  176   2HB   LYS  25          3HB       LYS  25   7.765   1.455   9.461
  177   1HG   LYS  25          2HG       LYS  25  10.056   0.731   7.580
  178   2HG   LYS  25          3HG       LYS  25   9.561   2.396   7.911
  179   1HD   LYS  25          2HD       LYS  25   9.975   2.064  10.335
  180   2HD   LYS  25          3HD       LYS  25  10.521   0.406  10.026
  181   1HE   LYS  25          2HE       LYS  25  12.332   1.281   8.543
  182   2HE   LYS  25          3HE       LYS  25  11.815   2.937   8.903
  183   1HZ   LYS  25          1HZ       LYS  25  12.347   2.529  11.215
  184   2HZ   LYS  25          2HZ       LYS  25  12.826   0.991  10.876
  185   3HZ   LYS  25          3HZ       LYS  25  13.659   2.265  10.263
  186    H    LEU  26           H        LEU  26   5.592  -0.833   8.090
  187    HA   LEU  26           HA       LEU  26   4.309  -0.831  10.621
  188   1HB   LEU  26          2HB       LEU  26   3.414  -0.654   8.182
  189   2HB   LEU  26          3HB       LEU  26   3.230  -2.365   8.218
  190    HG   LEU  26           HG       LEU  26   1.225  -0.774   8.775
  191   1HD1  LEU  26          1HD1      LEU  26   0.141  -2.503  10.057
  192   2HD1  LEU  26          2HD1      LEU  26   1.106  -3.216   8.753
  193   3HD1  LEU  26          3HD1      LEU  26   1.705  -3.271  10.426
  194   1HD2  LEU  26          1HD2      LEU  26   2.363   0.390  10.718
  195   2HD2  LEU  26          2HD2      LEU  26   0.791  -0.328  11.085
  196   3HD2  LEU  26          3HD2      LEU  26   2.269  -1.145  11.608
  197    H    GLY  27           H        GLY  27   5.312  -3.511   8.492
  198   1HA   GLY  27          2HA       GLY  27   6.838  -4.977   9.802
  199   2HA   GLY  27          3HA       GLY  27   5.490  -5.189  10.908
  200    H    GLY  28           H        GLY  28   3.821  -6.636  10.388
  201   1HA   GLY  28          2HA       GLY  28   4.778  -8.978   9.172
  202   2HA   GLY  28          3HA       GLY  28   3.092  -8.687   9.640
  203    H    VAL  29           H        VAL  29   2.212  -6.815   8.142
  204    HA   VAL  29           HA       VAL  29   1.026  -7.385   5.989
  205    HB   VAL  29           HB       VAL  29   1.072  -5.141   6.718
  206   1HG1  VAL  29          1HG1      VAL  29   3.926  -4.876   5.702
  207   2HG1  VAL  29          2HG1      VAL  29   2.877  -3.577   6.283
  208   3HG1  VAL  29          3HG1      VAL  29   3.385  -4.850   7.386
  209   1HG2  VAL  29          1HG2      VAL  29   2.071  -5.058   3.856
  210   2HG2  VAL  29          2HG2      VAL  29   0.465  -5.648   4.336
  211   3HG2  VAL  29          3HG2      VAL  29   0.928  -3.970   4.664
  212    H    LYS  30           H        LYS  30   1.220  -8.510   4.185
  213    HA   LYS  30           HA       LYS  30   3.483  -7.913   2.389
  214   1HB   LYS  30          2HB       LYS  30   2.023 -10.566   2.690
  215   2HB   LYS  30          3HB       LYS  30   3.056 -10.143   1.321
  216   1HG   LYS  30          2HG       LYS  30   3.978 -10.330   4.233
  217   2HG   LYS  30          3HG       LYS  30   4.137 -11.569   3.006
  218   1HD   LYS  30          2HD       LYS  30   6.192 -10.755   2.705
  219   2HD   LYS  30          3HD       LYS  30   5.374  -9.673   1.588
  220   1HE   LYS  30          2HE       LYS  30   7.152  -8.698   3.121
  221   2HE   LYS  30          3HE       LYS  30   5.650  -7.804   3.021
  222   1HZ   LYS  30          1HZ       LYS  30   6.562  -8.073   5.283
  223   2HZ   LYS  30          2HZ       LYS  30   5.028  -8.552   5.158
  224   3HZ   LYS  30          3HZ       LYS  30   6.224  -9.685   5.239
  225    H    TYR  31           H        TYR  31   2.670  -7.626   0.195
  226    HA   TYR  31           HA       TYR  31  -0.192  -7.218  -0.077
  227   1HB   TYR  31          2HB       TYR  31  -0.085  -4.828  -0.149
  228   2HB   TYR  31          3HB       TYR  31   0.586  -5.359   1.384
  229    HD1  TYR  31           HD1      TYR  31   1.066  -3.372  -1.520
  230    HD2  TYR  31           HD2      TYR  31   3.209  -5.439   1.596
  231    HE1  TYR  31           HE1      TYR  31   3.072  -2.087  -2.051
  232    HE2  TYR  31           HE2      TYR  31   5.289  -4.262   0.924
  233    HH   TYR  31           HH       TYR  31   5.340  -2.149  -1.976
  234    H    ASP  32           H        ASP  32  -0.729  -6.717  -2.226
  235    HA   ASP  32           HA       ASP  32   1.216  -7.550  -4.250
  236   1HB   ASP  32          2HB       ASP  32  -1.321  -8.192  -4.261
  237   2HB   ASP  32          3HB       ASP  32  -1.622  -6.505  -4.672
  238    H    ILE  33           H        ILE  33   1.567  -6.164  -6.088
  239    HA   ILE  33           HA       ILE  33   1.238  -3.252  -5.806
  240    HB   ILE  33           HB       ILE  33   4.024  -4.425  -6.169
  241   1HG1  ILE  33          2HG1      ILE  33   4.133  -2.703  -4.004
  242   2HG1  ILE  33          3HG1      ILE  33   2.591  -3.501  -3.758
  243   1HG2  ILE  33          1HG2      ILE  33   3.036  -1.555  -5.974
  244   2HG2  ILE  33          2HG2      ILE  33   4.738  -2.061  -6.124
  245   3HG2  ILE  33          3HG2      ILE  33   3.616  -2.330  -7.458
  246   1HD1  ILE  33          1HD1      ILE  33   3.798  -5.736  -3.962
  247   2HD1  ILE  33          2HD1      ILE  33   5.322  -4.821  -4.087
  248   3HD1  ILE  33          3HD1      ILE  33   4.365  -4.758  -2.608
  249    H    ASP  34           H        ASP  34  -0.031  -3.268  -7.602
  250    HA   ASP  34           HA       ASP  34   1.046  -4.343 -10.166
  251   1HB   ASP  34          2HB       ASP  34  -1.350  -4.672  -9.701
  252   2HB   ASP  34          3HB       ASP  34  -1.562  -2.915  -9.589
  253    H    LEU  35           H        LEU  35   2.652  -3.044 -10.891
  254    HA   LEU  35           HA       LEU  35   2.658  -0.163 -10.418
  255   1HB   LEU  35          2HB       LEU  35   4.507  -1.909 -12.090
  256   2HB   LEU  35          3HB       LEU  35   4.596  -0.153 -11.959
  257    HG   LEU  35           HG       LEU  35   4.522  -0.753  -9.315
  258   1HD1  LEU  35          1HD1      LEU  35   6.015  -2.648  -8.870
  259   2HD1  LEU  35          2HD1      LEU  35   4.564  -3.208  -9.716
  260   3HD1  LEU  35          3HD1      LEU  35   6.093  -3.028 -10.602
  261   1HD2  LEU  35          1HD2      LEU  35   6.128   0.735 -10.418
  262   2HD2  LEU  35          2HD2      LEU  35   6.963  -0.386  -9.331
  263   3HD2  LEU  35          3HD2      LEU  35   6.995  -0.666 -11.086
  264    HA   PRO  36           HA       PRO  36   1.868   0.135 -15.145
  265   1HB   PRO  36          2HB       PRO  36   0.171  -1.823 -16.250
  266   2HB   PRO  36          3HB       PRO  36   1.936  -1.692 -16.466
  267   1HG   PRO  36          2HG       PRO  36   0.417  -3.401 -14.512
  268   2HG   PRO  36          3HG       PRO  36   1.848  -3.842 -15.480
  269   1HD   PRO  36          2HD       PRO  36   2.080  -3.219 -12.902
  270   2HD   PRO  36          3HD       PRO  36   3.295  -2.597 -14.050
  271    H    ASN  37           H        ASN  37  -0.719  -1.566 -13.270
  272    HA   ASN  37           HA       ASN  37  -2.700   0.472 -14.124
  273   1HB   ASN  37          2HB       ASN  37  -3.022  -1.919 -12.283
  274   2HB   ASN  37          3HB       ASN  37  -4.301  -0.874 -12.872
  275   1HD2  ASN  37          1HD2      ASN  37  -2.499  -3.720 -13.560
  276   2HD2  ASN  37          2HD2      ASN  37  -3.004  -3.906 -15.242
  277    H    LYS  38           H        LYS  38  -0.279   0.328 -11.769
  278    HA   LYS  38           HA       LYS  38   0.135   1.408  -9.863
  279   1HB   LYS  38          2HB       LYS  38  -1.760   3.472 -11.070
  280   2HB   LYS  38          3HB       LYS  38  -0.562   3.718  -9.782
  281   1HG   LYS  38          2HG       LYS  38   1.219   2.933 -11.283
  282   2HG   LYS  38          3HG       LYS  38   0.078   2.828 -12.634
  283   1HD   LYS  38          2HD       LYS  38  -0.223   5.198 -12.718
  284   2HD   LYS  38          3HD       LYS  38   0.471   5.417 -11.108
  285   1HE   LYS  38          2HE       LYS  38   2.655   4.423 -12.042
  286   2HE   LYS  38          3HE       LYS  38   1.970   4.609 -13.654
  287   1HZ   LYS  38          1HZ       LYS  38   2.095   6.909 -11.804
  288   2HZ   LYS  38          2HZ       LYS  38   3.449   6.377 -12.517
  289   3HZ   LYS  38          3HZ       LYS  38   2.167   6.912 -13.445
  290    H    LYS  39           H        LYS  39  -1.226  -0.559  -9.111
  291    HA   LYS  39           HA       LYS  39  -3.124   0.502  -7.085
  292   1HB   LYS  39          2HB       LYS  39  -3.471  -2.092  -8.647
  293   2HB   LYS  39          3HB       LYS  39  -4.371  -1.645  -7.203
  294   1HG   LYS  39          2HG       LYS  39  -5.228   0.406  -8.472
  295   2HG   LYS  39          3HG       LYS  39  -4.443  -0.272  -9.905
  296   1HD   LYS  39          2HD       LYS  39  -6.639  -1.104 -10.090
  297   2HD   LYS  39          3HD       LYS  39  -5.735  -2.455  -9.390
  298   1HE   LYS  39          2HE       LYS  39  -6.567  -1.432  -7.060
  299   2HE   LYS  39          3HE       LYS  39  -7.721  -0.558  -8.068
  300   1HZ   LYS  39          1HZ       LYS  39  -8.714  -2.562  -7.304
  301   2HZ   LYS  39          2HZ       LYS  39  -8.372  -2.876  -8.892
  302   3HZ   LYS  39          3HZ       LYS  39  -7.472  -3.462  -7.613
  303    H    VAL  40           H        VAL  40  -3.087  -0.627  -5.086
  304    HA   VAL  40           HA       VAL  40  -1.045  -2.726  -4.710
  305    HB   VAL  40           HB       VAL  40  -1.644  -0.117  -3.321
  306   1HG1  VAL  40          1HG1      VAL  40  -0.698  -0.950  -1.175
  307   2HG1  VAL  40          2HG1      VAL  40  -2.346  -1.473  -1.569
  308   3HG1  VAL  40          3HG1      VAL  40  -0.990  -2.610  -1.760
  309   1HG2  VAL  40          1HG2      VAL  40   0.339  -0.551  -4.714
  310   2HG2  VAL  40          2HG2      VAL  40   0.743  -0.079  -3.046
  311   3HG2  VAL  40          3HG2      VAL  40   0.879  -1.782  -3.550
  312    H    CYS  41           H        CYS  41  -1.830  -4.418  -3.394
  313    HA   CYS  41           HA       CYS  41  -4.549  -4.107  -2.215
  314   1HB   CYS  41          2HB       CYS  41  -5.473  -5.872  -3.161
  315   2HB   CYS  41          3HB       CYS  41  -4.227  -5.845  -4.376
  316    HG   CYS  41           HG       CYS  41  -2.629  -7.450  -2.936
  317    H    ILE  42           H        ILE  42  -4.452  -4.409  -0.040
  318    HA   ILE  42           HA       ILE  42  -1.950  -5.671   1.036
  319    HB   ILE  42           HB       ILE  42  -3.734  -3.827   2.509
  320   1HG1  ILE  42          2HG1      ILE  42  -1.433  -3.083   0.649
  321   2HG1  ILE  42          3HG1      ILE  42  -3.114  -2.528   0.553
  322   1HG2  ILE  42          1HG2      ILE  42  -1.742  -3.504   3.899
  323   2HG2  ILE  42          2HG2      ILE  42  -2.064  -5.230   3.734
  324   3HG2  ILE  42          3HG2      ILE  42  -0.781  -4.455   2.778
  325   1HD1  ILE  42          1HD1      ILE  42  -2.776  -1.372   2.777
  326   2HD1  ILE  42          2HD1      ILE  42  -1.039  -1.739   2.612
  327   3HD1  ILE  42          3HD1      ILE  42  -1.849  -0.734   1.400
  328    H    GLU  43           H        GLU  43  -2.436  -7.629   1.347
  329    HA   GLU  43           HA       GLU  43  -4.970  -8.588   2.619
  330   1HB   GLU  43          2HB       GLU  43  -4.329  -9.342   0.246
  331   2HB   GLU  43          3HB       GLU  43  -3.059 -10.298   1.005
  332   1HG   GLU  43          2HG       GLU  43  -4.729 -11.531   2.316
  333   2HG   GLU  43          3HG       GLU  43  -6.030 -10.479   1.744
  334    H    SER  44           H        SER  44  -4.443  -8.377   4.792
  335    HA   SER  44           HA       SER  44  -2.499 -10.209   5.873
  336   1HB   SER  44          2HB       SER  44  -1.027  -8.292   5.226
  337   2HB   SER  44          3HB       SER  44  -1.986  -7.241   6.290
  338    HG   SER  44           HG       SER  44  -0.200  -8.062   7.470
  339    H    GLU  45           H        GLU  45  -2.275  -9.558   8.306
  340    HA   GLU  45           HA       GLU  45  -5.008  -9.083   9.382
  341   1HB   GLU  45          2HB       GLU  45  -3.634 -11.378   9.759
  342   2HB   GLU  45          3HB       GLU  45  -2.916 -10.450  11.079
  343   1HG   GLU  45          2HG       GLU  45  -4.895 -11.751  11.813
  344   2HG   GLU  45          3HG       GLU  45  -5.239 -10.014  11.943
  345    H    HIS  46           H        HIS  46  -4.405  -6.904   8.794
  346    HA   HIS  46           HA       HIS  46  -3.717  -5.560  11.291
  347   1HB   HIS  46          2HB       HIS  46  -2.708  -4.550   8.603
  348   2HB   HIS  46          3HB       HIS  46  -2.482  -3.772  10.170
  349    HD1  HIS  46           1HD      HIS  46  -0.869  -5.487  11.922
  350    HD2  HIS  46           2HD      HIS  46  -0.736  -5.903   7.749
  351    HE1  HIS  46           1HE      HIS  46   1.345  -6.632  11.375
  352    H    SER  47           H        SER  47  -5.060  -3.602  11.407
  353    HA   SER  47           HA       SER  47  -7.517  -3.854   9.902
  354   1HB   SER  47          2HB       SER  47  -7.493  -2.988  12.212
  355   2HB   SER  47          3HB       SER  47  -6.553  -1.580  11.679
  356    HG   SER  47           HG       SER  47  -8.797  -1.141  11.749
  357    H    MET  48           H        MET  48  -8.311  -2.548   8.280
  358    HA   MET  48           HA       MET  48  -6.911  -1.417   6.231
  359   1HB   MET  48          2HB       MET  48  -9.397  -1.890   6.495
  360   2HB   MET  48          3HB       MET  48  -9.530  -0.420   7.467
  361   1HG   MET  48          2HG       MET  48  -8.481   0.799   5.463
  362   2HG   MET  48          3HG       MET  48  -8.755  -0.697   4.561
  363   1HE   MET  48          1HE       MET  48 -11.644  -1.587   5.871
  364   2HE   MET  48          2HE       MET  48 -12.726  -0.855   4.669
  365   3HE   MET  48          3HE       MET  48 -11.247  -1.682   4.134
  366    H    ASP  49           H        ASP  49  -8.156   0.186   9.166
  367    HA   ASP  49           HA       ASP  49  -7.308   2.835   8.769
  368   1HB   ASP  49          2HB       ASP  49  -8.686   2.584  10.650
  369   2HB   ASP  49          3HB       ASP  49  -7.955   1.046  11.121
  370    H    THR  50           H        THR  50  -5.729   0.422  10.707
  371    HA   THR  50           HA       THR  50  -3.510   1.889  11.334
  372    HB   THR  50           HB       THR  50  -3.617  -1.141  11.139
  373    HG1  THR  50           1HG      THR  50  -5.126   0.670  12.644
  374   1HG2  THR  50          1HG2      THR  50  -2.327   0.735  13.182
  375   2HG2  THR  50          2HG2      THR  50  -2.320  -1.040  13.248
  376   3HG2  THR  50          3HG2      THR  50  -1.454  -0.200  11.946
  377    H    LEU  51           H        LEU  51  -3.937  -0.372   8.598
  378    HA   LEU  51           HA       LEU  51  -1.296  -0.055   7.474
  379   1HB   LEU  51          2HB       LEU  51  -3.973  -0.512   6.089
  380   2HB   LEU  51          3HB       LEU  51  -2.380  -0.592   5.311
  381    HG   LEU  51           HG       LEU  51  -3.162  -2.299   7.729
  382   1HD1  LEU  51          1HD1      LEU  51  -4.823  -2.819   6.131
  383   2HD1  LEU  51          2HD1      LEU  51  -3.665  -2.860   4.798
  384   3HD1  LEU  51          3HD1      LEU  51  -3.635  -4.127   6.050
  385   1HD2  LEU  51          1HD2      LEU  51  -1.363  -3.809   6.702
  386   2HD2  LEU  51          2HD2      LEU  51  -0.936  -2.436   5.664
  387   3HD2  LEU  51          3HD2      LEU  51  -0.798  -2.296   7.420
  388    H    LEU  52           H        LEU  52  -4.416   1.566   6.534
  389    HA   LEU  52           HA       LEU  52  -3.541   3.303   4.690
  390   1HB   LEU  52          2HB       LEU  52  -5.812   2.715   5.556
  391   2HB   LEU  52          3HB       LEU  52  -5.622   3.863   6.858
  392    HG   LEU  52           HG       LEU  52  -5.278   4.748   3.968
  393   1HD1  LEU  52          1HD1      LEU  52  -7.283   3.351   4.090
  394   2HD1  LEU  52          2HD1      LEU  52  -7.847   4.237   5.515
  395   3HD1  LEU  52          3HD1      LEU  52  -7.760   5.062   3.931
  396   1HD2  LEU  52          1HD2      LEU  52  -4.753   6.378   5.743
  397   2HD2  LEU  52          2HD2      LEU  52  -6.251   6.843   4.916
  398   3HD2  LEU  52          3HD2      LEU  52  -6.321   6.068   6.516
  399    H    ALA  53           H        ALA  53  -3.879   4.129   8.167
  400    HA   ALA  53           HA       ALA  53  -2.783   6.705   8.012
  401   1HB   ALA  53          1HB       ALA  53  -2.787   4.745  10.359
  402   2HB   ALA  53          2HB       ALA  53  -2.555   6.503  10.480
  403   3HB   ALA  53          3HB       ALA  53  -4.110   5.847   9.928
  404    H    THR  54           H        THR  54  -1.129   3.572   8.424
  405    HA   THR  54           HA       THR  54   1.435   4.772   8.981
  406    HB   THR  54           HB       THR  54   0.699   1.990   7.966
  407    HG1  THR  54           1HG      THR  54  -0.003   2.241   9.988
  408   1HG2  THR  54          1HG2      THR  54   3.020   1.460   8.776
  409   2HG2  THR  54          2HG2      THR  54   2.940   2.385   7.275
  410   3HG2  THR  54          3HG2      THR  54   3.355   3.197   8.810
  411    H    LEU  55           H        LEU  55   0.037   3.264   6.018
  412    HA   LEU  55           HA       LEU  55   2.309   3.880   4.447
  413   1HB   LEU  55          2HB       LEU  55   1.087   3.151   2.558
  414   2HB   LEU  55          3HB       LEU  55   1.070   2.065   3.911
  415    HG   LEU  55           HG       LEU  55  -1.260   2.837   4.424
  416   1HD1  LEU  55          1HD1      LEU  55  -2.337   3.734   2.204
  417   2HD1  LEU  55          2HD1      LEU  55  -1.484   4.867   3.259
  418   3HD1  LEU  55          3HD1      LEU  55  -0.645   4.207   1.853
  419   1HD2  LEU  55          1HD2      LEU  55  -0.631   1.489   1.787
  420   2HD2  LEU  55          2HD2      LEU  55  -0.691   0.718   3.391
  421   3HD2  LEU  55          3HD2      LEU  55  -2.178   1.372   2.673
  422    H    LYS  56           H        LYS  56  -0.550   5.706   5.028
  423    HA   LYS  56           HA       LYS  56  -0.484   7.777   3.321
  424   1HB   LYS  56          2HB       LYS  56  -1.798   7.406   5.622
  425   2HB   LYS  56          3HB       LYS  56  -0.539   8.442   6.291
  426   1HG   LYS  56          2HG       LYS  56  -1.189  10.098   4.425
  427   2HG   LYS  56          3HG       LYS  56  -2.536   8.967   4.088
  428   1HD   LYS  56          2HD       LYS  56  -3.249   9.168   6.492
  429   2HD   LYS  56          3HD       LYS  56  -2.021  10.408   6.742
  430   1HE   LYS  56          2HE       LYS  56  -4.413  10.534   4.823
  431   2HE   LYS  56          3HE       LYS  56  -4.276  11.379   6.371
  432   1HZ   LYS  56          1HZ       LYS  56  -3.776  12.830   4.555
  433   2HZ   LYS  56          2HZ       LYS  56  -2.418  12.616   5.456
  434   3HZ   LYS  56          3HZ       LYS  56  -2.580  11.848   4.007
  435    H    LYS  57           H        LYS  57   1.903   7.180   5.894
  436    HA   LYS  57           HA       LYS  57   3.074   9.782   5.911
  437   1HB   LYS  57          2HB       LYS  57   4.170   7.097   6.798
  438   2HB   LYS  57          3HB       LYS  57   4.896   8.674   7.165
  439   1HG   LYS  57          2HG       LYS  57   2.694   9.341   8.240
  440   2HG   LYS  57          3HG       LYS  57   2.131   7.686   7.992
  441   1HD   LYS  57          2HD       LYS  57   4.471   8.568   9.733
  442   2HD   LYS  57          3HD       LYS  57   2.874   8.008  10.264
  443   1HE   LYS  57          2HE       LYS  57   3.431   5.821   8.932
  444   2HE   LYS  57          3HE       LYS  57   5.100   6.395   8.938
  445   1HZ   LYS  57          1HZ       LYS  57   4.648   4.922  10.765
  446   2HZ   LYS  57          2HZ       LYS  57   4.979   6.421  11.358
  447   3HZ   LYS  57          3HZ       LYS  57   3.427   5.868  11.313
  448    H    THR  58           H        THR  58   3.323   7.350   3.471
  449    HA   THR  58           HA       THR  58   5.928   8.073   2.456
  450    HB   THR  58           HB       THR  58   5.047   7.322   0.270
  451    HG1  THR  58           1HG      THR  58   2.630   6.678   1.588
  452   1HG2  THR  58          1HG2      THR  58   4.601   4.978   0.953
  453   2HG2  THR  58          2HG2      THR  58   5.986   5.701   1.807
  454   3HG2  THR  58          3HG2      THR  58   4.429   5.538   2.636
  455    H    GLY  59           H        GLY  59   2.829   9.745   2.532
  456   1HA   GLY  59          2HA       GLY  59   2.247  11.826   1.828
  457   2HA   GLY  59          3HA       GLY  59   3.968  12.174   1.534
  458    H    LYS  60           H        LYS  60   1.646   9.793   0.183
  459    HA   LYS  60           HA       LYS  60   2.107  10.779  -2.605
  460   1HB   LYS  60          2HB       LYS  60   2.407   7.948  -1.592
  461   2HB   LYS  60          3HB       LYS  60   2.254   8.448  -3.284
  462   1HG   LYS  60          2HG       LYS  60   4.225  10.140  -2.683
  463   2HG   LYS  60          3HG       LYS  60   4.512   9.028  -1.335
  464   1HD   LYS  60          2HD       LYS  60   4.555   7.155  -2.958
  465   2HD   LYS  60          3HD       LYS  60   4.220   8.293  -4.262
  466   1HE   LYS  60          2HE       LYS  60   6.384   9.541  -3.563
  467   2HE   LYS  60          3HE       LYS  60   6.762   8.120  -2.575
  468   1HZ   LYS  60          1HZ       LYS  60   7.792   7.970  -4.718
  469   2HZ   LYS  60          2HZ       LYS  60   6.614   6.814  -4.642
  470   3HZ   LYS  60          3HZ       LYS  60   6.362   8.192  -5.499
  471    H    THR  61           H        THR  61   0.456   9.913  -4.099
  472    HA   THR  61           HA       THR  61  -2.156  10.192  -3.196
  473    HB   THR  61           HB       THR  61  -1.471   8.831  -5.803
  474    HG1  THR  61           1HG      THR  61  -0.551  10.745  -6.570
  475   1HG2  THR  61          1HG2      THR  61  -3.763   9.752  -5.365
  476   2HG2  THR  61          2HG2      THR  61  -3.050  11.366  -5.144
  477   3HG2  THR  61          3HG2      THR  61  -2.960  10.559  -6.724
  478    H    VAL  62           H        VAL  62  -0.990   7.929  -1.720
  479    HA   VAL  62           HA       VAL  62  -2.002   5.460  -2.949
  480    HB   VAL  62           HB       VAL  62   0.081   5.271  -1.933
  481   1HG1  VAL  62          1HG1      VAL  62   0.563   5.591   0.441
  482   2HG1  VAL  62          2HG1      VAL  62   0.166   7.110  -0.339
  483   3HG1  VAL  62          3HG1      VAL  62  -1.034   6.317   0.699
  484   1HG2  VAL  62          1HG2      VAL  62  -1.966   3.953  -0.117
  485   2HG2  VAL  62          2HG2      VAL  62  -1.489   3.376  -1.714
  486   3HG2  VAL  62          3HG2      VAL  62  -0.297   3.421  -0.409
  487    H    SER  63           H        SER  63  -4.107   5.786  -3.149
  488    HA   SER  63           HA       SER  63  -5.770   6.766  -0.878
  489   1HB   SER  63          2HB       SER  63  -6.460   6.397  -3.827
  490   2HB   SER  63          3HB       SER  63  -7.344   7.353  -2.622
  491    HG   SER  63           HG       SER  63  -4.695   7.836  -3.598
  492    H    TYR  64           H        TYR  64  -7.594   5.472  -0.203
  493    HA   TYR  64           HA       TYR  64  -7.319   2.570  -0.682
  494   1HB   TYR  64          2HB       TYR  64  -7.412   3.220   1.604
  495   2HB   TYR  64          3HB       TYR  64  -8.764   4.310   1.326
  496    HD1  TYR  64           HD1      TYR  64 -11.006   3.590   1.499
  497    HD2  TYR  64           HD2      TYR  64  -7.852   0.663   1.237
  498    HE1  TYR  64           HE1      TYR  64 -12.669   1.786   1.735
  499    HE2  TYR  64           HE2      TYR  64  -9.526  -1.147   1.524
  500    HH   TYR  64           HH       TYR  64 -13.025  -0.478   1.834
  501    H    LEU  65           H        LEU  65  -8.745   1.398  -1.940
  502    HA   LEU  65           HA       LEU  65 -11.533   2.203  -2.131
  503   1HB   LEU  65          2HB       LEU  65 -11.427   1.946  -4.687
  504   2HB   LEU  65          3HB       LEU  65 -11.144   3.485  -3.906
  505    HG   LEU  65           HG       LEU  65  -9.690   3.001  -5.789
  506   1HD1  LEU  65          1HD1      LEU  65  -7.917   3.344  -3.502
  507   2HD1  LEU  65          2HD1      LEU  65  -7.891   4.153  -5.065
  508   3HD1  LEU  65          3HD1      LEU  65  -9.134   4.580  -3.890
  509   1HD2  LEU  65          1HD2      LEU  65  -7.773   1.551  -5.717
  510   2HD2  LEU  65          2HD2      LEU  65  -8.307   0.889  -4.159
  511   3HD2  LEU  65          3HD2      LEU  65  -9.272   0.646  -5.634
  512    H    GLY  66           H        GLY  66 -11.447   0.047  -0.874
  513   1HA   GLY  66          2HA       GLY  66 -13.262  -1.477  -1.640
  514   2HA   GLY  66          3HA       GLY  66 -12.189  -2.002  -2.946
  515    H    LEU  67           H        LEU  67 -13.100  -4.001  -1.340
  516    HA   LEU  67           HA       LEU  67 -10.673  -4.878  -0.149
  517   1HB   LEU  67          2HB       LEU  67 -11.446  -5.295   2.090
  518   2HB   LEU  67          3HB       LEU  67 -11.683  -3.587   1.755
  519    HG   LEU  67           HG       LEU  67 -13.834  -5.765   1.767
  520   1HD1  LEU  67          1HD1      LEU  67 -13.252  -3.494   3.710
  521   2HD1  LEU  67          2HD1      LEU  67 -14.580  -4.667   3.832
  522   3HD1  LEU  67          3HD1      LEU  67 -12.903  -5.215   3.987
  523   1HD2  LEU  67          1HD2      LEU  67 -15.436  -3.810   1.759
  524   2HD2  LEU  67          2HD2      LEU  67 -14.075  -2.752   1.332
  525   3HD2  LEU  67          3HD2      LEU  67 -14.600  -4.048   0.228
  526    H    GLU  68           H        GLU  68 -10.641  -7.154   0.248
  527    HA   GLU  68           HA       GLU  68 -12.934  -8.811  -0.498
  528   1HB   GLU  68          2HB       GLU  68 -11.863  -8.025  -2.661
  529   2HB   GLU  68          3HB       GLU  68 -10.384  -8.818  -2.150
  530   1HG   GLU  68          2HG       GLU  68 -11.869 -10.972  -1.907
  531   2HG   GLU  68          3HG       GLU  68 -13.001 -10.097  -2.951
  Start of MODEL    3
    1   1H    MET   1           H1       MET   1  -7.961  -6.831   6.728
    2   2H    MET   1           H2       MET   1  -7.492  -6.733   8.324
    3   3H    MET   1           H3       MET   1  -6.642  -7.625   7.271
    4    HA   MET   1           HA       MET   1  -7.711  -9.115   8.563
    5   1HB   MET   1          2HB       MET   1 -10.245  -7.592   7.954
    6   2HB   MET   1          3HB       MET   1 -10.219  -9.293   8.494
    7   1HG   MET   1          2HG       MET   1  -8.937  -8.613  10.504
    8   2HG   MET   1          3HG       MET   1  -8.956  -6.937   9.943
    9   1HE   MET   1          1HE       MET   1 -12.661  -9.191  11.515
   10   2HE   MET   1          2HE       MET   1 -11.984  -9.582   9.923
   11   3HE   MET   1          3HE       MET   1 -11.035  -9.900  11.399
   12    HA   PRO   2           HA       PRO   2  -8.497 -10.994   4.404
   13   1HB   PRO   2          2HB       PRO   2 -10.538 -10.567   2.814
   14   2HB   PRO   2          3HB       PRO   2 -10.870 -11.098   4.460
   15   1HG   PRO   2          2HG       PRO   2 -10.905  -8.204   3.526
   16   2HG   PRO   2          3HG       PRO   2 -12.213  -9.099   4.343
   17   1HD   PRO   2          2HD       PRO   2 -10.316  -7.585   5.690
   18   2HD   PRO   2          3HD       PRO   2 -11.114  -9.040   6.387
   19    H    LYS   3           H        LYS   3  -9.491  -9.153   1.855
   20    HA   LYS   3           HA       LYS   3  -6.786  -8.032   1.474
   21   1HB   LYS   3          2HB       LYS   3  -8.030  -9.630  -0.119
   22   2HB   LYS   3          3HB       LYS   3  -9.038  -8.229  -0.505
   23   1HG   LYS   3          2HG       LYS   3  -6.984  -6.957  -1.145
   24   2HG   LYS   3          3HG       LYS   3  -6.018  -8.420  -0.919
   25   1HD   LYS   3          2HD       LYS   3  -8.425  -8.298  -2.813
   26   2HD   LYS   3          3HD       LYS   3  -6.840  -7.718  -3.286
   27   1HE   LYS   3          2HE       LYS   3  -7.094  -9.918  -4.145
   28   2HE   LYS   3          3HE       LYS   3  -5.824  -9.929  -2.907
   29   1HZ   LYS   3          1HZ       LYS   3  -8.619 -10.816  -2.482
   30   2HZ   LYS   3          2HZ       LYS   3  -7.362 -11.804  -2.785
   31   3HZ   LYS   3          3HZ       LYS   3  -7.330 -10.966  -1.405
   32    H    HIS   4           H        HIS   4  -6.504  -5.810   1.005
   33    HA   HIS   4           HA       HIS   4  -8.866  -4.018   0.913
   34   1HB   HIS   4          2HB       HIS   4  -6.568  -2.899   2.377
   35   2HB   HIS   4          3HB       HIS   4  -8.288  -2.791   2.717
   36    HD1  HIS   4           1HD      HIS   4  -5.377  -5.264   3.231
   37    HD2  HIS   4           2HD      HIS   4  -9.255  -4.427   4.575
   38    HE1  HIS   4           1HE      HIS   4  -5.695  -6.611   5.360
   39    H    GLU   5           H        GLU   5  -8.644  -2.407  -0.632
   40    HA   GLU   5           HA       GLU   5  -6.276  -2.681  -2.394
   41   1HB   GLU   5          2HB       GLU   5  -9.158  -1.748  -2.731
   42   2HB   GLU   5          3HB       GLU   5  -7.997  -1.790  -4.053
   43   1HG   GLU   5          2HG       GLU   5  -8.968  -4.190  -2.392
   44   2HG   GLU   5          3HG       GLU   5  -9.449  -3.787  -4.032
   45    H    PHE   6           H        PHE   6  -5.037  -0.963  -2.997
   46    HA   PHE   6           HA       PHE   6  -5.995   1.771  -2.409
   47   1HB   PHE   6          2HB       PHE   6  -3.147   0.906  -1.863
   48   2HB   PHE   6          3HB       PHE   6  -3.906   2.440  -1.469
   49    HD1  PHE   6           1HD      PHE   6  -4.775   2.747   0.811
   50    HD2  PHE   6           2HD      PHE   6  -3.951  -1.233  -0.693
   51    HE1  PHE   6           1HE      PHE   6  -5.288   1.786   3.006
   52    HE2  PHE   6           2HE      PHE   6  -4.484  -2.165   1.515
   53    HZ   PHE   6           HZ       PHE   6  -5.223  -0.664   3.366
   54    H    SER   7           H        SER   7  -5.751   3.082  -4.165
   55    HA   SER   7           HA       SER   7  -4.086   2.091  -6.440
   56   1HB   SER   7          2HB       SER   7  -6.518   2.510  -6.930
   57   2HB   SER   7          3HB       SER   7  -6.232   4.225  -6.571
   58    HG   SER   7           HG       SER   7  -4.633   4.189  -8.243
   59    H    VAL   8           H        VAL   8  -2.479   3.369  -7.205
   60    HA   VAL   8           HA       VAL   8  -1.586   5.660  -5.554
   61    HB   VAL   8           HB       VAL   8   0.091   3.528  -6.971
   62   1HG1  VAL   8          1HG1      VAL   8   0.562   5.406  -4.595
   63   2HG1  VAL   8          2HG1      VAL   8   1.722   4.173  -5.131
   64   3HG1  VAL   8          3HG1      VAL   8   1.316   5.522  -6.182
   65   1HG2  VAL   8          1HG2      VAL   8  -1.254   2.201  -5.421
   66   2HG2  VAL   8          2HG2      VAL   8   0.345   2.427  -4.721
   67   3HG2  VAL   8          3HG2      VAL   8  -1.007   3.393  -4.125
   68    H    ASP   9           H        ASP   9   0.139   6.980  -6.977
   69    HA   ASP   9           HA       ASP   9   0.276   5.887  -9.593
   70   1HB   ASP   9          2HB       ASP   9  -1.112   8.095  -9.747
   71   2HB   ASP   9          3HB       ASP   9   0.471   8.874  -9.575
   72    H    MET  10           H        MET  10   2.402   6.288 -10.489
   73    HA   MET  10           HA       MET  10   4.474   6.446  -8.360
   74   1HB   MET  10          2HB       MET  10   3.675   3.865  -9.787
   75   2HB   MET  10          3HB       MET  10   5.138   4.076  -8.816
   76   1HG   MET  10          2HG       MET  10   3.558   4.870  -6.930
   77   2HG   MET  10          3HG       MET  10   2.256   4.155  -7.886
   78   1HE   MET  10          1HE       MET  10   3.265   1.614  -9.033
   79   2HE   MET  10          2HE       MET  10   3.138   0.371  -7.759
   80   3HE   MET  10          3HE       MET  10   1.819   1.534  -7.989
   81    H    THR  11           H        THR  11   5.438   8.088  -9.557
   82    HA   THR  11           HA       THR  11   5.871   7.903 -12.305
   83    HB   THR  11           HB       THR  11   7.577   9.706 -10.618
   84    HG1  THR  11           1HG      THR  11   5.645  10.916 -10.095
   85   1HG2  THR  11          1HG2      THR  11   6.681  11.415 -12.146
   86   2HG2  THR  11          2HG2      THR  11   7.278  10.029 -13.078
   87   3HG2  THR  11          3HG2      THR  11   5.531  10.243 -12.823
   88    H    CYS  12           H        CYS  12   7.713   6.418  -9.737
   89    HA   CYS  12           HA       CYS  12   9.824   5.688 -11.673
   90   1HB   CYS  12          2HB       CYS  12  10.748   7.635 -10.413
   91   2HB   CYS  12          3HB       CYS  12  10.328   6.838  -8.880
   92    HG   CYS  12           HG       CYS  12  12.351   5.811 -11.279
   93    H    GLY  13           H        GLY  13  10.707   3.583 -11.079
   94   1HA   GLY  13          2HA       GLY  13   8.984   1.712  -9.886
   95   2HA   GLY  13          3HA       GLY  13  10.737   1.516 -10.076
   96    H    GLY  14           H        GLY  14  11.633   3.647  -8.448
   97   1HA   GLY  14          2HA       GLY  14  11.589   2.507  -5.883
   98   2HA   GLY  14          3HA       GLY  14  12.126   4.161  -6.253
   99    H    CYS  15           H        CYS  15   9.179   4.603  -7.367
  100    HA   CYS  15           HA       CYS  15   8.062   5.633  -4.932
  101   1HB   CYS  15          2HB       CYS  15   7.600   6.628  -7.111
  102   2HB   CYS  15          3HB       CYS  15   6.606   5.201  -7.518
  103    HG   CYS  15           HG       CYS  15   5.154   5.361  -5.276
  104    H    ALA  16           H        ALA  16   7.843   2.560  -6.743
  105    HA   ALA  16           HA       ALA  16   5.621   1.471  -5.186
  106   1HB   ALA  16          1HB       ALA  16   6.203   0.629  -7.463
  107   2HB   ALA  16          2HB       ALA  16   7.738   0.004  -6.819
  108   3HB   ALA  16          3HB       ALA  16   6.208  -0.635  -6.217
  109    H    GLU  17           H        GLU  17   9.224   1.205  -5.166
  110    HA   GLU  17           HA       GLU  17   9.457  -0.387  -2.871
  111   1HB   GLU  17          2HB       GLU  17  11.216   2.000  -3.575
  112   2HB   GLU  17          3HB       GLU  17  11.441   0.813  -2.293
  113   1HG   GLU  17          2HG       GLU  17  11.753  -0.992  -3.883
  114   2HG   GLU  17          3HG       GLU  17  11.592   0.162  -5.225
  115    H    ALA  18           H        ALA  18   8.915   3.191  -3.021
  116    HA   ALA  18           HA       ALA  18   9.120   3.773  -0.306
  117   1HB   ALA  18          1HB       ALA  18   6.917   4.858  -2.103
  118   2HB   ALA  18          2HB       ALA  18   7.596   5.611  -0.659
  119   3HB   ALA  18          3HB       ALA  18   8.601   5.440  -2.116
  120    H    VAL  19           H        VAL  19   6.306   2.368  -2.024
  121    HA   VAL  19           HA       VAL  19   4.622   2.205   0.283
  122    HB   VAL  19           HB       VAL  19   4.515   0.544  -2.268
  123   1HG1  VAL  19          1HG1      VAL  19   2.406   1.077  -0.134
  124   2HG1  VAL  19          2HG1      VAL  19   2.195   0.143  -1.625
  125   3HG1  VAL  19          3HG1      VAL  19   3.261  -0.466  -0.368
  126   1HG2  VAL  19          1HG2      VAL  19   2.753   2.150  -2.942
  127   2HG2  VAL  19          2HG2      VAL  19   3.080   3.125  -1.494
  128   3HG2  VAL  19          3HG2      VAL  19   4.312   2.960  -2.763
  129    H    SER  20           H        SER  20   6.548  -0.340  -1.499
  130    HA   SER  20           HA       SER  20   6.033  -2.381   0.278
  131   1HB   SER  20          2HB       SER  20   8.690  -1.951  -1.159
  132   2HB   SER  20          3HB       SER  20   7.921  -3.502  -0.753
  133    HG   SER  20           HG       SER  20   7.552  -2.842  -2.948
  134    H    ARG  21           H        ARG  21   8.688   0.020   0.591
  135    HA   ARG  21           HA       ARG  21   9.790  -1.107   2.951
  136   1HB   ARG  21          2HB       ARG  21  10.068   1.628   1.662
  137   2HB   ARG  21          3HB       ARG  21  10.995   1.054   3.066
  138   1HG   ARG  21          2HG       ARG  21  11.693  -0.953   1.727
  139   2HG   ARG  21          3HG       ARG  21  10.985  -0.253   0.281
  140   1HD   ARG  21          2HD       ARG  21  12.955   1.436   1.812
  141   2HD   ARG  21          3HD       ARG  21  13.560  -0.031   1.063
  142    HE   ARG  21           HE       ARG  21  13.306   0.778  -1.089
  143   1HH1  ARG  21          2HH2      ARG  21  11.754   3.061   1.101
  144   2HH1  ARG  21          1HH2      ARG  21  11.924   4.415   0.015
  145   1HH2  ARG  21          2HH1      ARG  21  13.489   2.354  -2.455
  146   2HH2  ARG  21          1HH1      ARG  21  12.936   4.006  -2.173
  147    H    VAL  22           H        VAL  22   7.460   1.801   2.604
  148    HA   VAL  22           HA       VAL  22   7.391   2.164   5.375
  149    HB   VAL  22           HB       VAL  22   6.661   3.720   3.486
  150   1HG1  VAL  22          1HG1      VAL  22   4.000   2.328   3.909
  151   2HG1  VAL  22          2HG1      VAL  22   4.316   3.730   2.867
  152   3HG1  VAL  22          3HG1      VAL  22   5.003   2.166   2.452
  153   1HG2  VAL  22          1HG2      VAL  22   4.916   3.343   5.923
  154   2HG2  VAL  22          2HG2      VAL  22   6.413   4.311   5.781
  155   3HG2  VAL  22          3HG2      VAL  22   4.930   4.788   4.897
  156    H    LEU  23           H        LEU  23   5.343   0.059   3.241
  157    HA   LEU  23           HA       LEU  23   3.725  -0.944   5.342
  158   1HB   LEU  23          2HB       LEU  23   4.541  -1.966   2.597
  159   2HB   LEU  23          3HB       LEU  23   3.626  -2.949   3.728
  160    HG   LEU  23           HG       LEU  23   2.220  -1.847   2.039
  161   1HD1  LEU  23          1HD1      LEU  23   1.278  -2.781   4.088
  162   2HD1  LEU  23          2HD1      LEU  23   1.664  -1.292   4.984
  163   3HD1  LEU  23          3HD1      LEU  23   0.468  -1.249   3.687
  164   1HD2  LEU  23          1HD2      LEU  23   1.525   0.440   2.398
  165   2HD2  LEU  23          2HD2      LEU  23   2.633   0.584   3.783
  166   3HD2  LEU  23          3HD2      LEU  23   3.272   0.410   2.128
  167    H    ASN  24           H        ASN  24   6.851  -2.252   4.029
  168    HA   ASN  24           HA       ASN  24   7.003  -4.466   5.777
  169   1HB   ASN  24          2HB       ASN  24   8.581  -4.425   4.069
  170   2HB   ASN  24          3HB       ASN  24   9.025  -2.741   4.362
  171   1HD2  ASN  24          1HD2      ASN  24  10.282  -2.183   6.182
  172   2HD2  ASN  24          2HD2      ASN  24  11.395  -3.370   6.880
  173    H    LYS  25           H        LYS  25   8.000  -1.086   6.302
  174    HA   LYS  25           HA       LYS  25   9.177  -1.342   8.834
  175   1HB   LYS  25          2HB       LYS  25   7.774   0.873   7.317
  176   2HB   LYS  25          3HB       LYS  25   8.089   1.120   9.024
  177   1HG   LYS  25          2HG       LYS  25  10.244   0.280   7.033
  178   2HG   LYS  25          3HG       LYS  25   9.838   1.968   7.367
  179   1HD   LYS  25          2HD       LYS  25  10.347   1.658   9.769
  180   2HD   LYS  25          3HD       LYS  25  10.800  -0.029   9.474
  181   1HE   LYS  25          2HE       LYS  25  12.592   0.728   7.906
  182   2HE   LYS  25          3HE       LYS  25  12.166   2.414   8.247
  183   1HZ   LYS  25          1HZ       LYS  25  13.160   0.464  10.226
  184   2HZ   LYS  25          2HZ       LYS  25  14.027   1.686   9.555
  185   3HZ   LYS  25          3HZ       LYS  25  12.765   2.029  10.547
  186    H    LEU  26           H        LEU  26   5.757  -1.216   8.000
  187    HA   LEU  26           HA       LEU  26   4.669  -0.819  10.559
  188   1HB   LEU  26          2HB       LEU  26   3.589  -0.964   8.268
  189   2HB   LEU  26          3HB       LEU  26   3.548  -2.699   8.410
  190    HG   LEU  26           HG       LEU  26   1.503  -1.248   8.900
  191   1HD1  LEU  26          1HD1      LEU  26   1.495  -3.649   9.135
  192   2HD1  LEU  26          2HD1      LEU  26   2.155  -3.517  10.787
  193   3HD1  LEU  26          3HD1      LEU  26   0.545  -2.862  10.403
  194   1HD2  LEU  26          1HD2      LEU  26   2.615  -1.223  11.733
  195   2HD2  LEU  26          2HD2      LEU  26   2.619   0.197  10.662
  196   3HD2  LEU  26          3HD2      LEU  26   1.085  -0.544  11.145
  197    H    GLY  27           H        GLY  27   5.910  -3.764   9.003
  198   1HA   GLY  27          2HA       GLY  27   6.769  -5.032  11.265
  199   2HA   GLY  27          3HA       GLY  27   5.047  -5.466  11.218
  200    H    GLY  28           H        GLY  28   4.272  -6.870   9.618
  201   1HA   GLY  28          2HA       GLY  28   6.133  -8.118   7.674
  202   2HA   GLY  28          3HA       GLY  28   5.512  -9.135   8.991
  203    H    VAL  29           H        VAL  29   3.952  -6.478   7.322
  204    HA   VAL  29           HA       VAL  29   1.453  -7.850   6.924
  205    HB   VAL  29           HB       VAL  29   1.382  -5.522   7.337
  206   1HG1  VAL  29          1HG1      VAL  29   3.421  -5.160   5.116
  207   2HG1  VAL  29          2HG1      VAL  29   2.463  -3.832   5.800
  208   3HG1  VAL  29          3HG1      VAL  29   3.572  -4.717   6.825
  209   1HG2  VAL  29          1HG2      VAL  29   0.899  -5.853   4.347
  210   2HG2  VAL  29          2HG2      VAL  29  -0.246  -6.228   5.663
  211   3HG2  VAL  29          3HG2      VAL  29   0.285  -4.568   5.382
  212    H    LYS  30           H        LYS  30   0.708  -8.974   5.122
  213    HA   LYS  30           HA       LYS  30   2.560  -9.299   2.871
  214   1HB   LYS  30          2HB       LYS  30   0.899 -11.072   3.986
  215   2HB   LYS  30          3HB       LYS  30  -0.152 -10.501   2.682
  216   1HG   LYS  30          2HG       LYS  30   2.701 -11.523   2.381
  217   2HG   LYS  30          3HG       LYS  30   1.256 -12.482   2.087
  218   1HD   LYS  30          2HD       LYS  30   0.785 -11.509   0.063
  219   2HD   LYS  30          3HD       LYS  30   1.391  -9.928   0.512
  220   1HE   LYS  30          2HE       LYS  30   3.731 -10.738   0.394
  221   2HE   LYS  30          3HE       LYS  30   3.128 -12.318  -0.177
  222   1HZ   LYS  30          1HZ       LYS  30   2.860  -9.695  -1.518
  223   2HZ   LYS  30          2HZ       LYS  30   3.682 -10.975  -2.103
  224   3HZ   LYS  30          3HZ       LYS  30   2.048 -10.971  -2.031
  225    H    TYR  31           H        TYR  31   2.672  -7.711   1.548
  226    HA   TYR  31           HA       TYR  31   0.257  -6.389   0.383
  227   1HB   TYR  31          2HB       TYR  31   1.952  -4.690  -0.400
  228   2HB   TYR  31          3HB       TYR  31   1.597  -4.707   1.316
  229    HD1  TYR  31           HD1      TYR  31   4.167  -6.070  -1.138
  230    HD2  TYR  31           HD2      TYR  31   3.288  -4.981   2.915
  231    HE1  TYR  31           HE1      TYR  31   6.581  -5.857  -0.685
  232    HE2  TYR  31           HE2      TYR  31   5.721  -4.718   3.374
  233    HH   TYR  31           HH       TYR  31   7.708  -4.141   2.141
  234    H    ASP  32           H        ASP  32   0.175  -6.237  -1.931
  235    HA   ASP  32           HA       ASP  32   2.454  -7.247  -3.465
  236   1HB   ASP  32          2HB       ASP  32  -0.381  -8.303  -3.532
  237   2HB   ASP  32          3HB       ASP  32   0.493  -8.131  -5.051
  238    H    ILE  33           H        ILE  33   2.640  -6.102  -5.430
  239    HA   ILE  33           HA       ILE  33   1.074  -3.575  -5.596
  240    HB   ILE  33           HB       ILE  33   4.106  -3.823  -5.433
  241   1HG1  ILE  33          2HG1      ILE  33   3.417  -2.050  -3.474
  242   2HG1  ILE  33          3HG1      ILE  33   2.012  -3.111  -3.401
  243   1HG2  ILE  33          1HG2      ILE  33   4.084  -1.356  -5.495
  244   2HG2  ILE  33          2HG2      ILE  33   3.479  -2.062  -6.995
  245   3HG2  ILE  33          3HG2      ILE  33   2.336  -1.382  -5.820
  246   1HD1  ILE  33          1HD1      ILE  33   3.799  -3.757  -1.850
  247   2HD1  ILE  33          2HD1      ILE  33   3.546  -5.046  -3.051
  248   3HD1  ILE  33          3HD1      ILE  33   4.940  -3.954  -3.193
  249    H    ASP  34           H        ASP  34   0.469  -3.229  -7.648
  250    HA   ASP  34           HA       ASP  34   2.051  -4.404  -9.890
  251   1HB   ASP  34          2HB       ASP  34  -0.310  -5.062  -9.966
  252   2HB   ASP  34          3HB       ASP  34  -0.801  -3.357  -9.883
  253    H    LEU  35           H        LEU  35   3.235  -3.020 -11.007
  254    HA   LEU  35           HA       LEU  35   3.221  -0.194 -10.337
  255   1HB   LEU  35          2HB       LEU  35   5.032  -1.899 -12.053
  256   2HB   LEU  35          3HB       LEU  35   5.042  -0.135 -12.152
  257    HG   LEU  35           HG       LEU  35   5.371  -0.039  -9.643
  258   1HD1  LEU  35          1HD1      LEU  35   6.419  -2.037  -8.589
  259   2HD1  LEU  35          2HD1      LEU  35   4.729  -2.331  -9.002
  260   3HD1  LEU  35          3HD1      LEU  35   6.018  -2.999 -10.026
  261   1HD2  LEU  35          1HD2      LEU  35   7.557  -1.345 -11.303
  262   2HD2  LEU  35          2HD2      LEU  35   7.184   0.393 -11.232
  263   3HD2  LEU  35          3HD2      LEU  35   7.785  -0.439  -9.789
  264    HA   PRO  36           HA       PRO  36   2.241   0.480 -14.949
  265   1HB   PRO  36          2HB       PRO  36   0.637  -1.429 -16.247
  266   2HB   PRO  36          3HB       PRO  36   2.400  -1.217 -16.420
  267   1HG   PRO  36          2HG       PRO  36   0.923  -3.136 -14.618
  268   2HG   PRO  36          3HG       PRO  36   2.354  -3.462 -15.634
  269   1HD   PRO  36          2HD       PRO  36   2.613  -3.045 -13.021
  270   2HD   PRO  36          3HD       PRO  36   3.780  -2.272 -14.127
  271    H    ASN  37           H        ASN  37  -0.279  -1.443 -13.177
  272    HA   ASN  37           HA       ASN  37  -2.349   0.505 -13.971
  273   1HB   ASN  37          2HB       ASN  37  -2.566  -1.859 -12.074
  274   2HB   ASN  37          3HB       ASN  37  -3.875  -0.903 -12.769
  275   1HD2  ASN  37          1HD2      ASN  37  -1.316  -3.225 -13.545
  276   2HD2  ASN  37          2HD2      ASN  37  -2.060  -3.808 -15.043
  277    H    LYS  38           H        LYS  38   0.128   0.597 -11.719
  278    HA   LYS  38           HA       LYS  38   0.551   1.543  -9.812
  279   1HB   LYS  38          2HB       LYS  38  -1.583   3.582 -10.518
  280   2HB   LYS  38          3HB       LYS  38  -0.132   3.750  -9.525
  281   1HG   LYS  38          2HG       LYS  38   0.809   4.642 -11.367
  282   2HG   LYS  38          3HG       LYS  38   0.975   2.995 -11.946
  283   1HD   LYS  38          2HD       LYS  38  -1.190   3.166 -13.123
  284   2HD   LYS  38          3HD       LYS  38  -1.458   4.790 -12.474
  285   1HE   LYS  38          2HE       LYS  38   0.894   4.032 -14.273
  286   2HE   LYS  38          3HE       LYS  38  -0.647   4.660 -14.870
  287   1HZ   LYS  38          1HZ       LYS  38  -0.268   6.666 -13.472
  288   2HZ   LYS  38          2HZ       LYS  38   1.146   6.146 -13.024
  289   3HZ   LYS  38          3HZ       LYS  38   0.905   6.467 -14.621
  290    H    LYS  39           H        LYS  39  -0.598  -0.514  -8.884
  291    HA   LYS  39           HA       LYS  39  -2.603   0.412  -6.903
  292   1HB   LYS  39          2HB       LYS  39  -3.054  -1.683  -9.026
  293   2HB   LYS  39          3HB       LYS  39  -3.773  -1.935  -7.436
  294   1HG   LYS  39          2HG       LYS  39  -5.283  -0.242  -7.618
  295   2HG   LYS  39          3HG       LYS  39  -4.156   0.798  -8.474
  296   1HD   LYS  39          2HD       LYS  39  -4.472  -0.729 -10.518
  297   2HD   LYS  39          3HD       LYS  39  -5.842  -1.430  -9.652
  298   1HE   LYS  39          2HE       LYS  39  -6.528   0.349 -11.232
  299   2HE   LYS  39          3HE       LYS  39  -6.942   0.793  -9.568
  300   1HZ   LYS  39          1HZ       LYS  39  -5.185   2.329  -9.514
  301   2HZ   LYS  39          2HZ       LYS  39  -4.450   1.711 -10.856
  302   3HZ   LYS  39          3HZ       LYS  39  -5.865   2.552 -10.982
  303    H    VAL  40           H        VAL  40  -2.725  -0.713  -4.998
  304    HA   VAL  40           HA       VAL  40  -0.608  -2.665  -4.409
  305    HB   VAL  40           HB       VAL  40  -1.577  -0.061  -3.199
  306   1HG1  VAL  40          1HG1      VAL  40  -1.643  -1.509  -1.418
  307   2HG1  VAL  40          2HG1      VAL  40  -0.057  -2.244  -1.802
  308   3HG1  VAL  40          3HG1      VAL  40  -0.166  -0.550  -1.224
  309   1HG2  VAL  40          1HG2      VAL  40   1.272  -0.963  -3.707
  310   2HG2  VAL  40          2HG2      VAL  40   0.342   0.032  -4.841
  311   3HG2  VAL  40          3HG2      VAL  40   0.707   0.649  -3.227
  312    H    CYS  41           H        CYS  41  -1.555  -4.413  -3.638
  313    HA   CYS  41           HA       CYS  41  -4.310  -4.306  -2.460
  314   1HB   CYS  41          2HB       CYS  41  -4.643  -6.576  -3.288
  315   2HB   CYS  41          3HB       CYS  41  -4.436  -5.436  -4.627
  316    HG   CYS  41           HG       CYS  41  -2.107  -7.335  -3.289
  317    H    ILE  42           H        ILE  42  -4.306  -4.929  -0.345
  318    HA   ILE  42           HA       ILE  42  -1.880  -6.386   0.660
  319    HB   ILE  42           HB       ILE  42  -3.301  -4.139   2.089
  320   1HG1  ILE  42          2HG1      ILE  42  -0.885  -4.071   0.226
  321   2HG1  ILE  42          3HG1      ILE  42  -2.373  -3.112   0.122
  322   1HG2  ILE  42          1HG2      ILE  42  -1.368  -4.169   3.564
  323   2HG2  ILE  42          2HG2      ILE  42  -2.008  -5.805   3.459
  324   3HG2  ILE  42          3HG2      ILE  42  -0.557  -5.363   2.533
  325   1HD1  ILE  42          1HD1      ILE  42  -1.701  -1.933   2.234
  326   2HD1  ILE  42          2HD1      ILE  42  -0.161  -2.838   2.163
  327   3HD1  ILE  42          3HD1      ILE  42  -0.578  -1.697   0.887
  328    H    GLU  43           H        GLU  43  -2.241  -8.037   1.981
  329    HA   GLU  43           HA       GLU  43  -5.047  -8.632   2.792
  330   1HB   GLU  43          2HB       GLU  43  -4.415  -9.605   0.546
  331   2HB   GLU  43          3HB       GLU  43  -3.192 -10.584   1.365
  332   1HG   GLU  43          2HG       GLU  43  -4.931 -11.737   2.640
  333   2HG   GLU  43          3HG       GLU  43  -6.169 -10.614   2.046
  334    H    SER  44           H        SER  44  -4.794  -8.532   5.006
  335    HA   SER  44           HA       SER  44  -2.720 -10.133   6.309
  336   1HB   SER  44          2HB       SER  44  -1.480  -8.162   5.453
  337   2HB   SER  44          3HB       SER  44  -2.578  -7.102   6.342
  338    HG   SER  44           HG       SER  44  -1.084  -7.354   7.824
  339    H    GLU  45           H        GLU  45  -3.025 -10.370   8.502
  340    HA   GLU  45           HA       GLU  45  -5.740  -9.992   9.382
  341   1HB   GLU  45          2HB       GLU  45  -3.364 -11.289  10.765
  342   2HB   GLU  45          3HB       GLU  45  -5.066 -11.443  11.217
  343   1HG   GLU  45          2HG       GLU  45  -5.555 -12.457   8.982
  344   2HG   GLU  45          3HG       GLU  45  -3.826 -12.408   8.593
  345    H    HIS  46           H        HIS  46  -4.921  -7.443   9.219
  346    HA   HIS  46           HA       HIS  46  -5.397  -6.671  12.033
  347   1HB   HIS  46          2HB       HIS  46  -3.813  -4.720  11.853
  348   2HB   HIS  46          3HB       HIS  46  -3.023  -6.297  11.936
  349    HD1  HIS  46           1HD      HIS  46  -4.323  -4.229   8.883
  350    HD2  HIS  46           2HD      HIS  46  -1.066  -6.523  10.279
  351    HE1  HIS  46           1HE      HIS  46  -2.790  -4.623   6.923
  352    H    SER  47           H        SER  47  -5.946  -4.089  11.906
  353    HA   SER  47           HA       SER  47  -8.152  -3.965  10.032
  354   1HB   SER  47          2HB       SER  47  -8.099  -2.879  12.359
  355   2HB   SER  47          3HB       SER  47  -7.201  -1.558  11.567
  356    HG   SER  47           HG       SER  47  -9.208  -0.976  11.007
  357    H    MET  48           H        MET  48  -8.481  -1.819   8.984
  358    HA   MET  48           HA       MET  48  -6.605  -1.647   6.709
  359   1HB   MET  48          2HB       MET  48  -9.102   0.041   7.020
  360   2HB   MET  48          3HB       MET  48  -8.335  -0.590   5.554
  361   1HG   MET  48          2HG       MET  48  -9.008  -2.928   6.432
  362   2HG   MET  48          3HG       MET  48  -9.991  -2.070   7.628
  363   1HE   MET  48          1HE       MET  48 -11.294  -4.266   5.968
  364   2HE   MET  48          2HE       MET  48 -12.110  -3.216   7.153
  365   3HE   MET  48          3HE       MET  48 -12.813  -3.445   5.543
  366    H    ASP  49           H        ASP  49  -7.914   0.256   9.401
  367    HA   ASP  49           HA       ASP  49  -7.014   2.798   8.919
  368   1HB   ASP  49          2HB       ASP  49  -6.924   1.452  11.659
  369   2HB   ASP  49          3HB       ASP  49  -7.209   3.158  11.297
  370    H    THR  50           H        THR  50  -5.368   0.225  10.592
  371    HA   THR  50           HA       THR  50  -2.888   1.119  11.224
  372    HB   THR  50           HB       THR  50  -3.386  -1.542   9.811
  373    HG1  THR  50           1HG      THR  50  -4.177  -2.177  11.920
  374   1HG2  THR  50          1HG2      THR  50  -1.770  -0.799  12.290
  375   2HG2  THR  50          2HG2      THR  50  -1.894  -2.414  11.556
  376   3HG2  THR  50          3HG2      THR  50  -1.109  -1.097  10.666
  377    H    LEU  51           H        LEU  51  -3.940  -0.061   7.975
  378    HA   LEU  51           HA       LEU  51  -1.288   0.241   6.827
  379   1HB   LEU  51          2HB       LEU  51  -4.001  -0.108   5.469
  380   2HB   LEU  51          3HB       LEU  51  -2.409  -0.201   4.696
  381    HG   LEU  51           HG       LEU  51  -3.443  -2.055   6.924
  382   1HD1  LEU  51          1HD1      LEU  51  -3.446  -3.754   5.062
  383   2HD1  LEU  51          2HD1      LEU  51  -4.620  -2.454   4.867
  384   3HD1  LEU  51          3HD1      LEU  51  -3.114  -2.433   3.930
  385   1HD2  LEU  51          1HD2      LEU  51  -1.296  -3.335   6.136
  386   2HD2  LEU  51          2HD2      LEU  51  -0.795  -1.789   5.478
  387   3HD2  LEU  51          3HD2      LEU  51  -1.085  -1.963   7.221
  388    H    LEU  52           H        LEU  52  -4.399   2.018   6.540
  389    HA   LEU  52           HA       LEU  52  -3.494   4.051   4.825
  390   1HB   LEU  52          2HB       LEU  52  -5.574   3.829   6.967
  391   2HB   LEU  52          3HB       LEU  52  -5.205   5.448   6.375
  392    HG   LEU  52           HG       LEU  52  -6.009   3.115   4.600
  393   1HD1  LEU  52          1HD1      LEU  52  -7.735   5.347   5.738
  394   2HD1  LEU  52          2HD1      LEU  52  -8.248   4.136   4.543
  395   3HD1  LEU  52          3HD1      LEU  52  -7.811   3.627   6.181
  396   1HD2  LEU  52          1HD2      LEU  52  -4.855   4.906   3.329
  397   2HD2  LEU  52          2HD2      LEU  52  -6.585   4.983   2.994
  398   3HD2  LEU  52          3HD2      LEU  52  -5.862   6.137   4.119
  399    H    ALA  53           H        ALA  53  -3.425   4.065   8.420
  400    HA   ALA  53           HA       ALA  53  -2.024   6.514   8.703
  401   1HB   ALA  53          1HB       ALA  53  -2.062   4.071  10.537
  402   2HB   ALA  53          2HB       ALA  53  -1.577   5.715  11.004
  403   3HB   ALA  53          3HB       ALA  53  -3.259   5.383  10.541
  404    H    THR  54           H        THR  54  -0.707   3.185   8.533
  405    HA   THR  54           HA       THR  54   2.023   3.867   8.785
  406    HB   THR  54           HB       THR  54   0.660   1.726   7.087
  407    HG1  THR  54           1HG      THR  54   0.258   1.501   9.247
  408   1HG2  THR  54          1HG2      THR  54   2.990   2.103   6.294
  409   2HG2  THR  54          2HG2      THR  54   3.565   1.824   7.959
  410   3HG2  THR  54          3HG2      THR  54   2.721   0.548   7.048
  411    H    LEU  55           H        LEU  55   0.124   3.524   5.726
  412    HA   LEU  55           HA       LEU  55   2.448   4.187   4.207
  413   1HB   LEU  55          2HB       LEU  55   1.212   3.633   2.346
  414   2HB   LEU  55          3HB       LEU  55   0.944   2.475   3.620
  415    HG   LEU  55           HG       LEU  55  -1.254   3.918   4.049
  416   1HD1  LEU  55          1HD1      LEU  55  -0.567   5.630   2.396
  417   2HD1  LEU  55          2HD1      LEU  55  -0.492   4.362   1.187
  418   3HD1  LEU  55          3HD1      LEU  55  -2.073   4.823   1.899
  419   1HD2  LEU  55          1HD2      LEU  55  -2.385   2.378   2.438
  420   2HD2  LEU  55          2HD2      LEU  55  -0.820   2.047   1.658
  421   3HD2  LEU  55          3HD2      LEU  55  -1.110   1.515   3.330
  422    H    LYS  56           H        LYS  56  -0.428   5.945   5.042
  423    HA   LYS  56           HA       LYS  56  -0.519   8.208   3.574
  424   1HB   LYS  56          2HB       LYS  56  -0.790   7.658   6.515
  425   2HB   LYS  56          3HB       LYS  56  -0.671   9.342   6.098
  426   1HG   LYS  56          2HG       LYS  56  -2.551   9.246   4.582
  427   2HG   LYS  56          3HG       LYS  56  -2.693   7.489   4.786
  428   1HD   LYS  56          2HD       LYS  56  -3.092   7.774   7.189
  429   2HD   LYS  56          3HD       LYS  56  -2.879   9.528   7.051
  430   1HE   LYS  56          2HE       LYS  56  -4.874   9.661   5.559
  431   2HE   LYS  56          3HE       LYS  56  -5.065   7.903   5.636
  432   1HZ   LYS  56          1HZ       LYS  56  -5.317   9.746   7.922
  433   2HZ   LYS  56          2HZ       LYS  56  -6.555   9.018   7.127
  434   3HZ   LYS  56          3HZ       LYS  56  -5.496   8.110   7.991
  435    H    LYS  57           H        LYS  57   1.864   7.621   6.078
  436    HA   LYS  57           HA       LYS  57   3.249   9.991   6.329
  437   1HB   LYS  57          2HB       LYS  57   4.131   7.113   6.361
  438   2HB   LYS  57          3HB       LYS  57   5.186   8.447   6.907
  439   1HG   LYS  57          2HG       LYS  57   3.444   9.067   8.575
  440   2HG   LYS  57          3HG       LYS  57   2.432   7.725   8.002
  441   1HD   LYS  57          2HD       LYS  57   4.221   6.108   8.559
  442   2HD   LYS  57          3HD       LYS  57   5.170   7.425   9.287
  443   1HE   LYS  57          2HE       LYS  57   3.356   7.852  10.920
  444   2HE   LYS  57          3HE       LYS  57   2.323   6.649  10.132
  445   1HZ   LYS  57          1HZ       LYS  57   3.344   5.764  12.082
  446   2HZ   LYS  57          2HZ       LYS  57   3.879   4.953  10.758
  447   3HZ   LYS  57          3HZ       LYS  57   4.856   6.053  11.503
  448    H    THR  58           H        THR  58   3.484   7.697   3.583
  449    HA   THR  58           HA       THR  58   5.946   8.718   2.524
  450    HB   THR  58           HB       THR  58   5.276   7.653   0.429
  451    HG1  THR  58           1HG      THR  58   2.858   6.966   1.760
  452   1HG2  THR  58          1HG2      THR  58   6.303   6.307   2.195
  453   2HG2  THR  58          2HG2      THR  58   4.702   5.970   2.884
  454   3HG2  THR  58          3HG2      THR  58   5.123   5.355   1.266
  455    H    GLY  59           H        GLY  59   2.608   9.864   2.333
  456   1HA   GLY  59          2HA       GLY  59   1.629  11.591   1.246
  457   2HA   GLY  59          3HA       GLY  59   3.229  12.363   1.215
  458    H    LYS  60           H        LYS  60   1.884   9.416  -0.395
  459    HA   LYS  60           HA       LYS  60   2.341  10.697  -3.066
  460   1HB   LYS  60          2HB       LYS  60   1.940   7.735  -2.580
  461   2HB   LYS  60          3HB       LYS  60   2.483   8.533  -4.037
  462   1HG   LYS  60          2HG       LYS  60   3.958   7.790  -1.536
  463   2HG   LYS  60          3HG       LYS  60   4.379   7.470  -3.202
  464   1HD   LYS  60          2HD       LYS  60   4.827   9.947  -1.552
  465   2HD   LYS  60          3HD       LYS  60   6.015   8.954  -2.347
  466   1HE   LYS  60          2HE       LYS  60   5.912  10.117  -4.289
  467   2HE   LYS  60          3HE       LYS  60   4.158  10.191  -4.297
  468   1HZ   LYS  60          1HZ       LYS  60   5.936  11.935  -2.721
  469   2HZ   LYS  60          2HZ       LYS  60   5.043  12.376  -4.034
  470   3HZ   LYS  60          3HZ       LYS  60   4.303  11.960  -2.619
  471    H    THR  61           H        THR  61   0.601   9.908  -4.710
  472    HA   THR  61           HA       THR  61  -1.982  10.452  -3.734
  473    HB   THR  61           HB       THR  61  -1.275   9.146  -6.374
  474    HG1  THR  61           1HG      THR  61  -0.650  11.829  -5.732
  475   1HG2  THR  61          1HG2      THR  61  -2.775  10.885  -7.276
  476   2HG2  THR  61          2HG2      THR  61  -3.603   9.958  -6.008
  477   3HG2  THR  61          3HG2      THR  61  -2.971  11.583  -5.651
  478    H    VAL  62           H        VAL  62  -1.113   8.253  -2.234
  479    HA   VAL  62           HA       VAL  62  -2.213   5.778  -3.400
  480    HB   VAL  62           HB       VAL  62  -0.130   5.488  -2.459
  481   1HG1  VAL  62          1HG1      VAL  62  -1.067   6.675   0.173
  482   2HG1  VAL  62          2HG1      VAL  62   0.488   5.869  -0.142
  483   3HG1  VAL  62          3HG1      VAL  62   0.112   7.375  -0.945
  484   1HG2  VAL  62          1HG2      VAL  62  -0.548   3.658  -0.989
  485   2HG2  VAL  62          2HG2      VAL  62  -2.118   4.326  -0.481
  486   3HG2  VAL  62          3HG2      VAL  62  -1.896   3.741  -2.128
  487    H    SER  63           H        SER  63  -4.363   6.158  -3.532
  488    HA   SER  63           HA       SER  63  -5.898   6.937  -1.094
  489   1HB   SER  63          2HB       SER  63  -6.730   6.634  -4.005
  490   2HB   SER  63          3HB       SER  63  -7.751   7.238  -2.681
  491    HG   SER  63           HG       SER  63  -6.686   8.918  -3.928
  492    H    TYR  64           H        TYR  64  -7.280   5.479  -0.103
  493    HA   TYR  64           HA       TYR  64  -7.093   2.626  -0.725
  494   1HB   TYR  64          2HB       TYR  64  -7.117   3.214   1.567
  495   2HB   TYR  64          3HB       TYR  64  -8.477   4.317   1.361
  496    HD1  TYR  64           HD1      TYR  64  -7.588   0.665   1.145
  497    HD2  TYR  64           HD2      TYR  64 -10.693   3.599   1.728
  498    HE1  TYR  64           HE1      TYR  64  -9.225  -1.135   1.588
  499    HE2  TYR  64           HE2      TYR  64 -12.300   1.797   2.247
  500    HH   TYR  64           HH       TYR  64 -12.616  -0.476   2.503
  501    H    LEU  65           H        LEU  65  -8.644   1.438  -1.951
  502    HA   LEU  65           HA       LEU  65 -11.375   2.433  -2.071
  503   1HB   LEU  65          2HB       LEU  65 -11.488   2.348  -4.486
  504   2HB   LEU  65          3HB       LEU  65 -10.499   3.646  -3.845
  505    HG   LEU  65           HG       LEU  65  -9.156   3.157  -5.495
  506   1HD1  LEU  65          1HD1      LEU  65  -8.312   0.802  -3.795
  507   2HD1  LEU  65          2HD1      LEU  65  -7.409   1.435  -5.159
  508   3HD1  LEU  65          3HD1      LEU  65  -7.683   2.476  -3.746
  509   1HD2  LEU  65          1HD2      LEU  65  -9.095   1.308  -6.890
  510   2HD2  LEU  65          2HD2      LEU  65  -9.628   0.208  -5.623
  511   3HD2  LEU  65          3HD2      LEU  65 -10.800   1.331  -6.376
  512    H    GLY  66           H        GLY  66 -11.291   0.316  -0.662
  513   1HA   GLY  66          2HA       GLY  66 -13.208  -1.136  -1.083
  514   2HA   GLY  66          3HA       GLY  66 -12.493  -1.628  -2.619
  515    H    LEU  67           H        LEU  67 -13.049  -3.733  -1.386
  516    HA   LEU  67           HA       LEU  67 -10.728  -4.849  -0.105
  517   1HB   LEU  67          2HB       LEU  67 -11.803  -5.386   1.984
  518   2HB   LEU  67          3HB       LEU  67 -11.890  -3.642   1.779
  519    HG   LEU  67           HG       LEU  67 -14.151  -5.666   1.353
  520   1HD1  LEU  67          1HD1      LEU  67 -13.749  -3.532   3.473
  521   2HD1  LEU  67          2HD1      LEU  67 -15.086  -4.698   3.384
  522   3HD1  LEU  67          3HD1      LEU  67 -13.440  -5.271   3.710
  523   1HD2  LEU  67          1HD2      LEU  67 -15.626  -3.595   1.334
  524   2HD2  LEU  67          2HD2      LEU  67 -14.161  -2.624   1.091
  525   3HD2  LEU  67          3HD2      LEU  67 -14.675  -3.821  -0.127
  526    H    GLU  68           H        GLU  68 -11.121  -7.227   0.315
  527    HA   GLU  68           HA       GLU  68 -13.444  -8.449  -0.954
  528   1HB   GLU  68          2HB       GLU  68 -11.608  -8.166  -2.741
  529   2HB   GLU  68          3HB       GLU  68 -10.573  -9.149  -1.699
  530   1HG   GLU  68          2HG       GLU  68 -12.267 -11.005  -1.846
  531   2HG   GLU  68          3HG       GLU  68 -13.128 -10.047  -3.066
  Start of MODEL    4
    1   1H    MET   1           H1       MET   1  -8.424  -6.611   6.733
    2   2H    MET   1           H2       MET   1  -7.223  -6.256   7.818
    3   3H    MET   1           H3       MET   1  -6.870  -6.957   6.412
    4    HA   MET   1           HA       MET   1  -6.799  -8.452   8.316
    5   1HB   MET   1          2HB       MET   1  -9.756  -7.882   8.446
    6   2HB   MET   1          3HB       MET   1  -9.006  -9.350   9.110
    7   1HG   MET   1          2HG       MET   1  -7.435  -7.866  10.414
    8   2HG   MET   1          3HG       MET   1  -8.384  -6.471   9.886
    9   1HE   MET   1          1HE       MET   1 -10.914  -6.072  10.617
   10   2HE   MET   1          2HE       MET   1 -11.416  -7.703  10.091
   11   3HE   MET   1          3HE       MET   1 -11.792  -7.144  11.733
   12    HA   PRO   2           HA       PRO   2  -8.137 -10.940   4.593
   13   1HB   PRO   2          2HB       PRO   2 -10.338 -10.603   3.170
   14   2HB   PRO   2          3HB       PRO   2 -10.483 -11.206   4.820
   15   1HG   PRO   2          2HG       PRO   2 -10.800  -8.306   3.979
   16   2HG   PRO   2          3HG       PRO   2 -11.966  -9.308   4.885
   17   1HD   PRO   2          2HD       PRO   2 -10.108  -7.691   6.121
   18   2HD   PRO   2          3HD       PRO   2 -10.664  -9.239   6.836
   19    H    LYS   3           H        LYS   3  -9.399  -9.197   2.116
   20    HA   LYS   3           HA       LYS   3  -6.777  -7.942   1.617
   21   1HB   LYS   3          2HB       LYS   3  -7.517  -9.670   0.190
   22   2HB   LYS   3          3HB       LYS   3  -9.026  -8.803  -0.182
   23   1HG   LYS   3          2HG       LYS   3  -7.651  -6.992  -1.257
   24   2HG   LYS   3          3HG       LYS   3  -6.213  -7.991  -0.994
   25   1HD   LYS   3          2HD       LYS   3  -8.672  -8.664  -2.716
   26   2HD   LYS   3          3HD       LYS   3  -7.060  -8.226  -3.274
   27   1HE   LYS   3          2HE       LYS   3  -7.086 -10.565  -3.517
   28   2HE   LYS   3          3HE       LYS   3  -6.197 -10.301  -2.015
   29   1HZ   LYS   3          1HZ       LYS   3  -7.657 -11.872  -1.333
   30   2HZ   LYS   3          2HZ       LYS   3  -8.617 -10.614  -1.055
   31   3HZ   LYS   3          3HZ       LYS   3  -8.885 -11.416  -2.425
   32    H    HIS   4           H        HIS   4  -6.584  -5.840   0.896
   33    HA   HIS   4           HA       HIS   4  -8.945  -4.118   0.679
   34   1HB   HIS   4          2HB       HIS   4  -7.148  -2.506   2.074
   35   2HB   HIS   4          3HB       HIS   4  -8.666  -3.181   2.646
   36    HD1  HIS   4           1HD      HIS   4  -5.239  -4.989   2.358
   37    HD2  HIS   4           2HD      HIS   4  -8.435  -4.235   4.947
   38    HE1  HIS   4           1HE      HIS   4  -4.723  -6.238   4.506
   39    H    GLU   5           H        GLU   5  -8.738  -2.692  -0.954
   40    HA   GLU   5           HA       GLU   5  -6.301  -2.838  -2.646
   41   1HB   GLU   5          2HB       GLU   5  -9.275  -2.352  -3.020
   42   2HB   GLU   5          3HB       GLU   5  -8.137  -1.770  -4.224
   43   1HG   GLU   5          2HG       GLU   5  -7.768  -4.602  -3.355
   44   2HG   GLU   5          3HG       GLU   5  -9.195  -4.203  -4.322
   45    H    PHE   6           H        PHE   6  -5.261  -1.003  -3.341
   46    HA   PHE   6           HA       PHE   6  -6.324   1.626  -2.558
   47   1HB   PHE   6          2HB       PHE   6  -3.466   0.633  -2.076
   48   2HB   PHE   6          3HB       PHE   6  -4.031   2.230  -1.669
   49    HD1  PHE   6           1HD      PHE   6  -4.628   2.636   0.632
   50    HD2  PHE   6           2HD      PHE   6  -4.423  -1.421  -0.851
   51    HE1  PHE   6           1HE      PHE   6  -4.777   1.762   2.928
   52    HE2  PHE   6           2HE      PHE   6  -4.716  -2.267   1.438
   53    HZ   PHE   6           HZ       PHE   6  -4.940  -0.681   3.341
   54    H    SER   7           H        SER   7  -6.033   3.106  -4.150
   55    HA   SER   7           HA       SER   7  -4.524   2.254  -6.588
   56   1HB   SER   7          2HB       SER   7  -6.982   2.978  -6.828
   57   2HB   SER   7          3HB       SER   7  -6.409   4.623  -6.464
   58    HG   SER   7           HG       SER   7  -4.957   4.336  -8.279
   59    H    VAL   8           H        VAL   8  -2.804   3.493  -7.279
   60    HA   VAL   8           HA       VAL   8  -1.867   5.724  -5.572
   61    HB   VAL   8           HB       VAL   8  -0.288   3.306  -6.618
   62   1HG1  VAL   8          1HG1      VAL   8   1.188   4.023  -4.621
   63   2HG1  VAL   8          2HG1      VAL   8   1.198   5.010  -6.075
   64   3HG1  VAL   8          3HG1      VAL   8   0.261   5.541  -4.654
   65   1HG2  VAL   8          1HG2      VAL   8  -0.380   2.535  -4.165
   66   2HG2  VAL   8          2HG2      VAL   8  -1.788   3.588  -4.007
   67   3HG2  VAL   8          3HG2      VAL   8  -1.800   2.241  -5.160
   68    H    ASP   9           H        ASP   9   0.188   6.715  -6.837
   69    HA   ASP   9           HA       ASP   9   0.173   5.967  -9.643
   70   1HB   ASP   9          2HB       ASP   9  -0.857   8.240  -9.525
   71   2HB   ASP   9          3HB       ASP   9   0.640   8.847  -8.806
   72    H    MET  10           H        MET  10   2.317   6.229 -10.526
   73    HA   MET  10           HA       MET  10   4.584   6.154  -8.647
   74   1HB   MET  10          2HB       MET  10   3.707   3.643 -10.162
   75   2HB   MET  10          3HB       MET  10   5.210   3.847  -9.264
   76   1HG   MET  10          2HG       MET  10   3.755   4.417  -7.234
   77   2HG   MET  10          3HG       MET  10   2.388   3.785  -8.153
   78   1HE   MET  10          1HE       MET  10   3.148   1.130  -5.352
   79   2HE   MET  10          2HE       MET  10   3.321   2.892  -5.264
   80   3HE   MET  10          3HE       MET  10   1.903   2.170  -6.077
   81    H    THR  11           H        THR  11   5.860   7.550  -9.730
   82    HA   THR  11           HA       THR  11   5.968   7.683 -12.615
   83    HB   THR  11           HB       THR  11   7.831   9.352 -11.893
   84    HG1  THR  11           1HG      THR  11   7.660   9.871  -9.649
   85   1HG2  THR  11          1HG2      THR  11   5.525  10.053 -12.486
   86   2HG2  THR  11          2HG2      THR  11   4.980   9.713 -10.832
   87   3HG2  THR  11          3HG2      THR  11   6.152  11.014 -11.134
   88    H    CYS  12           H        CYS  12   7.786   5.994 -10.056
   89    HA   CYS  12           HA       CYS  12   9.537   4.782 -12.116
   90   1HB   CYS  12          2HB       CYS  12  10.807   6.743 -11.281
   91   2HB   CYS  12          3HB       CYS  12  10.504   6.236  -9.602
   92    HG   CYS  12           HG       CYS  12  12.968   5.723 -10.203
   93    H    GLY  13           H        GLY  13  10.381   2.721 -11.325
   94   1HA   GLY  13          2HA       GLY  13   8.793   1.098  -9.716
   95   2HA   GLY  13          3HA       GLY  13  10.527   0.862  -9.996
   96    H    GLY  14           H        GLY  14  11.479   3.262  -8.702
   97   1HA   GLY  14          2HA       GLY  14  11.680   2.439  -6.034
   98   2HA   GLY  14          3HA       GLY  14  12.047   4.073  -6.623
   99    H    CYS  15           H        CYS  15   9.110   4.311  -7.580
  100    HA   CYS  15           HA       CYS  15   8.072   5.526  -5.210
  101   1HB   CYS  15          2HB       CYS  15   7.535   6.296  -7.467
  102   2HB   CYS  15          3HB       CYS  15   6.513   4.846  -7.678
  103    HG   CYS  15           HG       CYS  15   5.131   5.267  -5.436
  104    H    ALA  16           H        ALA  16   7.904   2.265  -6.621
  105    HA   ALA  16           HA       ALA  16   5.710   1.353  -4.937
  106   1HB   ALA  16          1HB       ALA  16   6.413  -0.893  -5.591
  107   2HB   ALA  16          2HB       ALA  16   6.297   0.141  -7.028
  108   3HB   ALA  16          3HB       ALA  16   7.882  -0.277  -6.340
  109    H    GLU  17           H        GLU  17   9.313   0.951  -4.880
  110    HA   GLU  17           HA       GLU  17   9.616  -0.228  -2.409
  111   1HB   GLU  17          2HB       GLU  17  11.270   1.878  -3.832
  112   2HB   GLU  17          3HB       GLU  17  11.757   1.197  -2.294
  113   1HG   GLU  17          2HG       GLU  17  10.928  -0.919  -4.203
  114   2HG   GLU  17          3HG       GLU  17  12.239   0.084  -4.816
  115    H    ALA  18           H        ALA  18   9.094   3.269  -2.999
  116    HA   ALA  18           HA       ALA  18   9.372   4.230  -0.386
  117   1HB   ALA  18          1HB       ALA  18   7.180   5.039  -2.340
  118   2HB   ALA  18          2HB       ALA  18   7.802   5.993  -0.988
  119   3HB   ALA  18          3HB       ALA  18   8.855   5.643  -2.379
  120    H    VAL  19           H        VAL  19   6.525   2.636  -1.845
  121    HA   VAL  19           HA       VAL  19   4.892   2.839   0.544
  122    HB   VAL  19           HB       VAL  19   4.548   1.299  -2.065
  123   1HG1  VAL  19          1HG1      VAL  19   2.182   1.083  -1.347
  124   2HG1  VAL  19          2HG1      VAL  19   3.282   0.144  -0.355
  125   3HG1  VAL  19          3HG1      VAL  19   2.622   1.696   0.251
  126   1HG2  VAL  19          1HG2      VAL  19   3.271   3.867  -1.023
  127   2HG2  VAL  19          2HG2      VAL  19   4.471   3.764  -2.329
  128   3HG2  VAL  19          3HG2      VAL  19   2.870   3.045  -2.545
  129    H    SER  20           H        SER  20   6.483   0.137  -1.264
  130    HA   SER  20           HA       SER  20   5.815  -1.946   0.391
  131   1HB   SER  20          2HB       SER  20   8.480  -1.633  -1.043
  132   2HB   SER  20          3HB       SER  20   7.626  -3.140  -0.694
  133    HG   SER  20           HG       SER  20   5.902  -2.321  -2.032
  134    H    ARG  21           H        ARG  21   8.602   0.282   0.813
  135    HA   ARG  21           HA       ARG  21   9.725  -1.168   3.005
  136   1HB   ARG  21          2HB       ARG  21  10.134   1.676   2.042
  137   2HB   ARG  21          3HB       ARG  21  11.058   0.911   3.351
  138   1HG   ARG  21          2HG       ARG  21  11.748  -0.923   1.822
  139   2HG   ARG  21          3HG       ARG  21  10.874  -0.172   0.493
  140   1HD   ARG  21          2HD       ARG  21  12.312   1.874   0.763
  141   2HD   ARG  21          3HD       ARG  21  13.241   0.976   1.996
  142    HE   ARG  21           HE       ARG  21  12.933  -0.408  -0.590
  143   1HH1  ARG  21          2HH2      ARG  21  14.916   1.930   1.154
  144   2HH1  ARG  21          1HH2      ARG  21  16.339   1.682   0.186
  145   1HH2  ARG  21          2HH1      ARG  21  14.740  -0.624  -2.001
  146   2HH2  ARG  21          1HH1      ARG  21  16.250   0.132  -1.617
  147    H    VAL  22           H        VAL  22   7.532   1.840   3.051
  148    HA   VAL  22           HA       VAL  22   7.575   1.922   5.853
  149    HB   VAL  22           HB       VAL  22   7.060   3.816   4.408
  150   1HG1  VAL  22          1HG1      VAL  22   5.690   2.859   2.677
  151   2HG1  VAL  22          2HG1      VAL  22   4.462   2.340   3.857
  152   3HG1  VAL  22          3HG1      VAL  22   4.722   4.054   3.537
  153   1HG2  VAL  22          1HG2      VAL  22   6.323   3.705   6.756
  154   2HG2  VAL  22          2HG2      VAL  22   5.258   4.708   5.728
  155   3HG2  VAL  22          3HG2      VAL  22   4.745   3.073   6.196
  156    H    LEU  23           H        LEU  23   5.421   0.181   3.506
  157    HA   LEU  23           HA       LEU  23   3.710  -0.880   5.574
  158   1HB   LEU  23          2HB       LEU  23   4.408  -1.701   2.733
  159   2HB   LEU  23          3HB       LEU  23   3.573  -2.804   3.795
  160    HG   LEU  23           HG       LEU  23   1.960  -1.821   2.477
  161   1HD1  LEU  23          1HD1      LEU  23   1.354  -2.177   4.905
  162   2HD1  LEU  23          2HD1      LEU  23   1.644  -0.443   5.183
  163   3HD1  LEU  23          3HD1      LEU  23   0.385  -0.948   4.063
  164   1HD2  LEU  23          1HD2      LEU  23   2.835   0.881   3.485
  165   2HD2  LEU  23          2HD2      LEU  23   3.190   0.169   1.895
  166   3HD2  LEU  23          3HD2      LEU  23   1.511   0.536   2.336
  167    H    ASN  24           H        ASN  24   6.764  -2.220   4.133
  168    HA   ASN  24           HA       ASN  24   6.830  -4.562   5.714
  169   1HB   ASN  24          2HB       ASN  24   8.415  -4.478   4.032
  170   2HB   ASN  24          3HB       ASN  24   8.914  -2.831   4.411
  171   1HD2  ASN  24          1HD2      ASN  24  10.188  -2.413   6.265
  172   2HD2  ASN  24          2HD2      ASN  24  11.256  -3.675   6.899
  173    H    LYS  25           H        LYS  25   7.969  -1.281   6.487
  174    HA   LYS  25           HA       LYS  25   9.034  -1.751   9.043
  175   1HB   LYS  25          2HB       LYS  25   7.821   0.614   7.604
  176   2HB   LYS  25          3HB       LYS  25   8.050   0.752   9.335
  177   1HG   LYS  25          2HG       LYS  25  10.276  -0.087   7.423
  178   2HG   LYS  25          3HG       LYS  25   9.929   1.601   7.824
  179   1HD   LYS  25          2HD       LYS  25  10.271   1.139  10.233
  180   2HD   LYS  25          3HD       LYS  25  10.671  -0.548   9.869
  181   1HE   LYS  25          2HE       LYS  25  12.590   0.211   8.463
  182   2HE   LYS  25          3HE       LYS  25  12.209   1.895   8.863
  183   1HZ   LYS  25          1HZ       LYS  25  12.643   1.374  11.172
  184   2HZ   LYS  25          2HZ       LYS  25  12.996  -0.190  10.796
  185   3HZ   LYS  25          3HZ       LYS  25  13.952   1.025  10.244
  186    H    LEU  26           H        LEU  26   5.658  -1.407   8.088
  187    HA   LEU  26           HA       LEU  26   4.465  -1.081  10.589
  188   1HB   LEU  26          2HB       LEU  26   3.490  -1.233   8.181
  189   2HB   LEU  26          3HB       LEU  26   3.365  -2.948   8.423
  190    HG   LEU  26           HG       LEU  26   1.403  -1.296   8.792
  191   1HD1  LEU  26          1HD1      LEU  26   0.222  -2.846  10.162
  192   2HD1  LEU  26          2HD1      LEU  26   1.187  -3.683   8.934
  193   3HD1  LEU  26          3HD1      LEU  26   1.740  -3.661  10.630
  194   1HD2  LEU  26          1HD2      LEU  26   0.908  -0.682  11.067
  195   2HD2  LEU  26          2HD2      LEU  26   2.385  -1.452  11.672
  196   3HD2  LEU  26          3HD2      LEU  26   2.487   0.011  10.667
  197    H    GLY  27           H        GLY  27   5.713  -4.004   9.025
  198   1HA   GLY  27          2HA       GLY  27   6.430  -5.308  11.350
  199   2HA   GLY  27          3HA       GLY  27   4.736  -5.783  11.123
  200    H    GLY  28           H        GLY  28   4.162  -7.143   9.394
  201   1HA   GLY  28          2HA       GLY  28   6.261  -8.280   7.627
  202   2HA   GLY  28          3HA       GLY  28   5.484  -9.362   8.802
  203    H    VAL  29           H        VAL  29   4.061  -6.614   7.167
  204    HA   VAL  29           HA       VAL  29   1.659  -7.923   6.455
  205    HB   VAL  29           HB       VAL  29   1.753  -5.571   6.916
  206   1HG1  VAL  29          1HG1      VAL  29   3.528  -5.243   4.475
  207   2HG1  VAL  29          2HG1      VAL  29   2.825  -3.951   5.482
  208   3HG1  VAL  29          3HG1      VAL  29   4.046  -5.028   6.150
  209   1HG2  VAL  29          1HG2      VAL  29   0.061  -6.343   5.215
  210   2HG2  VAL  29          2HG2      VAL  29   0.516  -4.638   5.064
  211   3HG2  VAL  29          3HG2      VAL  29   1.180  -5.832   3.937
  212    H    LYS  30           H        LYS  30   0.922  -8.813   4.596
  213    HA   LYS  30           HA       LYS  30   2.782  -9.226   2.343
  214   1HB   LYS  30          2HB       LYS  30   1.234 -11.035   3.536
  215   2HB   LYS  30          3HB       LYS  30   0.051 -10.455   2.360
  216   1HG   LYS  30          2HG       LYS  30   2.871 -11.444   1.760
  217   2HG   LYS  30          3HG       LYS  30   1.418 -12.426   1.606
  218   1HD   LYS  30          2HD       LYS  30   0.691 -11.394  -0.330
  219   2HD   LYS  30          3HD       LYS  30   1.418  -9.847   0.050
  220   1HE   LYS  30          2HE       LYS  30   3.693 -10.778  -0.333
  221   2HE   LYS  30          3HE       LYS  30   2.933 -12.297  -0.886
  222   1HZ   LYS  30          1HZ       LYS  30   1.719 -10.797  -2.530
  223   2HZ   LYS  30          2HZ       LYS  30   2.683  -9.603  -2.077
  224   3HZ   LYS  30          3HZ       LYS  30   3.322 -10.909  -2.821
  225    H    TYR  31           H        TYR  31   2.788  -7.620   1.040
  226    HA   TYR  31           HA       TYR  31   0.292  -6.348   0.006
  227   1HB   TYR  31          2HB       TYR  31   1.957  -4.623  -0.887
  228   2HB   TYR  31          3HB       TYR  31   1.504  -4.588   0.805
  229    HD1  TYR  31           HD1      TYR  31   4.266  -6.074  -1.371
  230    HD2  TYR  31           HD2      TYR  31   3.095  -4.428   2.421
  231    HE1  TYR  31           HE1      TYR  31   6.643  -5.830  -0.750
  232    HE2  TYR  31           HE2      TYR  31   5.491  -4.206   3.061
  233    HH   TYR  31           HH       TYR  31   7.585  -3.924   2.075
  234    H    ASP  32           H        ASP  32   0.114  -6.164  -2.273
  235    HA   ASP  32           HA       ASP  32   2.260  -7.250  -3.976
  236   1HB   ASP  32          2HB       ASP  32  -0.707  -7.948  -3.981
  237   2HB   ASP  32          3HB       ASP  32   0.233  -7.936  -5.474
  238    H    ILE  33           H        ILE  33   2.806  -5.728  -5.412
  239    HA   ILE  33           HA       ILE  33   1.111  -3.271  -5.617
  240    HB   ILE  33           HB       ILE  33   4.143  -3.518  -5.608
  241   1HG1  ILE  33          2HG1      ILE  33   3.545  -1.809  -3.572
  242   2HG1  ILE  33          3HG1      ILE  33   2.107  -2.832  -3.492
  243   1HG2  ILE  33          1HG2      ILE  33   4.080  -1.058  -5.625
  244   2HG2  ILE  33          2HG2      ILE  33   3.400  -1.729  -7.109
  245   3HG2  ILE  33          3HG2      ILE  33   2.314  -1.102  -5.848
  246   1HD1  ILE  33          1HD1      ILE  33   3.549  -4.816  -3.195
  247   2HD1  ILE  33          2HD1      ILE  33   4.996  -3.809  -3.434
  248   3HD1  ILE  33          3HD1      ILE  33   3.959  -3.551  -2.016
  249    H    ASP  34           H        ASP  34   0.114  -3.410  -7.535
  250    HA   ASP  34           HA       ASP  34   1.495  -4.428  -9.945
  251   1HB   ASP  34          2HB       ASP  34  -0.929  -4.749  -9.705
  252   2HB   ASP  34          3HB       ASP  34  -1.147  -2.999  -9.537
  253    H    LEU  35           H        LEU  35   3.114  -3.159 -10.583
  254    HA   LEU  35           HA       LEU  35   3.307  -0.355  -9.981
  255   1HB   LEU  35          2HB       LEU  35   5.258  -1.781  -9.970
  256   2HB   LEU  35          3HB       LEU  35   5.023  -2.207 -11.665
  257    HG   LEU  35           HG       LEU  35   5.487   0.138 -12.335
  258   1HD1  LEU  35          1HD1      LEU  35   6.056   0.582  -9.365
  259   2HD1  LEU  35          2HD1      LEU  35   6.467   1.711 -10.668
  260   3HD1  LEU  35          3HD1      LEU  35   4.772   1.365 -10.316
  261   1HD2  LEU  35          1HD2      LEU  35   7.618  -1.071 -10.522
  262   2HD2  LEU  35          2HD2      LEU  35   7.304  -1.538 -12.208
  263   3HD2  LEU  35          3HD2      LEU  35   7.889   0.093 -11.837
  264    HA   PRO  36           HA       PRO  36   2.721   0.286 -14.717
  265   1HB   PRO  36          2HB       PRO  36   0.968  -1.464 -16.023
  266   2HB   PRO  36          3HB       PRO  36   2.748  -1.475 -16.128
  267   1HG   PRO  36          2HG       PRO  36   0.975  -3.156 -14.374
  268   2HG   PRO  36          3HG       PRO  36   2.414  -3.665 -15.294
  269   1HD   PRO  36          2HD       PRO  36   2.555  -3.211 -12.671
  270   2HD   PRO  36          3HD       PRO  36   3.884  -2.658 -13.721
  271    H    ASN  37           H        ASN  37   0.007  -1.367 -12.990
  272    HA   ASN  37           HA       ASN  37  -1.870   0.764 -13.827
  273   1HB   ASN  37          2HB       ASN  37  -2.364  -1.743 -12.191
  274   2HB   ASN  37          3HB       ASN  37  -3.574  -0.633 -12.803
  275   1HD2  ASN  37          1HD2      ASN  37  -1.910  -3.522 -13.524
  276   2HD2  ASN  37          2HD2      ASN  37  -2.271  -3.563 -15.250
  277    H    LYS  38           H        LYS  38   0.188   0.098 -11.096
  278    HA   LYS  38           HA       LYS  38   0.514   1.181  -9.162
  279   1HB   LYS  38          2HB       LYS  38  -1.229   3.413 -10.264
  280   2HB   LYS  38          3HB       LYS  38  -0.137   3.443  -8.873
  281   1HG   LYS  38          2HG       LYS  38   1.379   4.227 -10.313
  282   2HG   LYS  38          3HG       LYS  38   1.608   2.542 -10.725
  283   1HD   LYS  38          2HD       LYS  38  -0.089   2.880 -12.569
  284   2HD   LYS  38          3HD       LYS  38  -0.184   4.596 -12.127
  285   1HE   LYS  38          2HE       LYS  38   2.086   5.007 -12.766
  286   2HE   LYS  38          3HE       LYS  38   2.484   3.280 -12.792
  287   1HZ   LYS  38          1HZ       LYS  38   0.671   4.601 -14.678
  288   2HZ   LYS  38          2HZ       LYS  38   2.210   4.085 -14.992
  289   3HZ   LYS  38          3HZ       LYS  38   1.028   2.984 -14.631
  290    H    LYS  39           H        LYS  39  -0.972  -0.815  -8.843
  291    HA   LYS  39           HA       LYS  39  -3.160   0.064  -6.976
  292   1HB   LYS  39          2HB       LYS  39  -3.071  -2.358  -8.791
  293   2HB   LYS  39          3HB       LYS  39  -4.089  -2.260  -7.347
  294   1HG   LYS  39          2HG       LYS  39  -5.308  -0.386  -8.183
  295   2HG   LYS  39          3HG       LYS  39  -4.152  -0.108  -9.483
  296   1HD   LYS  39          2HD       LYS  39  -6.277  -1.240 -10.256
  297   2HD   LYS  39          3HD       LYS  39  -4.778  -2.062 -10.678
  298   1HE   LYS  39          2HE       LYS  39  -6.509  -3.655  -9.974
  299   2HE   LYS  39          3HE       LYS  39  -5.085  -3.753  -8.943
  300   1HZ   LYS  39          1HZ       LYS  39  -7.547  -2.282  -8.196
  301   2HZ   LYS  39          2HZ       LYS  39  -7.187  -3.803  -7.704
  302   3HZ   LYS  39          3HZ       LYS  39  -6.285  -2.631  -7.191
  303    H    VAL  40           H        VAL  40  -2.420  -0.135  -4.946
  304    HA   VAL  40           HA       VAL  40  -0.465  -2.226  -4.218
  305    HB   VAL  40           HB       VAL  40  -1.539   0.345  -3.094
  306   1HG1  VAL  40          1HG1      VAL  40  -0.399  -0.173  -0.948
  307   2HG1  VAL  40          2HG1      VAL  40  -1.865  -1.106  -1.289
  308   3HG1  VAL  40          3HG1      VAL  40  -0.268  -1.872  -1.494
  309   1HG2  VAL  40          1HG2      VAL  40   1.318  -0.666  -3.213
  310   2HG2  VAL  40          2HG2      VAL  40   0.559   0.252  -4.530
  311   3HG2  VAL  40          3HG2      VAL  40   0.741   0.989  -2.936
  312    H    CYS  41           H        CYS  41  -1.377  -4.021  -3.526
  313    HA   CYS  41           HA       CYS  41  -4.224  -4.054  -2.583
  314   1HB   CYS  41          2HB       CYS  41  -3.046  -6.437  -3.998
  315   2HB   CYS  41          3HB       CYS  41  -4.735  -5.891  -3.852
  316    HG   CYS  41           HG       CYS  41  -2.283  -4.610  -5.652
  317    H    ILE  42           H        ILE  42  -4.226  -4.750  -0.453
  318    HA   ILE  42           HA       ILE  42  -1.802  -6.251   0.507
  319    HB   ILE  42           HB       ILE  42  -3.375  -4.161   2.041
  320   1HG1  ILE  42          2HG1      ILE  42  -0.763  -3.916   0.493
  321   2HG1  ILE  42          3HG1      ILE  42  -2.259  -3.011   0.228
  322   1HG2  ILE  42          1HG2      ILE  42  -0.692  -5.473   2.602
  323   2HG2  ILE  42          2HG2      ILE  42  -1.559  -4.349   3.669
  324   3HG2  ILE  42          3HG2      ILE  42  -2.212  -5.951   3.386
  325   1HD1  ILE  42          1HD1      ILE  42  -1.993  -1.940   2.465
  326   2HD1  ILE  42          2HD1      ILE  42  -0.405  -2.741   2.612
  327   3HD1  ILE  42          3HD1      ILE  42  -0.693  -1.569   1.321
  328    H    GLU  43           H        GLU  43  -2.185  -7.991   1.824
  329    HA   GLU  43           HA       GLU  43  -4.988  -8.596   2.614
  330   1HB   GLU  43          2HB       GLU  43  -4.536  -9.489   0.309
  331   2HB   GLU  43          3HB       GLU  43  -3.249 -10.494   0.973
  332   1HG   GLU  43          2HG       GLU  43  -4.845 -11.801   2.238
  333   2HG   GLU  43          3HG       GLU  43  -6.143 -10.634   1.928
  334    H    SER  44           H        SER  44  -4.473  -8.323   4.774
  335    HA   SER  44           HA       SER  44  -2.772 -10.279   6.065
  336   1HB   SER  44          2HB       SER  44  -1.908  -7.363   5.874
  337   2HB   SER  44          3HB       SER  44  -1.263  -8.479   7.089
  338    HG   SER  44           HG       SER  44  -1.203  -9.489   4.533
  339    H    GLU  45           H        GLU  45  -2.811 -10.129   8.335
  340    HA   GLU  45           HA       GLU  45  -5.254  -9.335   9.558
  341   1HB   GLU  45          2HB       GLU  45  -2.642 -10.338  10.742
  342   2HB   GLU  45          3HB       GLU  45  -4.210 -10.275  11.556
  343   1HG   GLU  45          2HG       GLU  45  -5.164 -11.826   9.866
  344   2HG   GLU  45          3HG       GLU  45  -3.588 -11.944   9.064
  345    H    HIS  46           H        HIS  46  -4.669  -6.983   8.636
  346    HA   HIS  46           HA       HIS  46  -4.000  -5.326  11.004
  347   1HB   HIS  46          2HB       HIS  46  -3.114  -4.749   8.140
  348   2HB   HIS  46          3HB       HIS  46  -2.782  -3.759   9.566
  349    HD1  HIS  46           1HD      HIS  46  -1.730  -6.232  11.430
  350    HD2  HIS  46           2HD      HIS  46  -0.704  -5.493   7.428
  351    HE1  HIS  46           1HE      HIS  46   0.583  -7.246  11.066
  352    H    SER  47           H        SER  47  -5.291  -3.163  10.774
  353    HA   SER  47           HA       SER  47  -7.749  -3.747   9.215
  354   1HB   SER  47          2HB       SER  47  -7.866  -2.857  11.590
  355   2HB   SER  47          3HB       SER  47  -7.346  -1.296  10.916
  356    HG   SER  47           HG       SER  47  -9.373  -1.098  10.312
  357    H    MET  48           H        MET  48  -8.644  -1.917   8.033
  358    HA   MET  48           HA       MET  48  -7.006  -1.000   5.839
  359   1HB   MET  48          2HB       MET  48  -9.619   0.092   6.984
  360   2HB   MET  48          3HB       MET  48  -8.946   0.497   5.396
  361   1HG   MET  48          2HG       MET  48  -9.135  -1.833   4.683
  362   2HG   MET  48          3HG       MET  48  -9.766  -2.310   6.265
  363   1HE   MET  48          1HE       MET  48 -13.328  -0.716   6.291
  364   2HE   MET  48          2HE       MET  48 -12.113  -1.622   7.221
  365   3HE   MET  48          3HE       MET  48 -11.881   0.115   6.891
  366    H    ASP  49           H        ASP  49  -8.254   0.422   8.835
  367    HA   ASP  49           HA       ASP  49  -7.256   2.985   8.777
  368   1HB   ASP  49          2HB       ASP  49  -7.365   1.304  11.318
  369   2HB   ASP  49          3HB       ASP  49  -7.686   3.026  11.122
  370    H    THR  50           H        THR  50  -5.818   0.138  10.196
  371    HA   THR  50           HA       THR  50  -3.427   1.127  11.221
  372    HB   THR  50           HB       THR  50  -3.659  -1.590   9.868
  373    HG1  THR  50           1HG      THR  50  -4.842  -0.824  12.315
  374   1HG2  THR  50          1HG2      THR  50  -2.380  -2.352  11.826
  375   2HG2  THR  50          2HG2      THR  50  -1.521  -1.048  10.987
  376   3HG2  THR  50          3HG2      THR  50  -2.390  -0.708  12.499
  377    H    LEU  51           H        LEU  51  -4.040  -0.356   8.008
  378    HA   LEU  51           HA       LEU  51  -1.370   0.028   7.046
  379   1HB   LEU  51          2HB       LEU  51  -3.974  -0.319   5.518
  380   2HB   LEU  51          3HB       LEU  51  -2.345  -0.448   4.818
  381    HG   LEU  51           HG       LEU  51  -3.341  -2.186   7.138
  382   1HD1  LEU  51          1HD1      LEU  51  -3.395  -2.796   4.167
  383   2HD1  LEU  51          2HD1      LEU  51  -3.685  -3.964   5.476
  384   3HD1  LEU  51          3HD1      LEU  51  -4.794  -2.600   5.244
  385   1HD2  LEU  51          1HD2      LEU  51  -0.991  -2.470   5.239
  386   2HD2  LEU  51          2HD2      LEU  51  -0.895  -2.138   6.989
  387   3HD2  LEU  51          3HD2      LEU  51  -1.509  -3.687   6.408
  388    H    LEU  52           H        LEU  52  -4.389   1.833   6.343
  389    HA   LEU  52           HA       LEU  52  -3.394   3.875   4.739
  390   1HB   LEU  52          2HB       LEU  52  -5.607   3.644   6.757
  391   2HB   LEU  52          3HB       LEU  52  -5.178   5.265   6.245
  392    HG   LEU  52           HG       LEU  52  -5.924   3.060   4.299
  393   1HD1  LEU  52          1HD1      LEU  52  -7.794   3.526   5.816
  394   2HD1  LEU  52          2HD1      LEU  52  -7.641   5.268   5.499
  395   3HD1  LEU  52          3HD1      LEU  52  -8.129   4.161   4.198
  396   1HD2  LEU  52          1HD2      LEU  52  -6.341   5.088   2.808
  397   2HD2  LEU  52          2HD2      LEU  52  -5.628   6.104   4.063
  398   3HD2  LEU  52          3HD2      LEU  52  -4.641   4.889   3.227
  399    H    ALA  53           H        ALA  53  -3.738   4.046   8.316
  400    HA   ALA  53           HA       ALA  53  -2.491   6.537   8.582
  401   1HB   ALA  53          1HB       ALA  53  -3.884   5.478  10.340
  402   2HB   ALA  53          2HB       ALA  53  -2.630   4.246  10.600
  403   3HB   ALA  53          3HB       ALA  53  -2.299   5.948  10.987
  404    H    THR  54           H        THR  54  -1.037   3.272   8.750
  405    HA   THR  54           HA       THR  54   1.600   4.152   9.364
  406    HB   THR  54           HB       THR  54   0.619   1.735   7.775
  407    HG1  THR  54           1HG      THR  54  -0.134   1.697   9.819
  408   1HG2  THR  54          1HG2      THR  54   2.832   0.791   8.447
  409   2HG2  THR  54          2HG2      THR  54   2.939   2.058   7.231
  410   3HG2  THR  54          3HG2      THR  54   3.356   2.410   8.930
  411    H    LEU  55           H        LEU  55   0.107   3.454   6.142
  412    HA   LEU  55           HA       LEU  55   2.574   3.963   4.809
  413   1HB   LEU  55          2HB       LEU  55   1.512   3.364   2.874
  414   2HB   LEU  55          3HB       LEU  55   1.041   2.281   4.160
  415    HG   LEU  55           HG       LEU  55  -1.107   3.790   4.287
  416   1HD1  LEU  55          1HD1      LEU  55  -1.652   4.670   2.027
  417   2HD1  LEU  55          2HD1      LEU  55  -0.226   5.467   2.719
  418   3HD1  LEU  55          3HD1      LEU  55   0.011   4.200   1.528
  419   1HD2  LEU  55          1HD2      LEU  55  -0.542   1.880   1.967
  420   2HD2  LEU  55          2HD2      LEU  55  -1.015   1.381   3.605
  421   3HD2  LEU  55          3HD2      LEU  55  -2.151   2.300   2.592
  422    H    LYS  56           H        LYS  56  -0.275   5.845   5.326
  423    HA   LYS  56           HA       LYS  56  -0.402   7.967   3.823
  424   1HB   LYS  56          2HB       LYS  56  -1.333   7.548   6.294
  425   2HB   LYS  56          3HB       LYS  56  -0.032   8.625   6.766
  426   1HG   LYS  56          2HG       LYS  56  -1.007  10.289   5.071
  427   2HG   LYS  56          3HG       LYS  56  -2.340   9.122   4.857
  428   1HD   LYS  56          2HD       LYS  56  -2.818   9.227   7.293
  429   2HD   LYS  56          3HD       LYS  56  -1.535  10.441   7.486
  430   1HE   LYS  56          2HE       LYS  56  -2.751  11.975   5.941
  431   2HE   LYS  56          3HE       LYS  56  -4.013  10.755   5.706
  432   1HZ   LYS  56          1HZ       LYS  56  -3.380  12.077   8.263
  433   2HZ   LYS  56          2HZ       LYS  56  -4.668  12.401   7.296
  434   3HZ   LYS  56          3HZ       LYS  56  -4.552  10.940   8.036
  435    H    LYS  57           H        LYS  57   2.181   7.549   6.083
  436    HA   LYS  57           HA       LYS  57   3.562   9.935   6.260
  437   1HB   LYS  57          2HB       LYS  57   4.498   7.063   6.228
  438   2HB   LYS  57          3HB       LYS  57   5.527   8.429   6.735
  439   1HG   LYS  57          2HG       LYS  57   3.868   8.985   8.492
  440   2HG   LYS  57          3HG       LYS  57   2.836   7.659   7.939
  441   1HD   LYS  57          2HD       LYS  57   4.699   6.044   8.369
  442   2HD   LYS  57          3HD       LYS  57   5.560   7.348   9.219
  443   1HE   LYS  57          2HE       LYS  57   3.671   7.585  10.802
  444   2HE   LYS  57          3HE       LYS  57   2.694   6.441   9.867
  445   1HZ   LYS  57          1HZ       LYS  57   4.237   4.715  10.417
  446   2HZ   LYS  57          2HZ       LYS  57   5.161   5.752  11.308
  447   3HZ   LYS  57          3HZ       LYS  57   3.624   5.402  11.777
  448    H    THR  58           H        THR  58   3.555   7.662   3.459
  449    HA   THR  58           HA       THR  58   5.902   8.636   2.178
  450    HB   THR  58           HB       THR  58   4.735   7.782   0.087
  451    HG1  THR  58           1HG      THR  58   2.567   8.162   0.798
  452   1HG2  THR  58          1HG2      THR  58   6.139   6.324   1.458
  453   2HG2  THR  58          2HG2      THR  58   4.765   6.005   2.537
  454   3HG2  THR  58          3HG2      THR  58   4.723   5.431   0.855
  455    H    GLY  59           H        GLY  59   2.663  10.020   2.445
  456   1HA   GLY  59          2HA       GLY  59   1.730  11.909   1.611
  457   2HA   GLY  59          3HA       GLY  59   3.387  12.554   1.534
  458    H    LYS  60           H        LYS  60   1.413  10.108  -0.231
  459    HA   LYS  60           HA       LYS  60   1.799  11.443  -2.816
  460   1HB   LYS  60          2HB       LYS  60   2.233   8.456  -2.313
  461   2HB   LYS  60          3HB       LYS  60   2.364   9.272  -3.874
  462   1HG   LYS  60          2HG       LYS  60   4.183   9.768  -1.474
  463   2HG   LYS  60          3HG       LYS  60   4.538   8.669  -2.774
  464   1HD   LYS  60          2HD       LYS  60   4.741  10.357  -4.406
  465   2HD   LYS  60          3HD       LYS  60   3.932  11.575  -3.427
  466   1HE   LYS  60          2HE       LYS  60   6.673  10.386  -2.778
  467   2HE   LYS  60          3HE       LYS  60   6.362  11.931  -3.582
  468   1HZ   LYS  60          1HZ       LYS  60   6.647  12.482  -1.356
  469   2HZ   LYS  60          2HZ       LYS  60   4.996  12.462  -1.519
  470   3HZ   LYS  60          3HZ       LYS  60   5.748  11.231  -0.789
  471    H    THR  61           H        THR  61   0.159  10.305  -4.407
  472    HA   THR  61           HA       THR  61  -2.370  10.422  -3.238
  473    HB   THR  61           HB       THR  61  -1.778   9.242  -5.960
  474    HG1  THR  61           1HG      THR  61  -1.377  11.974  -5.363
  475   1HG2  THR  61          1HG2      THR  61  -4.131   9.830  -5.368
  476   2HG2  THR  61          2HG2      THR  61  -3.620  11.497  -5.026
  477   3HG2  THR  61          3HG2      THR  61  -3.508  10.851  -6.678
  478    H    VAL  62           H        VAL  62  -0.988   8.206  -1.952
  479    HA   VAL  62           HA       VAL  62  -1.965   5.712  -3.148
  480    HB   VAL  62           HB       VAL  62   0.183   5.588  -2.246
  481   1HG1  VAL  62          1HG1      VAL  62   0.775   5.934   0.111
  482   2HG1  VAL  62          2HG1      VAL  62   0.318   7.430  -0.684
  483   3HG1  VAL  62          3HG1      VAL  62  -0.821   6.641   0.424
  484   1HG2  VAL  62          1HG2      VAL  62  -1.306   3.625  -1.891
  485   2HG2  VAL  62          2HG2      VAL  62   0.004   3.737  -0.720
  486   3HG2  VAL  62          3HG2      VAL  62  -1.653   4.198  -0.263
  487    H    SER  63           H        SER  63  -4.098   5.913  -3.210
  488    HA   SER  63           HA       SER  63  -5.660   6.792  -0.846
  489   1HB   SER  63          2HB       SER  63  -6.498   6.263  -3.732
  490   2HB   SER  63          3HB       SER  63  -7.398   7.172  -2.501
  491    HG   SER  63           HG       SER  63  -4.859   7.861  -3.638
  492    H    TYR  64           H        TYR  64  -7.403   5.426  -0.054
  493    HA   TYR  64           HA       TYR  64  -7.069   2.509  -0.553
  494   1HB   TYR  64          2HB       TYR  64  -6.885   3.079   1.746
  495   2HB   TYR  64          3HB       TYR  64  -8.257   4.186   1.659
  496    HD1  TYR  64           HD1      TYR  64 -10.366   3.476   2.362
  497    HD2  TYR  64           HD2      TYR  64  -7.475   0.538   1.093
  498    HE1  TYR  64           HE1      TYR  64 -12.081   1.718   2.536
  499    HE2  TYR  64           HE2      TYR  64  -9.207  -1.212   1.235
  500    HH   TYR  64           HH       TYR  64 -12.578  -0.503   2.166
  501    H    LEU  65           H        LEU  65  -8.646   1.369  -1.665
  502    HA   LEU  65           HA       LEU  65 -11.409   2.267  -1.660
  503   1HB   LEU  65          2HB       LEU  65 -11.492   2.168  -4.204
  504   2HB   LEU  65          3HB       LEU  65 -11.031   3.633  -3.376
  505    HG   LEU  65           HG       LEU  65  -9.755   3.098  -5.396
  506   1HD1  LEU  65          1HD1      LEU  65  -7.818   3.309  -3.199
  507   2HD1  LEU  65          2HD1      LEU  65  -7.843   4.140  -4.753
  508   3HD1  LEU  65          3HD1      LEU  65  -8.994   4.609  -3.495
  509   1HD2  LEU  65          1HD2      LEU  65  -8.418   0.884  -3.854
  510   2HD2  LEU  65          2HD2      LEU  65  -9.395   0.743  -5.337
  511   3HD2  LEU  65          3HD2      LEU  65  -7.844   1.559  -5.376
  512    H    GLY  66           H        GLY  66 -11.329   0.037  -0.503
  513   1HA   GLY  66          2HA       GLY  66 -13.269  -1.330  -1.222
  514   2HA   GLY  66          3HA       GLY  66 -12.337  -1.828  -2.640
  515    H    LEU  67           H        LEU  67 -13.344  -3.752  -0.894
  516    HA   LEU  67           HA       LEU  67 -10.931  -4.940   0.160
  517   1HB   LEU  67          2HB       LEU  67 -11.723  -5.285   2.383
  518   2HB   LEU  67          3HB       LEU  67 -11.803  -3.555   2.074
  519    HG   LEU  67           HG       LEU  67 -14.158  -5.517   2.042
  520   1HD1  LEU  67          1HD1      LEU  67 -14.780  -4.457   4.160
  521   2HD1  LEU  67          2HD1      LEU  67 -13.162  -5.168   4.275
  522   3HD1  LEU  67          3HD1      LEU  67 -13.348  -3.411   4.082
  523   1HD2  LEU  67          1HD2      LEU  67 -14.770  -3.670   0.596
  524   2HD2  LEU  67          2HD2      LEU  67 -15.545  -3.400   2.152
  525   3HD2  LEU  67          3HD2      LEU  67 -14.084  -2.481   1.733
  526    H    GLU  68           H        GLU  68 -11.219  -7.221   0.690
  527    HA   GLU  68           HA       GLU  68 -13.633  -8.565  -0.294
  528   1HB   GLU  68          2HB       GLU  68 -12.109  -8.168  -2.280
  529   2HB   GLU  68          3HB       GLU  68 -10.821  -8.997  -1.409
  530   1HG   GLU  68          2HG       GLU  68 -12.273 -11.061  -1.333
  531   2HG   GLU  68          3HG       GLU  68 -13.417 -10.223  -2.394
  Start of MODEL    5
    1   1H    MET   1           H1       MET   1 -12.832 -10.838   3.207
    2   2H    MET   1           H2       MET   1 -12.420 -11.668   1.869
    3   3H    MET   1           H3       MET   1 -13.367 -12.397   2.989
    4    HA   MET   1           HA       MET   1 -11.601 -12.484   4.549
    5   1HB   MET   1          2HB       MET   1 -10.514 -13.139   1.774
    6   2HB   MET   1          3HB       MET   1  -9.846 -13.748   3.293
    7   1HG   MET   1          2HG       MET   1 -11.984 -14.908   3.769
    8   2HG   MET   1          3HG       MET   1 -12.640 -14.353   2.219
    9   1HE   MET   1          1HE       MET   1 -10.581 -16.353  -0.390
   10   2HE   MET   1          2HE       MET   1 -11.836 -15.120  -0.120
   11   3HE   MET   1          3HE       MET   1 -10.124 -14.746   0.206
   12    HA   PRO   2           HA       PRO   2  -9.834  -8.729   5.072
   13   1HB   PRO   2          2HB       PRO   2  -7.306  -9.162   6.191
   14   2HB   PRO   2          3HB       PRO   2  -8.882  -9.244   7.025
   15   1HG   PRO   2          2HG       PRO   2  -7.297 -11.512   5.803
   16   2HG   PRO   2          3HG       PRO   2  -8.095 -11.469   7.403
   17   1HD   PRO   2          2HD       PRO   2  -9.303 -12.696   5.382
   18   2HD   PRO   2          3HD       PRO   2 -10.269 -11.592   6.410
   19    H    LYS   3           H        LYS   3  -9.783  -8.044   2.916
   20    HA   LYS   3           HA       LYS   3  -7.082  -7.771   1.714
   21   1HB   LYS   3          2HB       LYS   3  -8.332  -9.769   0.832
   22   2HB   LYS   3          3HB       LYS   3  -9.578  -8.669   0.213
   23   1HG   LYS   3          2HG       LYS   3  -7.942  -7.606  -1.286
   24   2HG   LYS   3          3HG       LYS   3  -6.628  -8.521  -0.506
   25   1HD   LYS   3          2HD       LYS   3  -7.655 -10.639  -1.208
   26   2HD   LYS   3          3HD       LYS   3  -8.915  -9.757  -2.093
   27   1HE   LYS   3          2HE       LYS   3  -7.333  -8.897  -3.686
   28   2HE   LYS   3          3HE       LYS   3  -5.957  -9.224  -2.617
   29   1HZ   LYS   3          1HZ       LYS   3  -7.543 -11.333  -3.893
   30   2HZ   LYS   3          2HZ       LYS   3  -6.031 -10.832  -4.348
   31   3HZ   LYS   3          3HZ       LYS   3  -6.261 -11.523  -2.875
   32    H    HIS   4           H        HIS   4  -6.729  -5.884   0.607
   33    HA   HIS   4           HA       HIS   4  -8.871  -3.907   0.394
   34   1HB   HIS   4          2HB       HIS   4  -7.060  -2.496   1.877
   35   2HB   HIS   4          3HB       HIS   4  -8.576  -3.181   2.463
   36    HD1  HIS   4           1HD      HIS   4  -8.220  -5.780   3.607
   37    HD2  HIS   4           2HD      HIS   4  -4.998  -3.096   3.367
   38    HE1  HIS   4           1HE      HIS   4  -6.447  -6.626   5.231
   39    H    GLU   5           H        GLU   5  -8.512  -2.702  -1.325
   40    HA   GLU   5           HA       GLU   5  -5.820  -2.756  -2.600
   41   1HB   GLU   5          2HB       GLU   5  -8.623  -2.507  -3.757
   42   2HB   GLU   5          3HB       GLU   5  -7.149  -2.224  -4.669
   43   1HG   GLU   5          2HG       GLU   5  -6.449  -4.589  -3.830
   44   2HG   GLU   5          3HG       GLU   5  -8.122  -4.787  -3.313
   45    H    PHE   6           H        PHE   6  -4.980  -0.893  -3.477
   46    HA   PHE   6           HA       PHE   6  -6.239   1.697  -2.734
   47   1HB   PHE   6          2HB       PHE   6  -3.338   0.810  -2.304
   48   2HB   PHE   6          3HB       PHE   6  -3.934   2.427  -2.006
   49    HD1  PHE   6           1HD      PHE   6  -4.759   3.002   0.168
   50    HD2  PHE   6           2HD      PHE   6  -4.229  -1.149  -0.894
   51    HE1  PHE   6           1HE      PHE   6  -5.056   2.341   2.542
   52    HE2  PHE   6           2HE      PHE   6  -4.690  -1.805   1.427
   53    HZ   PHE   6           HZ       PHE   6  -5.045  -0.062   3.181
   54    H    SER   7           H        SER   7  -5.841   3.307  -4.224
   55    HA   SER   7           HA       SER   7  -4.333   2.601  -6.710
   56   1HB   SER   7          2HB       SER   7  -6.604   3.632  -6.988
   57   2HB   SER   7          3HB       SER   7  -5.989   5.086  -6.148
   58    HG   SER   7           HG       SER   7  -5.811   5.221  -8.444
   59    H    VAL   8           H        VAL   8  -2.324   3.600  -7.053
   60    HA   VAL   8           HA       VAL   8  -1.279   5.355  -4.892
   61    HB   VAL   8           HB       VAL   8  -0.007   2.844  -6.095
   62   1HG1  VAL   8          1HG1      VAL   8   1.514   4.713  -5.242
   63   2HG1  VAL   8          2HG1      VAL   8   0.719   4.569  -3.667
   64   3HG1  VAL   8          3HG1      VAL   8   1.658   3.204  -4.319
   65   1HG2  VAL   8          1HG2      VAL   8  -0.304   1.981  -3.712
   66   2HG2  VAL   8          2HG2      VAL   8  -1.465   3.277  -3.453
   67   3HG2  VAL   8          3HG2      VAL   8  -1.781   2.037  -4.685
   68    H    ASP   9           H        ASP   9  -0.395   7.141  -5.847
   69    HA   ASP   9           HA       ASP   9   0.435   7.245  -8.616
   70   1HB   ASP   9          2HB       ASP   9  -0.133   9.306  -7.625
   71   2HB   ASP   9          3HB       ASP   9   0.936   9.038  -6.228
   72    H    MET  10           H        MET  10   1.568   5.240  -8.683
   73    HA   MET  10           HA       MET  10   4.375   5.351  -7.734
   74   1HB   MET  10          2HB       MET  10   2.887   3.131  -9.181
   75   2HB   MET  10          3HB       MET  10   4.589   3.097  -8.672
   76   1HG   MET  10          2HG       MET  10   3.790   3.635  -6.312
   77   2HG   MET  10          3HG       MET  10   2.149   3.330  -6.895
   78   1HE   MET  10          1HE       MET  10   2.056  -0.438  -7.466
   79   2HE   MET  10          2HE       MET  10   1.108   1.038  -7.204
   80   3HE   MET  10          3HE       MET  10   2.169   0.909  -8.622
   81    H    THR  11           H        THR  11   4.843   7.244  -8.860
   82    HA   THR  11           HA       THR  11   4.440   7.534 -11.633
   83    HB   THR  11           HB       THR  11   6.486   9.247 -10.328
   84    HG1  THR  11           1HG      THR  11   3.905   9.233  -9.184
   85   1HG2  THR  11          1HG2      THR  11   5.186   9.904 -12.339
   86   2HG2  THR  11          2HG2      THR  11   3.683   9.819 -11.394
   87   3HG2  THR  11          3HG2      THR  11   4.919  11.026 -10.988
   88    H    CYS  12           H        CYS  12   7.146   6.242  -9.696
   89    HA   CYS  12           HA       CYS  12   8.597   5.524 -12.139
   90   1HB   CYS  12          2HB       CYS  12   9.469   7.774 -11.779
   91   2HB   CYS  12          3HB       CYS  12   9.771   7.446 -10.057
   92    HG   CYS  12           HG       CYS  12  11.619   5.804 -10.286
   93    H    GLY  13           H        GLY  13  10.193   3.891 -11.611
   94   1HA   GLY  13          2HA       GLY  13   9.314   1.788 -10.241
   95   2HA   GLY  13          3HA       GLY  13  11.046   2.091 -10.431
   96    H    GLY  14           H        GLY  14  11.650   4.063  -8.702
   97   1HA   GLY  14          2HA       GLY  14  11.875   2.816  -6.240
   98   2HA   GLY  14          3HA       GLY  14  12.097   4.555  -6.508
   99    H    CYS  15           H        CYS  15   9.041   4.497  -7.381
  100    HA   CYS  15           HA       CYS  15   7.844   5.281  -4.922
  101   1HB   CYS  15          2HB       CYS  15   6.571   4.304  -7.464
  102   2HB   CYS  15          3HB       CYS  15   5.719   4.910  -6.022
  103    HG   CYS  15           HG       CYS  15   8.121   6.496  -7.584
  104    H    ALA  16           H        ALA  16   8.114   2.157  -6.675
  105    HA   ALA  16           HA       ALA  16   6.424   0.638  -4.928
  106   1HB   ALA  16          1HB       ALA  16   8.730  -0.281  -6.712
  107   2HB   ALA  16          2HB       ALA  16   7.495  -1.320  -5.990
  108   3HB   ALA  16          3HB       ALA  16   7.031  -0.119  -7.214
  109    H    GLU  17           H        GLU  17   9.951   1.342  -4.949
  110    HA   GLU  17           HA       GLU  17  10.562  -0.210  -2.622
  111   1HB   GLU  17          2HB       GLU  17  11.869   2.299  -3.776
  112   2HB   GLU  17          3HB       GLU  17  12.304   1.603  -2.235
  113   1HG   GLU  17          2HG       GLU  17  12.629  -0.640  -3.500
  114   2HG   GLU  17          3HG       GLU  17  12.625   0.361  -4.964
  115    H    ALA  18           H        ALA  18   9.377   3.175  -2.994
  116    HA   ALA  18           HA       ALA  18   9.555   3.853  -0.252
  117   1HB   ALA  18          1HB       ALA  18   9.041   5.478  -2.080
  118   2HB   ALA  18          2HB       ALA  18   7.391   4.819  -2.169
  119   3HB   ALA  18          3HB       ALA  18   7.946   5.600  -0.686
  120    H    VAL  19           H        VAL  19   6.789   2.481  -2.070
  121    HA   VAL  19           HA       VAL  19   5.051   2.116   0.122
  122    HB   VAL  19           HB       VAL  19   5.303   0.477  -2.427
  123   1HG1  VAL  19          1HG1      VAL  19   3.043  -0.312  -1.927
  124   2HG1  VAL  19          2HG1      VAL  19   4.100  -0.805  -0.624
  125   3HG1  VAL  19          3HG1      VAL  19   3.028   0.590  -0.392
  126   1HG2  VAL  19          1HG2      VAL  19   3.378   1.810  -3.167
  127   2HG2  VAL  19          2HG2      VAL  19   3.369   2.709  -1.635
  128   3HG2  VAL  19          3HG2      VAL  19   4.716   2.894  -2.770
  129    H    SER  20           H        SER  20   7.312  -0.288  -1.369
  130    HA   SER  20           HA       SER  20   6.714  -2.379   0.405
  131   1HB   SER  20          2HB       SER  20   7.995  -2.607  -1.715
  132   2HB   SER  20          3HB       SER  20   9.389  -1.808  -0.958
  133    HG   SER  20           HG       SER  20   9.451  -4.143  -0.876
  134    H    ARG  21           H        ARG  21   9.333   0.073   0.682
  135    HA   ARG  21           HA       ARG  21  10.419  -0.786   3.112
  136   1HB   ARG  21          2HB       ARG  21  10.226   1.960   1.827
  137   2HB   ARG  21          3HB       ARG  21  11.169   1.632   3.291
  138   1HG   ARG  21          2HG       ARG  21  12.550   0.009   2.159
  139   2HG   ARG  21          3HG       ARG  21  11.568   0.045   0.707
  140   1HD   ARG  21          2HD       ARG  21  12.154   2.362   0.257
  141   2HD   ARG  21          3HD       ARG  21  13.131   2.465   1.713
  142    HE   ARG  21           HE       ARG  21  13.818   1.161  -0.873
  143   1HH1  ARG  21          2HH2      ARG  21  14.683   1.269   2.542
  144   2HH1  ARG  21          1HH2      ARG  21  16.339   0.804   2.261
  145   1HH2  ARG  21          2HH1      ARG  21  15.787   0.568  -1.263
  146   2HH2  ARG  21          1HH1      ARG  21  17.033   0.349  -0.035
  147    H    VAL  22           H        VAL  22   7.804   1.838   2.730
  148    HA   VAL  22           HA       VAL  22   7.552   2.064   5.488
  149    HB   VAL  22           HB       VAL  22   6.918   3.706   3.732
  150   1HG1  VAL  22          1HG1      VAL  22   5.580   2.244   2.283
  151   2HG1  VAL  22          2HG1      VAL  22   4.374   2.062   3.579
  152   3HG1  VAL  22          3HG1      VAL  22   4.640   3.631   2.819
  153   1HG2  VAL  22          1HG2      VAL  22   4.991   4.569   4.961
  154   2HG2  VAL  22          2HG2      VAL  22   4.808   2.986   5.749
  155   3HG2  VAL  22          3HG2      VAL  22   6.274   3.965   6.056
  156    H    LEU  23           H        LEU  23   5.585  -0.005   3.197
  157    HA   LEU  23           HA       LEU  23   3.854  -0.988   5.166
  158   1HB   LEU  23          2HB       LEU  23   4.808  -1.997   2.465
  159   2HB   LEU  23          3HB       LEU  23   3.873  -3.035   3.519
  160    HG   LEU  23           HG       LEU  23   2.501  -1.931   1.819
  161   1HD1  LEU  23          1HD1      LEU  23   1.815  -1.385   4.739
  162   2HD1  LEU  23          2HD1      LEU  23   0.666  -1.397   3.394
  163   3HD1  LEU  23          3HD1      LEU  23   1.512  -2.893   3.835
  164   1HD2  LEU  23          1HD2      LEU  23   2.831   0.493   3.586
  165   2HD2  LEU  23          2HD2      LEU  23   3.567   0.320   1.973
  166   3HD2  LEU  23          3HD2      LEU  23   1.803   0.357   2.139
  167    H    ASN  24           H        ASN  24   7.041  -2.437   4.085
  168    HA   ASN  24           HA       ASN  24   6.854  -4.608   5.903
  169   1HB   ASN  24          2HB       ASN  24   9.205  -3.171   4.616
  170   2HB   ASN  24          3HB       ASN  24   9.350  -4.536   5.712
  171   1HD2  ASN  24          1HD2      ASN  24   8.693  -3.653   2.455
  172   2HD2  ASN  24          2HD2      ASN  24   8.385  -5.268   1.850
  173    H    LYS  25           H        LYS  25   8.226  -1.305   6.229
  174    HA   LYS  25           HA       LYS  25   9.275  -1.512   8.826
  175   1HB   LYS  25          2HB       LYS  25   8.124   0.761   7.179
  176   2HB   LYS  25          3HB       LYS  25   8.499   1.035   8.871
  177   1HG   LYS  25          2HG       LYS  25  10.512  -0.006   6.822
  178   2HG   LYS  25          3HG       LYS  25  10.335   1.672   7.337
  179   1HD   LYS  25          2HD       LYS  25  11.804   1.265   8.983
  180   2HD   LYS  25          3HD       LYS  25  10.534   0.333   9.776
  181   1HE   LYS  25          2HE       LYS  25  11.407  -1.697   8.348
  182   2HE   LYS  25          3HE       LYS  25  12.787  -0.668   7.968
  183   1HZ   LYS  25          1HZ       LYS  25  11.929  -1.492  10.668
  184   2HZ   LYS  25          2HZ       LYS  25  13.209  -2.096   9.837
  185   3HZ   LYS  25          3HZ       LYS  25  13.227  -0.532  10.344
  186    H    LEU  26           H        LEU  26   5.901  -0.956   7.870
  187    HA   LEU  26           HA       LEU  26   4.820  -0.464  10.372
  188   1HB   LEU  26          2HB       LEU  26   3.702  -0.682   8.061
  189   2HB   LEU  26          3HB       LEU  26   3.564  -2.398   8.365
  190    HG   LEU  26           HG       LEU  26   1.586  -0.876   8.764
  191   1HD1  LEU  26          1HD1      LEU  26   0.657  -2.203  10.504
  192   2HD1  LEU  26          2HD1      LEU  26   1.559  -3.210   9.351
  193   3HD1  LEU  26          3HD1      LEU  26   2.245  -2.850  10.954
  194   1HD2  LEU  26          1HD2      LEU  26   2.808  -0.519  11.544
  195   2HD2  LEU  26          2HD2      LEU  26   2.863   0.754  10.315
  196   3HD2  LEU  26          3HD2      LEU  26   1.304   0.173  10.923
  197    H    GLY  27           H        GLY  27   5.827  -3.606   9.006
  198   1HA   GLY  27          2HA       GLY  27   6.485  -4.813  11.386
  199   2HA   GLY  27          3HA       GLY  27   4.743  -5.126  11.237
  200    H    GLY  28           H        GLY  28   3.978  -6.421   9.495
  201   1HA   GLY  28          2HA       GLY  28   5.808  -7.827   7.693
  202   2HA   GLY  28          3HA       GLY  28   5.215  -8.809   9.051
  203    H    VAL  29           H        VAL  29   3.701  -6.218   7.205
  204    HA   VAL  29           HA       VAL  29   1.174  -7.625   6.917
  205    HB   VAL  29           HB       VAL  29   0.874  -5.369   7.215
  206   1HG1  VAL  29          1HG1      VAL  29   3.205  -4.791   5.361
  207   2HG1  VAL  29          2HG1      VAL  29   2.075  -3.557   5.959
  208   3HG1  VAL  29          3HG1      VAL  29   3.058  -4.446   7.097
  209   1HG2  VAL  29          1HG2      VAL  29  -0.038  -4.401   5.175
  210   2HG2  VAL  29          2HG2      VAL  29   0.861  -5.535   4.172
  211   3HG2  VAL  29          3HG2      VAL  29  -0.427  -6.118   5.253
  212    H    LYS  30           H        LYS  30   0.309  -8.553   5.044
  213    HA   LYS  30           HA       LYS  30   2.220  -9.095   2.825
  214   1HB   LYS  30          2HB       LYS  30   1.225 -11.036   3.500
  215   2HB   LYS  30          3HB       LYS  30  -0.366 -10.303   3.654
  216   1HG   LYS  30          2HG       LYS  30  -0.276 -11.779   1.685
  217   2HG   LYS  30          3HG       LYS  30  -0.624 -10.147   1.232
  218   1HD   LYS  30          2HD       LYS  30   0.946 -11.064  -0.368
  219   2HD   LYS  30          3HD       LYS  30   1.717  -9.750   0.482
  220   1HE   LYS  30          2HE       LYS  30   3.245 -11.646   0.194
  221   2HE   LYS  30          3HE       LYS  30   2.978 -11.306   1.906
  222   1HZ   LYS  30          1HZ       LYS  30   1.424 -13.123   1.975
  223   2HZ   LYS  30          2HZ       LYS  30   1.621 -13.428   0.369
  224   3HZ   LYS  30          3HZ       LYS  30   2.874 -13.657   1.413
  225    H    TYR  31           H        TYR  31   2.400  -7.371   1.738
  226    HA   TYR  31           HA       TYR  31   0.092  -6.044   0.385
  227   1HB   TYR  31          2HB       TYR  31   1.736  -4.255  -0.133
  228   2HB   TYR  31          3HB       TYR  31   1.421  -4.438   1.590
  229    HD1  TYR  31           HD1      TYR  31   3.129  -5.276   3.113
  230    HD2  TYR  31           HD2      TYR  31   3.894  -5.069  -1.100
  231    HE1  TYR  31           HE1      TYR  31   5.414  -6.125   3.502
  232    HE2  TYR  31           HE2      TYR  31   6.190  -5.952  -0.726
  233    HH   TYR  31           HH       TYR  31   7.349  -6.883   2.525
  234    H    ASP  32           H        ASP  32   0.209  -5.904  -1.918
  235    HA   ASP  32           HA       ASP  32   2.625  -6.927  -3.246
  236   1HB   ASP  32          2HB       ASP  32   0.883  -8.701  -3.457
  237   2HB   ASP  32          3HB       ASP  32  -0.227  -7.512  -4.159
  238    H    ILE  33           H        ILE  33   2.776  -5.921  -5.403
  239    HA   ILE  33           HA       ILE  33   1.844  -3.060  -5.257
  240    HB   ILE  33           HB       ILE  33   4.661  -3.947  -5.942
  241   1HG1  ILE  33          2HG1      ILE  33   4.913  -2.468  -3.677
  242   2HG1  ILE  33          3HG1      ILE  33   3.407  -3.283  -3.289
  243   1HG2  ILE  33          1HG2      ILE  33   3.934  -1.835  -6.987
  244   2HG2  ILE  33          2HG2      ILE  33   3.416  -1.234  -5.390
  245   3HG2  ILE  33          3HG2      ILE  33   5.132  -1.534  -5.730
  246   1HD1  ILE  33          1HD1      ILE  33   4.508  -5.481  -3.546
  247   2HD1  ILE  33          2HD1      ILE  33   5.960  -4.707  -4.220
  248   3HD1  ILE  33          3HD1      ILE  33   5.536  -4.448  -2.531
  249    H    ASP  34           H        ASP  34   0.473  -2.960  -6.967
  250    HA   ASP  34           HA       ASP  34   1.153  -4.310  -9.507
  251   1HB   ASP  34          2HB       ASP  34  -1.172  -4.365  -8.657
  252   2HB   ASP  34          3HB       ASP  34  -1.240  -2.603  -8.869
  253    H    LEU  35           H        LEU  35   3.058  -3.206  -9.810
  254    HA   LEU  35           HA       LEU  35   3.249  -0.373 -10.069
  255   1HB   LEU  35          2HB       LEU  35   5.116  -1.865  -9.484
  256   2HB   LEU  35          3HB       LEU  35   5.088  -2.544 -11.114
  257    HG   LEU  35           HG       LEU  35   5.731  -0.355 -12.062
  258   1HD1  LEU  35          1HD1      LEU  35   5.699   0.598  -9.159
  259   2HD1  LEU  35          2HD1      LEU  35   6.486   1.471 -10.487
  260   3HD1  LEU  35          3HD1      LEU  35   4.737   1.246 -10.507
  261   1HD2  LEU  35          1HD2      LEU  35   7.507  -1.184  -9.727
  262   2HD2  LEU  35          2HD2      LEU  35   7.472  -1.958 -11.326
  263   3HD2  LEU  35          3HD2      LEU  35   8.014  -0.278 -11.167
  264    HA   PRO  36           HA       PRO  36   2.602  -1.012 -14.773
  265   1HB   PRO  36          2HB       PRO  36   0.539  -2.833 -15.361
  266   2HB   PRO  36          3HB       PRO  36   2.274  -2.993 -15.736
  267   1HG   PRO  36          2HG       PRO  36   0.719  -4.216 -13.512
  268   2HG   PRO  36          3HG       PRO  36   2.136  -4.869 -14.362
  269   1HD   PRO  36          2HD       PRO  36   2.235  -3.816 -11.876
  270   2HD   PRO  36          3HD       PRO  36   3.624  -3.701 -12.980
  271    H    ASN  37           H        ASN  37  -0.188  -1.938 -12.598
  272    HA   ASN  37           HA       ASN  37  -1.834   0.080 -13.953
  273   1HB   ASN  37          2HB       ASN  37  -2.567  -1.886 -11.774
  274   2HB   ASN  37          3HB       ASN  37  -3.680  -0.880 -12.654
  275   1HD2  ASN  37          1HD2      ASN  37  -2.488  -3.982 -12.586
  276   2HD2  ASN  37          2HD2      ASN  37  -2.772  -4.414 -14.276
  277    H    LYS  38           H        LYS  38   0.072   0.190 -11.019
  278    HA   LYS  38           HA       LYS  38   0.443   1.994  -9.710
  279   1HB   LYS  38          2HB       LYS  38  -1.539   3.440 -11.518
  280   2HB   LYS  38          3HB       LYS  38  -0.918   4.153 -10.063
  281   1HG   LYS  38          2HG       LYS  38   0.322   4.832 -12.077
  282   2HG   LYS  38          3HG       LYS  38   1.356   4.096 -10.840
  283   1HD   LYS  38          2HD       LYS  38   1.407   2.000 -12.004
  284   2HD   LYS  38          3HD       LYS  38   0.174   2.545 -13.171
  285   1HE   LYS  38          2HE       LYS  38   1.774   4.077 -14.176
  286   2HE   LYS  38          3HE       LYS  38   2.973   3.727 -12.909
  287   1HZ   LYS  38          1HZ       LYS  38   1.852   1.668 -14.693
  288   2HZ   LYS  38          2HZ       LYS  38   3.320   2.418 -14.963
  289   3HZ   LYS  38          3HZ       LYS  38   3.054   1.479 -13.618
  290    H    LYS  39           H        LYS  39  -0.809  -0.173  -8.914
  291    HA   LYS  39           HA       LYS  39  -2.642   0.935  -6.878
  292   1HB   LYS  39          2HB       LYS  39  -3.109  -1.725  -8.309
  293   2HB   LYS  39          3HB       LYS  39  -3.992  -1.117  -6.927
  294   1HG   LYS  39          2HG       LYS  39  -4.695   0.871  -8.419
  295   2HG   LYS  39          3HG       LYS  39  -3.961  -0.024  -9.755
  296   1HD   LYS  39          2HD       LYS  39  -6.210  -0.705  -9.864
  297   2HD   LYS  39          3HD       LYS  39  -5.422  -2.034  -9.001
  298   1HE   LYS  39          2HE       LYS  39  -6.161  -0.806  -6.805
  299   2HE   LYS  39          3HE       LYS  39  -7.121   0.234  -7.865
  300   1HZ   LYS  39          1HZ       LYS  39  -8.246  -1.862  -8.603
  301   2HZ   LYS  39          2HZ       LYS  39  -7.441  -2.680  -7.419
  302   3HZ   LYS  39          3HZ       LYS  39  -8.452  -1.526  -7.005
  303    H    VAL  40           H        VAL  40  -2.597  -0.299  -4.852
  304    HA   VAL  40           HA       VAL  40  -0.440  -2.316  -4.618
  305    HB   VAL  40           HB       VAL  40  -1.252   0.065  -2.947
  306   1HG1  VAL  40          1HG1      VAL  40  -0.210  -2.522  -1.809
  307   2HG1  VAL  40          2HG1      VAL  40  -0.150  -0.942  -0.977
  308   3HG1  VAL  40          3HG1      VAL  40  -1.717  -1.624  -1.448
  309   1HG2  VAL  40          1HG2      VAL  40   1.445  -1.257  -3.439
  310   2HG2  VAL  40          2HG2      VAL  40   0.767   0.028  -4.460
  311   3HG2  VAL  40          3HG2      VAL  40   1.124   0.361  -2.754
  312    H    CYS  41           H        CYS  41  -1.233  -4.180  -3.756
  313    HA   CYS  41           HA       CYS  41  -4.161  -4.307  -3.074
  314   1HB   CYS  41          2HB       CYS  41  -2.510  -6.324  -4.661
  315   2HB   CYS  41          3HB       CYS  41  -4.158  -6.572  -4.038
  316    HG   CYS  41           HG       CYS  41  -3.080  -4.285  -6.137
  317    H    ILE  42           H        ILE  42  -4.282  -4.783  -0.913
  318    HA   ILE  42           HA       ILE  42  -2.020  -6.307   0.307
  319    HB   ILE  42           HB       ILE  42  -3.974  -4.395   1.595
  320   1HG1  ILE  42          2HG1      ILE  42  -1.160  -3.967   0.530
  321   2HG1  ILE  42          3HG1      ILE  42  -2.636  -3.062   0.163
  322   1HG2  ILE  42          1HG2      ILE  42  -1.367  -5.514   2.699
  323   2HG2  ILE  42          2HG2      ILE  42  -2.619  -4.605   3.557
  324   3HG2  ILE  42          3HG2      ILE  42  -2.960  -6.233   3.049
  325   1HD1  ILE  42          1HD1      ILE  42  -1.038  -3.004   2.739
  326   2HD1  ILE  42          2HD1      ILE  42  -1.281  -1.694   1.573
  327   3HD1  ILE  42          3HD1      ILE  42  -2.643  -2.254   2.565
  328    H    GLU  43           H        GLU  43  -2.465  -8.103   1.458
  329    HA   GLU  43           HA       GLU  43  -5.277  -9.010   1.810
  330   1HB   GLU  43          2HB       GLU  43  -4.412  -9.797  -0.428
  331   2HB   GLU  43          3HB       GLU  43  -3.114 -10.648   0.413
  332   1HG   GLU  43          2HG       GLU  43  -4.802 -12.029   1.596
  333   2HG   GLU  43          3HG       GLU  43  -6.102 -11.146   0.781
  334    H    SER  44           H        SER  44  -4.974  -8.723   4.089
  335    HA   SER  44           HA       SER  44  -2.836 -10.252   5.406
  336   1HB   SER  44          2HB       SER  44  -1.927  -7.995   4.371
  337   2HB   SER  44          3HB       SER  44  -2.734  -7.237   5.737
  338    HG   SER  44           HG       SER  44  -1.447  -8.583   7.096
  339    H    GLU  45           H        GLU  45  -3.780 -10.968   7.257
  340    HA   GLU  45           HA       GLU  45  -6.220  -9.753   8.218
  341   1HB   GLU  45          2HB       GLU  45  -5.749 -12.195   8.112
  342   2HB   GLU  45          3HB       GLU  45  -4.609 -12.016   9.456
  343   1HG   GLU  45          2HG       GLU  45  -6.375 -11.389  10.962
  344   2HG   GLU  45          3HG       GLU  45  -7.517 -11.108   9.641
  345    H    HIS  46           H        HIS  46  -5.017  -7.592   8.473
  346    HA   HIS  46           HA       HIS  46  -5.387  -7.402  11.318
  347   1HB   HIS  46          2HB       HIS  46  -3.579  -6.132  12.038
  348   2HB   HIS  46          3HB       HIS  46  -2.865  -7.487  11.181
  349    HD1  HIS  46           1HD      HIS  46  -3.767  -3.748  10.341
  350    HD2  HIS  46           2HD      HIS  46  -0.749  -6.668   9.954
  351    HE1  HIS  46           1HE      HIS  46  -1.645  -2.551   9.694
  352    H    SER  47           H        SER  47  -5.493  -4.908  11.927
  353    HA   SER  47           HA       SER  47  -7.713  -3.969  10.522
  354   1HB   SER  47          2HB       SER  47  -7.143  -3.271  12.839
  355   2HB   SER  47          3HB       SER  47  -5.821  -2.273  12.182
  356    HG   SER  47           HG       SER  47  -7.728  -1.047  12.458
  357    H    MET  48           H        MET  48  -8.041  -2.702   8.838
  358    HA   MET  48           HA       MET  48  -5.949  -2.237   6.917
  359   1HB   MET  48          2HB       MET  48  -8.820  -1.217   6.834
  360   2HB   MET  48          3HB       MET  48  -7.724  -1.533   5.477
  361   1HG   MET  48          2HG       MET  48  -7.701  -3.976   6.232
  362   2HG   MET  48          3HG       MET  48  -9.007  -3.571   7.349
  363   1HE   MET  48          1HE       MET  48 -10.645  -5.365   6.581
  364   2HE   MET  48          2HE       MET  48 -10.906  -5.746   4.868
  365   3HE   MET  48          3HE       MET  48  -9.299  -5.963   5.586
  366    H    ASP  49           H        ASP  49  -7.739  -0.278   9.258
  367    HA   ASP  49           HA       ASP  49  -7.174   2.324   8.333
  368   1HB   ASP  49          2HB       ASP  49  -8.800   2.000  10.086
  369   2HB   ASP  49          3HB       ASP  49  -7.599   1.227  11.140
  370    H    THR  50           H        THR  50  -5.471   0.366  10.671
  371    HA   THR  50           HA       THR  50  -3.273   1.890  11.312
  372    HB   THR  50           HB       THR  50  -3.270  -1.103  10.719
  373    HG1  THR  50           1HG      THR  50  -4.308   0.414  12.861
  374   1HG2  THR  50          1HG2      THR  50  -1.735   0.498  12.809
  375   2HG2  THR  50          2HG2      THR  50  -1.724  -1.270  12.604
  376   3HG2  THR  50          3HG2      THR  50  -1.042  -0.229  11.341
  377    H    LEU  51           H        LEU  51  -3.522  -0.343   8.476
  378    HA   LEU  51           HA       LEU  51  -0.935   0.290   7.417
  379   1HB   LEU  51          2HB       LEU  51  -3.445  -0.625   5.940
  380   2HB   LEU  51          3HB       LEU  51  -1.802  -0.606   5.288
  381    HG   LEU  51           HG       LEU  51  -2.733  -2.233   7.704
  382   1HD1  LEU  51          1HD1      LEU  51  -2.142  -3.008   4.862
  383   2HD1  LEU  51          2HD1      LEU  51  -2.535  -4.159   6.169
  384   3HD1  LEU  51          3HD1      LEU  51  -3.749  -2.981   5.624
  385   1HD2  LEU  51          1HD2      LEU  51  -0.504  -3.421   7.249
  386   2HD2  LEU  51          2HD2      LEU  51  -0.095  -2.101   6.143
  387   3HD2  LEU  51          3HD2      LEU  51  -0.321  -1.784   7.875
  388    H    LEU  52           H        LEU  52  -4.226   1.525   6.536
  389    HA   LEU  52           HA       LEU  52  -3.512   3.266   4.547
  390   1HB   LEU  52          2HB       LEU  52  -5.686   2.402   5.441
  391   2HB   LEU  52          3HB       LEU  52  -5.649   3.624   6.699
  392    HG   LEU  52           HG       LEU  52  -5.467   4.411   3.765
  393   1HD1  LEU  52          1HD1      LEU  52  -7.980   4.431   3.793
  394   2HD1  LEU  52          2HD1      LEU  52  -7.296   2.796   3.972
  395   3HD1  LEU  52          3HD1      LEU  52  -7.923   3.641   5.394
  396   1HD2  LEU  52          1HD2      LEU  52  -5.128   6.131   5.506
  397   2HD2  LEU  52          2HD2      LEU  52  -6.671   6.402   4.655
  398   3HD2  LEU  52          3HD2      LEU  52  -6.660   5.676   6.281
  399    H    ALA  53           H        ALA  53  -3.668   3.933   8.061
  400    HA   ALA  53           HA       ALA  53  -2.769   6.635   7.993
  401   1HB   ALA  53          1HB       ALA  53  -2.629   4.567  10.230
  402   2HB   ALA  53          2HB       ALA  53  -2.492   6.327  10.425
  403   3HB   ALA  53          3HB       ALA  53  -4.023   5.609   9.880
  404    H    THR  54           H        THR  54  -0.946   3.585   8.312
  405    HA   THR  54           HA       THR  54   1.601   4.874   8.612
  406    HB   THR  54           HB       THR  54   0.795   2.109   7.647
  407    HG1  THR  54           1HG      THR  54   1.802   3.143  10.089
  408   1HG2  THR  54          1HG2      THR  54   3.551   3.265   8.222
  409   2HG2  THR  54          2HG2      THR  54   3.178   1.530   8.189
  410   3HG2  THR  54          3HG2      THR  54   2.951   2.486   6.732
  411    H    LEU  55           H        LEU  55   0.210   3.326   5.629
  412    HA   LEU  55           HA       LEU  55   2.432   4.058   4.053
  413   1HB   LEU  55          2HB       LEU  55   1.209   3.216   2.223
  414   2HB   LEU  55          3HB       LEU  55   1.173   2.193   3.640
  415    HG   LEU  55           HG       LEU  55  -1.180   3.499   4.022
  416   1HD1  LEU  55          1HD1      LEU  55  -0.716   4.793   1.980
  417   2HD1  LEU  55          2HD1      LEU  55  -0.740   3.289   1.045
  418   3HD1  LEU  55          3HD1      LEU  55  -2.233   3.851   1.864
  419   1HD2  LEU  55          1HD2      LEU  55  -0.686   1.122   2.173
  420   2HD2  LEU  55          2HD2      LEU  55  -0.738   1.049   3.942
  421   3HD2  LEU  55          3HD2      LEU  55  -2.208   1.479   3.033
  422    H    LYS  56           H        LYS  56  -0.608   5.702   4.586
  423    HA   LYS  56           HA       LYS  56  -0.625   7.829   2.901
  424   1HB   LYS  56          2HB       LYS  56  -1.171   7.445   5.819
  425   2HB   LYS  56          3HB       LYS  56  -0.898   9.111   5.385
  426   1HG   LYS  56          2HG       LYS  56  -2.629   9.077   3.684
  427   2HG   LYS  56          3HG       LYS  56  -2.932   7.346   3.981
  428   1HD   LYS  56          2HD       LYS  56  -3.559   7.769   6.259
  429   2HD   LYS  56          3HD       LYS  56  -3.062   9.465   6.173
  430   1HE   LYS  56          2HE       LYS  56  -4.867  10.019   4.641
  431   2HE   LYS  56          3HE       LYS  56  -5.264   8.318   4.382
  432   1HZ   LYS  56          1HZ       LYS  56  -6.812   9.361   5.867
  433   2HZ   LYS  56          2HZ       LYS  56  -5.993   8.188   6.668
  434   3HZ   LYS  56          3HZ       LYS  56  -5.623   9.771   6.923
  435    H    LYS  57           H        LYS  57   1.742   7.342   5.524
  436    HA   LYS  57           HA       LYS  57   2.759  10.000   5.552
  437   1HB   LYS  57          2HB       LYS  57   3.919   7.377   6.489
  438   2HB   LYS  57          3HB       LYS  57   4.584   8.975   6.894
  439   1HG   LYS  57          2HG       LYS  57   2.333   9.547   7.887
  440   2HG   LYS  57          3HG       LYS  57   1.830   7.867   7.582
  441   1HD   LYS  57          2HD       LYS  57   3.951   7.179   8.920
  442   2HD   LYS  57          3HD       LYS  57   3.988   8.849   9.484
  443   1HE   LYS  57          2HE       LYS  57   1.901   6.680   9.964
  444   2HE   LYS  57          3HE       LYS  57   2.818   7.599  11.161
  445   1HZ   LYS  57          1HZ       LYS  57   0.621   8.534   9.442
  446   2HZ   LYS  57          2HZ       LYS  57   0.588   8.358  11.072
  447   3HZ   LYS  57          3HZ       LYS  57   1.511   9.551  10.411
  448    H    THR  58           H        THR  58   3.267   7.544   3.152
  449    HA   THR  58           HA       THR  58   5.869   8.367   2.221
  450    HB   THR  58           HB       THR  58   5.080   7.623   0.007
  451    HG1  THR  58           1HG      THR  58   2.607   7.020   1.252
  452   1HG2  THR  58          1HG2      THR  58   5.952   5.945   1.525
  453   2HG2  THR  58          2HG2      THR  58   4.365   5.765   2.296
  454   3HG2  THR  58          3HG2      THR  58   4.592   5.261   0.603
  455    H    GLY  59           H        GLY  59   2.652   9.825   2.081
  456   1HA   GLY  59          2HA       GLY  59   1.980  11.885   1.428
  457   2HA   GLY  59          3HA       GLY  59   3.669  12.360   1.175
  458    H    LYS  60           H        LYS  60   2.507   9.468  -0.504
  459    HA   LYS  60           HA       LYS  60   2.464  10.968  -3.066
  460   1HB   LYS  60          2HB       LYS  60   1.833   8.028  -2.547
  461   2HB   LYS  60          3HB       LYS  60   1.998   8.804  -4.119
  462   1HG   LYS  60          2HG       LYS  60   4.144   8.104  -2.134
  463   2HG   LYS  60          3HG       LYS  60   3.980   7.598  -3.818
  464   1HD   LYS  60          2HD       LYS  60   4.760  10.321  -2.776
  465   2HD   LYS  60          3HD       LYS  60   5.818   9.164  -3.567
  466   1HE   LYS  60          2HE       LYS  60   3.462  10.615  -4.917
  467   2HE   LYS  60          3HE       LYS  60   5.159  11.030  -5.078
  468   1HZ   LYS  60          1HZ       LYS  60   3.974   8.475  -6.000
  469   2HZ   LYS  60          2HZ       LYS  60   4.128   9.804  -6.875
  470   3HZ   LYS  60          3HZ       LYS  60   5.500   9.045  -6.337
  471    H    THR  61           H        THR  61   0.541  10.757  -4.499
  472    HA   THR  61           HA       THR  61  -1.902  11.397  -3.292
  473    HB   THR  61           HB       THR  61  -1.548  10.311  -6.079
  474    HG1  THR  61           1HG      THR  61  -0.401  12.136  -6.678
  475   1HG2  THR  61          1HG2      THR  61  -2.818  12.882  -5.019
  476   2HG2  THR  61          2HG2      THR  61  -2.878  12.307  -6.701
  477   3HG2  THR  61          3HG2      THR  61  -3.709  11.394  -5.425
  478    H    VAL  62           H        VAL  62  -1.326   9.025  -2.033
  479    HA   VAL  62           HA       VAL  62  -2.496   6.758  -3.465
  480    HB   VAL  62           HB       VAL  62  -0.600   6.226  -2.190
  481   1HG1  VAL  62          1HG1      VAL  62  -0.475   6.462   0.287
  482   2HG1  VAL  62          2HG1      VAL  62  -0.443   8.005  -0.551
  483   3HG1  VAL  62          3HG1      VAL  62  -1.937   7.469   0.248
  484   1HG2  VAL  62          1HG2      VAL  62  -1.368   4.410  -0.883
  485   2HG2  VAL  62          2HG2      VAL  62  -2.894   5.220  -0.469
  486   3HG2  VAL  62          3HG2      VAL  62  -2.608   4.647  -2.120
  487    H    SER  63           H        SER  63  -4.467   5.762  -3.012
  488    HA   SER  63           HA       SER  63  -6.069   6.743  -0.760
  489   1HB   SER  63          2HB       SER  63  -6.712   8.269  -2.625
  490   2HB   SER  63          3HB       SER  63  -7.195   6.853  -3.588
  491    HG   SER  63           HG       SER  63  -8.949   7.814  -2.387
  492    H    TYR  64           H        TYR  64  -8.220   5.464  -0.882
  493    HA   TYR  64           HA       TYR  64  -7.391   2.576  -0.861
  494   1HB   TYR  64          2HB       TYR  64  -7.516   3.524   1.340
  495   2HB   TYR  64          3HB       TYR  64  -9.069   4.279   1.000
  496    HD1  TYR  64           HD1      TYR  64 -11.091   3.163   1.535
  497    HD2  TYR  64           HD2      TYR  64  -7.433   0.902   1.272
  498    HE1  TYR  64           HE1      TYR  64 -12.155   1.298   2.756
  499    HE2  TYR  64           HE2      TYR  64  -8.444  -0.871   2.680
  500    HH   TYR  64           HH       TYR  64 -11.820  -0.731   3.817
  501    H    LEU  65           H        LEU  65  -8.597   1.261  -2.158
  502    HA   LEU  65           HA       LEU  65 -11.451   1.731  -2.591
  503   1HB   LEU  65          2HB       LEU  65 -10.957   1.405  -5.132
  504   2HB   LEU  65          3HB       LEU  65 -11.069   2.992  -4.379
  505    HG   LEU  65           HG       LEU  65  -9.349   2.849  -6.013
  506   1HD1  LEU  65          1HD1      LEU  65  -7.773   3.261  -3.562
  507   2HD1  LEU  65          2HD1      LEU  65  -7.793   4.163  -5.070
  508   3HD1  LEU  65          3HD1      LEU  65  -9.139   4.339  -3.954
  509   1HD2  LEU  65          1HD2      LEU  65  -7.334   1.578  -5.870
  510   2HD2  LEU  65          2HD2      LEU  65  -7.878   0.825  -4.354
  511   3HD2  LEU  65          3HD2      LEU  65  -8.738   0.517  -5.877
  512    H    GLY  66           H        GLY  66 -11.307  -0.239  -1.285
  513   1HA   GLY  66          2HA       GLY  66 -12.353  -2.370  -2.542
  514   2HA   GLY  66          3HA       GLY  66 -10.620  -2.737  -2.661
  515    H    LEU  67           H        LEU  67 -12.937  -3.932  -0.916
  516    HA   LEU  67           HA       LEU  67 -11.468  -4.124   1.593
  517   1HB   LEU  67          2HB       LEU  67 -12.744  -2.252   2.190
  518   2HB   LEU  67          3HB       LEU  67 -14.021  -2.625   1.031
  519    HG   LEU  67           HG       LEU  67 -14.821  -4.449   2.377
  520   1HD1  LEU  67          1HD1      LEU  67 -12.747  -5.006   3.682
  521   2HD1  LEU  67          2HD1      LEU  67 -12.838  -3.429   4.489
  522   3HD1  LEU  67          3HD1      LEU  67 -14.092  -4.655   4.771
  523   1HD2  LEU  67          1HD2      LEU  67 -14.650  -1.779   3.838
  524   2HD2  LEU  67          2HD2      LEU  67 -15.816  -2.215   2.569
  525   3HD2  LEU  67          3HD2      LEU  67 -15.864  -3.043   4.135
  526    H    GLU  68           H        GLU  68 -11.578  -6.357   2.022
  527    HA   GLU  68           HA       GLU  68 -14.131  -7.679   1.822
  528   1HB   GLU  68          2HB       GLU  68 -12.667  -8.145  -0.397
  529   2HB   GLU  68          3HB       GLU  68 -11.754  -9.175   0.710
  530   1HG   GLU  68          2HG       GLU  68 -14.158 -10.144   1.302
  531   2HG   GLU  68          3HG       GLU  68 -14.619  -9.406  -0.231
  Start of MODEL    6
    1   1H    MET   1           H1       MET   1  -7.716 -13.698   3.085
    2   2H    MET   1           H2       MET   1  -7.901 -14.876   1.932
    3   3H    MET   1           H3       MET   1  -7.461 -13.376   1.506
    4    HA   MET   1           HA       MET   1  -9.649 -13.622   0.895
    5   1HB   MET   1          2HB       MET   1 -10.049 -14.670   3.693
    6   2HB   MET   1          3HB       MET   1 -11.381 -13.868   2.832
    7   1HG   MET   1          2HG       MET   1 -11.165 -15.431   0.969
    8   2HG   MET   1          3HG       MET   1  -9.809 -16.244   1.773
    9   1HE   MET   1          1HE       MET   1 -11.047 -18.551   1.371
   10   2HE   MET   1          2HE       MET   1 -12.714 -18.870   1.905
   11   3HE   MET   1          3HE       MET   1 -12.410 -17.694   0.606
   12    HA   PRO   2           HA       PRO   2 -10.850  -9.803   3.313
   13   1HB   PRO   2          2HB       PRO   2  -9.592  -9.067   5.657
   14   2HB   PRO   2          3HB       PRO   2 -11.080 -10.063   5.580
   15   1HG   PRO   2          2HG       PRO   2  -8.208 -11.003   5.828
   16   2HG   PRO   2          3HG       PRO   2  -9.616 -11.528   6.800
   17   1HD   PRO   2          2HD       PRO   2  -8.748 -12.993   4.732
   18   2HD   PRO   2          3HD       PRO   2 -10.511 -12.763   4.976
   19    H    LYS   3           H        LYS   3 -10.001  -8.025   2.264
   20    HA   LYS   3           HA       LYS   3  -7.155  -7.417   2.425
   21   1HB   LYS   3          2HB       LYS   3  -6.709  -7.601   0.043
   22   2HB   LYS   3          3HB       LYS   3  -7.055  -9.141   0.840
   23   1HG   LYS   3          2HG       LYS   3  -9.431  -8.913   0.100
   24   2HG   LYS   3          3HG       LYS   3  -8.924  -7.513  -0.856
   25   1HD   LYS   3          2HD       LYS   3  -7.596 -10.263  -1.095
   26   2HD   LYS   3          3HD       LYS   3  -9.057  -9.911  -2.000
   27   1HE   LYS   3          2HE       LYS   3  -6.544  -8.173  -2.208
   28   2HE   LYS   3          3HE       LYS   3  -6.830  -9.587  -3.228
   29   1HZ   LYS   3          1HZ       LYS   3  -8.704  -7.288  -3.103
   30   2HZ   LYS   3          2HZ       LYS   3  -7.587  -7.469  -4.257
   31   3HZ   LYS   3          3HZ       LYS   3  -8.873  -8.547  -4.021
   32    H    HIS   4           H        HIS   4  -6.527  -5.560   1.209
   33    HA   HIS   4           HA       HIS   4  -8.613  -3.436   1.200
   34   1HB   HIS   4          2HB       HIS   4  -5.835  -3.340   2.417
   35   2HB   HIS   4          3HB       HIS   4  -7.033  -2.045   2.436
   36    HD1  HIS   4           1HD      HIS   4  -5.738  -4.553   4.677
   37    HD2  HIS   4           2HD      HIS   4  -9.589  -3.249   3.586
   38    HE1  HIS   4           1HE      HIS   4  -7.313  -5.288   6.541
   39    H    GLU   5           H        GLU   5  -8.660  -2.702  -0.918
   40    HA   GLU   5           HA       GLU   5  -6.218  -2.930  -2.610
   41   1HB   GLU   5          2HB       GLU   5  -9.154  -2.417  -3.115
   42   2HB   GLU   5          3HB       GLU   5  -7.943  -2.239  -4.381
   43   1HG   GLU   5          2HG       GLU   5  -8.180  -4.815  -2.771
   44   2HG   GLU   5          3HG       GLU   5  -9.211  -4.486  -4.156
   45    H    PHE   6           H        PHE   6  -5.175  -1.158  -3.473
   46    HA   PHE   6           HA       PHE   6  -6.209   1.578  -2.884
   47   1HB   PHE   6          2HB       PHE   6  -3.376   0.488  -2.495
   48   2HB   PHE   6          3HB       PHE   6  -3.813   2.177  -2.360
   49    HD1  PHE   6           1HD      PHE   6  -4.311  -1.203  -0.825
   50    HD2  PHE   6           2HD      PHE   6  -4.463   3.068  -0.237
   51    HE1  PHE   6           1HE      PHE   6  -4.586  -1.545   1.603
   52    HE2  PHE   6           2HE      PHE   6  -4.681   2.717   2.207
   53    HZ   PHE   6           HZ       PHE   6  -4.791   0.411   3.133
   54    H    SER   7           H        SER   7  -5.758   3.050  -4.519
   55    HA   SER   7           HA       SER   7  -4.185   2.048  -6.849
   56   1HB   SER   7          2HB       SER   7  -6.413   2.866  -7.498
   57   2HB   SER   7          3HB       SER   7  -5.977   4.472  -6.860
   58    HG   SER   7           HG       SER   7  -4.263   3.157  -8.704
   59    H    VAL   8           H        VAL   8  -2.230   3.005  -7.216
   60    HA   VAL   8           HA       VAL   8  -1.264   5.089  -5.325
   61    HB   VAL   8           HB       VAL   8  -0.021   2.406  -6.086
   62   1HG1  VAL   8          1HG1      VAL   8   1.712   2.993  -4.479
   63   2HG1  VAL   8          2HG1      VAL   8   1.558   4.372  -5.583
   64   3HG1  VAL   8          3HG1      VAL   8   0.833   4.458  -3.978
   65   1HG2  VAL   8          1HG2      VAL   8  -1.450   3.346  -3.566
   66   2HG2  VAL   8          2HG2      VAL   8  -1.780   1.891  -4.528
   67   3HG2  VAL   8          3HG2      VAL   8  -0.307   2.003  -3.537
   68    H    ASP   9           H        ASP   9  -0.631   6.734  -6.751
   69    HA   ASP   9           HA       ASP   9   0.091   6.100  -9.476
   70   1HB   ASP   9          2HB       ASP   9  -0.833   8.311  -8.744
   71   2HB   ASP   9          3HB       ASP   9   0.777   8.691  -8.088
   72    H    MET  10           H        MET  10   1.574   4.387  -8.998
   73    HA   MET  10           HA       MET  10   4.260   5.042  -8.083
   74   1HB   MET  10          2HB       MET  10   3.113   2.583  -9.466
   75   2HB   MET  10          3HB       MET  10   4.794   2.735  -8.911
   76   1HG   MET  10          2HG       MET  10   4.029   3.181  -6.616
   77   2HG   MET  10          3HG       MET  10   2.346   3.014  -7.128
   78   1HE   MET  10          1HE       MET  10   1.081   0.796  -7.373
   79   2HE   MET  10          2HE       MET  10   2.081   0.590  -8.824
   80   3HE   MET  10          3HE       MET  10   1.920  -0.743  -7.660
   81    H    THR  11           H        THR  11   4.340   6.974  -9.400
   82    HA   THR  11           HA       THR  11   4.475   6.847 -12.215
   83    HB   THR  11           HB       THR  11   5.929   9.032 -10.788
   84    HG1  THR  11           1HG      THR  11   3.176   8.524 -10.305
   85   1HG2  THR  11          1HG2      THR  11   5.200   9.206 -13.170
   86   2HG2  THR  11          2HG2      THR  11   3.507   9.033 -12.645
   87   3HG2  THR  11          3HG2      THR  11   4.452  10.447 -12.139
   88    H    CYS  12           H        CYS  12   6.920   6.290  -9.703
   89    HA   CYS  12           HA       CYS  12   8.885   5.641 -11.849
   90   1HB   CYS  12          2HB       CYS  12   9.560   7.779 -10.849
   91   2HB   CYS  12          3HB       CYS  12   9.409   7.092  -9.213
   92    HG   CYS  12           HG       CYS  12  11.930   7.213  -9.759
   93    H    GLY  13           H        GLY  13  10.044   3.726 -11.317
   94   1HA   GLY  13          2HA       GLY  13   8.870   1.678  -9.882
   95   2HA   GLY  13          3HA       GLY  13  10.612   1.817 -10.172
   96    H    GLY  14           H        GLY  14  11.230   4.112  -8.671
   97   1HA   GLY  14          2HA       GLY  14  11.563   2.953  -6.139
   98   2HA   GLY  14          3HA       GLY  14  11.901   4.656  -6.530
   99    H    CYS  15           H        CYS  15   8.785   4.697  -7.333
  100    HA   CYS  15           HA       CYS  15   7.725   5.687  -4.894
  101   1HB   CYS  15          2HB       CYS  15   6.698   6.194  -7.025
  102   2HB   CYS  15          3HB       CYS  15   6.234   4.478  -7.208
  103    HG   CYS  15           HG       CYS  15   5.527   6.541  -4.717
  104    H    ALA  16           H        ALA  16   7.749   2.482  -6.507
  105    HA   ALA  16           HA       ALA  16   6.095   1.147  -4.573
  106   1HB   ALA  16          1HB       ALA  16   6.358   0.306  -6.879
  107   2HB   ALA  16          2HB       ALA  16   8.079  -0.034  -6.573
  108   3HB   ALA  16          3HB       ALA  16   6.835  -0.907  -5.673
  109    H    GLU  17           H        GLU  17   9.654   1.572  -4.943
  110    HA   GLU  17           HA       GLU  17  10.391  -0.021  -2.693
  111   1HB   GLU  17          2HB       GLU  17  11.637   2.501  -3.876
  112   2HB   GLU  17          3HB       GLU  17  12.131   1.864  -2.331
  113   1HG   GLU  17          2HG       GLU  17  12.461  -0.416  -3.544
  114   2HG   GLU  17          3HG       GLU  17  12.467   0.567  -5.022
  115    H    ALA  18           H        ALA  18   9.367   3.433  -2.848
  116    HA   ALA  18           HA       ALA  18   9.753   3.949  -0.089
  117   1HB   ALA  18          1HB       ALA  18   9.348   5.715  -1.778
  118   2HB   ALA  18          2HB       ALA  18   7.649   5.208  -1.904
  119   3HB   ALA  18          3HB       ALA  18   8.263   5.857  -0.377
  120    H    VAL  19           H        VAL  19   6.760   3.032  -1.803
  121    HA   VAL  19           HA       VAL  19   5.040   2.749   0.409
  122    HB   VAL  19           HB       VAL  19   5.133   1.378  -2.299
  123   1HG1  VAL  19          1HG1      VAL  19   3.836  -0.115  -0.865
  124   2HG1  VAL  19          2HG1      VAL  19   2.934   1.271  -0.191
  125   3HG1  VAL  19          3HG1      VAL  19   2.750   0.805  -1.894
  126   1HG2  VAL  19          1HG2      VAL  19   3.346   2.961  -2.834
  127   2HG2  VAL  19          2HG2      VAL  19   3.362   3.601  -1.180
  128   3HG2  VAL  19          3HG2      VAL  19   4.748   3.863  -2.254
  129    H    SER  20           H        SER  20   6.946   0.221  -1.266
  130    HA   SER  20           HA       SER  20   6.265  -1.945   0.344
  131   1HB   SER  20          2HB       SER  20   7.511  -2.121  -1.806
  132   2HB   SER  20          3HB       SER  20   8.906  -1.305  -1.087
  133    HG   SER  20           HG       SER  20   9.199  -3.541  -1.129
  134    H    ARG  21           H        ARG  21   9.102   0.216   0.717
  135    HA   ARG  21           HA       ARG  21  10.128  -1.031   2.995
  136   1HB   ARG  21          2HB       ARG  21  10.431   1.777   1.886
  137   2HB   ARG  21          3HB       ARG  21  11.396   1.152   3.239
  138   1HG   ARG  21          2HG       ARG  21  12.335  -0.613   1.907
  139   2HG   ARG  21          3HG       ARG  21  11.188  -0.389   0.613
  140   1HD   ARG  21          2HD       ARG  21  13.228   0.417  -0.172
  141   2HD   ARG  21          3HD       ARG  21  12.160   1.811   0.049
  142    HE   ARG  21           HE       ARG  21  13.527   1.727   2.410
  143   1HH1  ARG  21          2HH2      ARG  21  14.693   1.682  -1.001
  144   2HH1  ARG  21          1HH2      ARG  21  16.043   2.684  -0.670
  145   1HH2  ARG  21          2HH1      ARG  21  15.412   2.993   2.821
  146   2HH2  ARG  21          1HH1      ARG  21  16.501   3.386   1.531
  147    H    VAL  22           H        VAL  22   7.727   1.814   2.897
  148    HA   VAL  22           HA       VAL  22   7.719   1.947   5.695
  149    HB   VAL  22           HB       VAL  22   7.084   3.795   4.285
  150   1HG1  VAL  22          1HG1      VAL  22   4.658   2.101   3.620
  151   2HG1  VAL  22          2HG1      VAL  22   4.712   3.842   3.393
  152   3HG1  VAL  22          3HG1      VAL  22   5.832   2.824   2.493
  153   1HG2  VAL  22          1HG2      VAL  22   4.775   2.826   5.962
  154   2HG2  VAL  22          2HG2      VAL  22   6.285   3.531   6.615
  155   3HG2  VAL  22          3HG2      VAL  22   5.199   4.513   5.589
  156    H    LEU  23           H        LEU  23   5.643  -0.031   3.403
  157    HA   LEU  23           HA       LEU  23   3.997  -1.003   5.542
  158   1HB   LEU  23          2HB       LEU  23   4.634  -2.021   2.768
  159   2HB   LEU  23          3HB       LEU  23   3.780  -3.007   3.935
  160    HG   LEU  23           HG       LEU  23   2.160  -2.133   2.613
  161   1HD1  LEU  23          1HD1      LEU  23   1.944  -0.385   5.093
  162   2HD1  LEU  23          2HD1      LEU  23   0.650  -1.079   4.117
  163   3HD1  LEU  23          3HD1      LEU  23   1.667  -2.142   5.104
  164   1HD2  LEU  23          1HD2      LEU  23   1.728   0.206   2.196
  165   2HD2  LEU  23          2HD2      LEU  23   3.160   0.641   3.154
  166   3HD2  LEU  23          3HD2      LEU  23   3.339  -0.302   1.648
  167    H    ASN  24           H        ASN  24   6.995  -2.287   4.133
  168    HA   ASN  24           HA       ASN  24   7.498  -4.456   5.857
  169   1HB   ASN  24          2HB       ASN  24   9.061  -4.398   4.220
  170   2HB   ASN  24          3HB       ASN  24   9.077  -2.658   4.137
  171   1HD2  ASN  24          1HD2      ASN  24  10.204  -1.418   5.649
  172   2HD2  ASN  24          2HD2      ASN  24  11.729  -2.070   6.290
  173    H    LYS  25           H        LYS  25   7.993  -0.963   6.468
  174    HA   LYS  25           HA       LYS  25   9.072  -1.403   9.121
  175   1HB   LYS  25          2HB       LYS  25   7.978   1.003   7.634
  176   2HB   LYS  25          3HB       LYS  25   8.248   1.072   9.363
  177   1HG   LYS  25          2HG       LYS  25  10.370   0.386   7.266
  178   2HG   LYS  25          3HG       LYS  25  10.154   1.937   8.072
  179   1HD   LYS  25          2HD       LYS  25  11.654   1.221   9.588
  180   2HD   LYS  25          3HD       LYS  25  10.317   0.289  10.260
  181   1HE   LYS  25          2HE       LYS  25  11.120  -1.586   8.530
  182   2HE   LYS  25          3HE       LYS  25  12.582  -0.611   8.422
  183   1HZ   LYS  25          1HZ       LYS  25  12.761  -2.354  10.045
  184   2HZ   LYS  25          2HZ       LYS  25  12.836  -0.901  10.814
  185   3HZ   LYS  25          3HZ       LYS  25  11.457  -1.805  10.874
  186    H    LEU  26           H        LEU  26   5.769  -0.861   7.937
  187    HA   LEU  26           HA       LEU  26   4.536  -0.669  10.429
  188   1HB   LEU  26          2HB       LEU  26   3.504  -0.549   8.113
  189   2HB   LEU  26          3HB       LEU  26   3.350  -2.278   8.109
  190    HG   LEU  26           HG       LEU  26   1.345  -0.738   8.782
  191   1HD1  LEU  26          1HD1      LEU  26   1.939  -3.236  10.403
  192   2HD1  LEU  26          2HD1      LEU  26   0.352  -2.496  10.103
  193   3HD1  LEU  26          3HD1      LEU  26   1.270  -3.189   8.756
  194   1HD2  LEU  26          1HD2      LEU  26   2.566   0.437  10.677
  195   2HD2  LEU  26          2HD2      LEU  26   1.028  -0.295  11.114
  196   3HD2  LEU  26          3HD2      LEU  26   2.532  -1.099  11.565
  197    H    GLY  27           H        GLY  27   5.344  -3.651   8.586
  198   1HA   GLY  27          2HA       GLY  27   6.542  -4.960  10.572
  199   2HA   GLY  27          3HA       GLY  27   4.850  -5.187  11.044
  200    H    GLY  28           H        GLY  28   3.487  -6.659   9.932
  201   1HA   GLY  28          2HA       GLY  28   5.080  -8.775   8.505
  202   2HA   GLY  28          3HA       GLY  28   3.925  -9.052   9.814
  203    H    VAL  29           H        VAL  29   4.068  -7.243   6.761
  204    HA   VAL  29           HA       VAL  29   1.190  -7.829   6.301
  205    HB   VAL  29           HB       VAL  29   1.499  -5.606   6.974
  206   1HG1  VAL  29          1HG1      VAL  29   3.807  -5.188   6.801
  207   2HG1  VAL  29          2HG1      VAL  29   3.826  -5.409   5.052
  208   3HG1  VAL  29          3HG1      VAL  29   2.985  -4.021   5.773
  209   1HG2  VAL  29          1HG2      VAL  29   0.704  -4.349   5.060
  210   2HG2  VAL  29          2HG2      VAL  29   1.243  -5.607   3.947
  211   3HG2  VAL  29          3HG2      VAL  29  -0.051  -5.952   5.112
  212    H    LYS  30           H        LYS  30   0.825  -9.194   4.555
  213    HA   LYS  30           HA       LYS  30   2.643  -8.976   2.267
  214   1HB   LYS  30          2HB       LYS  30   1.235 -11.075   2.922
  215   2HB   LYS  30          3HB       LYS  30   0.015 -10.298   1.902
  216   1HG   LYS  30          2HG       LYS  30   2.829 -11.170   1.188
  217   2HG   LYS  30          3HG       LYS  30   1.312 -11.768   0.501
  218   1HD   LYS  30          2HD       LYS  30   0.971  -9.577  -0.681
  219   2HD   LYS  30          3HD       LYS  30   2.393  -8.932   0.137
  220   1HE   LYS  30          2HE       LYS  30   3.278  -9.274  -1.835
  221   2HE   LYS  30          3HE       LYS  30   3.831 -10.651  -0.888
  222   1HZ   LYS  30          1HZ       LYS  30   1.914 -11.887  -2.014
  223   2HZ   LYS  30          2HZ       LYS  30   1.741 -10.567  -3.001
  224   3HZ   LYS  30          3HZ       LYS  30   3.110 -11.386  -3.038
  225    H    TYR  31           H        TYR  31   2.591  -6.950   1.724
  226    HA   TYR  31           HA       TYR  31   0.186  -5.728   0.431
  227   1HB   TYR  31          2HB       TYR  31   1.644  -3.813  -0.024
  228   2HB   TYR  31          3HB       TYR  31   1.434  -4.123   1.695
  229    HD1  TYR  31           HD1      TYR  31   3.261  -5.123   3.014
  230    HD2  TYR  31           HD2      TYR  31   3.854  -4.085  -1.089
  231    HE1  TYR  31           HE1      TYR  31   5.727  -5.289   3.351
  232    HE2  TYR  31           HE2      TYR  31   6.300  -4.369  -0.811
  233    HH   TYR  31           HH       TYR  31   8.003  -4.342   0.806
  234    H    ASP  32           H        ASP  32  -0.095  -6.231  -1.718
  235    HA   ASP  32           HA       ASP  32   2.325  -7.084  -3.235
  236   1HB   ASP  32          2HB       ASP  32   0.098  -8.581  -3.035
  237   2HB   ASP  32          3HB       ASP  32  -0.408  -7.530  -4.366
  238    H    ILE  33           H        ILE  33   2.251  -6.328  -5.513
  239    HA   ILE  33           HA       ILE  33   1.611  -3.386  -5.565
  240    HB   ILE  33           HB       ILE  33   4.342  -4.708  -5.578
  241   1HG1  ILE  33          2HG1      ILE  33   3.563  -2.182  -4.073
  242   2HG1  ILE  33          3HG1      ILE  33   3.149  -3.761  -3.408
  243   1HG2  ILE  33          1HG2      ILE  33   5.278  -2.468  -6.199
  244   2HG2  ILE  33          2HG2      ILE  33   4.353  -3.177  -7.504
  245   3HG2  ILE  33          3HG2      ILE  33   3.630  -1.900  -6.504
  246   1HD1  ILE  33          1HD1      ILE  33   5.987  -2.954  -4.154
  247   2HD1  ILE  33          2HD1      ILE  33   5.280  -2.895  -2.536
  248   3HD1  ILE  33          3HD1      ILE  33   5.460  -4.457  -3.363
  249    H    ASP  34           H        ASP  34   0.658  -3.022  -7.490
  250    HA   ASP  34           HA       ASP  34   1.626  -4.524  -9.885
  251   1HB   ASP  34          2HB       ASP  34  -0.699  -4.988  -9.204
  252   2HB   ASP  34          3HB       ASP  34  -1.092  -3.286  -9.478
  253    H    LEU  35           H        LEU  35   3.142  -3.291 -10.640
  254    HA   LEU  35           HA       LEU  35   3.294  -0.466 -10.367
  255   1HB   LEU  35          2HB       LEU  35   5.125  -2.406 -10.616
  256   2HB   LEU  35          3HB       LEU  35   5.032  -1.961 -12.310
  257    HG   LEU  35           HG       LEU  35   6.847  -0.809 -11.415
  258   1HD1  LEU  35          1HD1      LEU  35   4.675   1.313 -11.313
  259   2HD1  LEU  35          2HD1      LEU  35   6.396   1.537 -11.650
  260   3HD1  LEU  35          3HD1      LEU  35   5.385   0.659 -12.815
  261   1HD2  LEU  35          1HD2      LEU  35   6.850   0.558  -9.380
  262   2HD2  LEU  35          2HD2      LEU  35   5.146   0.164  -9.098
  263   3HD2  LEU  35          3HD2      LEU  35   6.380  -1.110  -9.029
  264    HA   PRO  36           HA       PRO  36   2.219  -0.294 -15.065
  265   1HB   PRO  36          2HB       PRO  36   0.580  -2.306 -16.064
  266   2HB   PRO  36          3HB       PRO  36   2.339  -2.178 -16.315
  267   1HG   PRO  36          2HG       PRO  36   0.865  -3.864 -14.321
  268   2HG   PRO  36          3HG       PRO  36   2.291  -4.299 -15.291
  269   1HD   PRO  36          2HD       PRO  36   2.492  -3.613 -12.712
  270   2HD   PRO  36          3HD       PRO  36   3.744  -3.110 -13.874
  271    H    ASN  37           H        ASN  37  -0.091  -2.058 -12.846
  272    HA   ASN  37           HA       ASN  37  -2.363  -0.570 -13.791
  273   1HB   ASN  37          2HB       ASN  37  -1.864  -2.088 -11.216
  274   2HB   ASN  37          3HB       ASN  37  -3.326  -1.185 -11.524
  275   1HD2  ASN  37          1HD2      ASN  37  -1.392  -3.588 -13.300
  276   2HD2  ASN  37          2HD2      ASN  37  -2.749  -4.438 -14.002
  277    H    LYS  38           H        LYS  38  -0.033   0.046 -11.133
  278    HA   LYS  38           HA       LYS  38   0.288   1.827  -9.789
  279   1HB   LYS  38          2HB       LYS  38  -1.746   3.354 -11.493
  280   2HB   LYS  38          3HB       LYS  38  -1.103   3.950 -10.030
  281   1HG   LYS  38          2HG       LYS  38   0.287   4.902 -11.623
  282   2HG   LYS  38          3HG       LYS  38   1.250   3.567 -10.975
  283   1HD   LYS  38          2HD       LYS  38   0.480   2.181 -12.977
  284   2HD   LYS  38          3HD       LYS  38  -0.361   3.605 -13.575
  285   1HE   LYS  38          2HE       LYS  38   1.730   3.373 -14.730
  286   2HE   LYS  38          3HE       LYS  38   1.872   4.798 -13.683
  287   1HZ   LYS  38          1HZ       LYS  38   2.831   2.115 -12.894
  288   2HZ   LYS  38          2HZ       LYS  38   3.784   3.201 -13.691
  289   3HZ   LYS  38          3HZ       LYS  38   3.236   3.566 -12.206
  290    H    LYS  39           H        LYS  39  -0.727  -0.344  -9.017
  291    HA   LYS  39           HA       LYS  39  -2.859   0.401  -7.119
  292   1HB   LYS  39          2HB       LYS  39  -2.909  -1.757  -9.187
  293   2HB   LYS  39          3HB       LYS  39  -3.444  -2.222  -7.567
  294   1HG   LYS  39          2HG       LYS  39  -5.239  -0.746  -7.533
  295   2HG   LYS  39          3HG       LYS  39  -4.617   0.231  -8.874
  296   1HD   LYS  39          2HD       LYS  39  -6.590  -1.287  -9.416
  297   2HD   LYS  39          3HD       LYS  39  -5.212  -1.331 -10.503
  298   1HE   LYS  39          2HE       LYS  39  -4.420  -3.450  -9.205
  299   2HE   LYS  39          3HE       LYS  39  -6.009  -3.426  -8.430
  300   1HZ   LYS  39          1HZ       LYS  39  -5.866  -4.848 -10.363
  301   2HZ   LYS  39          2HZ       LYS  39  -6.932  -3.632 -10.675
  302   3HZ   LYS  39          3HZ       LYS  39  -5.415  -3.601 -11.333
  303    H    VAL  40           H        VAL  40  -2.719  -0.661  -5.085
  304    HA   VAL  40           HA       VAL  40  -0.578  -2.621  -4.709
  305    HB   VAL  40           HB       VAL  40  -1.252  -0.035  -3.281
  306   1HG1  VAL  40          1HG1      VAL  40  -0.020  -0.816  -1.290
  307   2HG1  VAL  40          2HG1      VAL  40  -1.613  -1.545  -1.577
  308   3HG1  VAL  40          3HG1      VAL  40  -0.129  -2.481  -1.936
  309   1HG2  VAL  40          1HG2      VAL  40   1.182   0.196  -3.243
  310   2HG2  VAL  40          2HG2      VAL  40   1.374  -1.439  -3.910
  311   3HG2  VAL  40          3HG2      VAL  40   0.636  -0.149  -4.888
  312    H    CYS  41           H        CYS  41  -1.349  -4.327  -3.510
  313    HA   CYS  41           HA       CYS  41  -4.267  -4.291  -2.766
  314   1HB   CYS  41          2HB       CYS  41  -2.834  -6.609  -4.118
  315   2HB   CYS  41          3HB       CYS  41  -4.576  -6.372  -3.830
  316    HG   CYS  41           HG       CYS  41  -4.948  -4.498  -5.497
  317    H    ILE  42           H        ILE  42  -4.150  -4.469  -0.502
  318    HA   ILE  42           HA       ILE  42  -1.891  -6.088   0.587
  319    HB   ILE  42           HB       ILE  42  -3.605  -4.189   2.140
  320   1HG1  ILE  42          2HG1      ILE  42  -1.054  -3.609   0.559
  321   2HG1  ILE  42          3HG1      ILE  42  -2.630  -2.829   0.377
  322   1HG2  ILE  42          1HG2      ILE  42  -0.800  -5.268   2.605
  323   2HG2  ILE  42          2HG2      ILE  42  -1.741  -4.274   3.729
  324   3HG2  ILE  42          3HG2      ILE  42  -2.270  -5.910   3.364
  325   1HD1  ILE  42          1HD1      ILE  42  -0.703  -2.523   2.701
  326   2HD1  ILE  42          2HD1      ILE  42  -1.215  -1.300   1.529
  327   3HD1  ILE  42          3HD1      ILE  42  -2.377  -1.915   2.721
  328    H    GLU  43           H        GLU  43  -2.271  -7.973   1.430
  329    HA   GLU  43           HA       GLU  43  -4.990  -8.704   2.439
  330   1HB   GLU  43          2HB       GLU  43  -4.779  -9.478   0.101
  331   2HB   GLU  43          3HB       GLU  43  -3.320 -10.385   0.509
  332   1HG   GLU  43          2HG       GLU  43  -4.550 -11.842   2.009
  333   2HG   GLU  43          3HG       GLU  43  -6.005 -10.847   1.890
  334    H    SER  44           H        SER  44  -4.156  -8.431   4.548
  335    HA   SER  44           HA       SER  44  -2.521 -10.599   5.528
  336   1HB   SER  44          2HB       SER  44  -1.110  -8.385   4.620
  337   2HB   SER  44          3HB       SER  44  -1.343  -7.970   6.319
  338    HG   SER  44           HG       SER  44  -0.166  -9.766   6.886
  339    H    GLU  45           H        GLU  45  -2.550 -10.614   7.895
  340    HA   GLU  45           HA       GLU  45  -5.007  -9.565   8.975
  341   1HB   GLU  45          2HB       GLU  45  -2.716 -11.079  10.296
  342   2HB   GLU  45          3HB       GLU  45  -4.324 -10.803  10.979
  343   1HG   GLU  45          2HG       GLU  45  -5.350 -12.046   9.082
  344   2HG   GLU  45          3HG       GLU  45  -3.740 -12.379   8.418
  345    H    HIS  46           H        HIS  46  -4.126  -7.287   8.344
  346    HA   HIS  46           HA       HIS  46  -3.400  -5.981  10.901
  347   1HB   HIS  46          2HB       HIS  46  -2.147  -5.406   8.188
  348   2HB   HIS  46          3HB       HIS  46  -2.175  -4.231   9.503
  349    HD1  HIS  46           1HD      HIS  46  -0.844  -5.093  11.846
  350    HD2  HIS  46           2HD      HIS  46   0.008  -6.869   8.139
  351    HE1  HIS  46           1HE      HIS  46   1.515  -6.046  12.022
  352    H    SER  47           H        SER  47  -4.762  -4.237  11.254
  353    HA   SER  47           HA       SER  47  -7.180  -4.201   9.777
  354   1HB   SER  47          2HB       SER  47  -7.061  -3.538  12.141
  355   2HB   SER  47          3HB       SER  47  -6.112  -2.103  11.694
  356    HG   SER  47           HG       SER  47  -8.350  -1.640  11.899
  357    H    MET  48           H        MET  48  -8.010  -2.891   8.274
  358    HA   MET  48           HA       MET  48  -6.843  -1.559   6.237
  359   1HB   MET  48          2HB       MET  48  -9.273  -2.118   6.736
  360   2HB   MET  48          3HB       MET  48  -9.341  -0.703   7.785
  361   1HG   MET  48          2HG       MET  48  -8.587   0.640   5.719
  362   2HG   MET  48          3HG       MET  48  -8.910  -0.840   4.805
  363   1HE   MET  48          1HE       MET  48 -12.810  -1.242   5.566
  364   2HE   MET  48          2HE       MET  48 -11.342  -2.064   4.974
  365   3HE   MET  48          3HE       MET  48 -11.578  -1.788   6.716
  366    H    ASP  49           H        ASP  49  -7.940  -0.082   9.327
  367    HA   ASP  49           HA       ASP  49  -7.109   2.547   8.708
  368   1HB   ASP  49          2HB       ASP  49  -8.739   2.130  10.470
  369   2HB   ASP  49          3HB       ASP  49  -7.550   1.207  11.413
  370    H    THR  50           H        THR  50  -5.581   0.254  10.882
  371    HA   THR  50           HA       THR  50  -3.262   1.552  11.497
  372    HB   THR  50           HB       THR  50  -3.397  -1.432  10.879
  373    HG1  THR  50           1HG      THR  50  -3.980  -1.237  13.293
  374   1HG2  THR  50          1HG2      THR  50  -1.827   0.173  12.951
  375   2HG2  THR  50          2HG2      THR  50  -1.824  -1.599  12.787
  376   3HG2  THR  50          3HG2      THR  50  -1.158  -0.591  11.493
  377    H    LEU  51           H        LEU  51  -3.736  -0.553   8.595
  378    HA   LEU  51           HA       LEU  51  -1.148  -0.098   7.459
  379   1HB   LEU  51          2HB       LEU  51  -3.812  -0.622   6.071
  380   2HB   LEU  51          3HB       LEU  51  -2.220  -0.661   5.289
  381    HG   LEU  51           HG       LEU  51  -2.904  -2.406   7.702
  382   1HD1  LEU  51          1HD1      LEU  51  -4.619  -2.881   6.073
  383   2HD1  LEU  51          2HD1      LEU  51  -3.423  -3.015   4.771
  384   3HD1  LEU  51          3HD1      LEU  51  -3.460  -4.220   6.081
  385   1HD2  LEU  51          1HD2      LEU  51  -0.882  -2.654   5.439
  386   2HD2  LEU  51          2HD2      LEU  51  -0.516  -2.246   7.129
  387   3HD2  LEU  51          3HD2      LEU  51  -1.124  -3.857   6.723
  388    H    LEU  52           H        LEU  52  -4.315   1.435   6.598
  389    HA   LEU  52           HA       LEU  52  -3.455   3.183   4.711
  390   1HB   LEU  52          2HB       LEU  52  -5.705   2.439   5.477
  391   2HB   LEU  52          3HB       LEU  52  -5.659   3.612   6.781
  392    HG   LEU  52           HG       LEU  52  -5.264   4.448   3.869
  393   1HD1  LEU  52          1HD1      LEU  52  -7.192   2.959   3.966
  394   2HD1  LEU  52          2HD1      LEU  52  -7.843   3.834   5.359
  395   3HD1  LEU  52          3HD1      LEU  52  -7.761   4.637   3.764
  396   1HD2  LEU  52          1HD2      LEU  52  -6.453   5.787   6.346
  397   2HD2  LEU  52          2HD2      LEU  52  -4.881   6.161   5.612
  398   3HD2  LEU  52          3HD2      LEU  52  -6.374   6.520   4.726
  399    H    ALA  53           H        ALA  53  -3.935   3.957   8.185
  400    HA   ALA  53           HA       ALA  53  -2.978   6.585   8.135
  401   1HB   ALA  53          1HB       ALA  53  -2.908   4.550  10.412
  402   2HB   ALA  53          2HB       ALA  53  -2.776   6.312  10.592
  403   3HB   ALA  53          3HB       ALA  53  -4.286   5.591   9.997
  404    H    THR  54           H        THR  54  -1.177   3.536   8.632
  405    HA   THR  54           HA       THR  54   1.314   4.828   9.221
  406    HB   THR  54           HB       THR  54   0.721   2.064   8.067
  407    HG1  THR  54           1HG      THR  54  -0.019   2.234  10.097
  408   1HG2  THR  54          1HG2      THR  54   2.970   2.668   7.433
  409   2HG2  THR  54          2HG2      THR  54   3.315   3.297   9.066
  410   3HG2  THR  54          3HG2      THR  54   3.048   1.565   8.803
  411    H    LEU  55           H        LEU  55   0.135   3.314   6.172
  412    HA   LEU  55           HA       LEU  55   2.431   4.043   4.679
  413   1HB   LEU  55          2HB       LEU  55   1.298   3.213   2.802
  414   2HB   LEU  55          3HB       LEU  55   1.176   2.167   4.188
  415    HG   LEU  55           HG       LEU  55  -1.179   3.373   4.471
  416   1HD1  LEU  55          1HD1      LEU  55  -0.668   4.915   2.622
  417   2HD1  LEU  55          2HD1      LEU  55  -0.499   3.528   1.543
  418   3HD1  LEU  55          3HD1      LEU  55  -2.101   3.915   2.253
  419   1HD2  LEU  55          1HD2      LEU  55  -2.152   1.508   3.183
  420   2HD2  LEU  55          2HD2      LEU  55  -0.575   1.225   2.403
  421   3HD2  LEU  55          3HD2      LEU  55  -0.767   0.957   4.147
  422    H    LYS  56           H        LYS  56  -0.614   5.692   5.150
  423    HA   LYS  56           HA       LYS  56  -0.617   7.801   3.533
  424   1HB   LYS  56          2HB       LYS  56  -1.946   7.354   5.808
  425   2HB   LYS  56          3HB       LYS  56  -0.740   8.425   6.509
  426   1HG   LYS  56          2HG       LYS  56  -1.429  10.097   4.694
  427   2HG   LYS  56          3HG       LYS  56  -2.701   8.912   4.264
  428   1HD   LYS  56          2HD       LYS  56  -3.508   8.982   6.649
  429   2HD   LYS  56          3HD       LYS  56  -2.354  10.271   6.991
  430   1HE   LYS  56          2HE       LYS  56  -4.680  10.360   4.991
  431   2HE   LYS  56          3HE       LYS  56  -4.649  11.132   6.581
  432   1HZ   LYS  56          1HZ       LYS  56  -2.832  12.512   5.807
  433   2HZ   LYS  56          2HZ       LYS  56  -2.892  11.811   4.316
  434   3HZ   LYS  56          3HZ       LYS  56  -4.163  12.696   4.860
  435    H    LYS  57           H        LYS  57   1.753   7.371   6.172
  436    HA   LYS  57           HA       LYS  57   2.728  10.034   6.253
  437   1HB   LYS  57          2HB       LYS  57   4.047   7.411   7.012
  438   2HB   LYS  57          3HB       LYS  57   4.675   9.021   7.435
  439   1HG   LYS  57          2HG       LYS  57   2.471   9.495   8.577
  440   2HG   LYS  57          3HG       LYS  57   2.006   7.817   8.282
  441   1HD   LYS  57          2HD       LYS  57   4.379   8.766   9.947
  442   2HD   LYS  57          3HD       LYS  57   2.829   8.155  10.555
  443   1HE   LYS  57          2HE       LYS  57   3.317   5.979   9.278
  444   2HE   LYS  57          3HE       LYS  57   4.954   6.590   9.006
  445   1HZ   LYS  57          1HZ       LYS  57   4.839   5.168  10.915
  446   2HZ   LYS  57          2HZ       LYS  57   5.225   6.689  11.402
  447   3HZ   LYS  57          3HZ       LYS  57   3.701   6.108  11.631
  448    H    THR  58           H        THR  58   3.249   7.649   3.769
  449    HA   THR  58           HA       THR  58   5.745   8.619   2.737
  450    HB   THR  58           HB       THR  58   4.862   7.778   0.557
  451    HG1  THR  58           1HG      THR  58   2.543   6.987   1.960
  452   1HG2  THR  58          1HG2      THR  58   5.959   6.211   2.033
  453   2HG2  THR  58          2HG2      THR  58   4.460   5.962   2.943
  454   3HG2  THR  58          3HG2      THR  58   4.571   5.420   1.252
  455    H    GLY  59           H        GLY  59   2.406   9.788   2.549
  456   1HA   GLY  59          2HA       GLY  59   1.520  11.783   1.981
  457   2HA   GLY  59          3HA       GLY  59   3.148  12.463   1.819
  458    H    LYS  60           H        LYS  60   2.511   9.595  -0.113
  459    HA   LYS  60           HA       LYS  60   2.490  11.260  -2.585
  460   1HB   LYS  60          2HB       LYS  60   3.122   8.371  -1.914
  461   2HB   LYS  60          3HB       LYS  60   2.762   8.860  -3.565
  462   1HG   LYS  60          2HG       LYS  60   5.159   8.799  -3.097
  463   2HG   LYS  60          3HG       LYS  60   4.627  10.407  -3.641
  464   1HD   LYS  60          2HD       LYS  60   4.668  11.206  -1.309
  465   2HD   LYS  60          3HD       LYS  60   5.047   9.552  -0.766
  466   1HE   LYS  60          2HE       LYS  60   7.246   9.813  -2.071
  467   2HE   LYS  60          3HE       LYS  60   6.776  11.507  -2.314
  468   1HZ   LYS  60          1HZ       LYS  60   6.447  11.267   0.308
  469   2HZ   LYS  60          2HZ       LYS  60   7.630  10.171   0.111
  470   3HZ   LYS  60          3HZ       LYS  60   7.897  11.722  -0.368
  471    H    THR  61           H        THR  61   1.091  10.372  -4.393
  472    HA   THR  61           HA       THR  61  -1.621  10.324  -3.733
  473    HB   THR  61           HB       THR  61  -0.293   9.425  -6.280
  474    HG1  THR  61           1HG      THR  61  -0.487  12.114  -5.418
  475   1HG2  THR  61          1HG2      THR  61  -2.774   9.576  -6.288
  476   2HG2  THR  61          2HG2      THR  61  -2.667  11.270  -5.752
  477   3HG2  THR  61          3HG2      THR  61  -2.051  10.798  -7.354
  478    H    VAL  62           H        VAL  62  -1.004   8.401  -2.188
  479    HA   VAL  62           HA       VAL  62  -1.961   5.856  -3.416
  480    HB   VAL  62           HB       VAL  62  -0.169   5.307  -2.086
  481   1HG1  VAL  62          1HG1      VAL  62   0.281   7.298  -0.797
  482   2HG1  VAL  62          2HG1      VAL  62  -1.206   7.083   0.156
  483   3HG1  VAL  62          3HG1      VAL  62   0.124   5.920   0.291
  484   1HG2  VAL  62          1HG2      VAL  62  -2.439   4.879  -0.131
  485   2HG2  VAL  62          2HG2      VAL  62  -2.432   4.086  -1.712
  486   3HG2  VAL  62          3HG2      VAL  62  -1.108   3.788  -0.582
  487    H    SER  63           H        SER  63  -4.058   5.836  -3.658
  488    HA   SER  63           HA       SER  63  -5.845   7.043  -1.585
  489   1HB   SER  63          2HB       SER  63  -6.140   7.928  -3.901
  490   2HB   SER  63          3HB       SER  63  -6.473   6.275  -4.464
  491    HG   SER  63           HG       SER  63  -8.396   7.452  -3.923
  492    H    TYR  64           H        TYR  64  -7.657   5.663  -1.015
  493    HA   TYR  64           HA       TYR  64  -6.983   2.748  -1.040
  494   1HB   TYR  64          2HB       TYR  64  -6.805   3.663   1.188
  495   2HB   TYR  64          3HB       TYR  64  -8.333   4.518   1.013
  496    HD1  TYR  64           HD1      TYR  64 -10.121   3.597   2.191
  497    HD2  TYR  64           HD2      TYR  64  -7.165   0.953   0.492
  498    HE1  TYR  64           HE1      TYR  64 -11.458   1.644   2.889
  499    HE2  TYR  64           HE2      TYR  64  -8.585  -0.984   1.063
  500    HH   TYR  64           HH       TYR  64 -11.520  -0.638   3.053
  501    H    LEU  65           H        LEU  65  -8.443   1.462  -2.098
  502    HA   LEU  65           HA       LEU  65 -11.262   2.210  -2.249
  503   1HB   LEU  65          2HB       LEU  65 -11.175   1.870  -4.785
  504   2HB   LEU  65          3HB       LEU  65 -10.872   3.436  -4.061
  505    HG   LEU  65           HG       LEU  65  -9.458   2.941  -5.938
  506   1HD1  LEU  65          1HD1      LEU  65  -7.585   3.232  -3.680
  507   2HD1  LEU  65          2HD1      LEU  65  -7.591   4.013  -5.261
  508   3HD1  LEU  65          3HD1      LEU  65  -8.794   4.483  -4.051
  509   1HD2  LEU  65          1HD2      LEU  65  -8.075   0.793  -4.349
  510   2HD2  LEU  65          2HD2      LEU  65  -9.103   0.562  -5.782
  511   3HD2  LEU  65          3HD2      LEU  65  -7.584   1.432  -5.929
  512    H    GLY  66           H        GLY  66 -11.115   0.171  -0.882
  513   1HA   GLY  66          2HA       GLY  66 -12.850  -1.500  -1.953
  514   2HA   GLY  66          3HA       GLY  66 -11.386  -2.239  -2.602
  515    H    LEU  67           H        LEU  67 -13.485  -2.235   0.018
  516    HA   LEU  67           HA       LEU  67 -11.649  -3.699   1.809
  517   1HB   LEU  67          2HB       LEU  67 -12.995  -2.226   3.122
  518   2HB   LEU  67          3HB       LEU  67 -14.364  -2.355   2.015
  519    HG   LEU  67           HG       LEU  67 -14.779  -4.632   2.693
  520   1HD1  LEU  67          1HD1      LEU  67 -13.717  -5.564   4.747
  521   2HD1  LEU  67          2HD1      LEU  67 -12.474  -5.276   3.525
  522   3HD1  LEU  67          3HD1      LEU  67 -12.668  -4.138   4.867
  523   1HD2  LEU  67          1HD2      LEU  67 -15.728  -4.104   4.906
  524   2HD2  LEU  67          2HD2      LEU  67 -14.717  -2.648   4.998
  525   3HD2  LEU  67          3HD2      LEU  67 -15.977  -2.782   3.753
  526    H    GLU  68           H        GLU  68 -11.840  -5.986   1.555
  527    HA   GLU  68           HA       GLU  68 -13.962  -7.175  -0.085
  528   1HB   GLU  68          2HB       GLU  68 -12.292  -6.103  -1.615
  529   2HB   GLU  68          3HB       GLU  68 -11.008  -6.895  -0.714
  530   1HG   GLU  68          2HG       GLU  68 -11.902  -9.112  -1.550
  531   2HG   GLU  68          3HG       GLU  68 -13.043  -8.203  -2.566
  Start of MODEL    7
    1   1H    MET   1           H1       MET   1  -6.859 -10.669   7.039
    2   2H    MET   1           H2       MET   1  -7.431 -11.182   8.498
    3   3H    MET   1           H3       MET   1  -8.114 -11.690   7.051
    4    HA   MET   1           HA       MET   1  -9.494  -9.973   8.077
    5   1HB   MET   1          2HB       MET   1  -6.868  -8.840   8.333
    6   2HB   MET   1          3HB       MET   1  -7.772  -7.728   7.342
    7   1HG   MET   1          2HG       MET   1  -7.917  -7.154   9.710
    8   2HG   MET   1          3HG       MET   1  -9.525  -7.696   9.207
    9   1HE   MET   1          1HE       MET   1  -9.295  -8.838  12.949
   10   2HE   MET   1          2HE       MET   1  -8.587  -7.365  12.243
   11   3HE   MET   1          3HE       MET   1 -10.223  -7.892  11.758
   12    HA   PRO   2           HA       PRO   2 -10.599  -9.408   3.873
   13   1HB   PRO   2          2HB       PRO   2 -11.453  -6.882   3.318
   14   2HB   PRO   2          3HB       PRO   2 -12.330  -7.989   4.411
   15   1HG   PRO   2          2HG       PRO   2 -10.371  -5.810   5.179
   16   2HG   PRO   2          3HG       PRO   2 -11.998  -6.103   5.864
   17   1HD   PRO   2          2HD       PRO   2  -9.761  -6.981   7.062
   18   2HD   PRO   2          3HD       PRO   2 -11.224  -8.008   7.068
   19    H    LYS   3           H        LYS   3  -9.833  -8.973   1.806
   20    HA   LYS   3           HA       LYS   3  -7.076  -7.895   1.608
   21   1HB   LYS   3          2HB       LYS   3  -7.573  -9.984   0.430
   22   2HB   LYS   3          3HB       LYS   3  -8.948  -9.217  -0.361
   23   1HG   LYS   3          2HG       LYS   3  -7.070  -7.502  -1.290
   24   2HG   LYS   3          3HG       LYS   3  -5.966  -8.761  -0.785
   25   1HD   LYS   3          2HD       LYS   3  -6.595  -8.818  -3.198
   26   2HD   LYS   3          3HD       LYS   3  -6.949 -10.327  -2.353
   27   1HE   LYS   3          2HE       LYS   3  -8.715  -9.522  -3.992
   28   2HE   LYS   3          3HE       LYS   3  -9.309  -9.937  -2.393
   29   1HZ   LYS   3          1HZ       LYS   3 -10.284  -8.011  -3.173
   30   2HZ   LYS   3          2HZ       LYS   3  -9.345  -7.499  -1.911
   31   3HZ   LYS   3          3HZ       LYS   3  -8.905  -7.237  -3.512
   32    H    HIS   4           H        HIS   4  -7.140  -5.695   1.646
   33    HA   HIS   4           HA       HIS   4  -9.230  -4.239   0.156
   34   1HB   HIS   4          2HB       HIS   4  -8.348  -2.248   1.365
   35   2HB   HIS   4          3HB       HIS   4  -9.248  -3.425   2.316
   36    HD1  HIS   4           1HD      HIS   4  -5.771  -4.688   2.036
   37    HD2  HIS   4           2HD      HIS   4  -7.934  -1.899   4.322
   38    HE1  HIS   4           1HE      HIS   4  -4.505  -4.391   4.203
   39    H    GLU   5           H        GLU   5  -8.722  -2.388  -1.049
   40    HA   GLU   5           HA       GLU   5  -6.268  -2.856  -2.691
   41   1HB   GLU   5          2HB       GLU   5  -9.173  -2.483  -3.524
   42   2HB   GLU   5          3HB       GLU   5  -7.801  -2.498  -4.629
   43   1HG   GLU   5          2HG       GLU   5  -7.208  -4.772  -3.457
   44   2HG   GLU   5          3HG       GLU   5  -8.847  -4.711  -2.784
   45    H    PHE   6           H        PHE   6  -5.394  -1.128  -3.799
   46    HA   PHE   6           HA       PHE   6  -6.311   1.567  -2.997
   47   1HB   PHE   6          2HB       PHE   6  -3.474   0.522  -2.591
   48   2HB   PHE   6          3HB       PHE   6  -4.092   2.080  -2.084
   49    HD1  PHE   6           1HD      PHE   6  -4.470  -1.629  -1.494
   50    HD2  PHE   6           2HD      PHE   6  -4.667   2.326   0.280
   51    HE1  PHE   6           1HE      PHE   6  -4.820  -2.618   0.718
   52    HE2  PHE   6           2HE      PHE   6  -4.732   1.291   2.469
   53    HZ   PHE   6           HZ       PHE   6  -4.926  -1.163   2.739
   54    H    SER   7           H        SER   7  -5.816   3.126  -4.508
   55    HA   SER   7           HA       SER   7  -4.401   2.270  -6.981
   56   1HB   SER   7          2HB       SER   7  -6.576   3.506  -7.186
   57   2HB   SER   7          3HB       SER   7  -5.794   4.931  -6.443
   58    HG   SER   7           HG       SER   7  -4.694   5.234  -8.281
   59    H    VAL   8           H        VAL   8  -2.175   2.689  -7.051
   60    HA   VAL   8           HA       VAL   8  -1.048   4.623  -5.069
   61    HB   VAL   8           HB       VAL   8   0.072   1.950  -6.095
   62   1HG1  VAL   8          1HG1      VAL   8   1.767   2.378  -4.302
   63   2HG1  VAL   8          2HG1      VAL   8   1.808   3.614  -5.562
   64   3HG1  VAL   8          3HG1      VAL   8   1.034   3.981  -4.013
   65   1HG2  VAL   8          1HG2      VAL   8  -0.230   1.416  -3.548
   66   2HG2  VAL   8          2HG2      VAL   8  -1.216   2.864  -3.446
   67   3HG2  VAL   8          3HG2      VAL   8  -1.749   1.527  -4.476
   68    H    ASP   9           H        ASP   9  -1.260   6.224  -6.766
   69    HA   ASP   9           HA       ASP   9  -0.355   5.540  -9.417
   70   1HB   ASP   9          2HB       ASP   9  -1.776   7.796  -8.015
   71   2HB   ASP   9          3HB       ASP   9  -1.220   7.965  -9.641
   72    H    MET  10           H        MET  10   1.704   5.038  -8.463
   73    HA   MET  10           HA       MET  10   3.514   7.115  -7.635
   74   1HB   MET  10          2HB       MET  10   4.947   5.241  -7.094
   75   2HB   MET  10          3HB       MET  10   3.301   4.860  -6.643
   76   1HG   MET  10          2HG       MET  10   3.891   2.895  -7.692
   77   2HG   MET  10          3HG       MET  10   3.264   3.780  -9.073
   78   1HE   MET  10          1HE       MET  10   4.602   1.763 -10.335
   79   2HE   MET  10          2HE       MET  10   4.619   3.281 -11.271
   80   3HE   MET  10          3HE       MET  10   6.099   2.315 -11.139
   81    H    THR  11           H        THR  11   5.097   8.127  -8.834
   82    HA   THR  11           HA       THR  11   4.862   7.975 -11.634
   83    HB   THR  11           HB       THR  11   7.089   9.509 -10.324
   84    HG1  THR  11           1HG      THR  11   5.421  10.979  -9.564
   85   1HG2  THR  11          1HG2      THR  11   4.817  10.295 -12.212
   86   2HG2  THR  11          2HG2      THR  11   6.207  11.304 -11.761
   87   3HG2  THR  11          3HG2      THR  11   6.457   9.835 -12.722
   88    H    CYS  12           H        CYS  12   7.357   6.723  -9.405
   89    HA   CYS  12           HA       CYS  12   9.045   5.810 -11.707
   90   1HB   CYS  12          2HB       CYS  12  10.037   7.895 -10.861
   91   2HB   CYS  12          3HB       CYS  12   9.880   7.322  -9.184
   92    HG   CYS  12           HG       CYS  12  12.369   7.206  -9.830
   93    H    GLY  13           H        GLY  13  10.159   3.838 -11.224
   94   1HA   GLY  13          2HA       GLY  13   9.106   1.852  -9.680
   95   2HA   GLY  13          3HA       GLY  13  10.838   1.999 -10.016
   96    H    GLY  14           H        GLY  14  11.664   4.154  -8.530
   97   1HA   GLY  14          2HA       GLY  14  11.810   2.996  -5.981
   98   2HA   GLY  14          3HA       GLY  14  12.358   4.647  -6.366
   99    H    CYS  15           H        CYS  15   9.413   5.202  -7.237
  100    HA   CYS  15           HA       CYS  15   8.426   6.170  -4.706
  101   1HB   CYS  15          2HB       CYS  15   7.965   7.306  -6.821
  102   2HB   CYS  15          3HB       CYS  15   6.936   5.958  -7.313
  103    HG   CYS  15           HG       CYS  15   5.455   6.047  -5.082
  104    H    ALA  16           H        ALA  16   8.012   3.213  -6.663
  105    HA   ALA  16           HA       ALA  16   5.846   2.094  -5.021
  106   1HB   ALA  16          1HB       ALA  16   6.213   1.376  -7.353
  107   2HB   ALA  16          2HB       ALA  16   7.787   0.685  -6.890
  108   3HB   ALA  16          3HB       ALA  16   6.298   0.044  -6.188
  109    H    GLU  17           H        GLU  17   9.409   1.618  -5.361
  110    HA   GLU  17           HA       GLU  17   9.771  -0.207  -3.293
  111   1HB   GLU  17          2HB       GLU  17  11.624   2.118  -3.945
  112   2HB   GLU  17          3HB       GLU  17  12.045   0.679  -3.029
  113   1HG   GLU  17          2HG       GLU  17  11.723  -0.776  -4.924
  114   2HG   GLU  17          3HG       GLU  17  11.122   0.559  -5.916
  115    H    ALA  18           H        ALA  18   9.472   3.350  -3.009
  116    HA   ALA  18           HA       ALA  18   9.927   3.644  -0.255
  117   1HB   ALA  18          1HB       ALA  18   9.571   5.529  -1.811
  118   2HB   ALA  18          2HB       ALA  18   7.850   5.103  -1.933
  119   3HB   ALA  18          3HB       ALA  18   8.518   5.637  -0.384
  120    H    VAL  19           H        VAL  19   6.845   2.887  -1.917
  121    HA   VAL  19           HA       VAL  19   5.203   2.669   0.398
  122    HB   VAL  19           HB       VAL  19   4.934   1.538  -2.409
  123   1HG1  VAL  19          1HG1      VAL  19   2.885   1.508  -0.170
  124   2HG1  VAL  19          2HG1      VAL  19   2.565   1.154  -1.881
  125   3HG1  VAL  19          3HG1      VAL  19   3.618   0.086  -0.957
  126   1HG2  VAL  19          1HG2      VAL  19   3.300   3.348  -2.653
  127   2HG2  VAL  19          2HG2      VAL  19   3.569   3.855  -0.976
  128   3HG2  VAL  19          3HG2      VAL  19   4.860   4.022  -2.177
  129    H    SER  20           H        SER  20   6.796   0.100  -1.628
  130    HA   SER  20           HA       SER  20   6.133  -2.094  -0.100
  131   1HB   SER  20          2HB       SER  20   8.884  -1.683  -1.351
  132   2HB   SER  20          3HB       SER  20   7.957  -3.192  -1.195
  133    HG   SER  20           HG       SER  20   7.832  -2.205  -3.308
  134    H    ARG  21           H        ARG  21   9.045  -0.020   0.351
  135    HA   ARG  21           HA       ARG  21  10.143  -1.380   2.530
  136   1HB   ARG  21          2HB       ARG  21  10.291   1.497   1.605
  137   2HB   ARG  21          3HB       ARG  21  11.286   0.861   2.934
  138   1HG   ARG  21          2HG       ARG  21  12.323  -0.773   1.523
  139   2HG   ARG  21          3HG       ARG  21  11.207  -0.520   0.213
  140   1HD   ARG  21          2HD       ARG  21  13.291   0.460  -0.377
  141   2HD   ARG  21          3HD       ARG  21  12.100   1.727  -0.241
  142    HE   ARG  21           HE       ARG  21  14.458   1.163   1.464
  143   1HH1  ARG  21          2HH2      ARG  21  11.540   3.101   1.150
  144   2HH1  ARG  21          1HH2      ARG  21  12.135   4.465   2.049
  145   1HH2  ARG  21          2HH1      ARG  21  15.299   2.938   2.672
  146   2HH2  ARG  21          1HH1      ARG  21  14.324   4.339   2.970
  147    H    VAL  22           H        VAL  22   7.840   1.552   2.718
  148    HA   VAL  22           HA       VAL  22   7.885   1.455   5.509
  149    HB   VAL  22           HB       VAL  22   7.302   3.430   4.319
  150   1HG1  VAL  22          1HG1      VAL  22   5.029   3.692   3.332
  151   2HG1  VAL  22          2HG1      VAL  22   6.071   2.596   2.422
  152   3HG1  VAL  22          3HG1      VAL  22   4.797   1.941   3.470
  153   1HG2  VAL  22          1HG2      VAL  22   6.443   2.969   6.597
  154   2HG2  VAL  22          2HG2      VAL  22   5.392   4.066   5.654
  155   3HG2  VAL  22          3HG2      VAL  22   4.938   2.355   5.847
  156    H    LEU  23           H        LEU  23   5.646  -0.180   3.123
  157    HA   LEU  23           HA       LEU  23   3.987  -1.256   5.132
  158   1HB   LEU  23          2HB       LEU  23   4.593  -2.027   2.271
  159   2HB   LEU  23          3HB       LEU  23   3.728  -3.150   3.303
  160    HG   LEU  23           HG       LEU  23   2.168  -1.927   1.992
  161   1HD1  LEU  23          1HD1      LEU  23   0.623  -1.276   3.749
  162   2HD1  LEU  23          2HD1      LEU  23   1.517  -2.722   4.259
  163   3HD1  LEU  23          3HD1      LEU  23   1.918  -1.119   4.923
  164   1HD2  LEU  23          1HD2      LEU  23   1.747   0.435   2.346
  165   2HD2  LEU  23          2HD2      LEU  23   3.080   0.508   3.524
  166   3HD2  LEU  23          3HD2      LEU  23   3.411   0.163   1.802
  167    H    ASN  24           H        ASN  24   6.968  -2.769   3.688
  168    HA   ASN  24           HA       ASN  24   6.928  -5.091   5.293
  169   1HB   ASN  24          2HB       ASN  24   9.178  -3.381   4.142
  170   2HB   ASN  24          3HB       ASN  24   9.456  -4.838   5.071
  171   1HD2  ASN  24          1HD2      ASN  24   8.571  -3.624   1.964
  172   2HD2  ASN  24          2HD2      ASN  24   8.426  -5.203   1.186
  173    H    LYS  25           H        LYS  25   8.310  -1.850   5.931
  174    HA   LYS  25           HA       LYS  25   9.425  -2.382   8.454
  175   1HB   LYS  25          2HB       LYS  25   8.392   0.103   7.056
  176   2HB   LYS  25          3HB       LYS  25   8.866   0.214   8.745
  177   1HG   LYS  25          2HG       LYS  25  10.713  -0.974   6.639
  178   2HG   LYS  25          3HG       LYS  25  10.652   0.763   6.983
  179   1HD   LYS  25          2HD       LYS  25  11.196   0.371   9.352
  180   2HD   LYS  25          3HD       LYS  25  11.244  -1.378   9.087
  181   1HE   LYS  25          2HE       LYS  25  13.110  -1.075   7.452
  182   2HE   LYS  25          3HE       LYS  25  13.098   0.667   7.782
  183   1HZ   LYS  25          1HZ       LYS  25  14.772  -0.472   9.058
  184   2HZ   LYS  25          2HZ       LYS  25  13.648   0.163  10.073
  185   3HZ   LYS  25          3HZ       LYS  25  13.657  -1.452   9.758
  186    H    LEU  26           H        LEU  26   6.084  -1.456   7.645
  187    HA   LEU  26           HA       LEU  26   5.124  -1.041  10.211
  188   1HB   LEU  26          2HB       LEU  26   3.922  -0.922   7.988
  189   2HB   LEU  26          3HB       LEU  26   3.611  -2.636   8.082
  190    HG   LEU  26           HG       LEU  26   1.802  -0.968   8.759
  191   1HD1  LEU  26          1HD1      LEU  26   1.657  -3.419   9.122
  192   2HD1  LEU  26          2HD1      LEU  26   2.369  -3.194  10.734
  193   3HD1  LEU  26          3HD1      LEU  26   0.803  -2.465  10.350
  194   1HD2  LEU  26          1HD2      LEU  26   3.226   0.389  10.351
  195   2HD2  LEU  26          2HD2      LEU  26   1.695  -0.182  11.030
  196   3HD2  LEU  26          3HD2      LEU  26   3.202  -0.993  11.465
  197    H    GLY  27           H        GLY  27   5.702  -4.150   8.546
  198   1HA   GLY  27          2HA       GLY  27   6.686  -5.532  10.555
  199   2HA   GLY  27          3HA       GLY  27   4.976  -5.556  11.030
  200    H    GLY  28           H        GLY  28   3.458  -6.844   9.908
  201   1HA   GLY  28          2HA       GLY  28   4.710  -9.135   8.412
  202   2HA   GLY  28          3HA       GLY  28   3.642  -9.301   9.817
  203    H    VAL  29           H        VAL  29   3.767  -7.527   6.731
  204    HA   VAL  29           HA       VAL  29   0.844  -7.925   6.375
  205    HB   VAL  29           HB       VAL  29   1.302  -5.661   6.970
  206   1HG1  VAL  29          1HG1      VAL  29   3.617  -5.371   6.631
  207   2HG1  VAL  29          2HG1      VAL  29   3.510  -5.701   4.901
  208   3HG1  VAL  29          3HG1      VAL  29   2.791  -4.225   5.566
  209   1HG2  VAL  29          1HG2      VAL  29  -0.325  -6.136   5.147
  210   2HG2  VAL  29          2HG2      VAL  29   0.365  -4.508   5.143
  211   3HG2  VAL  29          3HG2      VAL  29   0.951  -5.708   3.971
  212    H    LYS  30           H        LYS  30   0.140  -8.863   4.386
  213    HA   LYS  30           HA       LYS  30   2.280  -9.176   2.366
  214   1HB   LYS  30          2HB       LYS  30   0.699 -11.134   3.015
  215   2HB   LYS  30          3HB       LYS  30  -0.421 -10.330   1.911
  216   1HG   LYS  30          2HG       LYS  30   2.314 -11.511   1.383
  217   2HG   LYS  30          3HG       LYS  30   0.788 -11.910   0.586
  218   1HD   LYS  30          2HD       LYS  30   0.873  -9.652  -0.601
  219   2HD   LYS  30          3HD       LYS  30   2.369  -9.319   0.270
  220   1HE   LYS  30          2HE       LYS  30   3.331  -9.878  -1.585
  221   2HE   LYS  30          3HE       LYS  30   3.337 -11.441  -0.769
  222   1HZ   LYS  30          1HZ       LYS  30   1.627 -10.511  -3.010
  223   2HZ   LYS  30          2HZ       LYS  30   2.625 -11.748  -2.995
  224   3HZ   LYS  30          3HZ       LYS  30   1.222 -11.859  -2.135
  225    H    TYR  31           H        TYR  31   2.427  -7.246   1.557
  226    HA   TYR  31           HA       TYR  31   0.125  -5.825   0.294
  227   1HB   TYR  31          2HB       TYR  31   1.762  -4.034  -0.150
  228   2HB   TYR  31          3HB       TYR  31   1.601  -4.350   1.575
  229    HD1  TYR  31           HD1      TYR  31   3.370  -5.558   2.797
  230    HD2  TYR  31           HD2      TYR  31   3.828  -4.638  -1.352
  231    HE1  TYR  31           HE1      TYR  31   5.656  -6.495   2.866
  232    HE2  TYR  31           HE2      TYR  31   6.139  -5.539  -1.307
  233    HH   TYR  31           HH       TYR  31   7.545  -6.978   1.656
  234    H    ASP  32           H        ASP  32   0.045  -5.781  -1.993
  235    HA   ASP  32           HA       ASP  32   2.372  -6.869  -3.426
  236   1HB   ASP  32          2HB       ASP  32   0.283  -8.564  -3.088
  237   2HB   ASP  32          3HB       ASP  32  -0.335  -7.656  -4.476
  238    H    ILE  33           H        ILE  33   2.392  -6.140  -5.648
  239    HA   ILE  33           HA       ILE  33   1.218  -3.377  -5.835
  240    HB   ILE  33           HB       ILE  33   4.193  -3.955  -6.012
  241   1HG1  ILE  33          2HG1      ILE  33   3.447  -2.027  -3.941
  242   2HG1  ILE  33          3HG1      ILE  33   2.753  -3.602  -3.583
  243   1HG2  ILE  33          1HG2      ILE  33   2.645  -1.352  -6.172
  244   2HG2  ILE  33          2HG2      ILE  33   4.413  -1.506  -6.089
  245   3HG2  ILE  33          3HG2      ILE  33   3.542  -2.141  -7.487
  246   1HD1  ILE  33          1HD1      ILE  33   5.050  -3.276  -2.668
  247   2HD1  ILE  33          2HD1      ILE  33   4.903  -4.691  -3.735
  248   3HD1  ILE  33          3HD1      ILE  33   5.671  -3.194  -4.324
  249    H    ASP  34           H        ASP  34   0.211  -3.377  -7.742
  250    HA   ASP  34           HA       ASP  34   1.424  -4.613 -10.146
  251   1HB   ASP  34          2HB       ASP  34  -1.018  -4.672  -9.929
  252   2HB   ASP  34          3HB       ASP  34  -1.064  -2.904  -9.821
  253    H    LEU  35           H        LEU  35   3.233  -3.558 -10.605
  254    HA   LEU  35           HA       LEU  35   3.692  -0.788 -10.062
  255   1HB   LEU  35          2HB       LEU  35   5.398  -2.676 -10.047
  256   2HB   LEU  35          3HB       LEU  35   5.337  -2.656 -11.807
  257    HG   LEU  35           HG       LEU  35   5.954  -0.124 -11.598
  258   1HD1  LEU  35          1HD1      LEU  35   6.892  -1.136  -8.865
  259   2HD1  LEU  35          2HD1      LEU  35   7.199   0.465  -9.556
  260   3HD1  LEU  35          3HD1      LEU  35   5.552  -0.005  -9.103
  261   1HD2  LEU  35          1HD2      LEU  35   7.949  -2.289 -10.816
  262   2HD2  LEU  35          2HD2      LEU  35   7.494  -1.824 -12.471
  263   3HD2  LEU  35          3HD2      LEU  35   8.357  -0.674 -11.434
  264    HA   PRO  36           HA       PRO  36   3.482  -0.174 -14.843
  265   1HB   PRO  36          2HB       PRO  36   1.689  -1.768 -16.266
  266   2HB   PRO  36          3HB       PRO  36   3.454  -2.007 -16.192
  267   1HG   PRO  36          2HG       PRO  36   1.328  -3.379 -14.560
  268   2HG   PRO  36          3HG       PRO  36   2.748  -4.106 -15.356
  269   1HD   PRO  36          2HD       PRO  36   2.768  -3.589 -12.749
  270   2HD   PRO  36          3HD       PRO  36   4.225  -3.240 -13.717
  271    H    ASN  37           H        ASN  37   0.477  -1.604 -13.385
  272    HA   ASN  37           HA       ASN  37  -1.124   0.607 -14.463
  273   1HB   ASN  37          2HB       ASN  37  -1.978  -1.690 -12.676
  274   2HB   ASN  37          3HB       ASN  37  -3.018  -0.519 -13.460
  275   1HD2  ASN  37          1HD2      ASN  37  -1.536  -3.585 -13.877
  276   2HD2  ASN  37          2HD2      ASN  37  -1.768  -3.707 -15.620
  277    H    LYS  38           H        LYS  38   0.427  -0.220 -11.295
  278    HA   LYS  38           HA       LYS  38   1.123   1.270  -9.809
  279   1HB   LYS  38          2HB       LYS  38  -0.573   3.449 -11.120
  280   2HB   LYS  38          3HB       LYS  38   0.667   3.593  -9.917
  281   1HG   LYS  38          2HG       LYS  38   2.404   2.902 -11.391
  282   2HG   LYS  38          3HG       LYS  38   1.257   2.367 -12.606
  283   1HD   LYS  38          2HD       LYS  38   0.439   4.759 -12.839
  284   2HD   LYS  38          3HD       LYS  38   1.729   5.239 -11.737
  285   1HE   LYS  38          2HE       LYS  38   2.508   5.594 -14.005
  286   2HE   LYS  38          3HE       LYS  38   3.425   4.256 -13.304
  287   1HZ   LYS  38          1HZ       LYS  38   2.710   3.754 -15.536
  288   2HZ   LYS  38          2HZ       LYS  38   1.937   2.724 -14.525
  289   3HZ   LYS  38          3HZ       LYS  38   1.131   3.996 -15.153
  290    H    LYS  39           H        LYS  39  -0.526  -0.577  -9.152
  291    HA   LYS  39           HA       LYS  39  -2.556   0.682  -7.405
  292   1HB   LYS  39          2HB       LYS  39  -2.984  -1.558  -9.435
  293   2HB   LYS  39          3HB       LYS  39  -3.854  -1.587  -7.911
  294   1HG   LYS  39          2HG       LYS  39  -5.300  -0.696  -9.501
  295   2HG   LYS  39          3HG       LYS  39  -4.894   0.574  -8.368
  296   1HD   LYS  39          2HD       LYS  39  -3.076   0.602 -10.649
  297   2HD   LYS  39          3HD       LYS  39  -4.729   0.580 -11.249
  298   1HE   LYS  39          2HE       LYS  39  -5.329   2.599 -10.071
  299   2HE   LYS  39          3HE       LYS  39  -3.877   2.507  -9.079
  300   1HZ   LYS  39          1HZ       LYS  39  -3.346   4.146 -10.530
  301   2HZ   LYS  39          2HZ       LYS  39  -2.631   2.835 -11.224
  302   3HZ   LYS  39          3HZ       LYS  39  -4.038   3.409 -11.827
  303    H    VAL  40           H        VAL  40  -2.857  -0.648  -5.369
  304    HA   VAL  40           HA       VAL  40  -0.987  -2.891  -5.069
  305    HB   VAL  40           HB       VAL  40  -1.522  -0.410  -3.441
  306   1HG1  VAL  40          1HG1      VAL  40  -0.628  -1.404  -1.414
  307   2HG1  VAL  40          2HG1      VAL  40  -2.222  -1.984  -1.914
  308   3HG1  VAL  40          3HG1      VAL  40  -0.782  -3.019  -2.152
  309   1HG2  VAL  40          1HG2      VAL  40   0.933  -0.514  -3.102
  310   2HG2  VAL  40          2HG2      VAL  40   0.972  -2.071  -3.940
  311   3HG2  VAL  40          3HG2      VAL  40   0.512  -0.601  -4.832
  312    H    CYS  41           H        CYS  41  -1.769  -4.519  -3.741
  313    HA   CYS  41           HA       CYS  41  -4.535  -4.274  -2.662
  314   1HB   CYS  41          2HB       CYS  41  -3.358  -6.791  -3.928
  315   2HB   CYS  41          3HB       CYS  41  -4.895  -6.679  -3.030
  316    HG   CYS  41           HG       CYS  41  -4.084  -4.984  -5.721
  317    H    ILE  42           H        ILE  42  -4.596  -5.091  -0.479
  318    HA   ILE  42           HA       ILE  42  -2.093  -6.295   0.537
  319    HB   ILE  42           HB       ILE  42  -3.463  -4.022   2.016
  320   1HG1  ILE  42          2HG1      ILE  42  -0.930  -3.828   0.364
  321   2HG1  ILE  42          3HG1      ILE  42  -2.490  -3.068   0.013
  322   1HG2  ILE  42          1HG2      ILE  42  -0.807  -5.442   2.433
  323   2HG2  ILE  42          2HG2      ILE  42  -1.389  -4.094   3.403
  324   3HG2  ILE  42          3HG2      ILE  42  -2.242  -5.625   3.456
  325   1HD1  ILE  42          1HD1      ILE  42  -0.570  -2.412   2.234
  326   2HD1  ILE  42          2HD1      ILE  42  -1.178  -1.362   0.953
  327   3HD1  ILE  42          3HD1      ILE  42  -2.265  -1.866   2.262
  328    H    GLU  43           H        GLU  43  -2.416  -7.782   2.163
  329    HA   GLU  43           HA       GLU  43  -4.967  -7.728   3.624
  330   1HB   GLU  43          2HB       GLU  43  -5.108  -9.438   1.703
  331   2HB   GLU  43          3HB       GLU  43  -3.892 -10.377   2.587
  332   1HG   GLU  43          2HG       GLU  43  -6.599  -9.474   3.702
  333   2HG   GLU  43          3HG       GLU  43  -6.268 -11.069   3.025
  334    H    SER  44           H        SER  44  -4.445  -7.824   5.775
  335    HA   SER  44           HA       SER  44  -3.056  -9.955   6.698
  336   1HB   SER  44          2HB       SER  44  -0.995  -8.886   6.401
  337   2HB   SER  44          3HB       SER  44  -1.539  -7.362   7.155
  338    HG   SER  44           HG       SER  44  -0.212  -9.008   8.441
  339    H    GLU  45           H        GLU  45  -3.058  -9.894   9.134
  340    HA   GLU  45           HA       GLU  45  -5.614  -9.112  10.197
  341   1HB   GLU  45          2HB       GLU  45  -3.069 -10.033  11.568
  342   2HB   GLU  45          3HB       GLU  45  -4.660  -9.881  12.333
  343   1HG   GLU  45          2HG       GLU  45  -4.104 -11.720   9.948
  344   2HG   GLU  45          3HG       GLU  45  -4.115 -12.208  11.644
  345    H    HIS  46           H        HIS  46  -2.564  -7.439   9.856
  346    HA   HIS  46           HA       HIS  46  -2.728  -5.439  11.856
  347   1HB   HIS  46          2HB       HIS  46  -1.907  -5.258   8.927
  348   2HB   HIS  46          3HB       HIS  46  -1.704  -3.946  10.087
  349    HD1  HIS  46           1HD      HIS  46  -0.038  -4.594  12.277
  350    HD2  HIS  46           2HD      HIS  46   0.220  -6.714   8.662
  351    HE1  HIS  46           1HE      HIS  46   2.322  -5.562  12.150
  352    H    SER  47           H        SER  47  -4.288  -3.904  12.279
  353    HA   SER  47           HA       SER  47  -6.731  -3.946  10.904
  354   1HB   SER  47          2HB       SER  47  -6.311  -3.049  13.260
  355   2HB   SER  47          3HB       SER  47  -5.818  -1.535  12.475
  356    HG   SER  47           HG       SER  47  -8.332  -2.809  12.436
  357    H    MET  48           H        MET  48  -7.751  -2.665   9.525
  358    HA   MET  48           HA       MET  48  -6.433  -2.077   7.160
  359   1HB   MET  48          2HB       MET  48  -9.068  -0.878   8.151
  360   2HB   MET  48          3HB       MET  48  -8.526  -0.975   6.470
  361   1HG   MET  48          2HG       MET  48  -8.492  -3.486   6.678
  362   2HG   MET  48          3HG       MET  48  -9.089  -3.319   8.331
  363   1HE   MET  48          1HE       MET  48 -10.287  -1.484   4.996
  364   2HE   MET  48          2HE       MET  48 -10.021  -3.200   4.570
  365   3HE   MET  48          3HE       MET  48 -11.665  -2.537   4.620
  366    H    ASP  49           H        ASP  49  -7.451   0.117   9.749
  367    HA   ASP  49           HA       ASP  49  -6.055   2.315   8.388
  368   1HB   ASP  49          2HB       ASP  49  -8.290   2.768   9.368
  369   2HB   ASP  49          3HB       ASP  49  -7.492   2.770  10.953
  370    H    THR  50           H        THR  50  -4.991  -0.040  10.556
  371    HA   THR  50           HA       THR  50  -2.869   1.627  11.700
  372    HB   THR  50           HB       THR  50  -2.886  -1.385  11.201
  373    HG1  THR  50           1HG      THR  50  -3.682   0.206  13.408
  374   1HG2  THR  50          1HG2      THR  50  -0.632  -0.481  11.572
  375   2HG2  THR  50          2HG2      THR  50  -1.193   0.376  13.025
  376   3HG2  THR  50          3HG2      THR  50  -1.183  -1.399  12.982
  377    H    LEU  51           H        LEU  51  -3.340  -0.581   8.891
  378    HA   LEU  51           HA       LEU  51  -0.806   0.016   7.674
  379   1HB   LEU  51          2HB       LEU  51  -3.404  -0.807   6.317
  380   2HB   LEU  51          3HB       LEU  51  -1.794  -0.779   5.575
  381    HG   LEU  51           HG       LEU  51  -2.589  -2.455   8.023
  382   1HD1  LEU  51          1HD1      LEU  51  -3.850  -3.238   6.189
  383   2HD1  LEU  51          2HD1      LEU  51  -2.463  -3.158   5.078
  384   3HD1  LEU  51          3HD1      LEU  51  -2.510  -4.377   6.378
  385   1HD2  LEU  51          1HD2      LEU  51  -0.102  -2.457   6.255
  386   2HD2  LEU  51          2HD2      LEU  51  -0.183  -2.084   7.989
  387   3HD2  LEU  51          3HD2      LEU  51  -0.486  -3.729   7.435
  388    H    LEU  52           H        LEU  52  -4.104   1.336   6.894
  389    HA   LEU  52           HA       LEU  52  -3.128   3.223   5.111
  390   1HB   LEU  52          2HB       LEU  52  -5.636   2.867   6.509
  391   2HB   LEU  52          3HB       LEU  52  -5.309   4.553   6.120
  392    HG   LEU  52           HG       LEU  52  -5.185   2.182   4.267
  393   1HD1  LEU  52          1HD1      LEU  52  -7.421   2.330   5.167
  394   2HD1  LEU  52          2HD1      LEU  52  -7.508   4.067   4.797
  395   3HD1  LEU  52          3HD1      LEU  52  -7.450   2.875   3.482
  396   1HD2  LEU  52          1HD2      LEU  52  -5.375   3.811   2.423
  397   2HD2  LEU  52          2HD2      LEU  52  -5.561   5.144   3.571
  398   3HD2  LEU  52          3HD2      LEU  52  -4.012   4.301   3.432
  399    H    ALA  53           H        ALA  53  -3.743   3.906   8.660
  400    HA   ALA  53           HA       ALA  53  -2.676   6.495   8.731
  401   1HB   ALA  53          1HB       ALA  53  -2.215   6.122  11.076
  402   2HB   ALA  53          2HB       ALA  53  -3.784   5.418  10.654
  403   3HB   ALA  53          3HB       ALA  53  -2.354   4.369  10.868
  404    H    THR  54           H        THR  54  -0.835   3.444   8.831
  405    HA   THR  54           HA       THR  54   1.704   4.749   9.134
  406    HB   THR  54           HB       THR  54   1.015   2.053   7.886
  407    HG1  THR  54           1HG      THR  54   0.400   2.147   9.996
  408   1HG2  THR  54          1HG2      THR  54   3.348   1.495   8.328
  409   2HG2  THR  54          2HG2      THR  54   3.233   2.841   7.194
  410   3HG2  THR  54          3HG2      THR  54   3.666   3.152   8.894
  411    H    LEU  55           H        LEU  55   0.209   3.367   6.133
  412    HA   LEU  55           HA       LEU  55   2.403   4.273   4.554
  413   1HB   LEU  55          2HB       LEU  55   1.320   3.229   2.779
  414   2HB   LEU  55          3HB       LEU  55   1.273   2.248   4.217
  415    HG   LEU  55           HG       LEU  55  -1.135   3.385   4.459
  416   1HD1  LEU  55          1HD1      LEU  55  -0.491   3.300   1.519
  417   2HD1  LEU  55          2HD1      LEU  55  -2.106   3.657   2.198
  418   3HD1  LEU  55          3HD1      LEU  55  -0.736   4.770   2.465
  419   1HD2  LEU  55          1HD2      LEU  55  -0.507   1.115   2.512
  420   2HD2  LEU  55          2HD2      LEU  55  -0.581   0.935   4.277
  421   3HD2  LEU  55          3HD2      LEU  55  -2.048   1.364   3.363
  422    H    LYS  56           H        LYS  56  -0.767   5.564   5.131
  423    HA   LYS  56           HA       LYS  56  -1.109   7.651   3.406
  424   1HB   LYS  56          2HB       LYS  56  -1.472   7.441   6.404
  425   2HB   LYS  56          3HB       LYS  56  -1.729   8.997   5.678
  426   1HG   LYS  56          2HG       LYS  56  -3.544   8.284   4.321
  427   2HG   LYS  56          3HG       LYS  56  -3.231   6.572   4.658
  428   1HD   LYS  56          2HD       LYS  56  -3.744   6.880   6.999
  429   2HD   LYS  56          3HD       LYS  56  -3.951   8.620   6.819
  430   1HE   LYS  56          2HE       LYS  56  -6.042   8.330   5.715
  431   2HE   LYS  56          3HE       LYS  56  -5.727   6.637   5.337
  432   1HZ   LYS  56          1HZ       LYS  56  -6.043   6.050   7.657
  433   2HZ   LYS  56          2HZ       LYS  56  -6.154   7.619   8.100
  434   3HZ   LYS  56          3HZ       LYS  56  -7.300   6.916   7.168
  435    H    LYS  57           H        LYS  57   1.232   7.576   6.122
  436    HA   LYS  57           HA       LYS  57   2.010  10.305   5.936
  437   1HB   LYS  57          2HB       LYS  57   3.416   7.892   7.110
  438   2HB   LYS  57          3HB       LYS  57   3.956   9.570   7.328
  439   1HG   LYS  57          2HG       LYS  57   1.720  10.110   8.311
  440   2HG   LYS  57          3HG       LYS  57   1.278   8.407   8.179
  441   1HD   LYS  57          2HD       LYS  57   3.712   9.374   9.740
  442   2HD   LYS  57          3HD       LYS  57   2.092   9.241  10.455
  443   1HE   LYS  57          2HE       LYS  57   1.979   6.855   9.896
  444   2HE   LYS  57          3HE       LYS  57   3.588   6.906   9.156
  445   1HZ   LYS  57          1HZ       LYS  57   3.647   6.052  11.377
  446   2HZ   LYS  57          2HZ       LYS  57   4.474   7.471  11.320
  447   3HZ   LYS  57          3HZ       LYS  57   2.969   7.416  11.991
  448    H    THR  58           H        THR  58   2.809   7.754   3.717
  449    HA   THR  58           HA       THR  58   5.365   8.760   2.854
  450    HB   THR  58           HB       THR  58   4.823   7.712   0.696
  451    HG1  THR  58           1HG      THR  58   2.330   6.980   1.810
  452   1HG2  THR  58          1HG2      THR  58   4.542   5.400   1.481
  453   2HG2  THR  58          2HG2      THR  58   5.737   6.304   2.435
  454   3HG2  THR  58          3HG2      THR  58   4.128   5.994   3.104
  455    H    GLY  59           H        GLY  59   2.006   9.763   2.311
  456   1HA   GLY  59          2HA       GLY  59   1.092  11.613   1.419
  457   2HA   GLY  59          3HA       GLY  59   2.686  12.389   1.470
  458    H    LYS  60           H        LYS  60   2.047   9.399  -0.369
  459    HA   LYS  60           HA       LYS  60   2.387  10.827  -2.975
  460   1HB   LYS  60          2HB       LYS  60   2.717   7.969  -1.989
  461   2HB   LYS  60          3HB       LYS  60   2.537   8.323  -3.703
  462   1HG   LYS  60          2HG       LYS  60   4.906   8.096  -2.892
  463   2HG   LYS  60          3HG       LYS  60   4.533   9.572  -3.815
  464   1HD   LYS  60          2HD       LYS  60   4.470  10.913  -1.834
  465   2HD   LYS  60          3HD       LYS  60   4.533   9.449  -0.814
  466   1HE   LYS  60          2HE       LYS  60   6.832   9.060  -1.414
  467   2HE   LYS  60          3HE       LYS  60   6.806  10.380  -2.601
  468   1HZ   LYS  60          1HZ       LYS  60   7.758  10.962  -0.370
  469   2HZ   LYS  60          2HZ       LYS  60   6.531  11.942  -0.867
  470   3HZ   LYS  60          3HZ       LYS  60   6.232  10.806   0.264
  471    H    THR  61           H        THR  61   0.900   9.772  -4.801
  472    HA   THR  61           HA       THR  61  -1.795  10.064  -4.040
  473    HB   THR  61           HB       THR  61  -0.572   8.902  -6.537
  474    HG1  THR  61           1HG      THR  61  -0.626  11.640  -5.817
  475   1HG2  THR  61          1HG2      THR  61  -2.321  10.273  -7.668
  476   2HG2  THR  61          2HG2      THR  61  -3.070   9.175  -6.488
  477   3HG2  THR  61          3HG2      THR  61  -2.856  10.896  -6.089
  478    H    VAL  62           H        VAL  62  -1.251   8.247  -2.354
  479    HA   VAL  62           HA       VAL  62  -2.080   5.573  -3.352
  480    HB   VAL  62           HB       VAL  62  -0.160   5.322  -2.144
  481   1HG1  VAL  62          1HG1      VAL  62   0.157   5.959   0.220
  482   2HG1  VAL  62          2HG1      VAL  62   0.068   7.356  -0.851
  483   3HG1  VAL  62          3HG1      VAL  62  -1.324   6.930   0.167
  484   1HG2  VAL  62          1HG2      VAL  62  -0.830   3.685  -0.631
  485   2HG2  VAL  62          2HG2      VAL  62  -2.276   4.586  -0.113
  486   3HG2  VAL  62          3HG2      VAL  62  -2.227   3.818  -1.704
  487    H    SER  63           H        SER  63  -4.192   5.858  -3.754
  488    HA   SER  63           HA       SER  63  -5.995   6.897  -1.595
  489   1HB   SER  63          2HB       SER  63  -6.583   6.243  -4.510
  490   2HB   SER  63          3HB       SER  63  -7.704   6.970  -3.344
  491    HG   SER  63           HG       SER  63  -5.205   8.080  -4.135
  492    H    TYR  64           H        TYR  64  -7.841   5.548  -1.030
  493    HA   TYR  64           HA       TYR  64  -7.310   2.615  -1.138
  494   1HB   TYR  64          2HB       TYR  64  -7.381   3.494   1.074
  495   2HB   TYR  64          3HB       TYR  64  -8.822   4.448   0.737
  496    HD1  TYR  64           HD1      TYR  64  -7.576   1.076   1.577
  497    HD2  TYR  64           HD2      TYR  64 -11.054   3.439   0.612
  498    HE1  TYR  64           HE1      TYR  64  -9.039  -0.575   2.708
  499    HE2  TYR  64           HE2      TYR  64 -12.510   1.687   1.557
  500    HH   TYR  64           HH       TYR  64 -12.596  -0.288   2.725
  501    H    LEU  65           H        LEU  65  -8.683   1.354  -2.347
  502    HA   LEU  65           HA       LEU  65 -11.473   2.070  -2.769
  503   1HB   LEU  65          2HB       LEU  65 -11.072   1.595  -5.300
  504   2HB   LEU  65          3HB       LEU  65 -11.013   3.216  -4.618
  505    HG   LEU  65           HG       LEU  65  -9.358   2.865  -6.272
  506   1HD1  LEU  65          1HD1      LEU  65  -8.955   4.353  -4.244
  507   2HD1  LEU  65          2HD1      LEU  65  -7.703   3.131  -3.873
  508   3HD1  LEU  65          3HD1      LEU  65  -7.660   4.035  -5.380
  509   1HD2  LEU  65          1HD2      LEU  65  -8.948   0.484  -6.118
  510   2HD2  LEU  65          2HD2      LEU  65  -7.452   1.411  -6.138
  511   3HD2  LEU  65          3HD2      LEU  65  -8.050   0.736  -4.607
  512    H    GLY  66           H        GLY  66 -11.496   0.094  -1.401
  513   1HA   GLY  66          2HA       GLY  66 -13.002  -1.705  -2.383
  514   2HA   GLY  66          3HA       GLY  66 -11.553  -2.338  -3.170
  515    H    LEU  67           H        LEU  67 -13.228  -3.698  -1.272
  516    HA   LEU  67           HA       LEU  67 -11.219  -4.761   0.468
  517   1HB   LEU  67          2HB       LEU  67 -12.288  -4.489   2.540
  518   2HB   LEU  67          3HB       LEU  67 -12.051  -2.881   1.869
  519    HG   LEU  67           HG       LEU  67 -14.682  -4.442   1.928
  520   1HD1  LEU  67          1HD1      LEU  67 -13.799  -2.042   3.564
  521   2HD1  LEU  67          2HD1      LEU  67 -15.367  -2.867   3.645
  522   3HD1  LEU  67          3HD1      LEU  67 -13.900  -3.719   4.149
  523   1HD2  LEU  67          1HD2      LEU  67 -15.699  -2.190   1.368
  524   2HD2  LEU  67          2HD2      LEU  67 -14.068  -1.598   0.994
  525   3HD2  LEU  67          3HD2      LEU  67 -14.802  -2.908   0.039
  526    H    GLU  68           H        GLU  68 -11.514  -6.995   0.491
  527    HA   GLU  68           HA       GLU  68 -14.217  -8.105   0.178
  528   1HB   GLU  68          2HB       GLU  68 -11.514  -8.609  -1.151
  529   2HB   GLU  68          3HB       GLU  68 -12.669  -9.879  -0.912
  530   1HG   GLU  68          2HG       GLU  68 -14.379  -8.597  -2.232
  531   2HG   GLU  68          3HG       GLU  68 -13.206  -7.286  -2.450
  Start of MODEL    8
    1   1H    MET   1           H1       MET   1  -7.545 -13.529   3.092
    2   2H    MET   1           H2       MET   1  -7.990 -14.727   4.160
    3   3H    MET   1           H3       MET   1  -9.112 -13.744   3.403
    4    HA   MET   1           HA       MET   1  -8.759 -13.093   5.728
    5   1HB   MET   1          2HB       MET   1  -6.056 -12.472   4.486
    6   2HB   MET   1          3HB       MET   1  -6.549 -11.753   6.002
    7   1HG   MET   1          2HG       MET   1  -6.774 -14.057   6.962
    8   2HG   MET   1          3HG       MET   1  -6.145 -14.719   5.452
    9   1HE   MET   1          1HE       MET   1  -2.444 -13.431   5.454
   10   2HE   MET   1          2HE       MET   1  -3.708 -14.283   4.538
   11   3HE   MET   1          3HE       MET   1  -3.785 -12.514   4.746
   12    HA   PRO   2           HA       PRO   2 -10.489  -9.437   3.938
   13   1HB   PRO   2          2HB       PRO   2  -9.754  -7.298   5.521
   14   2HB   PRO   2          3HB       PRO   2 -11.020  -8.486   5.947
   15   1HG   PRO   2          2HG       PRO   2  -8.115  -8.478   6.799
   16   2HG   PRO   2          3HG       PRO   2  -9.553  -8.709   7.839
   17   1HD   PRO   2          2HD       PRO   2  -8.168 -10.834   6.989
   18   2HD   PRO   2          3HD       PRO   2  -9.941 -10.898   6.927
   19    H    LYS   3           H        LYS   3  -9.817  -8.605   2.056
   20    HA   LYS   3           HA       LYS   3  -7.006  -7.717   1.750
   21   1HB   LYS   3          2HB       LYS   3  -7.572  -9.481   0.262
   22   2HB   LYS   3          3HB       LYS   3  -9.039  -8.662  -0.254
   23   1HG   LYS   3          2HG       LYS   3  -7.535  -6.762  -1.120
   24   2HG   LYS   3          3HG       LYS   3  -6.155  -7.821  -0.829
   25   1HD   LYS   3          2HD       LYS   3  -8.557  -8.444  -2.645
   26   2HD   LYS   3          3HD       LYS   3  -7.085  -7.650  -3.182
   27   1HE   LYS   3          2HE       LYS   3  -6.900  -9.887  -3.833
   28   2HE   LYS   3          3HE       LYS   3  -5.739  -9.660  -2.518
   29   1HZ   LYS   3          1HZ       LYS   3  -8.454 -10.794  -2.124
   30   2HZ   LYS   3          2HZ       LYS   3  -7.160 -11.727  -2.470
   31   3HZ   LYS   3          3HZ       LYS   3  -7.157 -10.923  -1.084
   32    H    HIS   4           H        HIS   4  -6.586  -5.677   1.169
   33    HA   HIS   4           HA       HIS   4  -8.798  -3.691   0.968
   34   1HB   HIS   4          2HB       HIS   4  -6.089  -3.367   2.322
   35   2HB   HIS   4          3HB       HIS   4  -7.411  -2.213   2.324
   36    HD1  HIS   4           1HD      HIS   4  -5.996  -5.006   4.323
   37    HD2  HIS   4           2HD      HIS   4  -9.787  -3.325   3.608
   38    HE1  HIS   4           1HE      HIS   4  -7.496  -5.755   6.240
   39    H    GLU   5           H        GLU   5  -8.693  -2.629  -1.023
   40    HA   GLU   5           HA       GLU   5  -6.156  -2.713  -2.587
   41   1HB   GLU   5          2HB       GLU   5  -9.037  -2.054  -3.307
   42   2HB   GLU   5          3HB       GLU   5  -7.665  -1.687  -4.340
   43   1HG   GLU   5          2HG       GLU   5  -7.091  -4.240  -3.996
   44   2HG   GLU   5          3HG       GLU   5  -8.827  -4.359  -3.660
   45    H    PHE   6           H        PHE   6  -5.144  -0.882  -3.322
   46    HA   PHE   6           HA       PHE   6  -6.164   1.773  -2.509
   47   1HB   PHE   6          2HB       PHE   6  -3.300   0.729  -2.154
   48   2HB   PHE   6          3HB       PHE   6  -3.844   2.327  -1.704
   49    HD1  PHE   6           1HD      PHE   6  -4.104  -1.317  -0.900
   50    HD2  PHE   6           2HD      PHE   6  -4.692   2.710   0.555
   51    HE1  PHE   6           1HE      PHE   6  -4.432  -2.181   1.374
   52    HE2  PHE   6           2HE      PHE   6  -4.921   1.831   2.843
   53    HZ   PHE   6           HZ       PHE   6  -4.890  -0.621   3.262
   54    H    SER   7           H        SER   7  -5.694   3.347  -3.986
   55    HA   SER   7           HA       SER   7  -4.368   2.536  -6.536
   56   1HB   SER   7          2HB       SER   7  -6.529   3.794  -6.698
   57   2HB   SER   7          3HB       SER   7  -5.741   5.163  -5.860
   58    HG   SER   7           HG       SER   7  -5.668   5.307  -8.172
   59    H    VAL   8           H        VAL   8  -2.295   3.328  -6.964
   60    HA   VAL   8           HA       VAL   8  -1.000   5.114  -4.976
   61    HB   VAL   8           HB       VAL   8   0.076   2.477  -6.107
   62   1HG1  VAL   8          1HG1      VAL   8   1.042   4.310  -3.852
   63   2HG1  VAL   8          2HG1      VAL   8   1.890   2.889  -4.516
   64   3HG1  VAL   8          3HG1      VAL   8   1.693   4.361  -5.491
   65   1HG2  VAL   8          1HG2      VAL   8  -0.072   1.737  -3.682
   66   2HG2  VAL   8          2HG2      VAL   8  -1.121   3.118  -3.373
   67   3HG2  VAL   8          3HG2      VAL   8  -1.636   1.853  -4.507
   68    H    ASP   9           H        ASP   9  -0.392   6.840  -6.246
   69    HA   ASP   9           HA       ASP   9   0.141   6.735  -9.047
   70   1HB   ASP   9          2HB       ASP   9  -0.538   8.719  -7.813
   71   2HB   ASP   9          3HB       ASP   9   0.978   8.668  -6.879
   72    H    MET  10           H        MET  10   1.466   4.724  -8.925
   73    HA   MET  10           HA       MET  10   4.277   5.102  -8.216
   74   1HB   MET  10          2HB       MET  10   2.883   2.768  -9.559
   75   2HB   MET  10          3HB       MET  10   4.603   2.843  -9.114
   76   1HG   MET  10          2HG       MET  10   3.892   3.416  -6.747
   77   2HG   MET  10          3HG       MET  10   2.235   3.053  -7.226
   78   1HE   MET  10          1HE       MET  10   1.214   0.778  -7.314
   79   2HE   MET  10          2HE       MET  10   2.174   0.622  -8.799
   80   3HE   MET  10          3HE       MET  10   2.149  -0.700  -7.605
   81    H    THR  11           H        THR  11   4.308   7.116  -9.413
   82    HA   THR  11           HA       THR  11   4.495   7.086 -12.269
   83    HB   THR  11           HB       THR  11   5.916   9.292 -11.096
   84    HG1  THR  11           1HG      THR  11   3.438   8.952  -9.789
   85   1HG2  THR  11          1HG2      THR  11   4.472   9.458 -13.071
   86   2HG2  THR  11          2HG2      THR  11   3.040   9.087 -12.082
   87   3HG2  THR  11          3HG2      THR  11   3.942  10.590 -11.809
   88    H    CYS  12           H        CYS  12   6.795   6.387  -9.636
   89    HA   CYS  12           HA       CYS  12   8.924   5.993 -11.703
   90   1HB   CYS  12          2HB       CYS  12   9.379   8.015 -10.342
   91   2HB   CYS  12          3HB       CYS  12   9.198   7.056  -8.852
   92    HG   CYS  12           HG       CYS  12  11.325   6.625 -11.342
   93    H    GLY  13           H        GLY  13  10.134   4.055 -11.328
   94   1HA   GLY  13          2HA       GLY  13   8.890   1.820 -10.172
   95   2HA   GLY  13          3HA       GLY  13  10.637   1.995 -10.436
   96    H    GLY  14           H        GLY  14  11.191   4.159  -8.756
   97   1HA   GLY  14          2HA       GLY  14  11.544   2.938  -6.256
   98   2HA   GLY  14          3HA       GLY  14  11.747   4.671  -6.585
   99    H    CYS  15           H        CYS  15   8.631   4.540  -7.433
  100    HA   CYS  15           HA       CYS  15   7.533   5.307  -4.916
  101   1HB   CYS  15          2HB       CYS  15   6.135   4.321  -7.387
  102   2HB   CYS  15          3HB       CYS  15   5.360   4.931  -5.904
  103    HG   CYS  15           HG       CYS  15   5.117   6.924  -7.333
  104    H    ALA  16           H        ALA  16   7.848   2.173  -6.667
  105    HA   ALA  16           HA       ALA  16   6.245   0.658  -4.806
  106   1HB   ALA  16          1HB       ALA  16   6.650  -0.130  -7.087
  107   2HB   ALA  16          2HB       ALA  16   8.392  -0.289  -6.750
  108   3HB   ALA  16          3HB       ALA  16   7.227  -1.308  -5.893
  109    H    GLU  17           H        GLU  17   9.736   1.514  -4.988
  110    HA   GLU  17           HA       GLU  17  10.505  -0.050  -2.702
  111   1HB   GLU  17          2HB       GLU  17  11.656   2.546  -3.832
  112   2HB   GLU  17          3HB       GLU  17  12.163   1.829  -2.322
  113   1HG   GLU  17          2HG       GLU  17  12.548  -0.366  -3.667
  114   2HG   GLU  17          3HG       GLU  17  12.486   0.686  -5.093
  115    H    ALA  18           H        ALA  18   9.160   3.285  -2.995
  116    HA   ALA  18           HA       ALA  18   9.259   3.902  -0.241
  117   1HB   ALA  18          1HB       ALA  18   8.616   5.516  -2.058
  118   2HB   ALA  18          2HB       ALA  18   7.006   4.754  -2.102
  119   3HB   ALA  18          3HB       ALA  18   7.559   5.545  -0.628
  120    H    VAL  19           H        VAL  19   6.621   2.325  -2.107
  121    HA   VAL  19           HA       VAL  19   4.918   1.777   0.058
  122    HB   VAL  19           HB       VAL  19   5.352   0.066  -2.426
  123   1HG1  VAL  19          1HG1      VAL  19   3.063   0.091  -0.411
  124   2HG1  VAL  19          2HG1      VAL  19   3.148  -0.871  -1.908
  125   3HG1  VAL  19          3HG1      VAL  19   4.246  -1.219  -0.588
  126   1HG2  VAL  19          1HG2      VAL  19   4.560   2.420  -2.888
  127   2HG2  VAL  19          2HG2      VAL  19   3.342   1.199  -3.262
  128   3HG2  VAL  19          3HG2      VAL  19   3.214   2.154  -1.770
  129    H    SER  20           H        SER  20   7.500  -0.352  -1.335
  130    HA   SER  20           HA       SER  20   7.059  -2.436   0.486
  131   1HB   SER  20          2HB       SER  20   8.408  -2.632  -1.617
  132   2HB   SER  20          3HB       SER  20   9.702  -1.685  -0.858
  133    HG   SER  20           HG       SER  20   8.660  -4.148   0.133
  134    H    ARG  21           H        ARG  21   9.330   0.281   0.761
  135    HA   ARG  21           HA       ARG  21  10.482  -0.548   3.216
  136   1HB   ARG  21          2HB       ARG  21  10.269   2.163   1.862
  137   2HB   ARG  21          3HB       ARG  21  11.244   1.851   3.313
  138   1HG   ARG  21          2HG       ARG  21  12.562   0.161   2.157
  139   2HG   ARG  21          3HG       ARG  21  11.559   0.251   0.719
  140   1HD   ARG  21          2HD       ARG  21  12.219   2.574   0.320
  141   2HD   ARG  21          3HD       ARG  21  13.290   2.555   1.718
  142    HE   ARG  21           HE       ARG  21  13.777   1.419  -0.959
  143   1HH1  ARG  21          2HH2      ARG  21  14.671   0.993   2.421
  144   2HH1  ARG  21          1HH2      ARG  21  16.224   0.293   2.051
  145   1HH2  ARG  21          2HH1      ARG  21  15.629   0.573  -1.462
  146   2HH2  ARG  21          1HH1      ARG  21  16.828   0.012  -0.298
  147    H    VAL  22           H        VAL  22   7.711   1.858   2.656
  148    HA   VAL  22           HA       VAL  22   7.379   2.239   5.399
  149    HB   VAL  22           HB       VAL  22   6.646   3.681   3.470
  150   1HG1  VAL  22          1HG1      VAL  22   4.177   1.922   3.548
  151   2HG1  VAL  22          2HG1      VAL  22   4.398   3.373   2.568
  152   3HG1  VAL  22          3HG1      VAL  22   5.367   1.947   2.229
  153   1HG2  VAL  22          1HG2      VAL  22   6.012   4.100   5.785
  154   2HG2  VAL  22          2HG2      VAL  22   4.727   4.547   4.627
  155   3HG2  VAL  22          3HG2      VAL  22   4.573   3.052   5.572
  156    H    LEU  23           H        LEU  23   5.667  -0.097   3.167
  157    HA   LEU  23           HA       LEU  23   4.010  -1.133   5.161
  158   1HB   LEU  23          2HB       LEU  23   5.040  -2.181   2.507
  159   2HB   LEU  23          3HB       LEU  23   4.169  -3.236   3.594
  160    HG   LEU  23           HG       LEU  23   2.733  -2.263   1.852
  161   1HD1  LEU  23          1HD1      LEU  23   1.693  -3.249   3.767
  162   2HD1  LEU  23          2HD1      LEU  23   2.083  -1.846   4.794
  163   3HD1  LEU  23          3HD1      LEU  23   0.908  -1.669   3.508
  164   1HD2  LEU  23          1HD2      LEU  23   1.855  -0.053   2.096
  165   2HD2  LEU  23          2HD2      LEU  23   2.814   0.211   3.569
  166   3HD2  LEU  23          3HD2      LEU  23   3.621   0.070   1.982
  167    H    ASN  24           H        ASN  24   7.338  -2.281   4.197
  168    HA   ASN  24           HA       ASN  24   7.472  -4.381   6.095
  169   1HB   ASN  24          2HB       ASN  24   9.515  -2.526   4.808
  170   2HB   ASN  24          3HB       ASN  24   9.941  -3.576   6.139
  171   1HD2  ASN  24          1HD2      ASN  24   9.184  -3.536   2.741
  172   2HD2  ASN  24          2HD2      ASN  24   9.705  -5.199   2.472
  173    H    LYS  25           H        LYS  25   8.316  -0.908   6.403
  174    HA   LYS  25           HA       LYS  25   9.249  -0.919   9.031
  175   1HB   LYS  25          2HB       LYS  25   7.907   1.158   7.276
  176   2HB   LYS  25          3HB       LYS  25   8.224   1.541   8.959
  177   1HG   LYS  25          2HG       LYS  25  10.405   0.477   7.122
  178   2HG   LYS  25          3HG       LYS  25  10.003   2.198   7.220
  179   1HD   LYS  25          2HD       LYS  25  10.436   2.205   9.651
  180   2HD   LYS  25          3HD       LYS  25  10.848   0.481   9.606
  181   1HE   LYS  25          2HE       LYS  25  12.719   0.972   8.027
  182   2HE   LYS  25          3HE       LYS  25  12.329   2.698   8.111
  183   1HZ   LYS  25          1HZ       LYS  25  12.826   2.628  10.464
  184   2HZ   LYS  25          2HZ       LYS  25  13.188   1.024  10.382
  185   3HZ   LYS  25          3HZ       LYS  25  14.117   2.119   9.586
  186    H    LEU  26           H        LEU  26   5.883  -0.745   7.924
  187    HA   LEU  26           HA       LEU  26   4.611  -0.273  10.348
  188   1HB   LEU  26          2HB       LEU  26   3.648  -0.675   8.029
  189   2HB   LEU  26          3HB       LEU  26   3.709  -2.393   8.339
  190    HG   LEU  26           HG       LEU  26   1.525  -1.097   8.632
  191   1HD1  LEU  26          1HD1      LEU  26   1.793  -3.464   9.164
  192   2HD1  LEU  26          2HD1      LEU  26   2.328  -3.047  10.809
  193   3HD1  LEU  26          3HD1      LEU  26   0.687  -2.643  10.273
  194   1HD2  LEU  26          1HD2      LEU  26   0.998  -0.157  10.777
  195   2HD2  LEU  26          2HD2      LEU  26   2.561  -0.626  11.457
  196   3HD2  LEU  26          3HD2      LEU  26   2.461   0.651  10.230
  197    H    GLY  27           H        GLY  27   6.017  -3.347   9.178
  198   1HA   GLY  27          2HA       GLY  27   6.741  -4.372  11.588
  199   2HA   GLY  27          3HA       GLY  27   5.019  -4.801  11.519
  200    H    GLY  28           H        GLY  28   4.291  -6.361  10.037
  201   1HA   GLY  28          2HA       GLY  28   6.263  -7.919   8.449
  202   2HA   GLY  28          3HA       GLY  28   5.498  -8.704   9.845
  203    H    VAL  29           H        VAL  29   4.213  -6.338   7.597
  204    HA   VAL  29           HA       VAL  29   1.803  -7.871   6.982
  205    HB   VAL  29           HB       VAL  29   1.778  -5.440   7.321
  206   1HG1  VAL  29          1HG1      VAL  29   3.465  -5.212   4.793
  207   2HG1  VAL  29          2HG1      VAL  29   2.796  -3.883   5.757
  208   3HG1  VAL  29          3HG1      VAL  29   4.070  -4.900   6.413
  209   1HG2  VAL  29          1HG2      VAL  29   0.470  -4.769   5.414
  210   2HG2  VAL  29          2HG2      VAL  29   1.121  -6.062   4.413
  211   3HG2  VAL  29          3HG2      VAL  29   0.085  -6.451   5.809
  212    H    LYS  30           H        LYS  30   1.207  -8.425   4.710
  213    HA   LYS  30           HA       LYS  30   3.477  -8.599   2.832
  214   1HB   LYS  30          2HB       LYS  30   2.907 -10.853   3.813
  215   2HB   LYS  30          3HB       LYS  30   1.318 -10.748   3.040
  216   1HG   LYS  30          2HG       LYS  30   3.891 -10.335   1.455
  217   2HG   LYS  30          3HG       LYS  30   3.369 -11.962   1.872
  218   1HD   LYS  30          2HD       LYS  30   1.465 -11.910   0.556
  219   2HD   LYS  30          3HD       LYS  30   1.365 -10.148   0.497
  220   1HE   LYS  30          2HE       LYS  30   3.239  -9.930  -0.933
  221   2HE   LYS  30          3HE       LYS  30   3.673 -11.643  -0.806
  222   1HZ   LYS  30          1HZ       LYS  30   1.821 -12.224  -2.131
  223   2HZ   LYS  30          2HZ       LYS  30   1.064 -10.784  -1.884
  224   3HZ   LYS  30          3HZ       LYS  30   2.295 -10.803  -2.851
  225    H    TYR  31           H        TYR  31   2.945  -7.855   0.805
  226    HA   TYR  31           HA       TYR  31   0.274  -6.779   0.243
  227   1HB   TYR  31          2HB       TYR  31   1.299  -4.510  -0.007
  228   2HB   TYR  31          3HB       TYR  31   1.196  -5.062   1.664
  229    HD1  TYR  31           HD1      TYR  31   3.263  -6.019   2.793
  230    HD2  TYR  31           HD2      TYR  31   3.418  -3.888  -0.935
  231    HE1  TYR  31           HE1      TYR  31   5.722  -5.931   2.969
  232    HE2  TYR  31           HE2      TYR  31   5.894  -3.924  -0.847
  233    HH   TYR  31           HH       TYR  31   7.648  -5.222   1.982
  234    H    ASP  32           H        ASP  32   0.192  -6.005  -1.961
  235    HA   ASP  32           HA       ASP  32   2.215  -7.232  -3.786
  236   1HB   ASP  32          2HB       ASP  32  -0.757  -7.592  -3.459
  237   2HB   ASP  32          3HB       ASP  32  -0.046  -7.837  -5.053
  238    H    ILE  33           H        ILE  33   2.699  -5.978  -5.502
  239    HA   ILE  33           HA       ILE  33   1.617  -3.198  -5.409
  240    HB   ILE  33           HB       ILE  33   4.512  -4.037  -5.780
  241   1HG1  ILE  33          2HG1      ILE  33   4.416  -2.950  -3.281
  242   2HG1  ILE  33          3HG1      ILE  33   2.897  -3.819  -3.270
  243   1HG2  ILE  33          1HG2      ILE  33   3.197  -1.397  -5.027
  244   2HG2  ILE  33          2HG2      ILE  33   4.942  -1.701  -5.138
  245   3HG2  ILE  33          3HG2      ILE  33   3.942  -1.813  -6.586
  246   1HD1  ILE  33          1HD1      ILE  33   4.593  -5.365  -2.464
  247   2HD1  ILE  33          2HD1      ILE  33   4.270  -5.887  -4.108
  248   3HD1  ILE  33          3HD1      ILE  33   5.706  -4.907  -3.764
  249    H    ASP  34           H        ASP  34   0.655  -2.768  -7.343
  250    HA   ASP  34           HA       ASP  34   1.580  -4.239  -9.768
  251   1HB   ASP  34          2HB       ASP  34  -0.767  -4.485  -8.979
  252   2HB   ASP  34          3HB       ASP  34  -1.028  -2.767  -9.332
  253    H    LEU  35           H        LEU  35   3.170  -3.069 -10.663
  254    HA   LEU  35           HA       LEU  35   3.386  -0.217 -10.544
  255   1HB   LEU  35          2HB       LEU  35   4.863  -2.414 -12.014
  256   2HB   LEU  35          3HB       LEU  35   5.189  -0.729 -12.386
  257    HG   LEU  35           HG       LEU  35   6.791  -1.738 -10.831
  258   1HD1  LEU  35          1HD1      LEU  35   6.380   0.733 -10.909
  259   2HD1  LEU  35          2HD1      LEU  35   5.295   0.556  -9.513
  260   3HD1  LEU  35          3HD1      LEU  35   7.013   0.149  -9.366
  261   1HD2  LEU  35          1HD2      LEU  35   4.545  -1.733  -8.784
  262   2HD2  LEU  35          2HD2      LEU  35   5.239  -3.185  -9.542
  263   3HD2  LEU  35          3HD2      LEU  35   6.242  -2.159  -8.501
  264    HA   PRO  36           HA       PRO  36   2.049  -0.154 -15.138
  265   1HB   PRO  36          2HB       PRO  36   0.268  -2.119 -15.994
  266   2HB   PRO  36          3HB       PRO  36   2.014  -2.037 -16.358
  267   1HG   PRO  36          2HG       PRO  36   0.624  -3.661 -14.250
  268   2HG   PRO  36          3HG       PRO  36   1.985  -4.140 -15.292
  269   1HD   PRO  36          2HD       PRO  36   2.329  -3.416 -12.732
  270   2HD   PRO  36          3HD       PRO  36   3.537  -2.963 -13.960
  271    H    ASN  37           H        ASN  37  -0.338  -1.877 -12.963
  272    HA   ASN  37           HA       ASN  37  -2.438  -0.079 -13.870
  273   1HB   ASN  37          2HB       ASN  37  -2.523  -2.205 -11.704
  274   2HB   ASN  37          3HB       ASN  37  -3.887  -1.323 -12.354
  275   1HD2  ASN  37          1HD2      ASN  37  -1.450  -3.777 -13.112
  276   2HD2  ASN  37          2HD2      ASN  37  -2.268  -4.390 -14.552
  277    H    LYS  38           H        LYS  38  -0.175   0.026 -11.127
  278    HA   LYS  38           HA       LYS  38   0.179   1.693  -9.675
  279   1HB   LYS  38          2HB       LYS  38  -1.770   3.207 -11.456
  280   2HB   LYS  38          3HB       LYS  38  -1.041   3.932 -10.053
  281   1HG   LYS  38          2HG       LYS  38   1.095   3.937 -10.948
  282   2HG   LYS  38          3HG       LYS  38   0.830   2.421 -11.798
  283   1HD   LYS  38          2HD       LYS  38  -0.681   3.694 -13.425
  284   2HD   LYS  38          3HD       LYS  38  -0.121   5.182 -12.644
  285   1HE   LYS  38          2HE       LYS  38   1.199   4.716 -14.660
  286   2HE   LYS  38          3HE       LYS  38   2.239   4.593 -13.230
  287   1HZ   LYS  38          1HZ       LYS  38   0.961   2.248 -14.511
  288   2HZ   LYS  38          2HZ       LYS  38   2.487   2.773 -14.880
  289   3HZ   LYS  38          3HZ       LYS  38   2.127   2.209 -13.382
  290    H    LYS  39           H        LYS  39  -1.093  -0.406  -8.927
  291    HA   LYS  39           HA       LYS  39  -2.864   0.691  -6.825
  292   1HB   LYS  39          2HB       LYS  39  -3.131  -2.005  -8.246
  293   2HB   LYS  39          3HB       LYS  39  -3.796  -1.674  -6.649
  294   1HG   LYS  39          2HG       LYS  39  -5.073   0.284  -7.730
  295   2HG   LYS  39          3HG       LYS  39  -4.676  -0.507  -9.277
  296   1HD   LYS  39          2HD       LYS  39  -5.503  -2.708  -8.115
  297   2HD   LYS  39          3HD       LYS  39  -6.161  -1.667  -6.849
  298   1HE   LYS  39          2HE       LYS  39  -7.598  -0.551  -8.623
  299   2HE   LYS  39          3HE       LYS  39  -6.937  -1.713  -9.793
  300   1HZ   LYS  39          1HZ       LYS  39  -7.773  -3.413  -7.988
  301   2HZ   LYS  39          2HZ       LYS  39  -8.718  -2.272  -7.498
  302   3HZ   LYS  39          3HZ       LYS  39  -8.873  -2.766  -9.060
  303    H    VAL  40           H        VAL  40  -2.599  -0.363  -4.764
  304    HA   VAL  40           HA       VAL  40  -0.655  -2.546  -4.617
  305    HB   VAL  40           HB       VAL  40  -1.163  -0.121  -2.853
  306   1HG1  VAL  40          1HG1      VAL  40  -0.332  -2.834  -1.834
  307   2HG1  VAL  40          2HG1      VAL  40  -0.110  -1.295  -0.950
  308   3HG1  VAL  40          3HG1      VAL  40  -1.743  -1.821  -1.401
  309   1HG2  VAL  40          1HG2      VAL  40   1.381  -1.675  -3.442
  310   2HG2  VAL  40          2HG2      VAL  40   0.800  -0.308  -4.423
  311   3HG2  VAL  40          3HG2      VAL  40   1.225  -0.051  -2.718
  312    H    CYS  41           H        CYS  41  -1.587  -4.314  -3.678
  313    HA   CYS  41           HA       CYS  41  -4.213  -3.933  -2.367
  314   1HB   CYS  41          2HB       CYS  41  -5.198  -5.775  -3.168
  315   2HB   CYS  41          3HB       CYS  41  -4.355  -5.325  -4.642
  316    HG   CYS  41           HG       CYS  41  -2.357  -6.920  -4.224
  317    H    ILE  42           H        ILE  42  -4.345  -4.952  -0.372
  318    HA   ILE  42           HA       ILE  42  -1.893  -6.394   0.562
  319    HB   ILE  42           HB       ILE  42  -3.486  -4.380   2.186
  320   1HG1  ILE  42          2HG1      ILE  42  -0.846  -4.015   0.708
  321   2HG1  ILE  42          3HG1      ILE  42  -2.355  -3.152   0.395
  322   1HG2  ILE  42          1HG2      ILE  42  -1.667  -4.664   3.828
  323   2HG2  ILE  42          2HG2      ILE  42  -2.314  -6.237   3.424
  324   3HG2  ILE  42          3HG2      ILE  42  -0.789  -5.701   2.698
  325   1HD1  ILE  42          1HD1      ILE  42  -0.779  -1.743   1.596
  326   2HD1  ILE  42          2HD1      ILE  42  -2.236  -2.032   2.560
  327   3HD1  ILE  42          3HD1      ILE  42  -0.737  -2.912   2.927
  328    H    GLU  43           H        GLU  43  -2.413  -8.236   1.681
  329    HA   GLU  43           HA       GLU  43  -5.184  -8.534   2.661
  330   1HB   GLU  43          2HB       GLU  43  -5.039  -9.725   0.504
  331   2HB   GLU  43          3HB       GLU  43  -3.712 -10.720   1.132
  332   1HG   GLU  43          2HG       GLU  43  -5.065 -11.565   2.901
  333   2HG   GLU  43          3HG       GLU  43  -6.425 -10.477   2.533
  334    H    SER  44           H        SER  44  -4.857  -8.392   4.758
  335    HA   SER  44           HA       SER  44  -3.162 -10.337   6.097
  336   1HB   SER  44          2HB       SER  44  -2.022  -8.492   7.406
  337   2HB   SER  44          3HB       SER  44  -1.463  -8.695   5.741
  338    HG   SER  44           HG       SER  44  -2.158  -6.469   6.730
  339    H    GLU  45           H        GLU  45  -4.192 -10.886   7.985
  340    HA   GLU  45           HA       GLU  45  -6.742  -9.614   8.473
  341   1HB   GLU  45          2HB       GLU  45  -6.123 -12.089   8.486
  342   2HB   GLU  45          3HB       GLU  45  -5.526 -11.852  10.128
  343   1HG   GLU  45          2HG       GLU  45  -7.699 -11.563  10.950
  344   2HG   GLU  45          3HG       GLU  45  -8.312 -10.864   9.447
  345    H    HIS  46           H        HIS  46  -5.416  -7.549   8.811
  346    HA   HIS  46           HA       HIS  46  -5.873  -6.953  11.611
  347   1HB   HIS  46          2HB       HIS  46  -3.831  -5.438  11.719
  348   2HB   HIS  46          3HB       HIS  46  -3.576  -7.168  11.916
  349    HD1  HIS  46           1HD      HIS  46  -1.307  -7.699  10.940
  350    HD2  HIS  46           2HD      HIS  46  -3.492  -4.914   8.659
  351    HE1  HIS  46           1HE      HIS  46   0.145  -7.091   8.930
  352    H    SER  47           H        SER  47  -6.226  -4.590  11.863
  353    HA   SER  47           HA       SER  47  -8.198  -4.052   9.995
  354   1HB   SER  47          2HB       SER  47  -7.934  -3.220  12.460
  355   2HB   SER  47          3HB       SER  47  -7.173  -1.791  11.725
  356    HG   SER  47           HG       SER  47  -9.116  -1.218  10.987
  357    H    MET  48           H        MET  48  -8.541  -2.588   8.384
  358    HA   MET  48           HA       MET  48  -6.700  -1.925   6.478
  359   1HB   MET  48          2HB       MET  48  -9.250  -1.898   6.472
  360   2HB   MET  48          3HB       MET  48  -9.177  -0.348   7.321
  361   1HG   MET  48          2HG       MET  48  -7.664   0.382   5.311
  362   2HG   MET  48          3HG       MET  48  -8.324  -1.053   4.524
  363   1HE   MET  48          1HE       MET  48 -11.373  -0.946   5.880
  364   2HE   MET  48          2HE       MET  48 -12.200  -0.120   4.543
  365   3HE   MET  48          3HE       MET  48 -11.011  -1.393   4.194
  366    H    ASP  49           H        ASP  49  -7.895   0.066   9.191
  367    HA   ASP  49           HA       ASP  49  -6.932   2.534   8.757
  368   1HB   ASP  49          2HB       ASP  49  -6.830   1.184  11.486
  369   2HB   ASP  49          3HB       ASP  49  -7.124   2.889  11.126
  370    H    THR  50           H        THR  50  -5.251  -0.004  10.452
  371    HA   THR  50           HA       THR  50  -2.851   1.112  11.167
  372    HB   THR  50           HB       THR  50  -3.192  -1.717  10.081
  373    HG1  THR  50           1HG      THR  50  -4.364  -2.209  11.821
  374   1HG2  THR  50          1HG2      THR  50  -1.802  -2.317  12.036
  375   2HG2  THR  50          2HG2      THR  50  -0.978  -1.146  10.992
  376   3HG2  THR  50          3HG2      THR  50  -1.720  -0.607  12.515
  377    H    LEU  51           H        LEU  51  -3.725  -0.430   8.042
  378    HA   LEU  51           HA       LEU  51  -1.076  -0.105   6.864
  379   1HB   LEU  51          2HB       LEU  51  -3.751  -0.575   5.486
  380   2HB   LEU  51          3HB       LEU  51  -2.137  -0.754   4.787
  381    HG   LEU  51           HG       LEU  51  -3.190  -2.367   7.209
  382   1HD1  LEU  51          1HD1      LEU  51  -4.650  -2.814   5.357
  383   2HD1  LEU  51          2HD1      LEU  51  -3.279  -3.083   4.273
  384   3HD1  LEU  51          3HD1      LEU  51  -3.585  -4.207   5.617
  385   1HD2  LEU  51          1HD2      LEU  51  -0.810  -2.743   5.348
  386   2HD2  LEU  51          2HD2      LEU  51  -0.755  -2.364   7.085
  387   3HD2  LEU  51          3HD2      LEU  51  -1.370  -3.930   6.545
  388    H    LEU  52           H        LEU  52  -4.287   1.340   6.375
  389    HA   LEU  52           HA       LEU  52  -3.878   3.302   4.558
  390   1HB   LEU  52          2HB       LEU  52  -5.700   2.781   6.783
  391   2HB   LEU  52          3HB       LEU  52  -5.480   4.513   6.611
  392    HG   LEU  52           HG       LEU  52  -6.290   2.639   4.346
  393   1HD1  LEU  52          1HD1      LEU  52  -8.024   4.388   6.127
  394   2HD1  LEU  52          2HD1      LEU  52  -8.563   3.445   4.716
  395   3HD1  LEU  52          3HD1      LEU  52  -7.943   2.615   6.155
  396   1HD2  LEU  52          1HD2      LEU  52  -6.289   5.668   4.710
  397   2HD2  LEU  52          2HD2      LEU  52  -5.306   4.759   3.540
  398   3HD2  LEU  52          3HD2      LEU  52  -7.066   4.846   3.351
  399    H    ALA  53           H        ALA  53  -3.382   3.790   8.083
  400    HA   ALA  53           HA       ALA  53  -2.299   6.401   7.863
  401   1HB   ALA  53          1HB       ALA  53  -1.443   5.986  10.154
  402   2HB   ALA  53          2HB       ALA  53  -3.120   5.432   9.981
  403   3HB   ALA  53          3HB       ALA  53  -1.794   4.252   9.974
  404    H    THR  54           H        THR  54  -0.596   3.268   8.092
  405    HA   THR  54           HA       THR  54   2.041   4.318   8.007
  406    HB   THR  54           HB       THR  54   0.995   1.806   8.282
  407    HG1  THR  54           1HG      THR  54   3.325   1.381   8.433
  408   1HG2  THR  54          1HG2      THR  54   2.743   1.871   5.826
  409   2HG2  THR  54          2HG2      THR  54   2.248   0.413   6.700
  410   3HG2  THR  54          3HG2      THR  54   1.037   1.366   5.856
  411    H    LEU  55           H        LEU  55   0.072   3.185   5.271
  412    HA   LEU  55           HA       LEU  55   2.122   3.960   3.399
  413   1HB   LEU  55          2HB       LEU  55   0.564   3.350   1.660
  414   2HB   LEU  55          3HB       LEU  55   0.965   2.161   2.856
  415    HG   LEU  55           HG       LEU  55  -1.367   3.311   3.893
  416   1HD1  LEU  55          1HD1      LEU  55  -1.465   4.591   1.801
  417   2HD1  LEU  55          2HD1      LEU  55  -1.654   3.060   0.909
  418   3HD1  LEU  55          3HD1      LEU  55  -2.898   3.568   2.089
  419   1HD2  LEU  55          1HD2      LEU  55  -2.316   1.141   3.254
  420   2HD2  LEU  55          2HD2      LEU  55  -1.014   0.917   2.050
  421   3HD2  LEU  55          3HD2      LEU  55  -0.618   0.958   3.779
  422    H    LYS  56           H        LYS  56  -0.913   5.581   4.420
  423    HA   LYS  56           HA       LYS  56  -0.741   7.832   2.739
  424   1HB   LYS  56          2HB       LYS  56  -1.725   7.452   5.586
  425   2HB   LYS  56          3HB       LYS  56  -1.651   9.059   4.895
  426   1HG   LYS  56          2HG       LYS  56  -3.040   8.450   3.010
  427   2HG   LYS  56          3HG       LYS  56  -3.127   6.761   3.552
  428   1HD   LYS  56          2HD       LYS  56  -4.326   7.350   5.534
  429   2HD   LYS  56          3HD       LYS  56  -3.979   9.079   5.333
  430   1HE   LYS  56          2HE       LYS  56  -5.362   9.207   3.309
  431   2HE   LYS  56          3HE       LYS  56  -5.662   7.468   3.345
  432   1HZ   LYS  56          1HZ       LYS  56  -6.848   7.789   5.424
  433   2HZ   LYS  56          2HZ       LYS  56  -6.565   9.411   5.375
  434   3HZ   LYS  56          3HZ       LYS  56  -7.503   8.703   4.227
  435    H    LYS  57           H        LYS  57   0.978   7.241   5.842
  436    HA   LYS  57           HA       LYS  57   2.222   9.770   5.994
  437   1HB   LYS  57          2HB       LYS  57   2.851   7.054   7.085
  438   2HB   LYS  57          3HB       LYS  57   3.975   8.402   7.376
  439   1HG   LYS  57          2HG       LYS  57   2.077   9.702   8.351
  440   2HG   LYS  57          3HG       LYS  57   1.036   8.290   8.139
  441   1HD   LYS  57          2HD       LYS  57   3.561   8.444   9.855
  442   2HD   LYS  57          3HD       LYS  57   1.891   8.502  10.450
  443   1HE   LYS  57          2HE       LYS  57   1.511   6.201   9.481
  444   2HE   LYS  57          3HE       LYS  57   3.231   6.129   9.048
  445   1HZ   LYS  57          1HZ       LYS  57   2.814   5.014  11.078
  446   2HZ   LYS  57          2HZ       LYS  57   3.770   6.319  11.365
  447   3HZ   LYS  57          3HZ       LYS  57   2.174   6.358  11.777
  448    H    THR  58           H        THR  58   2.896   7.457   3.495
  449    HA   THR  58           HA       THR  58   5.652   8.201   3.053
  450    HB   THR  58           HB       THR  58   5.246   7.593   0.722
  451    HG1  THR  58           1HG      THR  58   2.548   7.094   1.394
  452   1HG2  THR  58          1HG2      THR  58   5.700   5.798   2.268
  453   2HG2  THR  58          2HG2      THR  58   3.980   5.660   2.675
  454   3HG2  THR  58          3HG2      THR  58   4.536   5.271   1.031
  455    H    GLY  59           H        GLY  59   2.562   9.803   2.534
  456   1HA   GLY  59          2HA       GLY  59   2.043  11.938   2.008
  457   2HA   GLY  59          3HA       GLY  59   3.764  12.355   1.910
  458    H    LYS  60           H        LYS  60   2.459   9.651   0.008
  459    HA   LYS  60           HA       LYS  60   2.908  11.156  -2.527
  460   1HB   LYS  60          2HB       LYS  60   2.820   8.247  -1.704
  461   2HB   LYS  60          3HB       LYS  60   2.588   8.712  -3.383
  462   1HG   LYS  60          2HG       LYS  60   4.946   8.106  -2.754
  463   2HG   LYS  60          3HG       LYS  60   4.741   9.668  -3.575
  464   1HD   LYS  60          2HD       LYS  60   5.003  10.903  -1.549
  465   2HD   LYS  60          3HD       LYS  60   4.861   9.415  -0.581
  466   1HE   LYS  60          2HE       LYS  60   7.035   8.661  -1.320
  467   2HE   LYS  60          3HE       LYS  60   7.191  10.044  -2.424
  468   1HZ   LYS  60          1HZ       LYS  60   8.313  10.317  -0.225
  469   2HZ   LYS  60          2HZ       LYS  60   7.233  11.508  -0.577
  470   3HZ   LYS  60          3HZ       LYS  60   6.820  10.347   0.495
  471    H    THR  61           H        THR  61   1.400  10.678  -4.327
  472    HA   THR  61           HA       THR  61  -1.380  10.976  -3.673
  473    HB   THR  61           HB       THR  61  -1.168  10.337  -6.318
  474    HG1  THR  61           1HG      THR  61   0.831  10.963  -7.067
  475   1HG2  THR  61          1HG2      THR  61  -2.168  12.403  -5.432
  476   2HG2  THR  61          2HG2      THR  61  -0.549  13.036  -5.047
  477   3HG2  THR  61          3HG2      THR  61  -1.027  12.779  -6.738
  478    H    VAL  62           H        VAL  62  -1.248   9.139  -2.211
  479    HA   VAL  62           HA       VAL  62  -2.139   6.649  -3.586
  480    HB   VAL  62           HB       VAL  62  -0.132   6.023  -2.538
  481   1HG1  VAL  62          1HG1      VAL  62   0.336   6.405  -0.098
  482   2HG1  VAL  62          2HG1      VAL  62   0.389   7.860  -1.088
  483   3HG1  VAL  62          3HG1      VAL  62  -1.025   7.544  -0.056
  484   1HG2  VAL  62          1HG2      VAL  62  -2.158   4.556  -2.059
  485   2HG2  VAL  62          2HG2      VAL  62  -0.791   4.374  -0.946
  486   3HG2  VAL  62          3HG2      VAL  62  -2.225   5.299  -0.454
  487    H    SER  63           H        SER  63  -4.058   5.702  -2.833
  488    HA   SER  63           HA       SER  63  -5.252   6.659  -0.375
  489   1HB   SER  63          2HB       SER  63  -6.042   8.407  -1.993
  490   2HB   SER  63          3HB       SER  63  -6.827   7.122  -2.941
  491    HG   SER  63           HG       SER  63  -8.261   8.085  -1.414
  492    H    TYR  64           H        TYR  64  -7.574   5.594  -0.335
  493    HA   TYR  64           HA       TYR  64  -7.039   2.658  -0.652
  494   1HB   TYR  64          2HB       TYR  64  -6.981   3.265   1.637
  495   2HB   TYR  64          3HB       TYR  64  -8.396   4.315   1.478
  496    HD1  TYR  64           HD1      TYR  64 -10.584   3.497   1.824
  497    HD2  TYR  64           HD2      TYR  64  -7.362   0.727   1.099
  498    HE1  TYR  64           HE1      TYR  64 -12.187   1.612   1.862
  499    HE2  TYR  64           HE2      TYR  64  -8.962  -1.132   1.108
  500    HH   TYR  64           HH       TYR  64 -11.135  -1.719   1.166
  501    H    LEU  65           H        LEU  65  -8.505   1.482  -1.866
  502    HA   LEU  65           HA       LEU  65 -11.285   2.292  -2.075
  503   1HB   LEU  65          2HB       LEU  65 -11.103   2.272  -4.638
  504   2HB   LEU  65          3HB       LEU  65 -10.822   3.729  -3.714
  505    HG   LEU  65           HG       LEU  65  -9.313   3.408  -5.575
  506   1HD1  LEU  65          1HD1      LEU  65  -7.549   4.479  -4.704
  507   2HD1  LEU  65          2HD1      LEU  65  -8.783   4.759  -3.484
  508   3HD1  LEU  65          3HD1      LEU  65  -7.543   3.504  -3.239
  509   1HD2  LEU  65          1HD2      LEU  65  -7.996   1.125  -4.132
  510   2HD2  LEU  65          2HD2      LEU  65  -8.942   1.040  -5.641
  511   3HD2  LEU  65          3HD2      LEU  65  -7.431   1.921  -5.613
  512    H    GLY  66           H        GLY  66 -11.287   0.082  -1.011
  513   1HA   GLY  66          2HA       GLY  66 -12.877  -1.497  -2.340
  514   2HA   GLY  66          3HA       GLY  66 -11.382  -2.084  -3.081
  515    H    LEU  67           H        LEU  67 -13.433  -3.349  -1.068
  516    HA   LEU  67           HA       LEU  67 -11.479  -4.368   0.881
  517   1HB   LEU  67          2HB       LEU  67 -12.834  -2.969   2.227
  518   2HB   LEU  67          3HB       LEU  67 -14.248  -3.197   1.191
  519    HG   LEU  67           HG       LEU  67 -14.474  -5.485   1.943
  520   1HD1  LEU  67          1HD1      LEU  67 -12.298  -4.753   3.990
  521   2HD1  LEU  67          2HD1      LEU  67 -13.254  -6.248   4.002
  522   3HD1  LEU  67          3HD1      LEU  67 -12.101  -5.948   2.700
  523   1HD2  LEU  67          1HD2      LEU  67 -15.749  -3.682   3.007
  524   2HD2  LEU  67          2HD2      LEU  67 -15.349  -4.930   4.200
  525   3HD2  LEU  67          3HD2      LEU  67 -14.436  -3.407   4.172
  526    H    GLU  68           H        GLU  68 -11.487  -6.636   0.717
  527    HA   GLU  68           HA       GLU  68 -13.764  -8.033  -0.555
  528   1HB   GLU  68          2HB       GLU  68 -12.076  -7.607  -2.308
  529   2HB   GLU  68          3HB       GLU  68 -10.812  -8.193  -1.250
  530   1HG   GLU  68          2HG       GLU  68 -11.976 -10.470  -1.275
  531   2HG   GLU  68          3HG       GLU  68 -12.990  -9.828  -2.579
  Start of MODEL    9
    1   1H    MET   1           H1       MET   1  -7.781  -6.590   6.628
    2   2H    MET   1           H2       MET   1  -6.909  -6.437   8.037
    3   3H    MET   1           H3       MET   1  -6.444  -7.484   6.897
    4    HA   MET   1           HA       MET   1  -7.373  -8.616   8.734
    5   1HB   MET   1          2HB       MET   1  -9.865  -7.108   7.990
    6   2HB   MET   1          3HB       MET   1  -9.922  -8.690   8.810
    7   1HG   MET   1          2HG       MET   1  -8.509  -7.852  10.607
    8   2HG   MET   1          3HG       MET   1  -8.342  -6.285   9.800
    9   1HE   MET   1          1HE       MET   1  -8.941  -5.139  12.084
   10   2HE   MET   1          2HE       MET   1 -10.420  -5.499  13.006
   11   3HE   MET   1          3HE       MET   1  -9.152  -6.737  12.845
   12    HA   PRO   2           HA       PRO   2  -8.056 -11.009   4.845
   13   1HB   PRO   2          2HB       PRO   2 -10.002 -10.778   3.103
   14   2HB   PRO   2          3HB       PRO   2 -10.351 -11.430   4.717
   15   1HG   PRO   2          2HG       PRO   2 -10.841  -8.551   3.870
   16   2HG   PRO   2          3HG       PRO   2 -11.964  -9.662   4.685
   17   1HD   PRO   2          2HD       PRO   2 -10.354  -7.824   5.982
   18   2HD   PRO   2          3HD       PRO   2 -10.866  -9.359   6.739
   19    H    LYS   3           H        LYS   3  -9.415  -9.044   2.374
   20    HA   LYS   3           HA       LYS   3  -6.737  -7.921   1.855
   21   1HB   LYS   3          2HB       LYS   3  -7.398  -9.880   0.524
   22   2HB   LYS   3          3HB       LYS   3  -8.816  -9.010  -0.084
   23   1HG   LYS   3          2HG       LYS   3  -7.463  -7.408  -1.259
   24   2HG   LYS   3          3HG       LYS   3  -6.028  -7.874  -0.320
   25   1HD   LYS   3          2HD       LYS   3  -6.132 -10.148  -1.394
   26   2HD   LYS   3          3HD       LYS   3  -7.417  -9.540  -2.464
   27   1HE   LYS   3          2HE       LYS   3  -5.946  -7.866  -3.410
   28   2HE   LYS   3          3HE       LYS   3  -4.769  -8.067  -2.097
   29   1HZ   LYS   3          1HZ       LYS   3  -4.276 -10.239  -2.908
   30   2HZ   LYS   3          2HZ       LYS   3  -5.239  -9.991  -4.229
   31   3HZ   LYS   3          3HZ       LYS   3  -3.930  -8.995  -3.960
   32    H    HIS   4           H        HIS   4  -6.514  -5.960   0.926
   33    HA   HIS   4           HA       HIS   4  -8.859  -4.142   0.797
   34   1HB   HIS   4          2HB       HIS   4  -6.236  -3.635   2.256
   35   2HB   HIS   4          3HB       HIS   4  -7.640  -2.563   2.194
   36    HD1  HIS   4           1HD      HIS   4  -9.937  -4.535   2.979
   37    HD2  HIS   4           2HD      HIS   4  -6.066  -4.717   4.605
   38    HE1  HIS   4           1HE      HIS   4 -10.138  -5.756   5.203
   39    H    GLU   5           H        GLU   5  -8.765  -2.813  -0.961
   40    HA   GLU   5           HA       GLU   5  -6.444  -3.084  -2.806
   41   1HB   GLU   5          2HB       GLU   5  -9.376  -2.336  -3.087
   42   2HB   GLU   5          3HB       GLU   5  -8.246  -2.286  -4.436
   43   1HG   GLU   5          2HG       GLU   5  -8.787  -4.816  -2.784
   44   2HG   GLU   5          3HG       GLU   5  -9.688  -4.375  -4.229
   45    H    PHE   6           H        PHE   6  -5.430  -1.209  -3.648
   46    HA   PHE   6           HA       PHE   6  -6.459   1.447  -2.844
   47   1HB   PHE   6          2HB       PHE   6  -3.604   0.435  -2.498
   48   2HB   PHE   6          3HB       PHE   6  -4.136   2.057  -2.129
   49    HD1  PHE   6           1HD      PHE   6  -4.627   2.565   0.181
   50    HD2  PHE   6           2HD      PHE   6  -4.519  -1.548  -1.143
   51    HE1  PHE   6           1HE      PHE   6  -4.667   1.786   2.506
   52    HE2  PHE   6           2HE      PHE   6  -4.747  -2.295   1.182
   53    HZ   PHE   6           HZ       PHE   6  -4.870  -0.631   3.033
   54    H    SER   7           H        SER   7  -5.979   3.068  -4.322
   55    HA   SER   7           HA       SER   7  -4.380   2.265  -6.724
   56   1HB   SER   7          2HB       SER   7  -6.671   3.186  -7.193
   57   2HB   SER   7          3HB       SER   7  -6.106   4.731  -6.522
   58    HG   SER   7           HG       SER   7  -4.689   3.355  -8.578
   59    H    VAL   8           H        VAL   8  -2.672   3.584  -7.354
   60    HA   VAL   8           HA       VAL   8  -1.555   5.478  -5.356
   61    HB   VAL   8           HB       VAL   8  -0.125   3.396  -7.084
   62   1HG1  VAL   8          1HG1      VAL   8   1.226   5.291  -6.859
   63   2HG1  VAL   8          2HG1      VAL   8   0.911   5.439  -5.108
   64   3HG1  VAL   8          3HG1      VAL   8   1.866   4.076  -5.752
   65   1HG2  VAL   8          1HG2      VAL   8  -0.517   3.478  -4.052
   66   2HG2  VAL   8          2HG2      VAL   8  -1.234   2.283  -5.151
   67   3HG2  VAL   8          3HG2      VAL   8   0.518   2.356  -4.931
   68    H    ASP   9           H        ASP   9  -0.703   7.381  -6.366
   69    HA   ASP   9           HA       ASP   9  -0.818   7.450  -9.348
   70   1HB   ASP   9          2HB       ASP   9  -2.414   8.971  -7.763
   71   2HB   ASP   9          3HB       ASP   9  -1.005  10.027  -7.866
   72    H    MET  10           H        MET  10   1.218   6.284  -8.646
   73    HA   MET  10           HA       MET  10   3.237   7.929  -9.772
   74   1HB   MET  10          2HB       MET  10   4.995   7.347  -8.071
   75   2HB   MET  10          3HB       MET  10   3.817   8.539  -7.507
   76   1HG   MET  10          2HG       MET  10   2.646   6.829  -6.211
   77   2HG   MET  10          3HG       MET  10   3.738   5.573  -6.810
   78   1HE   MET  10          1HE       MET  10   4.212   4.716  -4.443
   79   2HE   MET  10          2HE       MET  10   4.694   5.734  -3.067
   80   3HE   MET  10          3HE       MET  10   3.066   5.900  -3.766
   81    H    THR  11           H        THR  11   4.872   6.498 -10.679
   82    HA   THR  11           HA       THR  11   4.712   3.646 -10.128
   83    HB   THR  11           HB       THR  11   2.921   3.989 -11.744
   84    HG1  THR  11           1HG      THR  11   3.316   2.118 -12.534
   85   1HG2  THR  11          1HG2      THR  11   3.486   4.418 -14.067
   86   2HG2  THR  11          2HG2      THR  11   4.055   5.761 -13.038
   87   3HG2  THR  11          3HG2      THR  11   5.209   4.547 -13.639
   88    H    CYS  12           H        CYS  12   6.560   5.820  -9.667
   89    HA   CYS  12           HA       CYS  12   8.637   5.663 -11.744
   90   1HB   CYS  12          2HB       CYS  12   7.980   7.805 -10.764
   91   2HB   CYS  12          3HB       CYS  12   8.506   7.265  -9.154
   92    HG   CYS  12           HG       CYS  12  10.965   6.817  -9.744
   93    H    GLY  13           H        GLY  13   8.637   3.252 -11.138
   94   1HA   GLY  13          2HA       GLY  13   9.789   1.432 -10.363
   95   2HA   GLY  13          3HA       GLY  13  11.179   2.515 -10.469
   96    H    GLY  14           H        GLY  14  11.701   3.775  -8.498
   97   1HA   GLY  14          2HA       GLY  14  11.818   2.145  -6.121
   98   2HA   GLY  14          3HA       GLY  14  12.373   3.823  -6.295
   99    H    CYS  15           H        CYS  15   9.422   4.296  -7.378
  100    HA   CYS  15           HA       CYS  15   7.944   5.034  -5.103
  101   1HB   CYS  15          2HB       CYS  15   5.979   4.814  -6.450
  102   2HB   CYS  15          3HB       CYS  15   7.280   5.477  -7.457
  103    HG   CYS  15           HG       CYS  15   5.996   2.431  -7.242
  104    H    ALA  16           H        ALA  16   8.394   1.804  -6.618
  105    HA   ALA  16           HA       ALA  16   6.544   0.474  -4.886
  106   1HB   ALA  16          1HB       ALA  16   7.537  -1.595  -5.785
  107   2HB   ALA  16          2HB       ALA  16   7.226  -0.440  -7.096
  108   3HB   ALA  16          3HB       ALA  16   8.881  -0.674  -6.489
  109    H    GLU  17           H        GLU  17  10.156   0.912  -4.781
  110    HA   GLU  17           HA       GLU  17  10.591  -0.479  -2.375
  111   1HB   GLU  17          2HB       GLU  17  11.913   1.945  -3.647
  112   2HB   GLU  17          3HB       GLU  17  12.463   1.258  -2.130
  113   1HG   GLU  17          2HG       GLU  17  11.986  -0.806  -4.239
  114   2HG   GLU  17          3HG       GLU  17  13.204   0.391  -4.651
  115    H    ALA  18           H        ALA  18   9.502   2.923  -2.869
  116    HA   ALA  18           HA       ALA  18   9.619   3.663  -0.132
  117   1HB   ALA  18          1HB       ALA  18   9.243   5.275  -1.964
  118   2HB   ALA  18          2HB       ALA  18   7.610   4.626  -2.216
  119   3HB   ALA  18          3HB       ALA  18   8.015   5.424  -0.688
  120    H    VAL  19           H        VAL  19   6.835   2.410  -1.991
  121    HA   VAL  19           HA       VAL  19   5.010   2.194   0.168
  122    HB   VAL  19           HB       VAL  19   5.208   0.718  -2.480
  123   1HG1  VAL  19          1HG1      VAL  19   2.917   0.849  -0.474
  124   2HG1  VAL  19          2HG1      VAL  19   2.810   0.210  -2.130
  125   3HG1  VAL  19          3HG1      VAL  19   3.817  -0.619  -0.955
  126   1HG2  VAL  19          1HG2      VAL  19   3.463   2.305  -3.173
  127   2HG2  VAL  19          2HG2      VAL  19   3.457   3.049  -1.562
  128   3HG2  VAL  19          3HG2      VAL  19   4.878   3.202  -2.607
  129    H    SER  20           H        SER  20   7.105  -0.283  -1.316
  130    HA   SER  20           HA       SER  20   6.400  -2.468   0.299
  131   1HB   SER  20          2HB       SER  20   7.740  -2.613  -1.817
  132   2HB   SER  20          3HB       SER  20   9.044  -1.681  -1.068
  133    HG   SER  20           HG       SER  20   9.614  -3.797  -1.040
  134    H    ARG  21           H        ARG  21   9.120  -0.163   0.764
  135    HA   ARG  21           HA       ARG  21  10.016  -1.403   3.143
  136   1HB   ARG  21          2HB       ARG  21  10.415   1.414   2.075
  137   2HB   ARG  21          3HB       ARG  21  11.241   0.760   3.503
  138   1HG   ARG  21          2HG       ARG  21  12.209  -1.073   2.164
  139   2HG   ARG  21          3HG       ARG  21  11.391  -0.500   0.716
  140   1HD   ARG  21          2HD       ARG  21  12.616   1.701   0.976
  141   2HD   ARG  21          3HD       ARG  21  13.521   0.941   2.310
  142    HE   ARG  21           HE       ARG  21  13.491  -0.436  -0.348
  143   1HH1  ARG  21          2HH2      ARG  21  15.307   1.728   1.779
  144   2HH1  ARG  21          1HH2      ARG  21  16.819   1.497   0.955
  145   1HH2  ARG  21          2HH1      ARG  21  15.430  -0.569  -1.571
  146   2HH2  ARG  21          1HH1      ARG  21  16.901   0.089  -0.946
  147    H    VAL  22           H        VAL  22   7.697   1.497   2.777
  148    HA   VAL  22           HA       VAL  22   7.467   1.718   5.545
  149    HB   VAL  22           HB       VAL  22   6.934   3.456   3.894
  150   1HG1  VAL  22          1HG1      VAL  22   5.583   2.178   2.310
  151   2HG1  VAL  22          2HG1      VAL  22   4.335   1.925   3.559
  152   3HG1  VAL  22          3HG1      VAL  22   4.672   3.549   2.933
  153   1HG2  VAL  22          1HG2      VAL  22   5.027   4.326   5.133
  154   2HG2  VAL  22          2HG2      VAL  22   4.705   2.703   5.773
  155   3HG2  VAL  22          3HG2      VAL  22   6.215   3.552   6.225
  156    H    LEU  23           H        LEU  23   5.440  -0.274   3.196
  157    HA   LEU  23           HA       LEU  23   3.747  -1.174   5.284
  158   1HB   LEU  23          2HB       LEU  23   4.371  -2.197   2.510
  159   2HB   LEU  23          3HB       LEU  23   3.460  -3.173   3.630
  160    HG   LEU  23           HG       LEU  23   1.795  -2.217   2.531
  161   1HD1  LEU  23          1HD1      LEU  23   0.566  -0.670   3.903
  162   2HD1  LEU  23          2HD1      LEU  23   1.486  -1.718   4.994
  163   3HD1  LEU  23          3HD1      LEU  23   2.024  -0.052   4.658
  164   1HD2  LEU  23          1HD2      LEU  23   3.074  -0.786   1.165
  165   2HD2  LEU  23          2HD2      LEU  23   1.602   0.040   1.719
  166   3HD2  LEU  23          3HD2      LEU  23   3.173   0.445   2.448
  167    H    ASN  24           H        ASN  24   6.819  -2.553   4.114
  168    HA   ASN  24           HA       ASN  24   6.819  -4.844   5.804
  169   1HB   ASN  24          2HB       ASN  24   8.460  -4.654   4.070
  170   2HB   ASN  24          3HB       ASN  24   8.961  -3.059   4.606
  171   1HD2  ASN  24          1HD2      ASN  24  10.005  -2.820   6.625
  172   2HD2  ASN  24          2HD2      ASN  24  11.057  -4.113   7.235
  173    H    LYS  25           H        LYS  25   7.968  -1.494   6.326
  174    HA   LYS  25           HA       LYS  25   8.989  -1.780   8.932
  175   1HB   LYS  25          2HB       LYS  25   7.875   0.537   7.319
  176   2HB   LYS  25          3HB       LYS  25   8.252   0.784   9.015
  177   1HG   LYS  25          2HG       LYS  25  10.298  -0.376   7.087
  178   2HG   LYS  25          3HG       LYS  25  10.063   1.364   7.307
  179   1HD   LYS  25          2HD       LYS  25  10.474   1.140   9.743
  180   2HD   LYS  25          3HD       LYS  25  10.770  -0.597   9.545
  181   1HE   LYS  25          2HE       LYS  25  12.677  -0.098   8.018
  182   2HE   LYS  25          3HE       LYS  25  12.385   1.638   8.221
  183   1HZ   LYS  25          1HZ       LYS  25  14.133   0.862   9.650
  184   2HZ   LYS  25          2HZ       LYS  25  12.869   1.383  10.561
  185   3HZ   LYS  25          3HZ       LYS  25  13.142  -0.230  10.374
  186    H    LEU  26           H        LEU  26   5.658  -1.120   7.867
  187    HA   LEU  26           HA       LEU  26   4.509  -0.550  10.298
  188   1HB   LEU  26          2HB       LEU  26   3.470  -0.808   7.944
  189   2HB   LEU  26          3HB       LEU  26   3.250  -2.496   8.301
  190    HG   LEU  26           HG       LEU  26   1.374  -0.704   8.648
  191   1HD1  LEU  26          1HD1      LEU  26   1.717  -2.978  10.611
  192   2HD1  LEU  26          2HD1      LEU  26   0.201  -2.153  10.177
  193   3HD1  LEU  26          3HD1      LEU  26   1.069  -3.099   8.957
  194   1HD2  LEU  26          1HD2      LEU  26   2.624   0.650  10.403
  195   2HD2  LEU  26          2HD2      LEU  26   1.044   0.077  10.917
  196   3HD2  LEU  26          3HD2      LEU  26   2.488  -0.746  11.489
  197    H    GLY  27           H        GLY  27   5.424  -3.748   9.041
  198   1HA   GLY  27          2HA       GLY  27   6.007  -4.789  11.522
  199   2HA   GLY  27          3HA       GLY  27   4.283  -5.167  11.314
  200    H    GLY  28           H        GLY  28   3.657  -6.700   9.754
  201   1HA   GLY  28          2HA       GLY  28   5.728  -8.171   8.215
  202   2HA   GLY  28          3HA       GLY  28   4.866  -9.049   9.497
  203    H    VAL  29           H        VAL  29   3.685  -6.444   7.394
  204    HA   VAL  29           HA       VAL  29   1.269  -7.904   6.793
  205    HB   VAL  29           HB       VAL  29   1.588  -5.353   7.123
  206   1HG1  VAL  29          1HG1      VAL  29   3.535  -5.250   5.455
  207   2HG1  VAL  29          2HG1      VAL  29   2.252  -5.389   4.197
  208   3HG1  VAL  29          3HG1      VAL  29   2.264  -4.019   5.335
  209   1HG2  VAL  29          1HG2      VAL  29  -0.548  -6.102   6.374
  210   2HG2  VAL  29          2HG2      VAL  29  -0.055  -4.785   5.315
  211   3HG2  VAL  29          3HG2      VAL  29   0.056  -6.452   4.735
  212    H    LYS  30           H        LYS  30   0.721  -8.917   4.831
  213    HA   LYS  30           HA       LYS  30   2.771  -9.096   2.697
  214   1HB   LYS  30          2HB       LYS  30   1.876 -11.149   2.954
  215   2HB   LYS  30          3HB       LYS  30   0.255 -10.568   3.312
  216   1HG   LYS  30          2HG       LYS  30   0.445 -11.694   1.111
  217   2HG   LYS  30          3HG       LYS  30  -0.184 -10.052   1.034
  218   1HD   LYS  30          2HD       LYS  30   1.980  -9.192   0.182
  219   2HD   LYS  30          3HD       LYS  30   2.752 -10.736   0.493
  220   1HE   LYS  30          2HE       LYS  30   2.101 -10.044  -1.845
  221   2HE   LYS  30          3HE       LYS  30   1.695 -11.712  -1.366
  222   1HZ   LYS  30          1HZ       LYS  30  -0.633 -11.064  -1.214
  223   2HZ   LYS  30          2HZ       LYS  30  -0.251  -9.455  -1.391
  224   3HZ   LYS  30          3HZ       LYS  30   0.007 -10.385  -2.612
  225    H    TYR  31           H        TYR  31   2.922  -7.392   1.559
  226    HA   TYR  31           HA       TYR  31   0.595  -5.771   0.643
  227   1HB   TYR  31          2HB       TYR  31   2.277  -3.989   0.322
  228   2HB   TYR  31          3HB       TYR  31   2.130  -4.490   2.002
  229    HD1  TYR  31           HD1      TYR  31   4.037  -5.607   3.167
  230    HD2  TYR  31           HD2      TYR  31   4.270  -4.726  -1.022
  231    HE1  TYR  31           HE1      TYR  31   6.459  -5.921   3.266
  232    HE2  TYR  31           HE2      TYR  31   6.730  -5.073  -0.942
  233    HH   TYR  31           HH       TYR  31   8.550  -5.009   0.606
  234    H    ASP  32           H        ASP  32   0.487  -5.333  -1.623
  235    HA   ASP  32           HA       ASP  32   2.473  -6.610  -3.440
  236   1HB   ASP  32          2HB       ASP  32  -0.474  -6.056  -3.826
  237   2HB   ASP  32          3HB       ASP  32   0.563  -6.883  -4.958
  238    H    ILE  33           H        ILE  33   2.939  -5.237  -5.267
  239    HA   ILE  33           HA       ILE  33   1.682  -2.543  -5.367
  240    HB   ILE  33           HB       ILE  33   4.646  -2.957  -5.800
  241   1HG1  ILE  33          2HG1      ILE  33   4.568  -1.370  -3.648
  242   2HG1  ILE  33          3HG1      ILE  33   3.139  -2.306  -3.257
  243   1HG2  ILE  33          1HG2      ILE  33   2.967  -0.447  -5.406
  244   2HG2  ILE  33          2HG2      ILE  33   4.693  -0.548  -5.805
  245   3HG2  ILE  33          3HG2      ILE  33   3.485  -1.067  -6.985
  246   1HD1  ILE  33          1HD1      ILE  33   5.886  -3.465  -3.920
  247   2HD1  ILE  33          2HD1      ILE  33   5.279  -3.176  -2.284
  248   3HD1  ILE  33          3HD1      ILE  33   4.494  -4.396  -3.310
  249    H    ASP  34           H        ASP  34   0.719  -2.475  -7.362
  250    HA   ASP  34           HA       ASP  34   1.931  -3.973  -9.645
  251   1HB   ASP  34          2HB       ASP  34  -0.433  -4.519  -9.120
  252   2HB   ASP  34          3HB       ASP  34  -0.861  -2.824  -9.424
  253    H    LEU  35           H        LEU  35   3.167  -2.733 -10.850
  254    HA   LEU  35           HA       LEU  35   3.239   0.140 -10.566
  255   1HB   LEU  35          2HB       LEU  35   4.778  -1.855 -12.258
  256   2HB   LEU  35          3HB       LEU  35   4.988  -0.120 -12.448
  257    HG   LEU  35           HG       LEU  35   6.718  -1.158 -11.107
  258   1HD1  LEU  35          1HD1      LEU  35   5.087   0.745  -9.386
  259   2HD1  LEU  35          2HD1      LEU  35   6.836   0.450  -9.330
  260   3HD1  LEU  35          3HD1      LEU  35   6.122   1.223 -10.751
  261   1HD2  LEU  35          1HD2      LEU  35   4.646  -1.710  -8.953
  262   2HD2  LEU  35          2HD2      LEU  35   5.367  -2.943 -10.013
  263   3HD2  LEU  35          3HD2      LEU  35   6.384  -2.029  -8.888
  264    HA   PRO  36           HA       PRO  36   1.922   0.341 -15.134
  265   1HB   PRO  36          2HB       PRO  36   0.493  -1.731 -16.296
  266   2HB   PRO  36          3HB       PRO  36   2.261  -1.509 -16.412
  267   1HG   PRO  36          2HG       PRO  36   0.744  -3.263 -14.470
  268   2HG   PRO  36          3HG       PRO  36   2.169  -3.696 -15.455
  269   1HD   PRO  36          2HD       PRO  36   2.446  -3.016 -12.893
  270   2HD   PRO  36          3HD       PRO  36   3.605  -2.381 -14.098
  271    H    ASN  37           H        ASN  37  -0.303  -1.651 -13.052
  272    HA   ASN  37           HA       ASN  37  -2.615  -0.094 -13.982
  273   1HB   ASN  37          2HB       ASN  37  -2.417  -2.111 -11.716
  274   2HB   ASN  37          3HB       ASN  37  -3.881  -1.388 -12.367
  275   1HD2  ASN  37          1HD2      ASN  37  -1.196  -3.591 -13.141
  276   2HD2  ASN  37          2HD2      ASN  37  -2.037  -4.412 -14.458
  277    H    LYS  38           H        LYS  38  -0.075   0.570 -11.816
  278    HA   LYS  38           HA       LYS  38   0.229   2.058 -10.150
  279   1HB   LYS  38          2HB       LYS  38  -2.274   3.440 -11.181
  280   2HB   LYS  38          3HB       LYS  38  -0.903   4.097 -10.253
  281   1HG   LYS  38          2HG       LYS  38   0.554   4.052 -12.090
  282   2HG   LYS  38          3HG       LYS  38  -0.499   2.993 -13.033
  283   1HD   LYS  38          2HD       LYS  38  -0.599   5.280 -13.851
  284   2HD   LYS  38          3HD       LYS  38  -2.174   4.710 -13.322
  285   1HE   LYS  38          2HE       LYS  38  -0.352   6.490 -11.604
  286   2HE   LYS  38          3HE       LYS  38  -1.539   7.119 -12.746
  287   1HZ   LYS  38          1HZ       LYS  38  -2.555   7.171 -10.752
  288   2HZ   LYS  38          2HZ       LYS  38  -3.249   5.867 -11.458
  289   3HZ   LYS  38          3HZ       LYS  38  -2.126   5.682 -10.251
  290    H    LYS  39           H        LYS  39  -0.725  -0.132  -9.085
  291    HA   LYS  39           HA       LYS  39  -2.785   0.774  -7.137
  292   1HB   LYS  39          2HB       LYS  39  -2.824  -1.815  -8.746
  293   2HB   LYS  39          3HB       LYS  39  -3.596  -1.643  -7.166
  294   1HG   LYS  39          2HG       LYS  39  -4.981   0.228  -8.026
  295   2HG   LYS  39          3HG       LYS  39  -4.248   0.020  -9.623
  296   1HD   LYS  39          2HD       LYS  39  -6.416  -1.087  -9.550
  297   2HD   LYS  39          3HD       LYS  39  -5.132  -2.296  -9.740
  298   1HE   LYS  39          2HE       LYS  39  -5.297  -2.918  -7.351
  299   2HE   LYS  39          3HE       LYS  39  -6.417  -1.584  -7.042
  300   1HZ   LYS  39          1HZ       LYS  39  -7.446  -3.699  -7.197
  301   2HZ   LYS  39          2HZ       LYS  39  -8.024  -2.747  -8.400
  302   3HZ   LYS  39          3HZ       LYS  39  -6.930  -3.954  -8.721
  303    H    VAL  40           H        VAL  40  -2.801  -0.377  -5.136
  304    HA   VAL  40           HA       VAL  40  -0.614  -2.245  -4.601
  305    HB   VAL  40           HB       VAL  40  -1.509   0.330  -3.234
  306   1HG1  VAL  40          1HG1      VAL  40  -0.471  -2.087  -1.736
  307   2HG1  VAL  40          2HG1      VAL  40  -0.549  -0.422  -1.094
  308   3HG1  VAL  40          3HG1      VAL  40  -2.042  -1.250  -1.573
  309   1HG2  VAL  40          1HG2      VAL  40   0.553   0.138  -4.612
  310   2HG2  VAL  40          2HG2      VAL  40   0.801   0.713  -2.950
  311   3HG2  VAL  40          3HG2      VAL  40   1.209  -0.971  -3.393
  312    H    CYS  41           H        CYS  41  -1.347  -3.953  -3.398
  313    HA   CYS  41           HA       CYS  41  -4.045  -3.724  -2.282
  314   1HB   CYS  41          2HB       CYS  41  -4.750  -5.862  -2.804
  315   2HB   CYS  41          3HB       CYS  41  -4.466  -5.034  -4.332
  316    HG   CYS  41           HG       CYS  41  -2.236  -7.068  -2.881
  317    H    ILE  42           H        ILE  42  -4.238  -4.840  -0.319
  318    HA   ILE  42           HA       ILE  42  -1.695  -5.937   0.759
  319    HB   ILE  42           HB       ILE  42  -3.392  -3.891   2.235
  320   1HG1  ILE  42          2HG1      ILE  42  -0.767  -3.489   0.713
  321   2HG1  ILE  42          3HG1      ILE  42  -2.330  -2.752   0.328
  322   1HG2  ILE  42          1HG2      ILE  42  -0.619  -5.056   2.752
  323   2HG2  ILE  42          2HG2      ILE  42  -1.478  -3.908   3.786
  324   3HG2  ILE  42          3HG2      ILE  42  -2.107  -5.536   3.602
  325   1HD1  ILE  42          1HD1      ILE  42  -0.619  -2.177   2.746
  326   2HD1  ILE  42          2HD1      ILE  42  -1.026  -1.098   1.407
  327   3HD1  ILE  42          3HD1      ILE  42  -2.288  -1.592   2.555
  328    H    GLU  43           H        GLU  43  -2.006  -7.609   2.123
  329    HA   GLU  43           HA       GLU  43  -4.791  -8.731   2.315
  330   1HB   GLU  43          2HB       GLU  43  -3.741  -8.964   0.073
  331   2HB   GLU  43          3HB       GLU  43  -2.297  -9.615   0.824
  332   1HG   GLU  43          2HG       GLU  43  -3.580 -11.658   1.438
  333   2HG   GLU  43          3HG       GLU  43  -4.994 -10.992   0.596
  334    H    SER  44           H        SER  44  -4.533  -8.528   4.642
  335    HA   SER  44           HA       SER  44  -2.715 -10.389   5.933
  336   1HB   SER  44          2HB       SER  44  -1.198  -8.484   5.360
  337   2HB   SER  44          3HB       SER  44  -2.345  -7.377   6.142
  338    HG   SER  44           HG       SER  44  -0.822  -9.439   7.390
  339    H    GLU  45           H        GLU  45  -3.041 -10.321   8.261
  340    HA   GLU  45           HA       GLU  45  -5.600  -9.942   9.316
  341   1HB   GLU  45          2HB       GLU  45  -2.873  -9.842  10.673
  342   2HB   GLU  45          3HB       GLU  45  -4.428 -10.063  11.489
  343   1HG   GLU  45          2HG       GLU  45  -4.810 -12.168  10.269
  344   2HG   GLU  45          3HG       GLU  45  -3.275 -11.989   9.405
  345    H    HIS  46           H        HIS  46  -2.984  -7.587   8.812
  346    HA   HIS  46           HA       HIS  46  -3.588  -5.794  10.873
  347   1HB   HIS  46          2HB       HIS  46  -2.301  -5.379   8.164
  348   2HB   HIS  46          3HB       HIS  46  -2.485  -4.056   9.312
  349    HD1  HIS  46           1HD      HIS  46  -1.244  -4.478  11.805
  350    HD2  HIS  46           2HD      HIS  46  -0.031  -6.714   8.460
  351    HE1  HIS  46           1HE      HIS  46   1.118  -5.302  12.284
  352    H    SER  47           H        SER  47  -4.504  -3.676  10.903
  353    HA   SER  47           HA       SER  47  -7.206  -3.579   9.886
  354   1HB   SER  47          2HB       SER  47  -7.175  -2.481  11.914
  355   2HB   SER  47          3HB       SER  47  -5.500  -1.962  11.704
  356    HG   SER  47           HG       SER  47  -7.779  -0.621  10.803
  357    H    MET  48           H        MET  48  -8.062  -2.386   8.287
  358    HA   MET  48           HA       MET  48  -6.688  -1.411   6.017
  359   1HB   MET  48          2HB       MET  48  -9.317  -0.414   7.244
  360   2HB   MET  48          3HB       MET  48  -8.760  -0.166   5.578
  361   1HG   MET  48          2HG       MET  48  -8.665  -2.680   5.385
  362   2HG   MET  48          3HG       MET  48  -9.591  -2.778   6.887
  363   1HE   MET  48          1HE       MET  48 -11.553  -0.174   6.434
  364   2HE   MET  48          2HE       MET  48 -12.960  -1.032   5.774
  365   3HE   MET  48          3HE       MET  48 -12.056  -1.733   7.138
  366    H    ASP  49           H        ASP  49  -7.750   0.138   9.034
  367    HA   ASP  49           HA       ASP  49  -7.332   2.816   8.275
  368   1HB   ASP  49          2HB       ASP  49  -7.288   1.851  11.154
  369   2HB   ASP  49          3HB       ASP  49  -8.001   3.311  10.480
  370    H    THR  50           H        THR  50  -5.578   0.630  10.350
  371    HA   THR  50           HA       THR  50  -3.300   2.182  10.953
  372    HB   THR  50           HB       THR  50  -3.447  -0.843  10.556
  373    HG1  THR  50           1HG      THR  50  -4.216   0.892  12.641
  374   1HG2  THR  50          1HG2      THR  50  -1.148  -0.062  10.808
  375   2HG2  THR  50          2HG2      THR  50  -1.585   0.892  12.245
  376   3HG2  THR  50          3HG2      THR  50  -1.670  -0.882  12.289
  377    H    LEU  51           H        LEU  51  -3.763  -0.164   8.217
  378    HA   LEU  51           HA       LEU  51  -1.178   0.295   7.098
  379   1HB   LEU  51          2HB       LEU  51  -3.753  -0.529   5.707
  380   2HB   LEU  51          3HB       LEU  51  -2.126  -0.591   4.991
  381    HG   LEU  51           HG       LEU  51  -2.787  -2.020   7.604
  382   1HD1  LEU  51          1HD1      LEU  51  -4.446  -2.848   6.073
  383   2HD1  LEU  51          2HD1      LEU  51  -3.261  -3.020   4.776
  384   3HD1  LEU  51          3HD1      LEU  51  -3.183  -4.082   6.202
  385   1HD2  LEU  51          1HD2      LEU  51  -0.691  -2.537   5.482
  386   2HD2  LEU  51          2HD2      LEU  51  -0.405  -1.794   7.065
  387   3HD2  LEU  51          3HD2      LEU  51  -0.934  -3.472   6.980
  388    H    LEU  52           H        LEU  52  -4.350   1.676   6.220
  389    HA   LEU  52           HA       LEU  52  -3.639   3.426   4.199
  390   1HB   LEU  52          2HB       LEU  52  -5.738   3.386   6.329
  391   2HB   LEU  52          3HB       LEU  52  -5.438   4.967   5.645
  392    HG   LEU  52           HG       LEU  52  -6.086   2.536   3.957
  393   1HD1  LEU  52          1HD1      LEU  52  -7.937   4.695   5.026
  394   2HD1  LEU  52          2HD1      LEU  52  -8.370   3.442   3.840
  395   3HD1  LEU  52          3HD1      LEU  52  -7.927   2.978   5.488
  396   1HD2  LEU  52          1HD2      LEU  52  -6.104   5.562   3.438
  397   2HD2  LEU  52          2HD2      LEU  52  -4.947   4.417   2.734
  398   3HD2  LEU  52          3HD2      LEU  52  -6.646   4.345   2.280
  399    H    ALA  53           H        ALA  53  -3.764   4.303   7.694
  400    HA   ALA  53           HA       ALA  53  -2.610   6.862   7.321
  401   1HB   ALA  53          1HB       ALA  53  -2.184   6.782   9.767
  402   2HB   ALA  53          2HB       ALA  53  -3.807   6.175   9.378
  403   3HB   ALA  53          3HB       ALA  53  -2.507   5.032   9.770
  404    H    THR  54           H        THR  54  -1.050   3.774   8.192
  405    HA   THR  54           HA       THR  54   1.570   4.738   8.528
  406    HB   THR  54           HB       THR  54   0.553   2.047   7.524
  407    HG1  THR  54           1HG      THR  54  -0.083   2.413   9.554
  408   1HG2  THR  54          1HG2      THR  54   2.828   1.260   8.281
  409   2HG2  THR  54          2HG2      THR  54   2.796   2.171   6.780
  410   3HG2  THR  54          3HG2      THR  54   3.353   2.951   8.288
  411    H    LEU  55           H        LEU  55   0.089   3.444   5.484
  412    HA   LEU  55           HA       LEU  55   2.540   3.905   4.044
  413   1HB   LEU  55          2HB       LEU  55   1.455   3.007   2.199
  414   2HB   LEU  55          3HB       LEU  55   1.095   2.063   3.613
  415    HG   LEU  55           HG       LEU  55  -1.135   3.493   3.636
  416   1HD1  LEU  55          1HD1      LEU  55  -0.161   4.876   1.750
  417   2HD1  LEU  55          2HD1      LEU  55  -0.289   3.446   0.740
  418   3HD1  LEU  55          3HD1      LEU  55  -1.776   4.192   1.422
  419   1HD2  LEU  55          1HD2      LEU  55  -1.008   1.037   3.308
  420   2HD2  LEU  55          2HD2      LEU  55  -2.130   1.756   2.130
  421   3HD2  LEU  55          3HD2      LEU  55  -0.498   1.288   1.620
  422    H    LYS  56           H        LYS  56  -0.569   5.605   4.273
  423    HA   LYS  56           HA       LYS  56  -0.028   7.695   2.465
  424   1HB   LYS  56          2HB       LYS  56  -1.697   7.582   5.016
  425   2HB   LYS  56          3HB       LYS  56  -1.519   9.075   4.115
  426   1HG   LYS  56          2HG       LYS  56  -2.181   7.935   2.021
  427   2HG   LYS  56          3HG       LYS  56  -2.531   6.455   2.925
  428   1HD   LYS  56          2HD       LYS  56  -4.315   7.472   4.109
  429   2HD   LYS  56          3HD       LYS  56  -3.768   9.118   3.706
  430   1HE   LYS  56          2HE       LYS  56  -4.152   8.748   1.301
  431   2HE   LYS  56          3HE       LYS  56  -4.626   7.065   1.601
  432   1HZ   LYS  56          1HZ       LYS  56  -6.129   9.473   2.381
  433   2HZ   LYS  56          2HZ       LYS  56  -6.412   8.456   1.109
  434   3HZ   LYS  56          3HZ       LYS  56  -6.608   7.912   2.664
  435    H    LYS  57           H        LYS  57   0.988   7.434   5.858
  436    HA   LYS  57           HA       LYS  57   2.081  10.010   6.115
  437   1HB   LYS  57          2HB       LYS  57   2.391   7.358   7.376
  438   2HB   LYS  57          3HB       LYS  57   3.688   8.537   7.737
  439   1HG   LYS  57          2HG       LYS  57   1.862  10.150   8.416
  440   2HG   LYS  57          3HG       LYS  57   0.687   8.849   8.198
  441   1HD   LYS  57          2HD       LYS  57   3.040   8.914  10.151
  442   2HD   LYS  57          3HD       LYS  57   1.328   9.133  10.557
  443   1HE   LYS  57          2HE       LYS  57   0.883   6.795   9.690
  444   2HE   LYS  57          3HE       LYS  57   2.634   6.586   9.469
  445   1HZ   LYS  57          1HZ       LYS  57   2.913   6.898  11.820
  446   2HZ   LYS  57          2HZ       LYS  57   1.289   7.081  12.035
  447   3HZ   LYS  57          3HZ       LYS  57   1.894   5.646  11.510
  448    H    THR  58           H        THR  58   3.284   7.601   3.884
  449    HA   THR  58           HA       THR  58   5.997   8.573   3.765
  450    HB   THR  58           HB       THR  58   5.961   7.812   1.428
  451    HG1  THR  58           1HG      THR  58   3.300   6.975   1.864
  452   1HG2  THR  58          1HG2      THR  58   6.455   6.226   3.197
  453   2HG2  THR  58          2HG2      THR  58   4.731   5.870   3.399
  454   3HG2  THR  58          3HG2      THR  58   5.557   5.444   1.876
  455    H    GLY  59           H        GLY  59   2.919   9.903   2.809
  456   1HA   GLY  59          2HA       GLY  59   2.411  12.071   2.330
  457   2HA   GLY  59          3HA       GLY  59   4.108  12.436   1.969
  458    H    LYS  60           H        LYS  60   2.588   9.605   0.482
  459    HA   LYS  60           HA       LYS  60   2.813  10.900  -2.190
  460   1HB   LYS  60          2HB       LYS  60   3.040   8.073  -1.120
  461   2HB   LYS  60          3HB       LYS  60   2.743   8.382  -2.825
  462   1HG   LYS  60          2HG       LYS  60   5.153   8.031  -2.194
  463   2HG   LYS  60          3HG       LYS  60   4.807   9.499  -3.133
  464   1HD   LYS  60          2HD       LYS  60   5.034  10.900  -1.221
  465   2HD   LYS  60          3HD       LYS  60   5.037   9.488  -0.126
  466   1HE   LYS  60          2HE       LYS  60   7.236   8.832  -0.918
  467   2HE   LYS  60          3HE       LYS  60   7.238  10.134  -2.125
  468   1HZ   LYS  60          1HZ       LYS  60   8.452  10.669  -0.050
  469   2HZ   LYS  60          2HZ       LYS  60   7.239  11.732  -0.377
  470   3HZ   LYS  60          3HZ       LYS  60   7.027  10.606   0.788
  471    H    THR  61           H        THR  61   1.241  10.573  -3.793
  472    HA   THR  61           HA       THR  61  -1.419  10.706  -3.032
  473    HB   THR  61           HB       THR  61  -0.308  10.053  -5.749
  474    HG1  THR  61           1HG      THR  61   0.360  12.220  -5.902
  475   1HG2  THR  61          1HG2      THR  61  -2.758  10.554  -5.556
  476   2HG2  THR  61          2HG2      THR  61  -2.362  12.114  -4.794
  477   3HG2  THR  61          3HG2      THR  61  -1.926  11.813  -6.489
  478    H    VAL  62           H        VAL  62  -1.165   8.519  -1.822
  479    HA   VAL  62           HA       VAL  62  -2.400   6.385  -3.531
  480    HB   VAL  62           HB       VAL  62  -0.301   5.550  -2.862
  481   1HG1  VAL  62          1HG1      VAL  62   0.359   7.053  -1.088
  482   2HG1  VAL  62          2HG1      VAL  62  -0.914   6.425  -0.016
  483   3HG1  VAL  62          3HG1      VAL  62   0.456   5.399  -0.514
  484   1HG2  VAL  62          1HG2      VAL  62  -2.291   4.375  -0.872
  485   2HG2  VAL  62          2HG2      VAL  62  -2.247   3.982  -2.597
  486   3HG2  VAL  62          3HG2      VAL  62  -0.864   3.588  -1.569
  487    H    SER  63           H        SER  63  -4.252   5.322  -2.790
  488    HA   SER  63           HA       SER  63  -5.240   5.768  -0.123
  489   1HB   SER  63          2HB       SER  63  -6.534   7.252  -2.435
  490   2HB   SER  63          3HB       SER  63  -7.513   6.718  -1.066
  491    HG   SER  63           HG       SER  63  -5.135   8.242  -0.825
  492    H    TYR  64           H        TYR  64  -7.348   4.744   0.197
  493    HA   TYR  64           HA       TYR  64  -7.231   2.018  -0.820
  494   1HB   TYR  64          2HB       TYR  64  -7.380   2.232   1.518
  495   2HB   TYR  64          3HB       TYR  64  -8.583   3.519   1.411
  496    HD1  TYR  64           HD1      TYR  64 -10.926   3.123   1.089
  497    HD2  TYR  64           HD2      TYR  64  -8.121  -0.143   1.384
  498    HE1  TYR  64           HE1      TYR  64 -12.777   1.593   1.636
  499    HE2  TYR  64           HE2      TYR  64  -9.984  -1.659   2.030
  500    HH   TYR  64           HH       TYR  64 -13.371  -0.522   2.273
  501    H    LEU  65           H        LEU  65  -8.727   1.085  -2.151
  502    HA   LEU  65           HA       LEU  65 -11.467   2.026  -2.227
  503   1HB   LEU  65          2HB       LEU  65 -11.410   1.877  -4.806
  504   2HB   LEU  65          3HB       LEU  65 -11.079   3.368  -3.956
  505    HG   LEU  65           HG       LEU  65  -9.652   2.946  -5.875
  506   1HD1  LEU  65          1HD1      LEU  65  -9.049   4.435  -3.932
  507   2HD1  LEU  65          2HD1      LEU  65  -7.842   3.180  -3.583
  508   3HD1  LEU  65          3HD1      LEU  65  -7.820   4.018  -5.131
  509   1HD2  LEU  65          1HD2      LEU  65  -9.272   0.580  -5.831
  510   2HD2  LEU  65          2HD2      LEU  65  -7.753   1.462  -5.871
  511   3HD2  LEU  65          3HD2      LEU  65  -8.299   0.734  -4.350
  512    H    GLY  66           H        GLY  66 -11.406  -0.134  -1.047
  513   1HA   GLY  66          2HA       GLY  66 -13.114  -1.778  -2.048
  514   2HA   GLY  66          3HA       GLY  66 -11.750  -2.383  -2.993
  515    H    LEU  67           H        LEU  67 -13.347  -3.799  -0.923
  516    HA   LEU  67           HA       LEU  67 -11.198  -4.701   0.858
  517   1HB   LEU  67          2HB       LEU  67 -12.279  -3.445   2.458
  518   2HB   LEU  67          3HB       LEU  67 -13.778  -3.357   1.528
  519    HG   LEU  67           HG       LEU  67 -14.298  -5.703   2.189
  520   1HD1  LEU  67          1HD1      LEU  67 -12.120  -5.208   4.272
  521   2HD1  LEU  67          2HD1      LEU  67 -13.148  -6.649   4.149
  522   3HD1  LEU  67          3HD1      LEU  67 -11.915  -6.337   2.918
  523   1HD2  LEU  67          1HD2      LEU  67 -15.348  -3.772   3.257
  524   2HD2  LEU  67          2HD2      LEU  67 -15.046  -5.040   4.456
  525   3HD2  LEU  67          3HD2      LEU  67 -13.984  -3.617   4.385
  526    H    GLU  68           H        GLU  68 -11.246  -6.988   0.878
  527    HA   GLU  68           HA       GLU  68 -13.665  -8.403   0.007
  528   1HB   GLU  68          2HB       GLU  68 -12.196  -7.951  -2.032
  529   2HB   GLU  68          3HB       GLU  68 -10.911  -8.870  -1.236
  530   1HG   GLU  68          2HG       GLU  68 -12.351 -10.878  -1.232
  531   2HG   GLU  68          3HG       GLU  68 -13.672  -9.945  -1.960
  Start of MODEL   10
    1   1H    MET   1           H1       MET   1  -8.157 -11.946   8.147
    2   2H    MET   1           H2       MET   1  -6.692 -11.310   7.827
    3   3H    MET   1           H3       MET   1  -7.214 -11.219   9.318
    4    HA   MET   1           HA       MET   1  -9.053  -9.724   8.592
    5   1HB   MET   1          2HB       MET   1  -6.175  -9.110   8.021
    6   2HB   MET   1          3HB       MET   1  -7.334  -7.976   7.354
    7   1HG   MET   1          2HG       MET   1  -6.597  -7.176   9.491
    8   2HG   MET   1          3HG       MET   1  -8.310  -7.586   9.572
    9   1HE   MET   1          1HE       MET   1  -6.644  -6.945  12.125
   10   2HE   MET   1          2HE       MET   1  -8.353  -7.449  12.162
   11   3HE   MET   1          3HE       MET   1  -7.164  -8.256  13.213
   12    HA   PRO   2           HA       PRO   2 -10.161 -10.037   4.250
   13   1HB   PRO   2          2HB       PRO   2 -11.109  -7.564   3.628
   14   2HB   PRO   2          3HB       PRO   2 -12.002  -8.676   4.709
   15   1HG   PRO   2          2HG       PRO   2 -10.129  -6.413   5.481
   16   2HG   PRO   2          3HG       PRO   2 -11.777  -6.710   6.110
   17   1HD   PRO   2          2HD       PRO   2  -9.581  -7.524   7.458
   18   2HD   PRO   2          3HD       PRO   2 -11.019  -8.581   7.385
   19    H    LYS   3           H        LYS   3  -9.792  -8.896   2.141
   20    HA   LYS   3           HA       LYS   3  -7.034  -7.850   1.877
   21   1HB   LYS   3          2HB       LYS   3  -7.984  -9.530   0.353
   22   2HB   LYS   3          3HB       LYS   3  -9.211  -8.336  -0.162
   23   1HG   LYS   3          2HG       LYS   3  -7.444  -6.902  -1.103
   24   2HG   LYS   3          3HG       LYS   3  -6.252  -8.145  -0.711
   25   1HD   LYS   3          2HD       LYS   3  -8.645  -8.396  -2.625
   26   2HD   LYS   3          3HD       LYS   3  -6.941  -8.316  -3.036
   27   1HE   LYS   3          2HE       LYS   3  -7.440 -10.594  -3.236
   28   2HE   LYS   3          3HE       LYS   3  -6.598 -10.455  -1.696
   29   1HZ   LYS   3          1HZ       LYS   3  -9.230 -10.353  -0.931
   30   2HZ   LYS   3          2HZ       LYS   3  -9.333 -11.222  -2.286
   31   3HZ   LYS   3          3HZ       LYS   3  -8.309 -11.668  -1.004
   32    H    HIS   4           H        HIS   4  -6.693  -5.733   1.009
   33    HA   HIS   4           HA       HIS   4  -9.027  -4.030   0.460
   34   1HB   HIS   4          2HB       HIS   4  -6.805  -3.409   2.442
   35   2HB   HIS   4          3HB       HIS   4  -7.726  -2.136   1.647
   36    HD1  HIS   4           1HD      HIS   4 -10.617  -2.692   1.917
   37    HD2  HIS   4           2HD      HIS   4  -7.828  -4.125   4.741
   38    HE1  HIS   4           1HE      HIS   4 -11.920  -3.210   4.058
   39    H    GLU   5           H        GLU   5  -8.676  -2.585  -1.181
   40    HA   GLU   5           HA       GLU   5  -6.032  -2.745  -2.569
   41   1HB   GLU   5          2HB       GLU   5  -8.840  -2.336  -3.676
   42   2HB   GLU   5          3HB       GLU   5  -7.347  -2.100  -4.575
   43   1HG   GLU   5          2HG       GLU   5  -6.860  -4.575  -3.696
   44   2HG   GLU   5          3HG       GLU   5  -8.632  -4.632  -3.635
   45    H    PHE   6           H        PHE   6  -5.161  -0.889  -3.411
   46    HA   PHE   6           HA       PHE   6  -6.330   1.708  -2.613
   47   1HB   PHE   6          2HB       PHE   6  -3.448   0.797  -2.153
   48   2HB   PHE   6          3HB       PHE   6  -4.109   2.340  -1.666
   49    HD1  PHE   6           1HD      PHE   6  -5.244   2.549   0.529
   50    HD2  PHE   6           2HD      PHE   6  -4.142  -1.337  -1.014
   51    HE1  PHE   6           1HE      PHE   6  -5.959   1.478   2.629
   52    HE2  PHE   6           2HE      PHE   6  -4.777  -2.362   1.135
   53    HZ   PHE   6           HZ       PHE   6  -5.654  -0.951   2.984
   54    H    SER   7           H        SER   7  -5.918   3.300  -4.132
   55    HA   SER   7           HA       SER   7  -4.434   2.512  -6.610
   56   1HB   SER   7          2HB       SER   7  -6.718   3.511  -6.898
   57   2HB   SER   7          3HB       SER   7  -6.091   5.013  -6.153
   58    HG   SER   7           HG       SER   7  -5.952   4.996  -8.464
   59    H    VAL   8           H        VAL   8  -2.550   3.645  -7.162
   60    HA   VAL   8           HA       VAL   8  -1.339   5.410  -5.091
   61    HB   VAL   8           HB       VAL   8  -0.324   2.739  -6.222
   62   1HG1  VAL   8          1HG1      VAL   8   1.563   4.098  -5.927
   63   2HG1  VAL   8          2HG1      VAL   8   0.929   4.845  -4.430
   64   3HG1  VAL   8          3HG1      VAL   8   1.499   3.154  -4.448
   65   1HG2  VAL   8          1HG2      VAL   8  -1.325   3.616  -3.473
   66   2HG2  VAL   8          2HG2      VAL   8  -1.956   2.290  -4.476
   67   3HG2  VAL   8          3HG2      VAL   8  -0.374   2.158  -3.714
   68    H    ASP   9           H        ASP   9  -1.532   7.177  -6.635
   69    HA   ASP   9           HA       ASP   9  -0.254   6.695  -9.231
   70   1HB   ASP   9          2HB       ASP   9  -2.257   8.252  -8.979
   71   2HB   ASP   9          3HB       ASP   9  -1.065   9.489  -8.548
   72    H    MET  10           H        MET  10   1.757   6.062  -8.580
   73    HA   MET  10           HA       MET  10   3.658   8.266  -8.597
   74   1HB   MET  10          2HB       MET  10   5.032   7.002  -6.774
   75   2HB   MET  10          3HB       MET  10   3.762   8.148  -6.309
   76   1HG   MET  10          2HG       MET  10   2.193   6.255  -5.992
   77   2HG   MET  10          3HG       MET  10   3.537   5.130  -6.243
   78   1HE   MET  10          1HE       MET  10   5.582   6.012  -2.912
   79   2HE   MET  10          2HE       MET  10   5.460   4.843  -4.241
   80   3HE   MET  10          3HE       MET  10   5.878   6.549  -4.583
   81    H    THR  11           H        THR  11   5.427   7.693  -9.838
   82    HA   THR  11           HA       THR  11   5.672   4.910 -10.827
   83    HB   THR  11           HB       THR  11   4.930   7.218 -12.680
   84    HG1  THR  11           1HG      THR  11   3.398   5.353 -11.272
   85   1HG2  THR  11          1HG2      THR  11   4.506   5.387 -14.282
   86   2HG2  THR  11          2HG2      THR  11   6.190   5.351 -13.736
   87   3HG2  THR  11          3HG2      THR  11   5.018   4.186 -13.080
   88    H    CYS  12           H        CYS  12   7.761   5.078  -9.892
   89    HA   CYS  12           HA       CYS  12   9.728   6.258 -11.755
   90   1HB   CYS  12          2HB       CYS  12   9.204   7.319  -8.994
   91   2HB   CYS  12          3HB       CYS  12  10.903   7.063  -9.398
   92    HG   CYS  12           HG       CYS  12   8.740   8.656 -11.281
   93    H    GLY  13           H        GLY  13   8.708   3.549 -10.841
   94   1HA   GLY  13          2HA       GLY  13   9.638   1.487 -10.505
   95   2HA   GLY  13          3HA       GLY  13  11.256   2.202 -10.588
   96    H    GLY  14           H        GLY  14  11.756   3.668  -8.613
   97   1HA   GLY  14          2HA       GLY  14  11.735   2.138  -6.220
   98   2HA   GLY  14          3HA       GLY  14  12.223   3.838  -6.370
   99    H    CYS  15           H        CYS  15   9.200   4.069  -7.522
  100    HA   CYS  15           HA       CYS  15   7.805   4.784  -5.156
  101   1HB   CYS  15          2HB       CYS  15   5.755   4.497  -6.471
  102   2HB   CYS  15          3HB       CYS  15   6.963   5.450  -7.351
  103    HG   CYS  15           HG       CYS  15   5.388   3.757  -8.784
  104    H    ALA  16           H        ALA  16   8.275   1.602  -6.768
  105    HA   ALA  16           HA       ALA  16   6.558   0.149  -5.004
  106   1HB   ALA  16          1HB       ALA  16   7.381  -0.748  -7.170
  107   2HB   ALA  16          2HB       ALA  16   9.036  -0.794  -6.526
  108   3HB   ALA  16          3HB       ALA  16   7.777  -1.832  -5.824
  109    H    GLU  17           H        GLU  17  10.071   0.920  -4.847
  110    HA   GLU  17           HA       GLU  17  10.578  -0.450  -2.407
  111   1HB   GLU  17          2HB       GLU  17  11.881   2.041  -3.613
  112   2HB   GLU  17          3HB       GLU  17  12.300   1.363  -2.054
  113   1HG   GLU  17          2HG       GLU  17  12.653  -0.894  -3.285
  114   2HG   GLU  17          3HG       GLU  17  12.665   0.086  -4.764
  115    H    ALA  18           H        ALA  18   9.321   2.862  -3.025
  116    HA   ALA  18           HA       ALA  18   9.438   3.741  -0.330
  117   1HB   ALA  18          1HB       ALA  18   8.967   5.246  -2.233
  118   2HB   ALA  18          2HB       ALA  18   7.372   4.486  -2.438
  119   3HB   ALA  18          3HB       ALA  18   7.735   5.391  -0.959
  120    H    VAL  19           H        VAL  19   6.733   2.206  -2.111
  121    HA   VAL  19           HA       VAL  19   4.974   1.992   0.109
  122    HB   VAL  19           HB       VAL  19   5.208   0.284  -2.400
  123   1HG1  VAL  19          1HG1      VAL  19   3.958  -0.924  -0.604
  124   2HG1  VAL  19          2HG1      VAL  19   2.930   0.517  -0.383
  125   3HG1  VAL  19          3HG1      VAL  19   2.903  -0.410  -1.901
  126   1HG2  VAL  19          1HG2      VAL  19   3.325   1.655  -3.199
  127   2HG2  VAL  19          2HG2      VAL  19   3.333   2.593  -1.692
  128   3HG2  VAL  19          3HG2      VAL  19   4.695   2.704  -2.819
  129    H    SER  20           H        SER  20   7.271  -0.430  -1.278
  130    HA   SER  20           HA       SER  20   6.663  -2.468   0.563
  131   1HB   SER  20          2HB       SER  20   7.996  -2.823  -1.514
  132   2HB   SER  20          3HB       SER  20   9.318  -1.858  -0.841
  133    HG   SER  20           HG       SER  20   8.336  -4.313   0.232
  134    H    ARG  21           H        ARG  21   9.181   0.067   0.837
  135    HA   ARG  21           HA       ARG  21  10.190  -0.793   3.336
  136   1HB   ARG  21          2HB       ARG  21  10.199   1.903   1.943
  137   2HB   ARG  21          3HB       ARG  21  11.087   1.560   3.440
  138   1HG   ARG  21          2HG       ARG  21  12.353  -0.221   2.379
  139   2HG   ARG  21          3HG       ARG  21  11.433  -0.105   0.893
  140   1HD   ARG  21          2HD       ARG  21  12.232   2.171   0.486
  141   2HD   ARG  21          3HD       ARG  21  13.204   2.146   1.953
  142    HE   ARG  21           HE       ARG  21  13.820   0.916  -0.659
  143   1HH1  ARG  21          2HH2      ARG  21  14.488   0.579   2.783
  144   2HH1  ARG  21          1HH2      ARG  21  16.051  -0.153   2.535
  145   1HH2  ARG  21          2HH1      ARG  21  15.680   0.024  -1.017
  146   2HH2  ARG  21          1HH1      ARG  21  16.796  -0.520   0.236
  147    H    VAL  22           H        VAL  22   7.635   1.789   2.643
  148    HA   VAL  22           HA       VAL  22   7.245   2.254   5.371
  149    HB   VAL  22           HB       VAL  22   6.522   3.604   3.239
  150   1HG1  VAL  22          1HG1      VAL  22   4.165   3.469   2.676
  151   2HG1  VAL  22          2HG1      VAL  22   4.858   1.878   2.415
  152   3HG1  VAL  22          3HG1      VAL  22   3.912   2.198   3.885
  153   1HG2  VAL  22          1HG2      VAL  22   4.816   4.759   4.584
  154   2HG2  VAL  22          2HG2      VAL  22   4.817   3.391   5.723
  155   3HG2  VAL  22          3HG2      VAL  22   6.298   4.374   5.507
  156    H    LEU  23           H        LEU  23   5.648  -0.238   3.259
  157    HA   LEU  23           HA       LEU  23   3.978  -1.042   5.458
  158   1HB   LEU  23          2HB       LEU  23   4.607  -2.210   2.756
  159   2HB   LEU  23          3HB       LEU  23   3.823  -3.163   3.995
  160    HG   LEU  23           HG       LEU  23   2.130  -2.400   2.686
  161   1HD1  LEU  23          1HD1      LEU  23   1.917  -0.458   5.020
  162   2HD1  LEU  23          2HD1      LEU  23   0.632  -1.309   4.167
  163   3HD1  LEU  23          3HD1      LEU  23   1.735  -2.211   5.223
  164   1HD2  LEU  23          1HD2      LEU  23   3.045   0.427   3.059
  165   2HD2  LEU  23          2HD2      LEU  23   3.263  -0.578   1.610
  166   3HD2  LEU  23          3HD2      LEU  23   1.625  -0.099   2.136
  167    H    ASN  24           H        ASN  24   7.190  -2.230   4.315
  168    HA   ASN  24           HA       ASN  24   7.452  -4.415   6.096
  169   1HB   ASN  24          2HB       ASN  24   9.367  -2.489   4.749
  170   2HB   ASN  24          3HB       ASN  24   9.928  -3.460   6.082
  171   1HD2  ASN  24          1HD2      ASN  24   8.878  -3.597   2.754
  172   2HD2  ASN  24          2HD2      ASN  24   9.531  -5.205   2.467
  173    H    LYS  25           H        LYS  25   8.012  -0.907   6.564
  174    HA   LYS  25           HA       LYS  25   8.887  -1.000   9.237
  175   1HB   LYS  25          2HB       LYS  25   7.492   0.998   7.470
  176   2HB   LYS  25          3HB       LYS  25   7.451   1.324   9.185
  177   1HG   LYS  25          2HG       LYS  25  10.008   0.689   7.643
  178   2HG   LYS  25          3HG       LYS  25   9.370   2.331   7.816
  179   1HD   LYS  25          2HD       LYS  25   9.502   2.194  10.266
  180   2HD   LYS  25          3HD       LYS  25  10.114   0.535  10.177
  181   1HE   LYS  25          2HE       LYS  25  12.098   1.340   8.882
  182   2HE   LYS  25          3HE       LYS  25  11.509   3.004   9.037
  183   1HZ   LYS  25          1HZ       LYS  25  12.266   1.236  11.274
  184   2HZ   LYS  25          2HZ       LYS  25  13.159   2.483  10.686
  185   3HZ   LYS  25          3HZ       LYS  25  11.722   2.782  11.425
  186    H    LEU  26           H        LEU  26   5.603  -1.327   7.978
  187    HA   LEU  26           HA       LEU  26   4.328  -1.239  10.558
  188   1HB   LEU  26          2HB       LEU  26   3.470  -1.015   8.044
  189   2HB   LEU  26          3HB       LEU  26   3.158  -2.708   8.158
  190    HG   LEU  26           HG       LEU  26   1.262  -1.013   8.631
  191   1HD1  LEU  26          1HD1      LEU  26   1.735  -3.319  10.545
  192   2HD1  LEU  26          2HD1      LEU  26   0.174  -2.542  10.193
  193   3HD1  LEU  26          3HD1      LEU  26   1.030  -3.427   8.915
  194   1HD2  LEU  26          1HD2      LEU  26   2.597   0.278  10.397
  195   2HD2  LEU  26          2HD2      LEU  26   0.945  -0.191  10.825
  196   3HD2  LEU  26          3HD2      LEU  26   2.308  -1.102  11.482
  197    H    GLY  27           H        GLY  27   5.348  -3.801   8.306
  198   1HA   GLY  27          2HA       GLY  27   6.807  -5.431   9.355
  199   2HA   GLY  27          3HA       GLY  27   5.686  -5.501  10.703
  200    H    GLY  28           H        GLY  28   3.675  -6.753  10.442
  201   1HA   GLY  28          2HA       GLY  28   4.348  -9.214   9.020
  202   2HA   GLY  28          3HA       GLY  28   3.026  -8.941  10.162
  203    H    VAL  29           H        VAL  29   3.941  -7.512   7.001
  204    HA   VAL  29           HA       VAL  29   1.074  -7.679   6.225
  205    HB   VAL  29           HB       VAL  29   1.557  -5.570   7.043
  206   1HG1  VAL  29          1HG1      VAL  29   3.088  -4.013   5.968
  207   2HG1  VAL  29          2HG1      VAL  29   3.918  -5.311   6.812
  208   3HG1  VAL  29          3HG1      VAL  29   3.833  -5.339   5.054
  209   1HG2  VAL  29          1HG2      VAL  29   0.794  -4.251   5.140
  210   2HG2  VAL  29          2HG2      VAL  29   1.221  -5.556   4.024
  211   3HG2  VAL  29          3HG2      VAL  29  -0.042  -5.802   5.239
  212    H    LYS  30           H        LYS  30   0.838  -9.182   4.680
  213    HA   LYS  30           HA       LYS  30   2.521  -9.114   2.255
  214   1HB   LYS  30          2HB       LYS  30   1.650 -11.181   2.464
  215   2HB   LYS  30          3HB       LYS  30   0.118 -10.625   3.142
  216   1HG   LYS  30          2HG       LYS  30  -0.137 -11.634   0.918
  217   2HG   LYS  30          3HG       LYS  30  -0.767 -10.017   1.030
  218   1HD   LYS  30          2HD       LYS  30   0.261 -10.293  -1.088
  219   2HD   LYS  30          3HD       LYS  30   1.263  -9.142  -0.242
  220   1HE   LYS  30          2HE       LYS  30   2.981 -10.784   0.189
  221   2HE   LYS  30          3HE       LYS  30   1.914 -12.105  -0.335
  222   1HZ   LYS  30          1HZ       LYS  30   1.856 -10.968  -2.547
  223   2HZ   LYS  30          2HZ       LYS  30   3.002  -9.990  -2.132
  224   3HZ   LYS  30          3HZ       LYS  30   3.341 -11.604  -2.163
  225    H    TYR  31           H        TYR  31   2.551  -7.248   1.428
  226    HA   TYR  31           HA       TYR  31   0.101  -6.042   0.267
  227   1HB   TYR  31          2HB       TYR  31   1.438  -4.002  -0.091
  228   2HB   TYR  31          3HB       TYR  31   1.239  -4.357   1.623
  229    HD1  TYR  31           HD1      TYR  31   3.633  -4.311  -1.196
  230    HD2  TYR  31           HD2      TYR  31   3.121  -5.171   2.964
  231    HE1  TYR  31           HE1      TYR  31   6.066  -4.846  -0.995
  232    HE2  TYR  31           HE2      TYR  31   5.551  -5.553   3.213
  233    HH   TYR  31           HH       TYR  31   7.543  -5.659   2.137
  234    H    ASP  32           H        ASP  32   0.270  -5.752  -2.031
  235    HA   ASP  32           HA       ASP  32   2.753  -6.600  -3.381
  236   1HB   ASP  32          2HB       ASP  32  -0.095  -7.615  -3.803
  237   2HB   ASP  32          3HB       ASP  32   1.006  -7.483  -5.165
  238    H    ILE  33           H        ILE  33   3.184  -5.344  -5.143
  239    HA   ILE  33           HA       ILE  33   1.606  -2.814  -5.359
  240    HB   ILE  33           HB       ILE  33   4.548  -3.263  -5.958
  241   1HG1  ILE  33          2HG1      ILE  33   4.554  -1.595  -3.845
  242   2HG1  ILE  33          3HG1      ILE  33   3.135  -2.537  -3.395
  243   1HG2  ILE  33          1HG2      ILE  33   3.468  -1.415  -7.204
  244   2HG2  ILE  33          2HG2      ILE  33   2.892  -0.729  -5.667
  245   3HG2  ILE  33          3HG2      ILE  33   4.633  -0.836  -6.012
  246   1HD1  ILE  33          1HD1      ILE  33   5.350  -3.330  -2.501
  247   2HD1  ILE  33          2HD1      ILE  33   4.464  -4.599  -3.379
  248   3HD1  ILE  33          3HD1      ILE  33   5.833  -3.747  -4.147
  249    H    ASP  34           H        ASP  34   0.452  -2.792  -7.261
  250    HA   ASP  34           HA       ASP  34   1.501  -4.338  -9.590
  251   1HB   ASP  34          2HB       ASP  34  -0.854  -4.720  -8.926
  252   2HB   ASP  34          3HB       ASP  34  -1.198  -3.022  -9.312
  253    H    LEU  35           H        LEU  35   2.964  -3.161 -10.581
  254    HA   LEU  35           HA       LEU  35   3.144  -0.335 -10.299
  255   1HB   LEU  35          2HB       LEU  35   4.950  -2.305 -10.755
  256   2HB   LEU  35          3HB       LEU  35   4.758  -1.741 -12.406
  257    HG   LEU  35           HG       LEU  35   6.624  -0.660 -11.494
  258   1HD1  LEU  35          1HD1      LEU  35   4.434   1.447 -11.306
  259   2HD1  LEU  35          2HD1      LEU  35   6.152   1.695 -11.655
  260   3HD1  LEU  35          3HD1      LEU  35   5.133   0.836 -12.826
  261   1HD2  LEU  35          1HD2      LEU  35   6.091  -1.071  -9.102
  262   2HD2  LEU  35          2HD2      LEU  35   6.745   0.540  -9.421
  263   3HD2  LEU  35          3HD2      LEU  35   5.008   0.335  -9.115
  264    HA   PRO  36           HA       PRO  36   1.898  -0.078 -14.931
  265   1HB   PRO  36          2HB       PRO  36   0.297  -2.059 -16.008
  266   2HB   PRO  36          3HB       PRO  36   2.071  -1.957 -16.193
  267   1HG   PRO  36          2HG       PRO  36   0.503  -3.610 -14.216
  268   2HG   PRO  36          3HG       PRO  36   1.895  -4.115 -15.208
  269   1HD   PRO  36          2HD       PRO  36   2.190  -3.442 -12.641
  270   2HD   PRO  36          3HD       PRO  36   3.419  -2.943 -13.832
  271    H    ASN  37           H        ASN  37  -0.401  -1.917 -12.748
  272    HA   ASN  37           HA       ASN  37  -2.615  -0.205 -13.559
  273   1HB   ASN  37          2HB       ASN  37  -2.333  -2.064 -11.173
  274   2HB   ASN  37          3HB       ASN  37  -3.756  -1.115 -11.556
  275   1HD2  ASN  37          1HD2      ASN  37  -1.650  -3.652 -12.935
  276   2HD2  ASN  37          2HD2      ASN  37  -2.910  -4.363 -13.945
  277    H    LYS  38           H        LYS  38  -0.030   0.071 -11.115
  278    HA   LYS  38           HA       LYS  38   0.557   1.809  -9.770
  279   1HB   LYS  38          2HB       LYS  38  -1.535   3.437 -11.290
  280   2HB   LYS  38          3HB       LYS  38  -0.411   4.004 -10.065
  281   1HG   LYS  38          2HG       LYS  38   1.512   3.258 -11.452
  282   2HG   LYS  38          3HG       LYS  38   0.420   2.542 -12.638
  283   1HD   LYS  38          2HD       LYS  38   1.378   4.693 -13.356
  284   2HD   LYS  38          3HD       LYS  38  -0.396   4.660 -13.371
  285   1HE   LYS  38          2HE       LYS  38  -0.607   6.070 -11.523
  286   2HE   LYS  38          3HE       LYS  38   1.005   5.672 -10.891
  287   1HZ   LYS  38          1HZ       LYS  38   0.896   7.877 -11.787
  288   2HZ   LYS  38          2HZ       LYS  38   2.019   6.922 -12.530
  289   3HZ   LYS  38          3HZ       LYS  38   0.563   7.312 -13.282
  290    H    LYS  39           H        LYS  39  -0.735  -0.213  -8.856
  291    HA   LYS  39           HA       LYS  39  -2.676   0.904  -6.911
  292   1HB   LYS  39          2HB       LYS  39  -2.900  -1.582  -8.651
  293   2HB   LYS  39          3HB       LYS  39  -3.516  -1.617  -6.995
  294   1HG   LYS  39          2HG       LYS  39  -5.037   0.205  -7.425
  295   2HG   LYS  39          3HG       LYS  39  -4.416   0.411  -9.071
  296   1HD   LYS  39          2HD       LYS  39  -6.616  -0.895  -8.808
  297   2HD   LYS  39          3HD       LYS  39  -5.364  -1.655  -9.805
  298   1HE   LYS  39          2HE       LYS  39  -4.743  -3.197  -8.055
  299   2HE   LYS  39          3HE       LYS  39  -5.728  -2.343  -6.850
  300   1HZ   LYS  39          1HZ       LYS  39  -7.655  -3.202  -7.754
  301   2HZ   LYS  39          2HZ       LYS  39  -6.912  -3.761  -9.160
  302   3HZ   LYS  39          3HZ       LYS  39  -6.647  -4.389  -7.642
  303    H    VAL  40           H        VAL  40  -2.669  -0.282  -4.844
  304    HA   VAL  40           HA       VAL  40  -0.529  -2.256  -4.474
  305    HB   VAL  40           HB       VAL  40  -1.359   0.197  -2.906
  306   1HG1  VAL  40          1HG1      VAL  40  -1.779  -1.467  -1.362
  307   2HG1  VAL  40          2HG1      VAL  40  -0.261  -2.346  -1.716
  308   3HG1  VAL  40          3HG1      VAL  40  -0.220  -0.744  -0.917
  309   1HG2  VAL  40          1HG2      VAL  40   1.035   0.499  -2.700
  310   2HG2  VAL  40          2HG2      VAL  40   1.336  -1.106  -3.422
  311   3HG2  VAL  40          3HG2      VAL  40   0.654   0.198  -4.405
  312    H    CYS  41           H        CYS  41  -1.336  -4.073  -3.530
  313    HA   CYS  41           HA       CYS  41  -4.227  -4.174  -2.723
  314   1HB   CYS  41          2HB       CYS  41  -2.593  -6.342  -4.110
  315   2HB   CYS  41          3HB       CYS  41  -4.311  -6.427  -3.648
  316    HG   CYS  41           HG       CYS  41  -5.309  -5.046  -5.396
  317    H    ILE  42           H        ILE  42  -4.400  -4.995  -0.586
  318    HA   ILE  42           HA       ILE  42  -1.986  -6.310   0.572
  319    HB   ILE  42           HB       ILE  42  -3.666  -4.240   2.026
  320   1HG1  ILE  42          2HG1      ILE  42  -1.028  -3.850   0.543
  321   2HG1  ILE  42          3HG1      ILE  42  -2.566  -3.043   0.225
  322   1HG2  ILE  42          1HG2      ILE  42  -0.907  -5.363   2.652
  323   2HG2  ILE  42          2HG2      ILE  42  -1.882  -4.310   3.686
  324   3HG2  ILE  42          3HG2      ILE  42  -2.411  -5.956   3.390
  325   1HD1  ILE  42          1HD1      ILE  42  -0.772  -2.636   2.636
  326   2HD1  ILE  42          2HD1      ILE  42  -1.173  -1.484   1.359
  327   3HD1  ILE  42          3HD1      ILE  42  -2.426  -1.984   2.508
  328    H    GLU  43           H        GLU  43  -2.393  -8.004   1.908
  329    HA   GLU  43           HA       GLU  43  -5.116  -8.531   2.901
  330   1HB   GLU  43          2HB       GLU  43  -4.889  -9.442   0.488
  331   2HB   GLU  43          3HB       GLU  43  -3.716 -10.580   1.122
  332   1HG   GLU  43          2HG       GLU  43  -5.461 -11.546   2.595
  333   2HG   GLU  43          3HG       GLU  43  -6.633 -10.342   2.038
  334    H    SER  44           H        SER  44  -4.132  -8.269   4.974
  335    HA   SER  44           HA       SER  44  -2.528 -10.483   5.908
  336   1HB   SER  44          2HB       SER  44  -1.072  -8.460   4.741
  337   2HB   SER  44          3HB       SER  44  -1.166  -7.869   6.402
  338    HG   SER  44           HG       SER  44   0.140  -9.494   7.009
  339    H    GLU  45           H        GLU  45  -2.108 -10.252   8.266
  340    HA   GLU  45           HA       GLU  45  -4.494  -9.304   9.529
  341   1HB   GLU  45          2HB       GLU  45  -2.048 -10.548  10.815
  342   2HB   GLU  45          3HB       GLU  45  -3.691 -10.437  11.471
  343   1HG   GLU  45          2HG       GLU  45  -2.795 -12.089   9.063
  344   2HG   GLU  45          3HG       GLU  45  -3.399 -12.672  10.616
  345    H    HIS  46           H        HIS  46  -3.888  -7.010   8.747
  346    HA   HIS  46           HA       HIS  46  -3.375  -5.563  11.255
  347   1HB   HIS  46          2HB       HIS  46  -2.064  -4.833   8.598
  348   2HB   HIS  46          3HB       HIS  46  -2.121  -3.788  10.020
  349    HD1  HIS  46           1HD      HIS  46  -0.701  -4.765  12.232
  350    HD2  HIS  46           2HD      HIS  46  -0.048  -6.515   8.465
  351    HE1  HIS  46           1HE      HIS  46   1.558  -5.946  12.355
  352    H    SER  47           H        SER  47  -4.808  -3.697  11.336
  353    HA   SER  47           HA       SER  47  -7.122  -4.142   9.671
  354   1HB   SER  47          2HB       SER  47  -7.144  -3.334  12.100
  355   2HB   SER  47          3HB       SER  47  -6.776  -1.720  11.454
  356    HG   SER  47           HG       SER  47  -8.810  -1.597  10.870
  357    H    MET  48           H        MET  48  -8.131  -2.670   8.295
  358    HA   MET  48           HA       MET  48  -6.900  -1.445   6.184
  359   1HB   MET  48          2HB       MET  48  -9.348  -1.973   6.651
  360   2HB   MET  48          3HB       MET  48  -9.398  -0.567   7.709
  361   1HG   MET  48          2HG       MET  48  -8.713   0.832   5.712
  362   2HG   MET  48          3HG       MET  48  -8.808  -0.647   4.742
  363   1HE   MET  48          1HE       MET  48 -12.456   1.480   6.657
  364   2HE   MET  48          2HE       MET  48 -11.337   0.539   7.658
  365   3HE   MET  48          3HE       MET  48 -10.770   2.019   6.842
  366    H    ASP  49           H        ASP  49  -7.933  -0.018   9.277
  367    HA   ASP  49           HA       ASP  49  -7.231   2.638   8.880
  368   1HB   ASP  49          2HB       ASP  49  -7.085   1.299  11.607
  369   2HB   ASP  49          3HB       ASP  49  -7.683   2.905  11.187
  370    H    THR  50           H        THR  50  -5.508   0.091  10.525
  371    HA   THR  50           HA       THR  50  -3.193   1.427  11.354
  372    HB   THR  50           HB       THR  50  -3.228  -1.492  10.488
  373    HG1  THR  50           1HG      THR  50  -4.517  -0.357  12.740
  374   1HG2  THR  50          1HG2      THR  50  -2.091  -0.074  12.941
  375   2HG2  THR  50          2HG2      THR  50  -1.946  -1.803  12.560
  376   3HG2  THR  50          3HG2      THR  50  -1.165  -0.598  11.520
  377    H    LEU  51           H        LEU  51  -3.815  -0.501   8.390
  378    HA   LEU  51           HA       LEU  51  -1.273  -0.075   7.160
  379   1HB   LEU  51          2HB       LEU  51  -4.002  -0.494   5.870
  380   2HB   LEU  51          3HB       LEU  51  -2.447  -0.595   5.031
  381    HG   LEU  51           HG       LEU  51  -3.166  -2.347   7.432
  382   1HD1  LEU  51          1HD1      LEU  51  -3.711  -4.120   5.780
  383   2HD1  LEU  51          2HD1      LEU  51  -4.839  -2.759   5.732
  384   3HD1  LEU  51          3HD1      LEU  51  -3.595  -2.912   4.478
  385   1HD2  LEU  51          1HD2      LEU  51  -1.406  -3.830   6.483
  386   2HD2  LEU  51          2HD2      LEU  51  -1.064  -2.603   5.249
  387   3HD2  LEU  51          3HD2      LEU  51  -0.759  -2.259   6.967
  388    H    LEU  52           H        LEU  52  -4.398   1.604   6.554
  389    HA   LEU  52           HA       LEU  52  -3.516   3.535   4.801
  390   1HB   LEU  52          2HB       LEU  52  -5.747   3.322   6.751
  391   2HB   LEU  52          3HB       LEU  52  -5.352   4.978   6.316
  392    HG   LEU  52           HG       LEU  52  -5.843   2.806   4.282
  393   1HD1  LEU  52          1HD1      LEU  52  -8.124   3.726   4.046
  394   2HD1  LEU  52          2HD1      LEU  52  -7.850   3.094   5.678
  395   3HD1  LEU  52          3HD1      LEU  52  -7.816   4.845   5.392
  396   1HD2  LEU  52          1HD2      LEU  52  -5.885   5.858   4.093
  397   2HD2  LEU  52          2HD2      LEU  52  -4.618   4.820   3.412
  398   3HD2  LEU  52          3HD2      LEU  52  -6.256   4.760   2.762
  399    H    ALA  53           H        ALA  53  -3.705   3.988   8.354
  400    HA   ALA  53           HA       ALA  53  -2.574   6.578   8.400
  401   1HB   ALA  53          1HB       ALA  53  -2.518   4.398  10.539
  402   2HB   ALA  53          2HB       ALA  53  -2.260   6.135  10.817
  403   3HB   ALA  53          3HB       ALA  53  -3.845   5.550  10.273
  404    H    THR  54           H        THR  54  -0.981   3.427   8.275
  405    HA   THR  54           HA       THR  54   1.673   4.515   8.760
  406    HB   THR  54           HB       THR  54   0.780   1.866   7.535
  407    HG1  THR  54           1HG      THR  54   0.107   2.013   9.601
  408   1HG2  THR  54          1HG2      THR  54   3.086   1.182   8.166
  409   2HG2  THR  54          2HG2      THR  54   3.030   2.343   6.837
  410   3HG2  THR  54          3HG2      THR  54   3.487   2.880   8.477
  411    H    LEU  55           H        LEU  55   0.155   3.134   5.790
  412    HA   LEU  55           HA       LEU  55   2.340   3.897   4.176
  413   1HB   LEU  55          2HB       LEU  55   1.063   3.108   2.341
  414   2HB   LEU  55          3HB       LEU  55   1.085   2.032   3.718
  415    HG   LEU  55           HG       LEU  55  -1.251   3.297   4.226
  416   1HD1  LEU  55          1HD1      LEU  55  -0.807   4.685   2.205
  417   2HD1  LEU  55          2HD1      LEU  55  -0.954   3.202   1.242
  418   3HD1  LEU  55          3HD1      LEU  55  -2.371   3.813   2.154
  419   1HD2  LEU  55          1HD2      LEU  55  -0.825   1.024   2.239
  420   2HD2  LEU  55          2HD2      LEU  55  -0.866   0.858   4.003
  421   3HD2  LEU  55          3HD2      LEU  55  -2.335   1.356   3.126
  422    H    LYS  56           H        LYS  56  -0.641   5.554   4.844
  423    HA   LYS  56           HA       LYS  56  -0.731   7.699   3.197
  424   1HB   LYS  56          2HB       LYS  56  -1.076   7.372   6.177
  425   2HB   LYS  56          3HB       LYS  56  -0.869   9.011   5.642
  426   1HG   LYS  56          2HG       LYS  56  -2.701   8.892   4.084
  427   2HG   LYS  56          3HG       LYS  56  -3.007   7.186   4.512
  428   1HD   LYS  56          2HD       LYS  56  -3.623   7.752   6.753
  429   2HD   LYS  56          3HD       LYS  56  -2.832   9.321   6.669
  430   1HE   LYS  56          2HE       LYS  56  -5.254   9.631   6.667
  431   2HE   LYS  56          3HE       LYS  56  -4.540  10.211   5.158
  432   1HZ   LYS  56          1HZ       LYS  56  -6.532   8.959   4.769
  433   2HZ   LYS  56          2HZ       LYS  56  -5.254   8.166   4.111
  434   3HZ   LYS  56          3HZ       LYS  56  -5.923   7.632   5.521
  435    H    LYS  57           H        LYS  57   1.738   7.198   5.726
  436    HA   LYS  57           HA       LYS  57   2.719   9.859   5.770
  437   1HB   LYS  57          2HB       LYS  57   4.018   7.244   6.547
  438   2HB   LYS  57          3HB       LYS  57   4.633   8.860   6.981
  439   1HG   LYS  57          2HG       LYS  57   2.341   9.254   8.077
  440   2HG   LYS  57          3HG       LYS  57   2.039   7.524   7.821
  441   1HD   LYS  57          2HD       LYS  57   4.459   7.309   8.991
  442   2HD   LYS  57          3HD       LYS  57   4.020   8.879   9.657
  443   1HE   LYS  57          2HE       LYS  57   2.745   6.151  10.070
  444   2HE   LYS  57          3HE       LYS  57   3.343   7.286  11.283
  445   1HZ   LYS  57          1HZ       LYS  57   1.008   7.309  11.314
  446   2HZ   LYS  57          2HZ       LYS  57   1.429   8.729  10.590
  447   3HZ   LYS  57          3HZ       LYS  57   0.871   7.446   9.693
  448    H    THR  58           H        THR  58   3.172   7.472   3.289
  449    HA   THR  58           HA       THR  58   5.675   8.337   2.209
  450    HB   THR  58           HB       THR  58   4.629   7.714   0.009
  451    HG1  THR  58           1HG      THR  58   2.373   6.905   1.508
  452   1HG2  THR  58          1HG2      THR  58   4.303   5.319   0.557
  453   2HG2  THR  58          2HG2      THR  58   5.750   6.006   1.323
  454   3HG2  THR  58          3HG2      THR  58   4.290   5.732   2.287
  455    H    GLY  59           H        GLY  59   2.395   9.698   2.088
  456   1HA   GLY  59          2HA       GLY  59   1.635  11.785   1.678
  457   2HA   GLY  59          3HA       GLY  59   3.302  12.376   1.576
  458    H    LYS  60           H        LYS  60   2.229   9.726  -0.514
  459    HA   LYS  60           HA       LYS  60   2.337  11.478  -2.931
  460   1HB   LYS  60          2HB       LYS  60   2.784   8.544  -2.320
  461   2HB   LYS  60          3HB       LYS  60   2.419   9.067  -3.958
  462   1HG   LYS  60          2HG       LYS  60   4.843   8.830  -3.479
  463   2HG   LYS  60          3HG       LYS  60   4.372  10.424  -4.110
  464   1HD   LYS  60          2HD       LYS  60   4.553  11.435  -1.951
  465   2HD   LYS  60          3HD       LYS  60   4.675   9.828  -1.180
  466   1HE   LYS  60          2HE       LYS  60   6.899   9.516  -2.073
  467   2HE   LYS  60          3HE       LYS  60   6.801  11.039  -2.981
  468   1HZ   LYS  60          1HZ       LYS  60   6.717  12.237  -0.954
  469   2HZ   LYS  60          2HZ       LYS  60   6.517  10.895  -0.044
  470   3HZ   LYS  60          3HZ       LYS  60   7.970  11.180  -0.791
  471    H    THR  61           H        THR  61   0.832  10.338  -4.736
  472    HA   THR  61           HA       THR  61  -1.820  10.844  -3.974
  473    HB   THR  61           HB       THR  61  -1.075   9.414  -6.467
  474    HG1  THR  61           1HG      THR  61   0.507  10.570  -6.978
  475   1HG2  THR  61          1HG2      THR  61  -2.342  11.270  -7.538
  476   2HG2  THR  61          2HG2      THR  61  -3.290  10.532  -6.232
  477   3HG2  THR  61          3HG2      THR  61  -2.468  12.090  -5.971
  478    H    VAL  62           H        VAL  62  -1.243   8.895  -2.252
  479    HA   VAL  62           HA       VAL  62  -2.297   6.332  -3.286
  480    HB   VAL  62           HB       VAL  62  -0.344   6.051  -2.044
  481   1HG1  VAL  62          1HG1      VAL  62  -0.209   8.038  -0.640
  482   2HG1  VAL  62          2HG1      VAL  62  -1.641   7.534   0.285
  483   3HG1  VAL  62          3HG1      VAL  62  -0.140   6.593   0.367
  484   1HG2  VAL  62          1HG2      VAL  62  -1.043   4.373  -0.597
  485   2HG2  VAL  62          2HG2      VAL  62  -2.537   5.221  -0.125
  486   3HG2  VAL  62          3HG2      VAL  62  -2.392   4.495  -1.732
  487    H    SER  63           H        SER  63  -4.355   5.663  -2.926
  488    HA   SER  63           HA       SER  63  -5.848   6.731  -0.640
  489   1HB   SER  63          2HB       SER  63  -6.405   8.318  -2.489
  490   2HB   SER  63          3HB       SER  63  -7.010   6.947  -3.447
  491    HG   SER  63           HG       SER  63  -8.675   8.004  -2.223
  492    H    TYR  64           H        TYR  64  -8.104   5.593  -0.762
  493    HA   TYR  64           HA       TYR  64  -7.419   2.671  -0.776
  494   1HB   TYR  64          2HB       TYR  64  -7.483   3.446   1.445
  495   2HB   TYR  64          3HB       TYR  64  -8.892   4.472   1.155
  496    HD1  TYR  64           HD1      TYR  64 -10.937   3.713   2.017
  497    HD2  TYR  64           HD2      TYR  64  -7.982   0.834   0.761
  498    HE1  TYR  64           HE1      TYR  64 -12.508   1.877   2.524
  499    HE2  TYR  64           HE2      TYR  64  -9.546  -0.974   1.241
  500    HH   TYR  64           HH       TYR  64 -12.828  -0.409   2.569
  501    H    LEU  65           H        LEU  65  -8.727   1.330  -1.964
  502    HA   LEU  65           HA       LEU  65 -11.543   1.931  -2.373
  503   1HB   LEU  65          2HB       LEU  65 -11.121   1.592  -4.921
  504   2HB   LEU  65          3HB       LEU  65 -11.121   3.179  -4.166
  505    HG   LEU  65           HG       LEU  65  -9.460   2.911  -5.847
  506   1HD1  LEU  65          1HD1      LEU  65  -9.143   4.430  -3.831
  507   2HD1  LEU  65          2HD1      LEU  65  -7.818   3.302  -3.435
  508   3HD1  LEU  65          3HD1      LEU  65  -7.825   4.173  -4.963
  509   1HD2  LEU  65          1HD2      LEU  65  -7.476   1.563  -5.708
  510   2HD2  LEU  65          2HD2      LEU  65  -8.050   0.845  -4.190
  511   3HD2  LEU  65          3HD2      LEU  65  -8.922   0.566  -5.712
  512    H    GLY  66           H        GLY  66 -11.478  -0.137  -1.082
  513   1HA   GLY  66          2HA       GLY  66 -12.912  -1.879  -2.405
  514   2HA   GLY  66          3HA       GLY  66 -11.335  -2.493  -2.925
  515    H    LEU  67           H        LEU  67 -13.199  -4.061  -1.486
  516    HA   LEU  67           HA       LEU  67 -11.422  -4.841   0.632
  517   1HB   LEU  67          2HB       LEU  67 -12.969  -5.030   2.385
  518   2HB   LEU  67          3HB       LEU  67 -12.973  -3.356   1.827
  519    HG   LEU  67           HG       LEU  67 -15.128  -5.442   1.253
  520   1HD1  LEU  67          1HD1      LEU  67 -16.473  -4.097   2.806
  521   2HD1  LEU  67          2HD1      LEU  67 -15.013  -4.702   3.604
  522   3HD1  LEU  67          3HD1      LEU  67 -15.097  -3.006   3.081
  523   1HD2  LEU  67          1HD2      LEU  67 -16.456  -3.427   0.497
  524   2HD2  LEU  67          2HD2      LEU  67 -14.955  -2.480   0.522
  525   3HD2  LEU  67          3HD2      LEU  67 -15.145  -3.854  -0.595
  526    H    GLU  68           H        GLU  68 -11.192  -7.038   0.612
  527    HA   GLU  68           HA       GLU  68 -13.273  -8.834  -0.281
  528   1HB   GLU  68          2HB       GLU  68 -12.163  -7.847  -2.406
  529   2HB   GLU  68          3HB       GLU  68 -10.714  -8.702  -1.908
  530   1HG   GLU  68          2HG       GLU  68 -12.265 -10.828  -1.836
  531   2HG   GLU  68          3HG       GLU  68 -13.357  -9.853  -2.828
  Start of MODEL   11
    1   1H    MET   1           H1       MET   1  -6.823 -13.529   5.303
    2   2H    MET   1           H2       MET   1  -7.560 -14.314   6.580
    3   3H    MET   1           H3       MET   1  -8.335 -14.087   5.115
    4    HA   MET   1           HA       MET   1  -9.135 -12.538   6.765
    5   1HB   MET   1          2HB       MET   1  -7.160 -10.562   6.780
    6   2HB   MET   1          3HB       MET   1  -7.595 -11.615   8.129
    7   1HG   MET   1          2HG       MET   1  -5.169 -11.505   7.735
    8   2HG   MET   1          3HG       MET   1  -5.788 -13.143   7.587
    9   1HE   MET   1          1HE       MET   1  -2.917 -13.280   4.990
   10   2HE   MET   1          2HE       MET   1  -2.943 -12.629   6.646
   11   3HE   MET   1          3HE       MET   1  -3.767 -14.163   6.281
   12    HA   PRO   2           HA       PRO   2 -10.327 -10.560   3.117
   13   1HB   PRO   2          2HB       PRO   2 -10.737  -7.880   3.683
   14   2HB   PRO   2          3HB       PRO   2 -11.841  -9.201   4.157
   15   1HG   PRO   2          2HG       PRO   2  -9.673  -7.881   5.814
   16   2HG   PRO   2          3HG       PRO   2 -11.349  -8.252   6.311
   17   1HD   PRO   2          2HD       PRO   2  -9.308  -9.866   7.006
   18   2HD   PRO   2          3HD       PRO   2 -10.850 -10.586   6.468
   19    H    LYS   3           H        LYS   3  -9.819  -9.082   1.410
   20    HA   LYS   3           HA       LYS   3  -6.968  -8.196   1.336
   21   1HB   LYS   3          2HB       LYS   3  -7.471  -9.945  -0.232
   22   2HB   LYS   3          3HB       LYS   3  -8.844  -9.053  -0.874
   23   1HG   LYS   3          2HG       LYS   3  -7.165  -7.197  -1.517
   24   2HG   LYS   3          3HG       LYS   3  -5.888  -8.371  -1.184
   25   1HD   LYS   3          2HD       LYS   3  -8.216  -8.743  -3.157
   26   2HD   LYS   3          3HD       LYS   3  -6.655  -8.067  -3.584
   27   1HE   LYS   3          2HE       LYS   3  -6.689 -10.319  -4.292
   28   2HE   LYS   3          3HE       LYS   3  -5.505 -10.170  -2.981
   29   1HZ   LYS   3          1HZ       LYS   3  -8.279 -11.093  -2.525
   30   2HZ   LYS   3          2HZ       LYS   3  -7.072 -12.134  -2.921
   31   3HZ   LYS   3          3HZ       LYS   3  -6.947 -11.309  -1.541
   32    H    HIS   4           H        HIS   4  -6.598  -6.105   0.840
   33    HA   HIS   4           HA       HIS   4  -8.896  -4.214   0.688
   34   1HB   HIS   4          2HB       HIS   4  -6.172  -3.714   1.938
   35   2HB   HIS   4          3HB       HIS   4  -7.659  -2.818   2.140
   36    HD1  HIS   4           1HD      HIS   4  -5.905  -6.038   3.237
   37    HD2  HIS   4           2HD      HIS   4  -9.473  -3.932   3.893
   38    HE1  HIS   4           1HE      HIS   4  -6.960  -7.029   5.356
   39    H    GLU   5           H        GLU   5  -8.852  -2.917  -1.146
   40    HA   GLU   5           HA       GLU   5  -6.454  -3.053  -2.910
   41   1HB   GLU   5          2HB       GLU   5  -9.385  -2.391  -3.258
   42   2HB   GLU   5          3HB       GLU   5  -8.215  -2.169  -4.549
   43   1HG   GLU   5          2HG       GLU   5  -8.669  -4.836  -3.099
   44   2HG   GLU   5          3HG       GLU   5  -9.519  -4.361  -4.559
   45    H    PHE   6           H        PHE   6  -5.403  -1.208  -3.621
   46    HA   PHE   6           HA       PHE   6  -6.464   1.436  -2.824
   47   1HB   PHE   6          2HB       PHE   6  -3.584   0.469  -2.426
   48   2HB   PHE   6          3HB       PHE   6  -4.177   2.043  -1.969
   49    HD1  PHE   6           1HD      PHE   6  -4.504  -1.625  -1.249
   50    HD2  PHE   6           2HD      PHE   6  -4.734   2.385   0.401
   51    HE1  PHE   6           1HE      PHE   6  -4.566  -2.539   1.016
   52    HE2  PHE   6           2HE      PHE   6  -4.584   1.430   2.636
   53    HZ   PHE   6           HZ       PHE   6  -4.645  -1.025   2.990
   54    H    SER   7           H        SER   7  -6.016   3.047  -4.268
   55    HA   SER   7           HA       SER   7  -4.529   2.329  -6.765
   56   1HB   SER   7          2HB       SER   7  -6.838   3.424  -6.951
   57   2HB   SER   7          3HB       SER   7  -6.086   4.890  -6.275
   58    HG   SER   7           HG       SER   7  -4.631   4.804  -8.072
   59    H    VAL   8           H        VAL   8  -2.654   3.494  -7.295
   60    HA   VAL   8           HA       VAL   8  -1.421   5.030  -5.049
   61    HB   VAL   8           HB       VAL   8  -0.366   2.795  -6.843
   62   1HG1  VAL   8          1HG1      VAL   8   1.465   4.251  -6.367
   63   2HG1  VAL   8          2HG1      VAL   8   1.016   4.381  -4.644
   64   3HG1  VAL   8          3HG1      VAL   8   1.618   2.847  -5.316
   65   1HG2  VAL   8          1HG2      VAL   8  -1.070   2.891  -3.879
   66   2HG2  VAL   8          2HG2      VAL   8  -1.839   1.880  -5.122
   67   3HG2  VAL   8          3HG2      VAL   8  -0.169   1.583  -4.651
   68    H    ASP   9           H        ASP   9   0.150   6.585  -5.654
   69    HA   ASP   9           HA       ASP   9   0.218   7.372  -8.536
   70   1HB   ASP   9          2HB       ASP   9  -0.338   9.302  -7.276
   71   2HB   ASP   9          3HB       ASP   9   0.869   8.934  -6.024
   72    H    MET  10           H        MET  10   2.258   7.584  -9.453
   73    HA   MET  10           HA       MET  10   4.487   6.052  -8.229
   74   1HB   MET  10          2HB       MET  10   3.083   5.147 -10.785
   75   2HB   MET  10          3HB       MET  10   4.615   4.528 -10.150
   76   1HG   MET  10          2HG       MET  10   3.274   4.066  -7.959
   77   2HG   MET  10          3HG       MET  10   1.842   4.226  -8.966
   78   1HE   MET  10          1HE       MET  10   2.431   0.325  -8.200
   79   2HE   MET  10          2HE       MET  10   3.031   1.628  -7.148
   80   3HE   MET  10          3HE       MET  10   1.397   1.724  -7.848
   81    H    THR  11           H        THR  11   5.356   8.216  -8.258
   82    HA   THR  11           HA       THR  11   5.775   9.597 -10.743
   83    HB   THR  11           HB       THR  11   7.383  10.881  -9.057
   84    HG1  THR  11           1HG      THR  11   7.404   9.324  -7.437
   85   1HG2  THR  11          1HG2      THR  11   5.281  11.781  -9.864
   86   2HG2  THR  11          2HG2      THR  11   4.351  10.722  -8.799
   87   3HG2  THR  11          3HG2      THR  11   5.362  12.023  -8.114
   88    H    CYS  12           H        CYS  12   7.489   6.984  -9.167
   89    HA   CYS  12           HA       CYS  12   9.324   6.842 -11.397
   90   1HB   CYS  12          2HB       CYS  12  10.660   8.328  -9.932
   91   2HB   CYS  12          3HB       CYS  12  10.361   7.256  -8.543
   92    HG   CYS  12           HG       CYS  12  12.806   6.933  -9.325
   93    H    GLY  13           H        GLY  13  10.130   4.588 -11.461
   94   1HA   GLY  13          2HA       GLY  13   8.510   2.532 -10.550
   95   2HA   GLY  13          3HA       GLY  13  10.242   2.364 -10.894
   96    H    GLY  14           H        GLY  14  11.294   4.032  -8.872
   97   1HA   GLY  14          2HA       GLY  14  11.496   2.323  -6.662
   98   2HA   GLY  14          3HA       GLY  14  11.992   4.025  -6.698
   99    H    CYS  15           H        CYS  15   8.844   4.427  -7.355
  100    HA   CYS  15           HA       CYS  15   7.840   4.980  -4.783
  101   1HB   CYS  15          2HB       CYS  15   5.662   4.987  -5.736
  102   2HB   CYS  15          3HB       CYS  15   6.763   5.705  -6.922
  103    HG   CYS  15           HG       CYS  15   7.049   3.509  -8.341
  104    H    ALA  16           H        ALA  16   7.964   1.912  -6.667
  105    HA   ALA  16           HA       ALA  16   6.359   0.402  -4.853
  106   1HB   ALA  16          1HB       ALA  16   7.313  -1.557  -6.027
  107   2HB   ALA  16          2HB       ALA  16   6.811  -0.304  -7.180
  108   3HB   ALA  16          3HB       ALA  16   8.533  -0.517  -6.795
  109    H    GLU  17           H        GLU  17   9.920   0.868  -5.135
  110    HA   GLU  17           HA       GLU  17  10.683  -0.742  -2.976
  111   1HB   GLU  17          2HB       GLU  17  11.831   1.797  -4.199
  112   2HB   GLU  17          3HB       GLU  17  12.646   0.960  -2.906
  113   1HG   GLU  17          2HG       GLU  17  11.758  -0.840  -5.136
  114   2HG   GLU  17          3HG       GLU  17  12.919   0.400  -5.583
  115    H    ALA  18           H        ALA  18   9.610   2.661  -3.058
  116    HA   ALA  18           HA       ALA  18  10.121   3.219  -0.292
  117   1HB   ALA  18          1HB       ALA  18   8.748   5.220  -0.669
  118   2HB   ALA  18          2HB       ALA  18   9.892   4.975  -2.004
  119   3HB   ALA  18          3HB       ALA  18   8.177   4.567  -2.216
  120    H    VAL  19           H        VAL  19   7.069   2.464  -2.027
  121    HA   VAL  19           HA       VAL  19   5.387   2.410   0.247
  122    HB   VAL  19           HB       VAL  19   5.209   1.071  -2.479
  123   1HG1  VAL  19          1HG1      VAL  19   2.790   0.798  -2.005
  124   2HG1  VAL  19          2HG1      VAL  19   3.785  -0.247  -0.988
  125   3HG1  VAL  19          3HG1      VAL  19   3.074   1.245  -0.313
  126   1HG2  VAL  19          1HG2      VAL  19   3.721   3.458  -1.273
  127   2HG2  VAL  19          2HG2      VAL  19   5.113   3.616  -2.350
  128   3HG2  VAL  19          3HG2      VAL  19   3.620   2.878  -2.947
  129    H    SER  20           H        SER  20   7.180  -0.252  -1.395
  130    HA   SER  20           HA       SER  20   6.369  -2.321   0.327
  131   1HB   SER  20          2HB       SER  20   7.660  -2.649  -1.781
  132   2HB   SER  20          3HB       SER  20   9.076  -1.870  -1.053
  133    HG   SER  20           HG       SER  20   9.224  -4.134  -0.971
  134    H    ARG  21           H        ARG  21   9.287  -0.167   0.723
  135    HA   ARG  21           HA       ARG  21   9.987  -1.190   3.228
  136   1HB   ARG  21          2HB       ARG  21  10.399   1.514   1.918
  137   2HB   ARG  21          3HB       ARG  21  11.118   1.092   3.486
  138   1HG   ARG  21          2HG       ARG  21  12.303  -0.755   2.596
  139   2HG   ARG  21          3HG       ARG  21  11.392  -0.777   1.122
  140   1HD   ARG  21          2HD       ARG  21  12.397   1.458   0.474
  141   2HD   ARG  21          3HD       ARG  21  13.345   1.417   1.962
  142    HE   ARG  21           HE       ARG  21  14.886   0.148   0.866
  143   1HH1  ARG  21          2HH2      ARG  21  11.738  -0.434  -0.738
  144   2HH1  ARG  21          1HH2      ARG  21  12.507  -1.454  -1.964
  145   1HH2  ARG  21          2HH1      ARG  21  15.777  -1.055  -1.008
  146   2HH2  ARG  21          1HH1      ARG  21  14.617  -1.613  -2.196
  147    H    VAL  22           H        VAL  22   7.737   1.666   2.605
  148    HA   VAL  22           HA       VAL  22   7.381   2.111   5.329
  149    HB   VAL  22           HB       VAL  22   6.652   3.512   3.209
  150   1HG1  VAL  22          1HG1      VAL  22   4.003   2.245   4.034
  151   2HG1  VAL  22          2HG1      VAL  22   4.228   3.567   2.877
  152   3HG1  VAL  22          3HG1      VAL  22   4.814   1.968   2.477
  153   1HG2  VAL  22          1HG2      VAL  22   6.670   4.290   5.488
  154   2HG2  VAL  22          2HG2      VAL  22   5.140   4.786   4.715
  155   3HG2  VAL  22          3HG2      VAL  22   5.154   3.405   5.835
  156    H    LEU  23           H        LEU  23   5.517  -0.130   3.155
  157    HA   LEU  23           HA       LEU  23   3.727  -0.854   5.248
  158   1HB   LEU  23          2HB       LEU  23   4.512  -2.157   2.631
  159   2HB   LEU  23          3HB       LEU  23   3.588  -3.033   3.839
  160    HG   LEU  23           HG       LEU  23   2.071  -2.266   2.302
  161   1HD1  LEU  23          1HD1      LEU  23   0.450  -1.178   3.675
  162   2HD1  LEU  23          2HD1      LEU  23   1.424  -2.190   4.745
  163   3HD1  LEU  23          3HD1      LEU  23   1.669  -0.430   4.704
  164   1HD2  LEU  23          1HD2      LEU  23   3.013   0.537   2.830
  165   2HD2  LEU  23          2HD2      LEU  23   3.297  -0.447   1.369
  166   3HD2  LEU  23          3HD2      LEU  23   1.649   0.066   1.787
  167    H    ASN  24           H        ASN  24   6.753  -2.428   4.104
  168    HA   ASN  24           HA       ASN  24   6.893  -4.570   5.902
  169   1HB   ASN  24          2HB       ASN  24   8.470  -4.466   4.144
  170   2HB   ASN  24          3HB       ASN  24   8.910  -2.806   4.511
  171   1HD2  ASN  24          1HD2      ASN  24  10.175  -2.293   6.285
  172   2HD2  ASN  24          2HD2      ASN  24  11.290  -3.486   6.979
  173    H    LYS  25           H        LYS  25   7.910  -1.187   6.358
  174    HA   LYS  25           HA       LYS  25   9.082  -1.423   8.917
  175   1HB   LYS  25          2HB       LYS  25   7.787   0.817   7.327
  176   2HB   LYS  25          3HB       LYS  25   8.183   1.096   9.010
  177   1HG   LYS  25          2HG       LYS  25  10.226   0.060   6.997
  178   2HG   LYS  25          3HG       LYS  25   9.924   1.781   7.268
  179   1HD   LYS  25          2HD       LYS  25  10.484   1.532   9.669
  180   2HD   LYS  25          3HD       LYS  25  10.828  -0.189   9.424
  181   1HE   LYS  25          2HE       LYS  25  12.614   0.403   7.781
  182   2HE   LYS  25          3HE       LYS  25  12.296   2.123   8.066
  183   1HZ   LYS  25          1HZ       LYS  25  13.237   0.197  10.092
  184   2HZ   LYS  25          2HZ       LYS  25  14.151   1.339   9.348
  185   3HZ   LYS  25          3HZ       LYS  25  12.941   1.793  10.361
  186    H    LEU  26           H        LEU  26   5.688  -1.056   7.972
  187    HA   LEU  26           HA       LEU  26   4.662  -0.453  10.517
  188   1HB   LEU  26          2HB       LEU  26   3.511  -0.505   8.233
  189   2HB   LEU  26          3HB       LEU  26   3.266  -2.219   8.440
  190    HG   LEU  26           HG       LEU  26   1.399  -0.541   8.980
  191   1HD1  LEU  26          1HD1      LEU  26   0.391  -2.016  10.596
  192   2HD1  LEU  26          2HD1      LEU  26   1.275  -2.975   9.395
  193   3HD1  LEU  26          3HD1      LEU  26   1.965  -2.719  11.014
  194   1HD2  LEU  26          1HD2      LEU  26   2.797   0.857  10.598
  195   2HD2  LEU  26          2HD2      LEU  26   1.223   0.337  11.206
  196   3HD2  LEU  26          3HD2      LEU  26   2.687  -0.495  11.742
  197    H    GLY  27           H        GLY  27   5.417  -3.592   8.994
  198   1HA   GLY  27          2HA       GLY  27   6.320  -4.863  11.177
  199   2HA   GLY  27          3HA       GLY  27   4.569  -4.985  11.442
  200    H    GLY  28           H        GLY  28   3.283  -6.412  10.192
  201   1HA   GLY  28          2HA       GLY  28   4.833  -8.540   8.736
  202   2HA   GLY  28          3HA       GLY  28   3.720  -8.857  10.079
  203    H    VAL  29           H        VAL  29   3.744  -6.822   7.168
  204    HA   VAL  29           HA       VAL  29   0.895  -7.489   6.658
  205    HB   VAL  29           HB       VAL  29   1.148  -5.226   7.197
  206   1HG1  VAL  29          1HG1      VAL  29   3.489  -4.810   7.012
  207   2HG1  VAL  29          2HG1      VAL  29   3.469  -5.038   5.257
  208   3HG1  VAL  29          3HG1      VAL  29   2.620  -3.667   5.997
  209   1HG2  VAL  29          1HG2      VAL  29   0.309  -4.135   5.237
  210   2HG2  VAL  29          2HG2      VAL  29   0.988  -5.379   4.174
  211   3HG2  VAL  29          3HG2      VAL  29  -0.322  -5.784   5.309
  212    H    LYS  30           H        LYS  30   0.563  -8.938   4.997
  213    HA   LYS  30           HA       LYS  30   2.529  -9.042   2.813
  214   1HB   LYS  30          2HB       LYS  30   1.036 -11.010   3.815
  215   2HB   LYS  30          3HB       LYS  30  -0.021 -10.514   2.485
  216   1HG   LYS  30          2HG       LYS  30   2.935 -11.243   2.322
  217   2HG   LYS  30          3HG       LYS  30   1.604 -12.281   1.818
  218   1HD   LYS  30          2HD       LYS  30   1.159 -11.055  -0.133
  219   2HD   LYS  30          3HD       LYS  30   1.835  -9.564   0.482
  220   1HE   LYS  30          2HE       LYS  30   4.116 -10.462   0.409
  221   2HE   LYS  30          3HE       LYS  30   3.480 -11.941  -0.364
  222   1HZ   LYS  30          1HZ       LYS  30   3.229  -9.173  -1.402
  223   2HZ   LYS  30          2HZ       LYS  30   4.185 -10.341  -2.066
  224   3HZ   LYS  30          3HZ       LYS  30   2.555 -10.456  -2.092
  225    H    TYR  31           H        TYR  31   2.528  -7.294   1.740
  226    HA   TYR  31           HA       TYR  31   0.101  -6.224   0.378
  227   1HB   TYR  31          2HB       TYR  31   1.532  -4.268  -0.143
  228   2HB   TYR  31          3HB       TYR  31   1.259  -4.493   1.581
  229    HD1  TYR  31           HD1      TYR  31   3.039  -5.196   3.071
  230    HD2  TYR  31           HD2      TYR  31   3.778  -4.735  -1.117
  231    HE1  TYR  31           HE1      TYR  31   5.486  -5.323   3.509
  232    HE2  TYR  31           HE2      TYR  31   6.230  -4.863  -0.704
  233    HH   TYR  31           HH       TYR  31   7.874  -4.691   0.971
  234    H    ASP  32           H        ASP  32   0.202  -5.934  -1.898
  235    HA   ASP  32           HA       ASP  32   2.538  -6.942  -3.360
  236   1HB   ASP  32          2HB       ASP  32  -0.261  -8.067  -3.397
  237   2HB   ASP  32          3HB       ASP  32   0.573  -7.903  -4.941
  238    H    ILE  33           H        ILE  33   2.722  -5.981  -5.385
  239    HA   ILE  33           HA       ILE  33   1.304  -3.357  -5.622
  240    HB   ILE  33           HB       ILE  33   4.237  -3.918  -6.167
  241   1HG1  ILE  33          2HG1      ILE  33   4.262  -2.184  -4.079
  242   2HG1  ILE  33          3HG1      ILE  33   2.863  -3.140  -3.609
  243   1HG2  ILE  33          1HG2      ILE  33   2.662  -1.327  -5.958
  244   2HG2  ILE  33          2HG2      ILE  33   4.406  -1.482  -6.259
  245   3HG2  ILE  33          3HG2      ILE  33   3.253  -2.067  -7.462
  246   1HD1  ILE  33          1HD1      ILE  33   5.569  -4.340  -4.365
  247   2HD1  ILE  33          2HD1      ILE  33   5.109  -3.906  -2.720
  248   3HD1  ILE  33          3HD1      ILE  33   4.213  -5.181  -3.569
  249    H    ASP  34           H        ASP  34   0.347  -3.163  -7.618
  250    HA   ASP  34           HA       ASP  34   1.497  -4.675  -9.928
  251   1HB   ASP  34          2HB       ASP  34  -0.909  -5.104  -9.552
  252   2HB   ASP  34          3HB       ASP  34  -1.220  -3.366  -9.755
  253    H    LEU  35           H        LEU  35   2.841  -3.480 -11.034
  254    HA   LEU  35           HA       LEU  35   3.100  -0.655 -10.576
  255   1HB   LEU  35          2HB       LEU  35   4.901  -2.533 -11.056
  256   2HB   LEU  35          3HB       LEU  35   4.621  -2.114 -12.736
  257    HG   LEU  35           HG       LEU  35   6.509  -0.943 -12.034
  258   1HD1  LEU  35          1HD1      LEU  35   5.988   1.389 -12.338
  259   2HD1  LEU  35          2HD1      LEU  35   4.933   0.419 -13.384
  260   3HD1  LEU  35          3HD1      LEU  35   4.297   1.136 -11.885
  261   1HD2  LEU  35          1HD2      LEU  35   5.017   0.080  -9.588
  262   2HD2  LEU  35          2HD2      LEU  35   6.284  -1.156  -9.621
  263   3HD2  LEU  35          3HD2      LEU  35   6.667   0.512 -10.069
  264    HA   PRO  36           HA       PRO  36   1.937  -0.195 -15.204
  265   1HB   PRO  36          2HB       PRO  36   0.317  -2.085 -16.429
  266   2HB   PRO  36          3HB       PRO  36   2.101  -2.032 -16.525
  267   1HG   PRO  36          2HG       PRO  36   0.397  -3.674 -14.642
  268   2HG   PRO  36          3HG       PRO  36   1.785  -4.220 -15.622
  269   1HD   PRO  36          2HD       PRO  36   2.097  -3.637 -13.047
  270   2HD   PRO  36          3HD       PRO  36   3.326  -3.096 -14.223
  271    H    ASN  37           H        ASN  37  -0.456  -1.842 -13.056
  272    HA   ASN  37           HA       ASN  37  -2.595  -0.027 -13.968
  273   1HB   ASN  37          2HB       ASN  37  -2.581  -2.143 -11.789
  274   2HB   ASN  37          3HB       ASN  37  -3.966  -1.194 -12.314
  275   1HD2  ASN  37          1HD2      ASN  37  -1.622  -3.641 -13.402
  276   2HD2  ASN  37          2HD2      ASN  37  -2.639  -4.276 -14.698
  277    H    LYS  38           H        LYS  38   0.009   0.280 -11.756
  278    HA   LYS  38           HA       LYS  38   0.440   1.555 -10.010
  279   1HB   LYS  38          2HB       LYS  38  -1.713   3.437 -11.082
  280   2HB   LYS  38          3HB       LYS  38  -0.523   3.774  -9.847
  281   1HG   LYS  38          2HG       LYS  38   0.304   4.814 -11.744
  282   2HG   LYS  38          3HG       LYS  38   1.333   3.423 -11.413
  283   1HD   LYS  38          2HD       LYS  38   0.988   3.730 -13.792
  284   2HD   LYS  38          3HD       LYS  38   0.364   2.181 -13.250
  285   1HE   LYS  38          2HE       LYS  38  -1.967   3.138 -13.250
  286   2HE   LYS  38          3HE       LYS  38  -1.313   4.689 -13.798
  287   1HZ   LYS  38          1HZ       LYS  38  -1.096   2.123 -15.235
  288   2HZ   LYS  38          2HZ       LYS  38  -2.206   3.291 -15.575
  289   3HZ   LYS  38          3HZ       LYS  38  -0.597   3.580 -15.805
  290    H    LYS  39           H        LYS  39  -0.765  -0.530  -9.163
  291    HA   LYS  39           HA       LYS  39  -2.937   0.351  -7.297
  292   1HB   LYS  39          2HB       LYS  39  -3.545  -1.147  -9.417
  293   2HB   LYS  39          3HB       LYS  39  -2.769  -2.421  -8.478
  294   1HG   LYS  39          2HG       LYS  39  -4.940  -2.701  -7.839
  295   2HG   LYS  39          3HG       LYS  39  -4.383  -1.635  -6.542
  296   1HD   LYS  39          2HD       LYS  39  -5.234   0.340  -7.865
  297   2HD   LYS  39          3HD       LYS  39  -5.856  -0.762  -9.091
  298   1HE   LYS  39          2HE       LYS  39  -6.725  -0.606  -6.162
  299   2HE   LYS  39          3HE       LYS  39  -7.632  -0.019  -7.573
  300   1HZ   LYS  39          1HZ       LYS  39  -8.472  -2.121  -6.885
  301   2HZ   LYS  39          2HZ       LYS  39  -7.702  -2.374  -8.321
  302   3HZ   LYS  39          3HZ       LYS  39  -7.031  -2.823  -6.882
  303    H    VAL  40           H        VAL  40  -2.801  -0.552  -5.160
  304    HA   VAL  40           HA       VAL  40  -0.792  -2.665  -4.712
  305    HB   VAL  40           HB       VAL  40  -1.440  -0.079  -3.284
  306   1HG1  VAL  40          1HG1      VAL  40  -2.110  -1.609  -1.636
  307   2HG1  VAL  40          2HG1      VAL  40  -0.646  -2.616  -1.842
  308   3HG1  VAL  40          3HG1      VAL  40  -0.525  -0.965  -1.173
  309   1HG2  VAL  40          1HG2      VAL  40   0.604  -0.503  -4.692
  310   2HG2  VAL  40          2HG2      VAL  40   0.937   0.008  -3.019
  311   3HG2  VAL  40          3HG2      VAL  40   1.116  -1.701  -3.485
  312    H    CYS  41           H        CYS  41  -1.573  -4.371  -3.606
  313    HA   CYS  41           HA       CYS  41  -4.334  -4.230  -2.538
  314   1HB   CYS  41          2HB       CYS  41  -4.800  -6.476  -3.199
  315   2HB   CYS  41          3HB       CYS  41  -4.415  -5.569  -4.668
  316    HG   CYS  41           HG       CYS  41  -3.523  -7.962  -4.871
  317    H    ILE  42           H        ILE  42  -4.483  -5.218  -0.492
  318    HA   ILE  42           HA       ILE  42  -2.015  -6.521   0.553
  319    HB   ILE  42           HB       ILE  42  -3.533  -4.400   2.085
  320   1HG1  ILE  42          2HG1      ILE  42  -0.948  -4.094   0.482
  321   2HG1  ILE  42          3HG1      ILE  42  -2.467  -3.245   0.202
  322   1HG2  ILE  42          1HG2      ILE  42  -0.789  -5.598   2.571
  323   2HG2  ILE  42          2HG2      ILE  42  -1.700  -4.539   3.650
  324   3HG2  ILE  42          3HG2      ILE  42  -2.271  -6.169   3.368
  325   1HD1  ILE  42          1HD1      ILE  42  -0.976  -1.729   1.285
  326   2HD1  ILE  42          2HD1      ILE  42  -2.226  -2.171   2.465
  327   3HD1  ILE  42          3HD1      ILE  42  -0.602  -2.897   2.561
  328    H    GLU  43           H        GLU  43  -2.390  -8.264   1.692
  329    HA   GLU  43           HA       GLU  43  -5.146  -8.823   2.715
  330   1HB   GLU  43          2HB       GLU  43  -4.717  -9.867   0.429
  331   2HB   GLU  43          3HB       GLU  43  -3.456 -10.848   1.186
  332   1HG   GLU  43          2HG       GLU  43  -5.165 -11.784   2.736
  333   2HG   GLU  43          3HG       GLU  43  -6.413 -10.784   1.978
  334    H    SER  44           H        SER  44  -4.422  -8.308   4.820
  335    HA   SER  44           HA       SER  44  -2.822 -10.300   6.138
  336   1HB   SER  44          2HB       SER  44  -1.467  -8.031   5.090
  337   2HB   SER  44          3HB       SER  44  -1.669  -7.683   6.809
  338    HG   SER  44           HG       SER  44  -0.436  -9.455   7.284
  339    H    GLU  45           H        GLU  45  -2.932  -9.909   8.485
  340    HA   GLU  45           HA       GLU  45  -5.557  -9.046   9.218
  341   1HB   GLU  45          2HB       GLU  45  -5.097  -9.992  11.361
  342   2HB   GLU  45          3HB       GLU  45  -4.658 -11.083  10.037
  343   1HG   GLU  45          2HG       GLU  45  -2.282 -10.142  10.251
  344   2HG   GLU  45          3HG       GLU  45  -2.854  -9.370  11.733
  345    H    HIS  46           H        HIS  46  -2.811  -7.153   8.908
  346    HA   HIS  46           HA       HIS  46  -3.090  -5.474  11.259
  347   1HB   HIS  46          2HB       HIS  46  -1.843  -5.050   8.529
  348   2HB   HIS  46          3HB       HIS  46  -1.931  -3.766   9.737
  349    HD1  HIS  46           1HD      HIS  46  -0.502  -4.156  12.051
  350    HD2  HIS  46           2HD      HIS  46   0.200  -6.686   8.777
  351    HE1  HIS  46           1HE      HIS  46   1.820  -5.154  12.387
  352    H    SER  47           H        SER  47  -4.483  -3.793  11.609
  353    HA   SER  47           HA       SER  47  -6.907  -3.728  10.192
  354   1HB   SER  47          2HB       SER  47  -6.652  -3.008  12.545
  355   2HB   SER  47          3HB       SER  47  -5.783  -1.560  11.996
  356    HG   SER  47           HG       SER  47  -7.999  -1.132  12.287
  357    H    MET  48           H        MET  48  -7.830  -2.348   8.811
  358    HA   MET  48           HA       MET  48  -6.444  -1.371   6.584
  359   1HB   MET  48          2HB       MET  48  -9.106  -0.257   7.589
  360   2HB   MET  48          3HB       MET  48  -8.509  -0.338   5.929
  361   1HG   MET  48          2HG       MET  48  -8.614  -2.874   6.138
  362   2HG   MET  48          3HG       MET  48  -9.405  -2.642   7.703
  363   1HE   MET  48          1HE       MET  48 -12.506  -3.808   5.820
  364   2HE   MET  48          2HE       MET  48 -10.861  -4.480   5.815
  365   3HE   MET  48          3HE       MET  48 -11.576  -3.891   7.332
  366    H    ASP  49           H        ASP  49  -7.773   0.325   9.368
  367    HA   ASP  49           HA       ASP  49  -7.019   2.997   9.097
  368   1HB   ASP  49          2HB       ASP  49  -8.282   2.521  11.004
  369   2HB   ASP  49          3HB       ASP  49  -7.373   1.055  11.386
  370    H    THR  50           H        THR  50  -5.252   0.614  10.886
  371    HA   THR  50           HA       THR  50  -3.037   2.100  11.440
  372    HB   THR  50           HB       THR  50  -3.198  -0.930  11.177
  373    HG1  THR  50           1HG      THR  50  -4.524   0.878  12.791
  374   1HG2  THR  50          1HG2      THR  50  -0.927  -0.203  11.687
  375   2HG2  THR  50          2HG2      THR  50  -1.519   0.827  13.014
  376   3HG2  THR  50          3HG2      THR  50  -1.666  -0.943  13.115
  377    H    LEU  51           H        LEU  51  -3.473  -0.175   8.692
  378    HA   LEU  51           HA       LEU  51  -0.861   0.305   7.548
  379   1HB   LEU  51          2HB       LEU  51  -3.463  -0.388   6.121
  380   2HB   LEU  51          3HB       LEU  51  -1.828  -0.406   5.427
  381    HG   LEU  51           HG       LEU  51  -2.883  -2.177   7.710
  382   1HD1  LEU  51          1HD1      LEU  51  -2.135  -2.750   4.834
  383   2HD1  LEU  51          2HD1      LEU  51  -2.594  -3.985   6.035
  384   3HD1  LEU  51          3HD1      LEU  51  -3.775  -2.769   5.515
  385   1HD2  LEU  51          1HD2      LEU  51  -0.674  -3.394   7.365
  386   2HD2  LEU  51          2HD2      LEU  51  -0.123  -1.976   6.453
  387   3HD2  LEU  51          3HD2      LEU  51  -0.562  -1.829   8.168
  388    H    LEU  52           H        LEU  52  -4.056   1.713   6.626
  389    HA   LEU  52           HA       LEU  52  -3.213   3.506   4.727
  390   1HB   LEU  52          2HB       LEU  52  -5.495   3.351   6.602
  391   2HB   LEU  52          3HB       LEU  52  -5.183   4.977   6.014
  392    HG   LEU  52           HG       LEU  52  -5.455   2.579   4.195
  393   1HD1  LEU  52          1HD1      LEU  52  -7.627   4.454   5.189
  394   2HD1  LEU  52          2HD1      LEU  52  -7.815   3.292   3.860
  395   3HD1  LEU  52          3HD1      LEU  52  -7.488   2.707   5.492
  396   1HD2  LEU  52          1HD2      LEU  52  -4.391   4.673   3.240
  397   2HD2  LEU  52          2HD2      LEU  52  -5.945   4.330   2.491
  398   3HD2  LEU  52          3HD2      LEU  52  -5.827   5.587   3.731
  399    H    ALA  53           H        ALA  53  -3.587   4.305   8.193
  400    HA   ALA  53           HA       ALA  53  -2.589   6.915   8.077
  401   1HB   ALA  53          1HB       ALA  53  -3.824   5.957  10.005
  402   2HB   ALA  53          2HB       ALA  53  -2.442   4.903  10.373
  403   3HB   ALA  53          3HB       ALA  53  -2.283   6.667  10.531
  404    H    THR  54           H        THR  54  -0.801   3.856   8.406
  405    HA   THR  54           HA       THR  54   1.739   5.138   8.910
  406    HB   THR  54           HB       THR  54   1.060   2.340   7.893
  407    HG1  THR  54           1HG      THR  54   0.366   2.596   9.930
  408   1HG2  THR  54          1HG2      THR  54   3.700   3.535   8.807
  409   2HG2  THR  54          2HG2      THR  54   3.374   1.806   8.581
  410   3HG2  THR  54          3HG2      THR  54   3.307   2.886   7.192
  411    H    LEU  55           H        LEU  55   0.328   3.581   5.983
  412    HA   LEU  55           HA       LEU  55   2.547   4.253   4.352
  413   1HB   LEU  55          2HB       LEU  55   1.295   3.485   2.503
  414   2HB   LEU  55          3HB       LEU  55   1.361   2.404   3.860
  415    HG   LEU  55           HG       LEU  55  -1.000   3.140   4.433
  416   1HD1  LEU  55          1HD1      LEU  55  -0.540   4.292   1.735
  417   2HD1  LEU  55          2HD1      LEU  55  -2.199   3.935   2.307
  418   3HD1  LEU  55          3HD1      LEU  55  -1.186   5.122   3.152
  419   1HD2  LEU  55          1HD2      LEU  55  -1.893   1.552   2.741
  420   2HD2  LEU  55          2HD2      LEU  55  -0.364   1.696   1.836
  421   3HD2  LEU  55          3HD2      LEU  55  -0.374   0.983   3.466
  422    H    LYS  56           H        LYS  56  -0.339   6.005   5.011
  423    HA   LYS  56           HA       LYS  56  -0.405   8.075   3.335
  424   1HB   LYS  56          2HB       LYS  56  -1.548   7.663   5.711
  425   2HB   LYS  56          3HB       LYS  56  -0.263   8.703   6.317
  426   1HG   LYS  56          2HG       LYS  56  -1.070  10.439   4.635
  427   2HG   LYS  56          3HG       LYS  56  -2.366   9.283   4.219
  428   1HD   LYS  56          2HD       LYS  56  -3.131   9.278   6.578
  429   2HD   LYS  56          3HD       LYS  56  -1.863  10.449   6.996
  430   1HE   LYS  56          2HE       LYS  56  -2.873  12.107   5.432
  431   2HE   LYS  56          3HE       LYS  56  -4.118  10.931   4.977
  432   1HZ   LYS  56          1HZ       LYS  56  -3.749  12.062   7.674
  433   2HZ   LYS  56          2HZ       LYS  56  -4.922  12.481   6.602
  434   3HZ   LYS  56          3HZ       LYS  56  -4.904  10.970   7.244
  435    H    LYS  57           H        LYS  57   2.119   7.559   5.798
  436    HA   LYS  57           HA       LYS  57   3.258  10.166   5.717
  437   1HB   LYS  57          2HB       LYS  57   4.445   7.507   6.567
  438   2HB   LYS  57          3HB       LYS  57   5.161   9.100   6.894
  439   1HG   LYS  57          2HG       LYS  57   3.013   9.739   8.068
  440   2HG   LYS  57          3HG       LYS  57   2.457   8.073   7.862
  441   1HD   LYS  57          2HD       LYS  57   4.898   8.979   9.448
  442   2HD   LYS  57          3HD       LYS  57   3.334   8.447  10.093
  443   1HE   LYS  57          2HE       LYS  57   3.746   6.221   8.830
  444   2HE   LYS  57          3HE       LYS  57   5.412   6.769   8.608
  445   1HZ   LYS  57          1HZ       LYS  57   4.045   6.364  11.191
  446   2HZ   LYS  57          2HZ       LYS  57   5.177   5.377  10.532
  447   3HZ   LYS  57          3HZ       LYS  57   5.597   6.892  11.016
  448    H    THR  58           H        THR  58   3.475   7.657   3.316
  449    HA   THR  58           HA       THR  58   6.043   8.438   2.223
  450    HB   THR  58           HB       THR  58   5.266   7.420   0.165
  451    HG1  THR  58           1HG      THR  58   2.768   6.986   1.446
  452   1HG2  THR  58          1HG2      THR  58   4.804   5.149   0.987
  453   2HG2  THR  58          2HG2      THR  58   6.113   5.945   1.892
  454   3HG2  THR  58          3HG2      THR  58   4.500   5.807   2.612
  455    H    GLY  59           H        GLY  59   2.842   9.902   2.228
  456   1HA   GLY  59          2HA       GLY  59   2.060  11.817   1.322
  457   2HA   GLY  59          3HA       GLY  59   3.720  12.277   0.892
  458    H    LYS  60           H        LYS  60   2.386   9.205  -0.251
  459    HA   LYS  60           HA       LYS  60   2.145  10.280  -3.028
  460   1HB   LYS  60          2HB       LYS  60   1.992   7.431  -1.942
  461   2HB   LYS  60          3HB       LYS  60   1.923   7.877  -3.638
  462   1HG   LYS  60          2HG       LYS  60   4.260   8.103  -1.714
  463   2HG   LYS  60          3HG       LYS  60   4.139   7.063  -3.133
  464   1HD   LYS  60          2HD       LYS  60   4.413  10.087  -3.032
  465   2HD   LYS  60          3HD       LYS  60   5.641   8.930  -3.551
  466   1HE   LYS  60          2HE       LYS  60   4.233   8.245  -5.506
  467   2HE   LYS  60          3HE       LYS  60   2.953   9.327  -4.966
  468   1HZ   LYS  60          1HZ       LYS  60   4.615  11.159  -5.253
  469   2HZ   LYS  60          2HZ       LYS  60   5.447  10.097  -6.240
  470   3HZ   LYS  60          3HZ       LYS  60   3.881  10.473  -6.536
  471    H    THR  61           H        THR  61   0.127   9.938  -4.235
  472    HA   THR  61           HA       THR  61  -2.297  10.027  -2.777
  473    HB   THR  61           HB       THR  61  -1.930   9.232  -5.658
  474    HG1  THR  61           1HG      THR  61  -1.462  11.831  -4.618
  475   1HG2  THR  61          1HG2      THR  61  -3.747  11.259  -4.285
  476   2HG2  THR  61          2HG2      THR  61  -3.780  10.828  -6.012
  477   3HG2  THR  61          3HG2      THR  61  -4.227   9.619  -4.787
  478    H    VAL  62           H        VAL  62  -1.219   7.908  -1.657
  479    HA   VAL  62           HA       VAL  62  -2.115   5.393  -2.953
  480    HB   VAL  62           HB       VAL  62  -0.008   5.187  -2.043
  481   1HG1  VAL  62          1HG1      VAL  62   0.609   5.548   0.297
  482   2HG1  VAL  62          2HG1      VAL  62   0.173   7.042  -0.496
  483   3HG1  VAL  62          3HG1      VAL  62  -0.977   6.293   0.619
  484   1HG2  VAL  62          1HG2      VAL  62  -0.300   3.346  -0.496
  485   2HG2  VAL  62          2HG2      VAL  62  -1.948   3.879  -0.099
  486   3HG2  VAL  62          3HG2      VAL  62  -1.574   3.302  -1.722
  487    H    SER  63           H        SER  63  -4.269   5.708  -3.069
  488    HA   SER  63           HA       SER  63  -5.809   6.390  -0.591
  489   1HB   SER  63          2HB       SER  63  -6.679   6.346  -3.512
  490   2HB   SER  63          3HB       SER  63  -7.608   6.966  -2.133
  491    HG   SER  63           HG       SER  63  -5.704   8.410  -1.829
  492    H    TYR  64           H        TYR  64  -7.648   5.060  -0.052
  493    HA   TYR  64           HA       TYR  64  -7.324   2.195  -0.701
  494   1HB   TYR  64          2HB       TYR  64  -7.435   2.996   1.607
  495   2HB   TYR  64          3HB       TYR  64  -9.041   3.674   1.335
  496    HD1  TYR  64           HD1      TYR  64  -7.338   1.001   2.778
  497    HD2  TYR  64           HD2      TYR  64 -10.887   1.888   0.494
  498    HE1  TYR  64           HE1      TYR  64  -8.334  -1.157   3.446
  499    HE2  TYR  64           HE2      TYR  64 -11.738  -0.392   0.946
  500    HH   TYR  64           HH       TYR  64 -10.680  -2.600   1.325
  501    H    LEU  65           H        LEU  65  -8.722   1.177  -2.119
  502    HA   LEU  65           HA       LEU  65 -11.513   1.963  -2.241
  503   1HB   LEU  65          2HB       LEU  65 -11.417   1.966  -4.803
  504   2HB   LEU  65          3HB       LEU  65 -11.133   3.422  -3.876
  505    HG   LEU  65           HG       LEU  65  -9.670   3.122  -5.798
  506   1HD1  LEU  65          1HD1      LEU  65  -7.881   4.214  -4.970
  507   2HD1  LEU  65          2HD1      LEU  65  -9.122   4.520  -3.753
  508   3HD1  LEU  65          3HD1      LEU  65  -7.888   3.269  -3.487
  509   1HD2  LEU  65          1HD2      LEU  65  -8.290   0.877  -4.355
  510   2HD2  LEU  65          2HD2      LEU  65  -9.248   0.776  -5.857
  511   3HD2  LEU  65          3HD2      LEU  65  -7.749   1.688  -5.834
  512    H    GLY  66           H        GLY  66 -11.452  -0.211  -1.186
  513   1HA   GLY  66          2HA       GLY  66 -13.079  -1.807  -2.385
  514   2HA   GLY  66          3HA       GLY  66 -11.643  -2.400  -3.223
  515    H    LEU  67           H        LEU  67 -13.454  -3.832  -1.314
  516    HA   LEU  67           HA       LEU  67 -11.491  -4.822   0.623
  517   1HB   LEU  67          2HB       LEU  67 -12.827  -3.436   2.019
  518   2HB   LEU  67          3HB       LEU  67 -14.256  -3.641   1.000
  519    HG   LEU  67           HG       LEU  67 -14.509  -5.934   1.702
  520   1HD1  LEU  67          1HD1      LEU  67 -12.272  -5.296   3.707
  521   2HD1  LEU  67          2HD1      LEU  67 -13.266  -6.768   3.718
  522   3HD1  LEU  67          3HD1      LEU  67 -12.148  -6.465   2.384
  523   1HD2  LEU  67          1HD2      LEU  67 -15.336  -5.426   3.987
  524   2HD2  LEU  67          2HD2      LEU  67 -14.399  -3.915   3.982
  525   3HD2  LEU  67          3HD2      LEU  67 -15.736  -4.140   2.835
  526    H    GLU  68           H        GLU  68 -11.495  -7.073   0.363
  527    HA   GLU  68           HA       GLU  68 -13.792  -8.434  -0.941
  528   1HB   GLU  68          2HB       GLU  68 -12.023  -8.073  -2.637
  529   2HB   GLU  68          3HB       GLU  68 -10.818  -8.674  -1.506
  530   1HG   GLU  68          2HG       GLU  68 -11.962 -10.922  -1.561
  531   2HG   GLU  68          3HG       GLU  68 -13.013 -10.291  -2.842
  Start of MODEL   12
    1   1H    MET   1           H1       MET   1  -8.305 -10.804   8.568
    2   2H    MET   1           H2       MET   1  -9.260  -9.810   9.431
    3   3H    MET   1           H3       MET   1  -9.873 -11.127   8.637
    4    HA   MET   1           HA       MET   1 -10.515  -9.264   7.384
    5   1HB   MET   1          2HB       MET   1  -7.568  -8.469   7.386
    6   2HB   MET   1          3HB       MET   1  -8.865  -7.666   6.498
    7   1HG   MET   1          2HG       MET   1  -8.467  -6.364   8.447
    8   2HG   MET   1          3HG       MET   1 -10.009  -7.192   8.677
    9   1HE   MET   1          1HE       MET   1  -8.879  -5.826  11.119
   10   2HE   MET   1          2HE       MET   1 -10.256  -6.957  11.207
   11   3HE   MET   1          3HE       MET   1  -8.902  -7.110  12.352
   12    HA   PRO   2           HA       PRO   2  -8.990 -11.736   3.852
   13   1HB   PRO   2          2HB       PRO   2 -10.660 -10.967   1.911
   14   2HB   PRO   2          3HB       PRO   2 -11.263 -11.826   3.332
   15   1HG   PRO   2          2HG       PRO   2 -11.320  -8.819   2.941
   16   2HG   PRO   2          3HG       PRO   2 -12.666  -9.891   3.392
   17   1HD   PRO   2          2HD       PRO   2 -11.095  -8.502   5.204
   18   2HD   PRO   2          3HD       PRO   2 -11.853 -10.080   5.588
   19    H    LYS   3           H        LYS   3  -9.706  -9.100   1.632
   20    HA   LYS   3           HA       LYS   3  -7.034  -7.918   2.112
   21   1HB   LYS   3          2HB       LYS   3  -6.607  -7.865  -0.295
   22   2HB   LYS   3          3HB       LYS   3  -6.610  -9.485   0.405
   23   1HG   LYS   3          2HG       LYS   3  -8.735 -10.009  -0.386
   24   2HG   LYS   3          3HG       LYS   3  -9.102  -8.332  -0.812
   25   1HD   LYS   3          2HD       LYS   3  -6.773  -9.779  -2.111
   26   2HD   LYS   3          3HD       LYS   3  -8.420 -10.031  -2.720
   27   1HE   LYS   3          2HE       LYS   3  -8.746  -7.714  -3.248
   28   2HE   LYS   3          3HE       LYS   3  -7.318  -7.206  -2.344
   29   1HZ   LYS   3          1HZ       LYS   3  -5.929  -8.190  -3.940
   30   2HZ   LYS   3          2HZ       LYS   3  -7.210  -8.822  -4.796
   31   3HZ   LYS   3          3HZ       LYS   3  -6.995  -7.188  -4.680
   32    H    HIS   4           H        HIS   4  -6.631  -5.929   1.040
   33    HA   HIS   4           HA       HIS   4  -9.021  -4.158   0.773
   34   1HB   HIS   4          2HB       HIS   4  -6.406  -3.738   2.292
   35   2HB   HIS   4          3HB       HIS   4  -7.604  -2.493   2.039
   36    HD1  HIS   4           1HD      HIS   4  -9.828  -5.185   2.703
   37    HD2  HIS   4           2HD      HIS   4  -6.834  -3.304   4.970
   38    HE1  HIS   4           1HE      HIS   4 -10.395  -5.606   5.161
   39    H    GLU   5           H        GLU   5  -8.931  -2.811  -1.020
   40    HA   GLU   5           HA       GLU   5  -6.561  -3.025  -2.812
   41   1HB   GLU   5          2HB       GLU   5  -9.482  -2.300  -3.066
   42   2HB   GLU   5          3HB       GLU   5  -8.370  -1.906  -4.361
   43   1HG   GLU   5          2HG       GLU   5  -8.626  -4.723  -3.164
   44   2HG   GLU   5          3HG       GLU   5  -9.646  -4.142  -4.472
   45    H    PHE   6           H        PHE   6  -5.440  -1.194  -3.549
   46    HA   PHE   6           HA       PHE   6  -6.346   1.463  -2.663
   47   1HB   PHE   6          2HB       PHE   6  -3.485   0.497  -2.292
   48   2HB   PHE   6          3HB       PHE   6  -4.139   2.053  -1.815
   49    HD1  PHE   6           1HD      PHE   6  -4.704   2.345   0.544
   50    HD2  PHE   6           2HD      PHE   6  -4.394  -1.635  -1.142
   51    HE1  PHE   6           1HE      PHE   6  -4.893   1.356   2.772
   52    HE2  PHE   6           2HE      PHE   6  -4.729  -2.593   1.098
   53    HZ   PHE   6           HZ       PHE   6  -4.999  -1.102   3.074
   54    H    SER   7           H        SER   7  -5.907   3.050  -4.119
   55    HA   SER   7           HA       SER   7  -4.519   2.371  -6.665
   56   1HB   SER   7          2HB       SER   7  -6.799   3.487  -6.708
   57   2HB   SER   7          3HB       SER   7  -6.058   4.899  -5.928
   58    HG   SER   7           HG       SER   7  -4.650   4.992  -7.782
   59    H    VAL   8           H        VAL   8  -2.441   3.242  -7.029
   60    HA   VAL   8           HA       VAL   8  -1.298   4.947  -4.879
   61    HB   VAL   8           HB       VAL   8  -0.127   2.405  -6.093
   62   1HG1  VAL   8          1HG1      VAL   8   1.540   2.704  -4.338
   63   2HG1  VAL   8          2HG1      VAL   8   1.413   4.258  -5.193
   64   3HG1  VAL   8          3HG1      VAL   8   0.625   4.057  -3.629
   65   1HG2  VAL   8          1HG2      VAL   8  -1.714   2.885  -3.536
   66   2HG2  VAL   8          2HG2      VAL   8  -1.897   1.596  -4.727
   67   3HG2  VAL   8          3HG2      VAL   8  -0.494   1.607  -3.642
   68    H    ASP   9           H        ASP   9  -0.647   6.803  -5.983
   69    HA   ASP   9           HA       ASP   9   0.374   6.592  -8.695
   70   1HB   ASP   9          2HB       ASP   9  -0.354   8.785  -8.011
   71   2HB   ASP   9          3HB       ASP   9   0.867   8.822  -6.713
   72    H    MET  10           H        MET  10   1.656   4.706  -8.423
   73    HA   MET  10           HA       MET  10   4.374   5.098  -7.343
   74   1HB   MET  10          2HB       MET  10   3.146   2.943  -9.092
   75   2HB   MET  10          3HB       MET  10   4.854   2.990  -8.590
   76   1HG   MET  10          2HG       MET  10   4.173   3.118  -6.213
   77   2HG   MET  10          3HG       MET  10   2.474   3.038  -6.690
   78   1HE   MET  10          1HE       MET  10   1.181   0.940  -7.342
   79   2HE   MET  10          2HE       MET  10   2.233   0.787  -8.770
   80   3HE   MET  10          3HE       MET  10   1.967  -0.610  -7.699
   81    H    THR  11           H        THR  11   4.963   7.052  -8.203
   82    HA   THR  11           HA       THR  11   4.399   7.901 -10.780
   83    HB   THR  11           HB       THR  11   6.711   9.041  -9.226
   84    HG1  THR  11           1HG      THR  11   4.098   9.294  -8.185
   85   1HG2  THR  11          1HG2      THR  11   5.501  11.149  -9.603
   86   2HG2  THR  11          2HG2      THR  11   5.724  10.273 -11.133
   87   3HG2  THR  11          3HG2      THR  11   4.141  10.266 -10.323
   88    H    CYS  12           H        CYS  12   7.269   6.351  -9.343
   89    HA   CYS  12           HA       CYS  12   8.196   5.460 -11.941
   90   1HB   CYS  12          2HB       CYS  12   9.418   7.582 -11.781
   91   2HB   CYS  12          3HB       CYS  12   9.968   7.201 -10.132
   92    HG   CYS  12           HG       CYS  12  11.524   5.345 -10.656
   93    H    GLY  13           H        GLY  13   9.766   3.641 -11.485
   94   1HA   GLY  13          2HA       GLY  13   8.868   1.710  -9.870
   95   2HA   GLY  13          3HA       GLY  13  10.588   1.865 -10.241
   96    H    GLY  14           H        GLY  14  11.457   3.978  -8.751
   97   1HA   GLY  14          2HA       GLY  14  11.704   2.776  -6.270
   98   2HA   GLY  14          3HA       GLY  14  12.214   4.448  -6.612
   99    H    CYS  15           H        CYS  15   9.133   4.925  -7.270
  100    HA   CYS  15           HA       CYS  15   8.294   5.751  -4.634
  101   1HB   CYS  15          2HB       CYS  15   7.413   6.882  -6.580
  102   2HB   CYS  15          3HB       CYS  15   6.637   5.373  -7.130
  103    HG   CYS  15           HG       CYS  15   4.848   6.977  -6.006
  104    H    ALA  16           H        ALA  16   7.750   2.903  -6.739
  105    HA   ALA  16           HA       ALA  16   5.849   1.564  -5.032
  106   1HB   ALA  16          1HB       ALA  16   6.221  -0.322  -6.436
  107   2HB   ALA  16          2HB       ALA  16   6.307   1.112  -7.487
  108   3HB   ALA  16          3HB       ALA  16   7.787   0.263  -6.991
  109    H    GLU  17           H        GLU  17   9.426   1.393  -5.430
  110    HA   GLU  17           HA       GLU  17   9.907  -0.472  -3.354
  111   1HB   GLU  17          2HB       GLU  17  11.545   2.018  -3.926
  112   2HB   GLU  17          3HB       GLU  17  11.985   0.591  -2.970
  113   1HG   GLU  17          2HG       GLU  17  12.160  -0.794  -4.898
  114   2HG   GLU  17          3HG       GLU  17  11.549   0.498  -5.949
  115    H    ALA  18           H        ALA  18   9.433   3.110  -3.151
  116    HA   ALA  18           HA       ALA  18   9.976   3.334  -0.365
  117   1HB   ALA  18          1HB       ALA  18   8.856   5.470  -0.457
  118   2HB   ALA  18          2HB       ALA  18   9.819   5.273  -1.939
  119   3HB   ALA  18          3HB       ALA  18   8.050   5.058  -1.973
  120    H    VAL  19           H        VAL  19   6.916   2.813  -2.137
  121    HA   VAL  19           HA       VAL  19   5.228   2.669   0.124
  122    HB   VAL  19           HB       VAL  19   5.010   1.453  -2.651
  123   1HG1  VAL  19          1HG1      VAL  19   3.574   0.091  -1.232
  124   2HG1  VAL  19          2HG1      VAL  19   2.917   1.548  -0.441
  125   3HG1  VAL  19          3HG1      VAL  19   2.579   1.227  -2.152
  126   1HG2  VAL  19          1HG2      VAL  19   3.570   3.807  -1.340
  127   2HG2  VAL  19          2HG2      VAL  19   4.971   3.988  -2.406
  128   3HG2  VAL  19          3HG2      VAL  19   3.472   3.305  -3.038
  129    H    SER  20           H        SER  20   7.043   0.041  -1.596
  130    HA   SER  20           HA       SER  20   6.284  -2.055   0.158
  131   1HB   SER  20          2HB       SER  20   7.578  -2.426  -1.928
  132   2HB   SER  20          3HB       SER  20   8.996  -1.679  -1.179
  133    HG   SER  20           HG       SER  20   7.696  -4.078  -0.401
  134    H    ARG  21           H        ARG  21   9.176   0.148   0.463
  135    HA   ARG  21           HA       ARG  21  10.080  -0.861   2.884
  136   1HB   ARG  21          2HB       ARG  21  10.287   1.915   1.664
  137   2HB   ARG  21          3HB       ARG  21  11.096   1.444   3.168
  138   1HG   ARG  21          2HG       ARG  21  12.199  -0.435   2.027
  139   2HG   ARG  21          3HG       ARG  21  11.480   0.015   0.481
  140   1HD   ARG  21          2HD       ARG  21  13.125   1.997   2.075
  141   2HD   ARG  21          3HD       ARG  21  13.938   0.753   1.147
  142    HE   ARG  21           HE       ARG  21  12.399   3.068   0.130
  143   1HH1  ARG  21          2HH2      ARG  21  14.092   0.030  -0.816
  144   2HH1  ARG  21          1HH2      ARG  21  14.299   0.638  -2.466
  145   1HH2  ARG  21          2HH1      ARG  21  12.904   3.732  -2.117
  146   2HH2  ARG  21          1HH1      ARG  21  13.691   2.502  -3.113
  147    H    VAL  22           H        VAL  22   7.752   1.977   2.551
  148    HA   VAL  22           HA       VAL  22   7.484   2.276   5.295
  149    HB   VAL  22           HB       VAL  22   6.707   3.771   3.304
  150   1HG1  VAL  22          1HG1      VAL  22   5.013   2.217   2.392
  151   2HG1  VAL  22          2HG1      VAL  22   4.110   2.298   3.920
  152   3HG1  VAL  22          3HG1      VAL  22   4.286   3.724   2.888
  153   1HG2  VAL  22          1HG2      VAL  22   5.126   4.913   4.799
  154   2HG2  VAL  22          2HG2      VAL  22   5.108   3.483   5.858
  155   3HG2  VAL  22          3HG2      VAL  22   6.623   4.404   5.622
  156    H    LEU  23           H        LEU  23   5.562   0.110   3.062
  157    HA   LEU  23           HA       LEU  23   3.863  -0.794   5.173
  158   1HB   LEU  23          2HB       LEU  23   4.621  -1.796   2.405
  159   2HB   LEU  23          3HB       LEU  23   3.835  -2.874   3.515
  160    HG   LEU  23           HG       LEU  23   2.135  -2.122   2.271
  161   1HD1  LEU  23          1HD1      LEU  23   1.671  -2.008   4.769
  162   2HD1  LEU  23          2HD1      LEU  23   1.851  -0.238   4.644
  163   3HD1  LEU  23          3HD1      LEU  23   0.587  -1.057   3.739
  164   1HD2  LEU  23          1HD2      LEU  23   1.586   0.226   1.795
  165   2HD2  LEU  23          2HD2      LEU  23   3.111   0.701   2.585
  166   3HD2  LEU  23          3HD2      LEU  23   3.133  -0.334   1.136
  167    H    ASN  24           H        ASN  24   6.988  -2.241   3.974
  168    HA   ASN  24           HA       ASN  24   6.995  -4.422   5.732
  169   1HB   ASN  24          2HB       ASN  24   9.252  -2.684   4.660
  170   2HB   ASN  24          3HB       ASN  24   9.476  -4.145   5.601
  171   1HD2  ASN  24          1HD2      ASN  24   8.842  -2.925   2.481
  172   2HD2  ASN  24          2HD2      ASN  24   8.752  -4.445   1.627
  173    H    LYS  25           H        LYS  25   8.034  -1.042   6.228
  174    HA   LYS  25           HA       LYS  25   9.017  -1.253   8.868
  175   1HB   LYS  25          2HB       LYS  25   8.112   0.943   7.056
  176   2HB   LYS  25          3HB       LYS  25   7.846   1.261   8.760
  177   1HG   LYS  25          2HG       LYS  25  10.012   2.109   8.172
  178   2HG   LYS  25          3HG       LYS  25  10.180   0.746   9.286
  179   1HD   LYS  25          2HD       LYS  25  10.621  -0.728   7.189
  180   2HD   LYS  25          3HD       LYS  25  10.579   0.760   6.253
  181   1HE   LYS  25          2HE       LYS  25  12.884   0.196   6.661
  182   2HE   LYS  25          3HE       LYS  25  12.499   1.660   7.576
  183   1HZ   LYS  25          1HZ       LYS  25  12.301   0.288   9.547
  184   2HZ   LYS  25          2HZ       LYS  25  12.612  -1.078   8.684
  185   3HZ   LYS  25          3HZ       LYS  25  13.774   0.072   8.855
  186    H    LEU  26           H        LEU  26   5.658  -1.183   7.763
  187    HA   LEU  26           HA       LEU  26   4.461  -0.549  10.238
  188   1HB   LEU  26          2HB       LEU  26   3.433  -0.871   7.915
  189   2HB   LEU  26          3HB       LEU  26   3.391  -2.580   8.197
  190    HG   LEU  26           HG       LEU  26   1.372  -0.943   8.606
  191   1HD1  LEU  26          1HD1      LEU  26   1.811  -3.363  10.350
  192   2HD1  LEU  26          2HD1      LEU  26   0.258  -2.568   9.972
  193   3HD1  LEU  26          3HD1      LEU  26   1.191  -3.338   8.678
  194   1HD2  LEU  26          1HD2      LEU  26   0.904  -0.375  10.890
  195   2HD2  LEU  26          2HD2      LEU  26   2.376  -1.162  11.470
  196   3HD2  LEU  26          3HD2      LEU  26   2.477   0.324  10.509
  197    H    GLY  27           H        GLY  27   5.717  -3.577   8.911
  198   1HA   GLY  27          2HA       GLY  27   6.697  -4.626  11.181
  199   2HA   GLY  27          3HA       GLY  27   4.975  -5.029  11.357
  200    H    GLY  28           H        GLY  28   4.031  -6.624  10.082
  201   1HA   GLY  28          2HA       GLY  28   5.849  -8.361   8.440
  202   2HA   GLY  28          3HA       GLY  28   4.879  -9.003   9.779
  203    H    VAL  29           H        VAL  29   4.010  -6.439   7.548
  204    HA   VAL  29           HA       VAL  29   1.443  -7.509   6.959
  205    HB   VAL  29           HB       VAL  29   1.900  -5.120   7.008
  206   1HG1  VAL  29          1HG1      VAL  29   4.230  -5.030   6.256
  207   2HG1  VAL  29          2HG1      VAL  29   3.780  -5.667   4.668
  208   3HG1  VAL  29          3HG1      VAL  29   3.218  -4.061   5.189
  209   1HG2  VAL  29          1HG2      VAL  29   1.307  -5.772   4.096
  210   2HG2  VAL  29          2HG2      VAL  29   0.115  -5.960   5.396
  211   3HG2  VAL  29          3HG2      VAL  29   0.795  -4.366   5.030
  212    H    LYS  30           H        LYS  30   0.637  -8.342   4.941
  213    HA   LYS  30           HA       LYS  30   2.698  -8.847   2.834
  214   1HB   LYS  30          2HB       LYS  30   1.967 -10.936   3.568
  215   2HB   LYS  30          3HB       LYS  30   0.260 -10.479   3.465
  216   1HG   LYS  30          2HG       LYS  30   1.054 -11.929   1.589
  217   2HG   LYS  30          3HG       LYS  30   0.318 -10.398   1.088
  218   1HD   LYS  30          2HD       LYS  30   2.599  -9.427   0.675
  219   2HD   LYS  30          3HD       LYS  30   3.357 -10.869   1.324
  220   1HE   LYS  30          2HE       LYS  30   3.176 -10.388  -1.209
  221   2HE   LYS  30          3HE       LYS  30   2.953 -12.055  -0.639
  222   1HZ   LYS  30          1HZ       LYS  30   0.629 -11.877  -1.006
  223   2HZ   LYS  30          2HZ       LYS  30   0.648 -10.245  -1.090
  224   3HZ   LYS  30          3HZ       LYS  30   1.227 -11.043  -2.306
  225    H    TYR  31           H        TYR  31   2.640  -7.305   1.510
  226    HA   TYR  31           HA       TYR  31   0.142  -6.129   0.406
  227   1HB   TYR  31          2HB       TYR  31   1.702  -4.358  -0.454
  228   2HB   TYR  31          3HB       TYR  31   1.516  -4.427   1.292
  229    HD1  TYR  31           HD1      TYR  31   3.325  -4.888   2.720
  230    HD2  TYR  31           HD2      TYR  31   3.812  -5.475  -1.489
  231    HE1  TYR  31           HE1      TYR  31   5.751  -5.337   3.081
  232    HE2  TYR  31           HE2      TYR  31   6.231  -5.923  -1.157
  233    HH   TYR  31           HH       TYR  31   7.704  -6.101   2.075
  234    H    ASP  32           H        ASP  32   0.055  -5.804  -1.888
  235    HA   ASP  32           HA       ASP  32   1.745  -7.539  -3.623
  236   1HB   ASP  32          2HB       ASP  32  -1.252  -7.361  -3.230
  237   2HB   ASP  32          3HB       ASP  32  -0.564  -8.009  -4.716
  238    H    ILE  33           H        ILE  33   2.683  -6.110  -4.969
  239    HA   ILE  33           HA       ILE  33   1.495  -3.421  -5.296
  240    HB   ILE  33           HB       ILE  33   4.287  -4.529  -5.702
  241   1HG1  ILE  33          2HG1      ILE  33   3.744  -2.417  -3.665
  242   2HG1  ILE  33          3HG1      ILE  33   3.030  -3.976  -3.278
  243   1HG2  ILE  33          1HG2      ILE  33   3.959  -2.636  -7.219
  244   2HG2  ILE  33          2HG2      ILE  33   3.243  -1.695  -5.890
  245   3HG2  ILE  33          3HG2      ILE  33   4.963  -2.143  -5.848
  246   1HD1  ILE  33          1HD1      ILE  33   5.159  -5.107  -3.428
  247   2HD1  ILE  33          2HD1      ILE  33   5.958  -3.629  -4.032
  248   3HD1  ILE  33          3HD1      ILE  33   5.331  -3.686  -2.374
  249    H    ASP  34           H        ASP  34   0.309  -3.079  -7.097
  250    HA   ASP  34           HA       ASP  34   0.883  -4.580  -9.596
  251   1HB   ASP  34          2HB       ASP  34  -1.432  -4.493  -8.742
  252   2HB   ASP  34          3HB       ASP  34  -1.382  -2.727  -8.869
  253    H    LEU  35           H        LEU  35   2.796  -3.600 -10.110
  254    HA   LEU  35           HA       LEU  35   3.270  -0.822  -9.903
  255   1HB   LEU  35          2HB       LEU  35   4.998  -2.616  -9.813
  256   2HB   LEU  35          3HB       LEU  35   4.794  -2.866 -11.545
  257    HG   LEU  35           HG       LEU  35   5.499  -0.444 -11.904
  258   1HD1  LEU  35          1HD1      LEU  35   6.197  -0.684  -8.946
  259   2HD1  LEU  35          2HD1      LEU  35   6.784   0.607 -10.003
  260   3HD1  LEU  35          3HD1      LEU  35   5.057   0.490  -9.649
  261   1HD2  LEU  35          1HD2      LEU  35   7.471  -2.259 -10.446
  262   2HD2  LEU  35          2HD2      LEU  35   7.082  -2.325 -12.181
  263   3HD2  LEU  35          3HD2      LEU  35   7.894  -0.900 -11.503
  264    HA   PRO  36           HA       PRO  36   2.570  -0.542 -14.637
  265   1HB   PRO  36          2HB       PRO  36   0.798  -2.279 -15.846
  266   2HB   PRO  36          3HB       PRO  36   2.575  -2.473 -15.831
  267   1HG   PRO  36          2HG       PRO  36   0.557  -3.763 -13.991
  268   2HG   PRO  36          3HG       PRO  36   1.925  -4.538 -14.834
  269   1HD   PRO  36          2HD       PRO  36   2.086  -3.834 -12.276
  270   2HD   PRO  36          3HD       PRO  36   3.495  -3.573 -13.339
  271    H    ASN  37           H        ASN  37  -0.284  -1.960 -12.742
  272    HA   ASN  37           HA       ASN  37  -1.951   0.104 -14.010
  273   1HB   ASN  37          2HB       ASN  37  -2.750  -1.831 -11.842
  274   2HB   ASN  37          3HB       ASN  37  -3.793  -0.796 -12.782
  275   1HD2  ASN  37          1HD2      ASN  37  -1.689  -3.629 -12.988
  276   2HD2  ASN  37          2HD2      ASN  37  -2.335  -4.225 -14.527
  277    H    LYS  38           H        LYS  38   0.111   0.125 -11.204
  278    HA   LYS  38           HA       LYS  38   0.555   1.823  -9.818
  279   1HB   LYS  38          2HB       LYS  38  -1.475   3.455 -11.393
  280   2HB   LYS  38          3HB       LYS  38  -0.436   4.046 -10.119
  281   1HG   LYS  38          2HG       LYS  38   1.585   3.541 -11.405
  282   2HG   LYS  38          3HG       LYS  38   0.643   2.662 -12.606
  283   1HD   LYS  38          2HD       LYS  38   1.140   4.779 -13.590
  284   2HD   LYS  38          3HD       LYS  38  -0.578   4.703 -13.226
  285   1HE   LYS  38          2HE       LYS  38   0.066   6.891 -12.598
  286   2HE   LYS  38          3HE       LYS  38  -0.095   6.029 -11.075
  287   1HZ   LYS  38          1HZ       LYS  38   2.396   6.755 -12.475
  288   2HZ   LYS  38          2HZ       LYS  38   1.849   7.288 -11.024
  289   3HZ   LYS  38          3HZ       LYS  38   2.403   5.755 -11.179
  290    H    LYS  39           H        LYS  39  -0.758  -0.238  -8.947
  291    HA   LYS  39           HA       LYS  39  -2.589   0.933  -6.948
  292   1HB   LYS  39          2HB       LYS  39  -3.188  -1.663  -8.440
  293   2HB   LYS  39          3HB       LYS  39  -4.088  -0.977  -7.080
  294   1HG   LYS  39          2HG       LYS  39  -4.875   0.860  -8.440
  295   2HG   LYS  39          3HG       LYS  39  -3.828   0.390  -9.778
  296   1HD   LYS  39          2HD       LYS  39  -6.137  -0.281 -10.163
  297   2HD   LYS  39          3HD       LYS  39  -5.047  -1.663 -10.172
  298   1HE   LYS  39          2HE       LYS  39  -6.609  -0.876  -7.660
  299   2HE   LYS  39          3HE       LYS  39  -7.362  -1.832  -8.939
  300   1HZ   LYS  39          1HZ       LYS  39  -5.734  -3.536  -8.626
  301   2HZ   LYS  39          2HZ       LYS  39  -4.950  -2.663  -7.473
  302   3HZ   LYS  39          3HZ       LYS  39  -6.458  -3.179  -7.191
  303    H    VAL  40           H        VAL  40  -2.795  -0.562  -5.012
  304    HA   VAL  40           HA       VAL  40  -0.855  -2.745  -4.857
  305    HB   VAL  40           HB       VAL  40  -1.406  -0.349  -3.059
  306   1HG1  VAL  40          1HG1      VAL  40  -1.956  -2.102  -1.662
  307   2HG1  VAL  40          2HG1      VAL  40  -0.484  -3.036  -2.082
  308   3HG1  VAL  40          3HG1      VAL  40  -0.362  -1.505  -1.169
  309   1HG2  VAL  40          1HG2      VAL  40   0.584  -0.360  -4.558
  310   2HG2  VAL  40          2HG2      VAL  40   1.013  -0.291  -2.834
  311   3HG2  VAL  40          3HG2      VAL  40   1.178  -1.815  -3.722
  312    H    CYS  41           H        CYS  41  -1.827  -4.474  -3.720
  313    HA   CYS  41           HA       CYS  41  -4.349  -3.839  -2.353
  314   1HB   CYS  41          2HB       CYS  41  -5.573  -5.481  -3.092
  315   2HB   CYS  41          3HB       CYS  41  -4.526  -5.569  -4.504
  316    HG   CYS  41           HG       CYS  41  -3.081  -7.505  -3.673
  317    H    ILE  42           H        ILE  42  -4.508  -5.004  -0.327
  318    HA   ILE  42           HA       ILE  42  -1.946  -6.234   0.543
  319    HB   ILE  42           HB       ILE  42  -3.546  -4.280   2.204
  320   1HG1  ILE  42          2HG1      ILE  42  -0.920  -3.941   0.663
  321   2HG1  ILE  42          3HG1      ILE  42  -2.416  -3.040   0.411
  322   1HG2  ILE  42          1HG2      ILE  42  -2.341  -6.084   3.443
  323   2HG2  ILE  42          2HG2      ILE  42  -0.817  -5.492   2.740
  324   3HG2  ILE  42          3HG2      ILE  42  -1.767  -4.470   3.834
  325   1HD1  ILE  42          1HD1      ILE  42  -0.582  -2.827   2.807
  326   2HD1  ILE  42          2HD1      ILE  42  -0.828  -1.635   1.524
  327   3HD1  ILE  42          3HD1      ILE  42  -2.150  -1.989   2.647
  328    H    GLU  43           H        GLU  43  -2.210  -8.060   1.532
  329    HA   GLU  43           HA       GLU  43  -4.984  -9.031   2.171
  330   1HB   GLU  43          2HB       GLU  43  -4.180  -9.739  -0.089
  331   2HB   GLU  43          3HB       GLU  43  -2.756 -10.477   0.642
  332   1HG   GLU  43          2HG       GLU  43  -4.108 -12.148   1.746
  333   2HG   GLU  43          3HG       GLU  43  -5.611 -11.306   1.338
  334    H    SER  44           H        SER  44  -4.489  -8.463   4.325
  335    HA   SER  44           HA       SER  44  -2.526 -10.083   5.757
  336   1HB   SER  44          2HB       SER  44  -1.433  -8.001   4.505
  337   2HB   SER  44          3HB       SER  44  -2.149  -7.071   5.827
  338    HG   SER  44           HG       SER  44  -0.929  -8.430   7.255
  339    H    GLU  45           H        GLU  45  -3.119 -10.160   7.972
  340    HA   GLU  45           HA       GLU  45  -5.659  -8.964   8.691
  341   1HB   GLU  45          2HB       GLU  45  -3.703 -10.546  10.392
  342   2HB   GLU  45          3HB       GLU  45  -5.385 -10.154  10.762
  343   1HG   GLU  45          2HG       GLU  45  -5.476 -11.340   8.164
  344   2HG   GLU  45          3HG       GLU  45  -4.323 -12.316   9.086
  345    H    HIS  46           H        HIS  46  -4.775  -6.771   8.159
  346    HA   HIS  46           HA       HIS  46  -4.142  -5.416  10.726
  347   1HB   HIS  46          2HB       HIS  46  -2.999  -4.696   7.993
  348   2HB   HIS  46          3HB       HIS  46  -2.851  -3.712   9.453
  349    HD1  HIS  46           1HD      HIS  46  -1.787  -5.711  11.565
  350    HD2  HIS  46           2HD      HIS  46  -0.612  -5.595   7.532
  351    HE1  HIS  46           1HE      HIS  46   0.588  -6.644  11.461
  352    H    SER  47           H        SER  47  -5.328  -3.399  10.881
  353    HA   SER  47           HA       SER  47  -7.777  -3.426   9.325
  354   1HB   SER  47          2HB       SER  47  -7.713  -2.681  11.697
  355   2HB   SER  47          3HB       SER  47  -6.760  -1.267  11.208
  356    HG   SER  47           HG       SER  47  -9.006  -0.818  11.284
  357    H    MET  48           H        MET  48  -8.515  -1.714   8.041
  358    HA   MET  48           HA       MET  48  -6.909  -0.744   5.914
  359   1HB   MET  48          2HB       MET  48  -9.458   0.441   7.129
  360   2HB   MET  48          3HB       MET  48  -8.780   0.851   5.545
  361   1HG   MET  48          2HG       MET  48  -9.125  -1.451   4.780
  362   2HG   MET  48          3HG       MET  48  -9.745  -1.909   6.379
  363   1HE   MET  48          1HE       MET  48 -11.901  -2.973   5.470
  364   2HE   MET  48          2HE       MET  48 -12.946  -2.192   4.258
  365   3HE   MET  48          3HE       MET  48 -11.281  -2.661   3.828
  366    H    ASP  49           H        ASP  49  -8.023   0.734   8.912
  367    HA   ASP  49           HA       ASP  49  -6.874   3.291   8.917
  368   1HB   ASP  49          2HB       ASP  49  -8.242   2.890  10.766
  369   2HB   ASP  49          3HB       ASP  49  -7.670   1.233  10.979
  370    H    THR  50           H        THR  50  -5.536   0.499  10.483
  371    HA   THR  50           HA       THR  50  -3.178   1.582  11.244
  372    HB   THR  50           HB       THR  50  -3.628  -1.348  10.566
  373    HG1  THR  50           1HG      THR  50  -4.903   0.345  12.386
  374   1HG2  THR  50          1HG2      THR  50  -2.105   0.011  12.847
  375   2HG2  THR  50          2HG2      THR  50  -2.327  -1.739  12.648
  376   3HG2  THR  50          3HG2      THR  50  -1.366  -0.831  11.465
  377    H    LEU  51           H        LEU  51  -3.805  -0.254   8.239
  378    HA   LEU  51           HA       LEU  51  -1.125  -0.021   7.174
  379   1HB   LEU  51          2HB       LEU  51  -3.807  -0.254   5.749
  380   2HB   LEU  51          3HB       LEU  51  -2.216  -0.398   4.976
  381    HG   LEU  51           HG       LEU  51  -3.117  -2.178   7.305
  382   1HD1  LEU  51          1HD1      LEU  51  -3.475  -2.727   4.343
  383   2HD1  LEU  51          2HD1      LEU  51  -3.761  -3.880   5.662
  384   3HD1  LEU  51          3HD1      LEU  51  -4.754  -2.421   5.533
  385   1HD2  LEU  51          1HD2      LEU  51  -0.957  -2.469   5.179
  386   2HD2  LEU  51          2HD2      LEU  51  -0.706  -2.230   6.922
  387   3HD2  LEU  51          3HD2      LEU  51  -1.417  -3.736   6.328
  388    H    LEU  52           H        LEU  52  -4.116   1.806   6.344
  389    HA   LEU  52           HA       LEU  52  -3.096   3.693   4.654
  390   1HB   LEU  52          2HB       LEU  52  -5.342   3.726   6.651
  391   2HB   LEU  52          3HB       LEU  52  -4.974   5.192   5.780
  392    HG   LEU  52           HG       LEU  52  -5.576   2.528   4.454
  393   1HD1  LEU  52          1HD1      LEU  52  -7.504   3.327   5.756
  394   2HD1  LEU  52          2HD1      LEU  52  -7.433   4.888   4.909
  395   3HD1  LEU  52          3HD1      LEU  52  -7.810   3.394   4.017
  396   1HD2  LEU  52          1HD2      LEU  52  -4.360   3.978   2.902
  397   2HD2  LEU  52          2HD2      LEU  52  -6.060   4.102   2.471
  398   3HD2  LEU  52          3HD2      LEU  52  -5.308   5.394   3.409
  399    H    ALA  53           H        ALA  53  -3.509   4.272   8.171
  400    HA   ALA  53           HA       ALA  53  -2.297   6.787   8.209
  401   1HB   ALA  53          1HB       ALA  53  -2.087   6.408  10.657
  402   2HB   ALA  53          2HB       ALA  53  -3.662   5.845  10.061
  403   3HB   ALA  53          3HB       ALA  53  -2.378   4.671  10.415
  404    H    THR  54           H        THR  54  -0.748   3.581   8.338
  405    HA   THR  54           HA       THR  54   1.881   4.668   8.930
  406    HB   THR  54           HB       THR  54   1.022   1.980   7.762
  407    HG1  THR  54           1HG      THR  54   0.306   2.064   9.771
  408   1HG2  THR  54          1HG2      THR  54   3.713   3.013   8.721
  409   2HG2  THR  54          2HG2      THR  54   3.303   1.302   8.518
  410   3HG2  THR  54          3HG2      THR  54   3.285   2.369   7.112
  411    H    LEU  55           H        LEU  55   0.356   3.366   5.933
  412    HA   LEU  55           HA       LEU  55   2.625   3.995   4.373
  413   1HB   LEU  55          2HB       LEU  55   1.350   3.387   2.460
  414   2HB   LEU  55          3HB       LEU  55   1.304   2.246   3.770
  415    HG   LEU  55           HG       LEU  55  -0.979   3.106   4.362
  416   1HD1  LEU  55          1HD1      LEU  55  -1.205   5.161   3.339
  417   2HD1  LEU  55          2HD1      LEU  55  -0.304   4.626   1.921
  418   3HD1  LEU  55          3HD1      LEU  55  -2.016   4.136   2.147
  419   1HD2  LEU  55          1HD2      LEU  55  -0.468   1.826   1.663
  420   2HD2  LEU  55          2HD2      LEU  55  -0.534   1.000   3.236
  421   3HD2  LEU  55          3HD2      LEU  55  -2.003   1.744   2.570
  422    H    LYS  56           H        LYS  56  -0.140   5.889   5.074
  423    HA   LYS  56           HA       LYS  56  -0.104   8.028   3.488
  424   1HB   LYS  56          2HB       LYS  56  -1.298   7.583   5.816
  425   2HB   LYS  56          3HB       LYS  56   0.056   8.476   6.505
  426   1HG   LYS  56          2HG       LYS  56  -0.605  10.361   4.870
  427   2HG   LYS  56          3HG       LYS  56  -1.995   9.316   4.452
  428   1HD   LYS  56          2HD       LYS  56  -2.698   9.304   6.835
  429   2HD   LYS  56          3HD       LYS  56  -1.335  10.370   7.240
  430   1HE   LYS  56          2HE       LYS  56  -2.258  12.131   5.736
  431   2HE   LYS  56          3HE       LYS  56  -3.595  11.060   5.286
  432   1HZ   LYS  56          1HZ       LYS  56  -4.250  12.632   6.953
  433   2HZ   LYS  56          2HZ       LYS  56  -4.333  11.112   7.568
  434   3HZ   LYS  56          3HZ       LYS  56  -3.092  12.108   7.993
  435    H    LYS  57           H        LYS  57   2.414   7.227   5.837
  436    HA   LYS  57           HA       LYS  57   3.739   9.709   6.068
  437   1HB   LYS  57          2HB       LYS  57   4.663   6.860   6.402
  438   2HB   LYS  57          3HB       LYS  57   5.640   8.271   6.876
  439   1HG   LYS  57          2HG       LYS  57   3.870   8.991   8.406
  440   2HG   LYS  57          3HG       LYS  57   2.810   7.698   7.819
  441   1HD   LYS  57          2HD       LYS  57   4.374   5.975   8.604
  442   2HD   LYS  57          3HD       LYS  57   5.377   7.231   9.364
  443   1HE   LYS  57          2HE       LYS  57   3.543   7.878  10.848
  444   2HE   LYS  57          3HE       LYS  57   2.387   6.881   9.957
  445   1HZ   LYS  57          1HZ       LYS  57   3.050   5.840  11.982
  446   2HZ   LYS  57          2HZ       LYS  57   3.518   4.927  10.706
  447   3HZ   LYS  57          3HZ       LYS  57   4.632   5.820  11.533
  448    H    THR  58           H        THR  58   3.685   7.507   3.328
  449    HA   THR  58           HA       THR  58   6.168   8.294   2.109
  450    HB   THR  58           HB       THR  58   5.011   7.628  -0.016
  451    HG1  THR  58           1HG      THR  58   2.814   6.897   1.587
  452   1HG2  THR  58          1HG2      THR  58   4.664   5.249   0.659
  453   2HG2  THR  58          2HG2      THR  58   6.178   5.953   1.280
  454   3HG2  THR  58          3HG2      THR  58   4.786   5.770   2.359
  455    H    GLY  59           H        GLY  59   3.096   9.922   2.513
  456   1HA   GLY  59          2HA       GLY  59   2.369  11.986   1.985
  457   2HA   GLY  59          3HA       GLY  59   4.029  12.419   1.515
  458    H    LYS  60           H        LYS  60   1.584  10.062   0.262
  459    HA   LYS  60           HA       LYS  60   1.893  11.135  -2.528
  460   1HB   LYS  60          2HB       LYS  60   2.381   8.315  -1.658
  461   2HB   LYS  60          3HB       LYS  60   2.213   8.917  -3.320
  462   1HG   LYS  60          2HG       LYS  60   4.002  10.727  -2.636
  463   2HG   LYS  60          3HG       LYS  60   4.234   9.686  -1.212
  464   1HD   LYS  60          2HD       LYS  60   4.773   7.832  -2.702
  465   2HD   LYS  60          3HD       LYS  60   4.466   8.890  -4.087
  466   1HE   LYS  60          2HE       LYS  60   6.935   8.748  -3.627
  467   2HE   LYS  60          3HE       LYS  60   6.300  10.391  -3.482
  468   1HZ   LYS  60          1HZ       LYS  60   6.957   8.581  -1.257
  469   2HZ   LYS  60          2HZ       LYS  60   7.748   9.951  -1.681
  470   3HZ   LYS  60          3HZ       LYS  60   6.252  10.042  -1.021
  471    H    THR  61           H        THR  61   0.197  10.388  -3.995
  472    HA   THR  61           HA       THR  61  -2.394   9.955  -2.961
  473    HB   THR  61           HB       THR  61  -1.324   9.363  -5.723
  474    HG1  THR  61           1HG      THR  61  -1.756  11.935  -4.612
  475   1HG2  THR  61          1HG2      THR  61  -3.844  10.769  -4.738
  476   2HG2  THR  61          2HG2      THR  61  -3.429  10.445  -6.439
  477   3HG2  THR  61          3HG2      THR  61  -3.763   9.091  -5.334
  478    H    VAL  62           H        VAL  62  -1.361   8.158  -1.601
  479    HA   VAL  62           HA       VAL  62  -1.823   5.467  -2.832
  480    HB   VAL  62           HB       VAL  62   0.349   5.601  -1.925
  481   1HG1  VAL  62          1HG1      VAL  62  -0.782   6.587   0.712
  482   2HG1  VAL  62          2HG1      VAL  62   0.865   5.991   0.439
  483   3HG1  VAL  62          3HG1      VAL  62   0.313   7.429  -0.397
  484   1HG2  VAL  62          1HG2      VAL  62  -1.469   3.998  -0.095
  485   2HG2  VAL  62          2HG2      VAL  62  -0.786   3.484  -1.637
  486   3HG2  VAL  62          3HG2      VAL  62   0.286   3.777  -0.271
  487    H    SER  63           H        SER  63  -4.027   5.528  -2.896
  488    HA   SER  63           HA       SER  63  -5.518   6.248  -0.394
  489   1HB   SER  63          2HB       SER  63  -6.333   6.531  -3.310
  490   2HB   SER  63          3HB       SER  63  -7.224   7.113  -1.889
  491    HG   SER  63           HG       SER  63  -5.951   8.772  -2.865
  492    H    TYR  64           H        TYR  64  -7.124   4.862   0.302
  493    HA   TYR  64           HA       TYR  64  -7.156   2.126  -0.688
  494   1HB   TYR  64          2HB       TYR  64  -7.202   2.413   1.644
  495   2HB   TYR  64          3HB       TYR  64  -8.449   3.663   1.567
  496    HD1  TYR  64           HD1      TYR  64 -10.795   3.110   1.467
  497    HD2  TYR  64           HD2      TYR  64  -7.797   0.012   1.305
  498    HE1  TYR  64           HE1      TYR  64 -12.562   1.384   1.690
  499    HE2  TYR  64           HE2      TYR  64  -9.572  -1.694   1.614
  500    HH   TYR  64           HH       TYR  64 -11.766  -2.070   1.394
  501    H    LEU  65           H        LEU  65  -8.750   1.136  -1.985
  502    HA   LEU  65           HA       LEU  65 -11.439   2.112  -1.922
  503   1HB   LEU  65          2HB       LEU  65 -11.732   2.330  -4.312
  504   2HB   LEU  65          3HB       LEU  65 -10.751   3.581  -3.570
  505    HG   LEU  65           HG       LEU  65  -9.587   3.361  -5.415
  506   1HD1  LEU  65          1HD1      LEU  65  -7.934   2.785  -3.828
  507   2HD1  LEU  65          2HD1      LEU  65  -8.323   1.037  -3.979
  508   3HD1  LEU  65          3HD1      LEU  65  -7.665   1.903  -5.359
  509   1HD2  LEU  65          1HD2      LEU  65 -11.088   1.341  -6.258
  510   2HD2  LEU  65          2HD2      LEU  65  -9.493   1.679  -6.976
  511   3HD2  LEU  65          3HD2      LEU  65  -9.644   0.402  -5.773
  512    H    GLY  66           H        GLY  66 -11.510  -0.079  -0.861
  513   1HA   GLY  66          2HA       GLY  66 -13.271  -1.573  -1.957
  514   2HA   GLY  66          3HA       GLY  66 -11.960  -2.187  -2.968
  515    H    LEU  67           H        LEU  67 -13.629  -3.668  -1.027
  516    HA   LEU  67           HA       LEU  67 -11.554  -4.812   0.725
  517   1HB   LEU  67          2HB       LEU  67 -12.936  -3.692   2.291
  518   2HB   LEU  67          3HB       LEU  67 -14.360  -3.800   1.253
  519    HG   LEU  67           HG       LEU  67 -14.546  -6.185   1.678
  520   1HD1  LEU  67          1HD1      LEU  67 -12.162  -6.682   2.325
  521   2HD1  LEU  67          2HD1      LEU  67 -12.369  -5.689   3.779
  522   3HD1  LEU  67          3HD1      LEU  67 -13.291  -7.195   3.587
  523   1HD2  LEU  67          1HD2      LEU  67 -15.837  -4.560   2.989
  524   2HD2  LEU  67          2HD2      LEU  67 -15.403  -5.957   3.990
  525   3HD2  LEU  67          3HD2      LEU  67 -14.515  -4.429   4.170
  526    H    GLU  68           H        GLU  68 -11.460  -7.059   0.230
  527    HA   GLU  68           HA       GLU  68 -13.723  -8.360  -1.084
  528   1HB   GLU  68          2HB       GLU  68 -11.998  -7.324  -2.842
  529   2HB   GLU  68          3HB       GLU  68 -10.933  -8.604  -2.245
  530   1HG   GLU  68          2HG       GLU  68 -11.936  -9.565  -4.124
  531   2HG   GLU  68          3HG       GLU  68 -12.924 -10.209  -2.803
  Start of MODEL   13
    1   1H    MET   1           H1       MET   1 -11.987 -11.583   3.870
    2   2H    MET   1           H2       MET   1 -12.973 -10.453   3.098
    3   3H    MET   1           H3       MET   1 -11.445 -10.311   2.927
    4    HA   MET   1           HA       MET   1 -12.604  -8.806   4.458
    5   1HB   MET   1          2HB       MET   1 -12.066 -11.117   6.377
    6   2HB   MET   1          3HB       MET   1 -12.546  -9.476   6.829
    7   1HG   MET   1          2HG       MET   1 -14.184 -11.436   5.168
    8   2HG   MET   1          3HG       MET   1 -14.469 -10.978   6.847
    9   1HE   MET   1          1HE       MET   1 -17.517  -9.476   4.856
   10   2HE   MET   1          2HE       MET   1 -16.633 -10.960   4.430
   11   3HE   MET   1          3HE       MET   1 -17.019 -10.608   6.135
   12    HA   PRO   2           HA       PRO   2  -8.175  -8.694   5.986
   13   1HB   PRO   2          2HB       PRO   2  -6.306 -10.575   5.409
   14   2HB   PRO   2          3HB       PRO   2  -7.477 -10.764   6.744
   15   1HG   PRO   2          2HG       PRO   2  -7.665 -11.867   3.930
   16   2HG   PRO   2          3HG       PRO   2  -7.854 -12.765   5.463
   17   1HD   PRO   2          2HD       PRO   2  -9.958 -11.846   4.058
   18   2HD   PRO   2          3HD       PRO   2  -9.980 -11.813   5.852
   19    H    LYS   3           H        LYS   3  -9.242  -9.092   2.747
   20    HA   LYS   3           HA       LYS   3  -6.651  -8.237   1.648
   21   1HB   LYS   3          2HB       LYS   3  -7.685 -10.321   0.845
   22   2HB   LYS   3          3HB       LYS   3  -9.042  -9.406   0.208
   23   1HG   LYS   3          2HG       LYS   3  -6.225  -8.594  -0.597
   24   2HG   LYS   3          3HG       LYS   3  -6.891 -10.093  -1.254
   25   1HD   LYS   3          2HD       LYS   3  -8.821  -8.977  -2.162
   26   2HD   LYS   3          3HD       LYS   3  -8.352  -7.428  -1.432
   27   1HE   LYS   3          2HE       LYS   3  -6.357  -7.313  -2.823
   28   2HE   LYS   3          3HE       LYS   3  -6.719  -8.894  -3.549
   29   1HZ   LYS   3          1HZ       LYS   3  -7.474  -6.893  -4.859
   30   2HZ   LYS   3          2HZ       LYS   3  -8.752  -7.944  -4.461
   31   3HZ   LYS   3          3HZ       LYS   3  -8.565  -6.601  -3.669
   32    H    HIS   4           H        HIS   4  -6.469  -6.182   0.622
   33    HA   HIS   4           HA       HIS   4  -8.907  -4.720   0.050
   34   1HB   HIS   4          2HB       HIS   4  -7.471  -2.814   1.566
   35   2HB   HIS   4          3HB       HIS   4  -9.031  -3.534   1.946
   36    HD1  HIS   4           1HD      HIS   4  -8.859  -5.824   3.580
   37    HD2  HIS   4           2HD      HIS   4  -5.579  -3.198   3.310
   38    HE1  HIS   4           1HE      HIS   4  -7.401  -6.234   5.653
   39    H    GLU   5           H        GLU   5  -8.596  -2.791  -1.174
   40    HA   GLU   5           HA       GLU   5  -6.100  -2.899  -2.823
   41   1HB   GLU   5          2HB       GLU   5  -9.032  -2.395  -3.353
   42   2HB   GLU   5          3HB       GLU   5  -7.818  -1.945  -4.539
   43   1HG   GLU   5          2HG       GLU   5  -7.864  -4.728  -3.340
   44   2HG   GLU   5          3HG       GLU   5  -8.996  -4.282  -4.612
   45    H    PHE   6           H        PHE   6  -5.150  -1.030  -3.572
   46    HA   PHE   6           HA       PHE   6  -6.203   1.594  -2.717
   47   1HB   PHE   6          2HB       PHE   6  -3.346   0.559  -2.344
   48   2HB   PHE   6          3HB       PHE   6  -3.867   2.191  -1.995
   49    HD1  PHE   6           1HD      PHE   6  -4.328  -1.397  -0.975
   50    HD2  PHE   6           2HD      PHE   6  -4.570   2.742   0.221
   51    HE1  PHE   6           1HE      PHE   6  -4.898  -2.097   1.314
   52    HE2  PHE   6           2HE      PHE   6  -4.976   2.025   2.563
   53    HZ   PHE   6           HZ       PHE   6  -5.193  -0.387   3.111
   54    H    SER   7           H        SER   7  -5.831   3.186  -4.235
   55    HA   SER   7           HA       SER   7  -4.393   2.384  -6.743
   56   1HB   SER   7          2HB       SER   7  -6.838   3.301  -6.817
   57   2HB   SER   7          3HB       SER   7  -6.084   4.878  -6.514
   58    HG   SER   7           HG       SER   7  -4.785   4.428  -8.407
   59    H    VAL   8           H        VAL   8  -2.556   3.557  -7.341
   60    HA   VAL   8           HA       VAL   8  -1.463   5.320  -5.213
   61    HB   VAL   8           HB       VAL   8  -0.120   3.131  -6.883
   62   1HG1  VAL   8          1HG1      VAL   8   0.732   4.671  -4.390
   63   2HG1  VAL   8          2HG1      VAL   8   1.631   3.328  -5.121
   64   3HG1  VAL   8          3HG1      VAL   8   1.427   4.850  -6.004
   65   1HG2  VAL   8          1HG2      VAL   8  -1.342   3.052  -4.076
   66   2HG2  VAL   8          2HG2      VAL   8  -1.702   1.994  -5.453
   67   3HG2  VAL   8          3HG2      VAL   8  -0.134   1.901  -4.653
   68    H    ASP   9           H        ASP   9  -0.120   6.983  -5.859
   69    HA   ASP   9           HA       ASP   9   0.296   7.484  -8.783
   70   1HB   ASP   9          2HB       ASP   9  -0.403   9.449  -7.663
   71   2HB   ASP   9          3HB       ASP   9   0.738   9.184  -6.319
   72    H    MET  10           H        MET  10   1.663   5.727  -9.167
   73    HA   MET  10           HA       MET  10   4.298   5.749  -7.757
   74   1HB   MET  10          2HB       MET  10   3.149   3.705  -9.679
   75   2HB   MET  10          3HB       MET  10   4.797   3.724  -9.026
   76   1HG   MET  10          2HG       MET  10   3.617   3.899  -6.686
   77   2HG   MET  10          3HG       MET  10   2.208   3.274  -7.546
   78   1HE   MET  10          1HE       MET  10   3.020   1.295  -9.432
   79   2HE   MET  10          2HE       MET  10   3.316  -0.225  -8.564
   80   3HE   MET  10          3HE       MET  10   1.911   0.767  -8.129
   81    H    THR  11           H        THR  11   4.823   7.811  -8.476
   82    HA   THR  11           HA       THR  11   4.855   8.494 -11.205
   83    HB   THR  11           HB       THR  11   6.721   9.866  -9.290
   84    HG1  THR  11           1HG      THR  11   3.923   9.671  -8.859
   85   1HG2  THR  11          1HG2      THR  11   5.555  11.870 -10.099
   86   2HG2  THR  11          2HG2      THR  11   6.060  10.866 -11.475
   87   3HG2  THR  11          3HG2      THR  11   4.361  10.867 -10.947
   88    H    CYS  12           H        CYS  12   7.171   6.771  -9.189
   89    HA   CYS  12           HA       CYS  12   8.904   6.369 -11.541
   90   1HB   CYS  12          2HB       CYS  12  10.054   8.122 -10.187
   91   2HB   CYS  12          3HB       CYS  12   9.882   7.109  -8.733
   92    HG   CYS  12           HG       CYS  12  11.470   6.458 -11.553
   93    H    GLY  13           H        GLY  13   9.851   4.208 -11.370
   94   1HA   GLY  13          2HA       GLY  13   8.283   2.167 -10.268
   95   2HA   GLY  13          3HA       GLY  13  10.004   2.025 -10.679
   96    H    GLY  14           H        GLY  14  11.052   3.931  -8.863
   97   1HA   GLY  14          2HA       GLY  14  11.407   2.431  -6.519
   98   2HA   GLY  14          3HA       GLY  14  11.821   4.146  -6.711
   99    H    CYS  15           H        CYS  15   8.665   4.499  -7.287
  100    HA   CYS  15           HA       CYS  15   7.877   5.175  -4.643
  101   1HB   CYS  15          2HB       CYS  15   6.792   6.094  -6.607
  102   2HB   CYS  15          3HB       CYS  15   6.077   4.494  -6.959
  103    HG   CYS  15           HG       CYS  15   4.329   6.182  -5.768
  104    H    ALA  16           H        ALA  16   7.722   2.163  -6.576
  105    HA   ALA  16           HA       ALA  16   6.098   0.645  -4.797
  106   1HB   ALA  16          1HB       ALA  16   6.989  -1.306  -5.953
  107   2HB   ALA  16          2HB       ALA  16   6.638  -0.037  -7.145
  108   3HB   ALA  16          3HB       ALA  16   8.315  -0.354  -6.640
  109    H    GLU  17           H        GLU  17   9.709   1.139  -4.910
  110    HA   GLU  17           HA       GLU  17  10.228  -0.422  -2.582
  111   1HB   GLU  17          2HB       GLU  17  11.662   1.946  -3.856
  112   2HB   GLU  17          3HB       GLU  17  12.098   1.325  -2.283
  113   1HG   GLU  17          2HG       GLU  17  11.932  -1.021  -3.839
  114   2HG   GLU  17          3HG       GLU  17  12.614   0.189  -4.930
  115    H    ALA  18           H        ALA  18   9.238   3.017  -2.951
  116    HA   ALA  18           HA       ALA  18   9.556   3.718  -0.224
  117   1HB   ALA  18          1HB       ALA  18   7.311   4.757  -2.000
  118   2HB   ALA  18          2HB       ALA  18   8.052   5.541  -0.604
  119   3HB   ALA  18          3HB       ALA  18   9.000   5.323  -2.090
  120    H    VAL  19           H        VAL  19   6.680   2.439  -1.914
  121    HA   VAL  19           HA       VAL  19   5.016   2.095   0.332
  122    HB   VAL  19           HB       VAL  19   5.152   0.512  -2.259
  123   1HG1  VAL  19          1HG1      VAL  19   2.933   0.581  -0.167
  124   2HG1  VAL  19          2HG1      VAL  19   2.900  -0.271  -1.721
  125   3HG1  VAL  19          3HG1      VAL  19   3.993  -0.815  -0.464
  126   1HG2  VAL  19          1HG2      VAL  19   3.268   2.733  -1.332
  127   2HG2  VAL  19          2HG2      VAL  19   4.591   2.956  -2.486
  128   3HG2  VAL  19          3HG2      VAL  19   3.234   1.904  -2.901
  129    H    SER  20           H        SER  20   7.129  -0.343  -1.278
  130    HA   SER  20           HA       SER  20   6.699  -2.489   0.397
  131   1HB   SER  20          2HB       SER  20   8.066  -2.456  -1.734
  132   2HB   SER  20          3HB       SER  20   9.372  -1.658  -0.840
  133    HG   SER  20           HG       SER  20   9.835  -3.793  -0.872
  134    H    ARG  21           H        ARG  21   9.181   0.044   0.851
  135    HA   ARG  21           HA       ARG  21  10.281  -1.026   3.230
  136   1HB   ARG  21          2HB       ARG  21  10.253   1.792   2.101
  137   2HB   ARG  21          3HB       ARG  21  11.214   1.289   3.506
  138   1HG   ARG  21          2HG       ARG  21  12.403  -0.391   2.167
  139   2HG   ARG  21          3HG       ARG  21  11.420  -0.033   0.752
  140   1HD   ARG  21          2HD       ARG  21  12.288   2.335   0.812
  141   2HD   ARG  21          3HD       ARG  21  13.382   1.819   2.121
  142    HE   ARG  21           HE       ARG  21  13.479   0.254  -0.434
  143   1HH1  ARG  21          2HH2      ARG  21  14.898   2.985   1.307
  144   2HH1  ARG  21          1HH2      ARG  21  16.368   2.967   0.375
  145   1HH2  ARG  21          2HH1      ARG  21  15.246   0.303  -1.698
  146   2HH2  ARG  21          1HH1      ARG  21  16.585   1.377  -1.424
  147    H    VAL  22           H        VAL  22   7.747   1.686   2.924
  148    HA   VAL  22           HA       VAL  22   7.510   1.854   5.693
  149    HB   VAL  22           HB       VAL  22   6.918   3.569   4.017
  150   1HG1  VAL  22          1HG1      VAL  22   5.591   2.259   2.453
  151   2HG1  VAL  22          2HG1      VAL  22   4.370   1.946   3.713
  152   3HG1  VAL  22          3HG1      VAL  22   4.631   3.586   3.101
  153   1HG2  VAL  22          1HG2      VAL  22   4.752   2.808   5.960
  154   2HG2  VAL  22          2HG2      VAL  22   6.246   3.714   6.346
  155   3HG2  VAL  22          3HG2      VAL  22   5.011   4.423   5.264
  156    H    LEU  23           H        LEU  23   5.592  -0.143   3.330
  157    HA   LEU  23           HA       LEU  23   3.814  -1.231   5.188
  158   1HB   LEU  23          2HB       LEU  23   4.919  -2.115   2.510
  159   2HB   LEU  23          3HB       LEU  23   3.968  -3.233   3.459
  160    HG   LEU  23           HG       LEU  23   2.649  -2.051   1.756
  161   1HD1  LEU  23          1HD1      LEU  23   1.539  -3.129   3.651
  162   2HD1  LEU  23          2HD1      LEU  23   1.799  -1.684   4.661
  163   3HD1  LEU  23          3HD1      LEU  23   0.733  -1.605   3.254
  164   1HD2  LEU  23          1HD2      LEU  23   2.859   0.280   3.670
  165   2HD2  LEU  23          2HD2      LEU  23   3.632   0.209   2.071
  166   3HD2  LEU  23          3HD2      LEU  23   1.871   0.196   2.190
  167    H    ASN  24           H        ASN  24   7.114  -2.490   4.274
  168    HA   ASN  24           HA       ASN  24   7.030  -4.700   6.065
  169   1HB   ASN  24          2HB       ASN  24   9.234  -2.993   4.853
  170   2HB   ASN  24          3HB       ASN  24   9.579  -4.138   6.133
  171   1HD2  ASN  24          1HD2      ASN  24   8.431  -3.858   2.813
  172   2HD2  ASN  24          2HD2      ASN  24   8.658  -5.544   2.388
  173    H    LYS  25           H        LYS  25   8.148  -1.330   6.523
  174    HA   LYS  25           HA       LYS  25   9.009  -1.552   9.179
  175   1HB   LYS  25          2HB       LYS  25   7.918   0.737   7.508
  176   2HB   LYS  25          3HB       LYS  25   8.240   0.997   9.204
  177   1HG   LYS  25          2HG       LYS  25  10.255   0.113   7.093
  178   2HG   LYS  25          3HG       LYS  25  10.137   1.702   7.845
  179   1HD   LYS  25          2HD       LYS  25  11.095  -0.907   9.076
  180   2HD   LYS  25          3HD       LYS  25  11.978   0.598   8.848
  181   1HE   LYS  25          2HE       LYS  25  10.504   1.726  10.531
  182   2HE   LYS  25          3HE       LYS  25   9.636   0.203  10.795
  183   1HZ   LYS  25          1HZ       LYS  25  12.487   0.617  11.350
  184   2HZ   LYS  25          2HZ       LYS  25  11.272   0.537  12.455
  185   3HZ   LYS  25          3HZ       LYS  25  11.651  -0.788  11.564
  186    H    LEU  26           H        LEU  26   5.716  -0.997   8.005
  187    HA   LEU  26           HA       LEU  26   4.422  -0.502  10.392
  188   1HB   LEU  26          2HB       LEU  26   3.496  -0.800   8.010
  189   2HB   LEU  26          3HB       LEU  26   3.398  -2.514   8.329
  190    HG   LEU  26           HG       LEU  26   1.382  -0.876   8.593
  191   1HD1  LEU  26          1HD1      LEU  26   1.219  -3.282   8.807
  192   2HD1  LEU  26          2HD1      LEU  26   1.744  -3.184  10.508
  193   3HD1  LEU  26          3HD1      LEU  26   0.216  -2.426   9.991
  194   1HD2  LEU  26          1HD2      LEU  26   2.417   0.493  10.492
  195   2HD2  LEU  26          2HD2      LEU  26   0.838  -0.205  10.843
  196   3HD2  LEU  26          3HD2      LEU  26   2.290  -0.954  11.506
  197    H    GLY  27           H        GLY  27   5.591  -3.645   9.184
  198   1HA   GLY  27          2HA       GLY  27   6.091  -4.768  11.657
  199   2HA   GLY  27          3HA       GLY  27   4.376  -5.131  11.379
  200    H    GLY  28           H        GLY  28   3.775  -6.581   9.725
  201   1HA   GLY  28          2HA       GLY  28   5.821  -7.991   8.136
  202   2HA   GLY  28          3HA       GLY  28   5.063  -8.924   9.443
  203    H    VAL  29           H        VAL  29   3.650  -6.369   7.461
  204    HA   VAL  29           HA       VAL  29   1.257  -7.803   6.832
  205    HB   VAL  29           HB       VAL  29   1.469  -5.346   7.056
  206   1HG1  VAL  29          1HG1      VAL  29   3.772  -5.240   5.801
  207   2HG1  VAL  29          2HG1      VAL  29   2.784  -5.248   4.334
  208   3HG1  VAL  29          3HG1      VAL  29   2.587  -3.955   5.532
  209   1HG2  VAL  29          1HG2      VAL  29   0.617  -6.148   4.248
  210   2HG2  VAL  29          2HG2      VAL  29  -0.405  -6.252   5.689
  211   3HG2  VAL  29          3HG2      VAL  29   0.145  -4.676   5.103
  212    H    LYS  30           H        LYS  30   0.636  -8.788   4.863
  213    HA   LYS  30           HA       LYS  30   2.759  -9.218   2.829
  214   1HB   LYS  30          2HB       LYS  30   1.172 -11.133   3.622
  215   2HB   LYS  30          3HB       LYS  30   0.000 -10.342   2.560
  216   1HG   LYS  30          2HG       LYS  30   2.616 -11.665   1.841
  217   2HG   LYS  30          3HG       LYS  30   0.987 -11.990   1.228
  218   1HD   LYS  30          2HD       LYS  30   1.078  -9.627   0.161
  219   2HD   LYS  30          3HD       LYS  30   2.792  -9.605   0.630
  220   1HE   LYS  30          2HE       LYS  30   2.854 -10.136  -1.538
  221   2HE   LYS  30          3HE       LYS  30   3.097 -11.715  -0.770
  222   1HZ   LYS  30          1HZ       LYS  30   1.375 -11.186  -2.713
  223   2HZ   LYS  30          2HZ       LYS  30   0.939 -12.340  -1.555
  224   3HZ   LYS  30          3HZ       LYS  30   0.427 -10.752  -1.555
  225    H    TYR  31           H        TYR  31   2.905  -7.534   1.573
  226    HA   TYR  31           HA       TYR  31   0.550  -5.995   0.590
  227   1HB   TYR  31          2HB       TYR  31   2.108  -4.174   0.193
  228   2HB   TYR  31          3HB       TYR  31   2.094  -4.632   1.892
  229    HD1  TYR  31           HD1      TYR  31   4.017  -6.127   2.792
  230    HD2  TYR  31           HD2      TYR  31   4.159  -4.160  -1.036
  231    HE1  TYR  31           HE1      TYR  31   6.417  -6.630   2.640
  232    HE2  TYR  31           HE2      TYR  31   6.598  -4.640  -1.167
  233    HH   TYR  31           HH       TYR  31   8.435  -5.248   0.111
  234    H    ASP  32           H        ASP  32   0.407  -5.714  -1.657
  235    HA   ASP  32           HA       ASP  32   2.274  -7.172  -3.455
  236   1HB   ASP  32          2HB       ASP  32  -0.756  -7.173  -3.243
  237   2HB   ASP  32          3HB       ASP  32   0.052  -7.613  -4.736
  238    H    ILE  33           H        ILE  33   2.511  -6.074  -5.467
  239    HA   ILE  33           HA       ILE  33   1.373  -3.320  -5.621
  240    HB   ILE  33           HB       ILE  33   4.220  -3.958  -6.370
  241   1HG1  ILE  33          2HG1      ILE  33   4.496  -2.398  -4.178
  242   2HG1  ILE  33          3HG1      ILE  33   3.126  -3.345  -3.632
  243   1HG2  ILE  33          1HG2      ILE  33   3.067  -2.014  -7.371
  244   2HG2  ILE  33          2HG2      ILE  33   2.766  -1.356  -5.752
  245   3HG2  ILE  33          3HG2      ILE  33   4.431  -1.537  -6.349
  246   1HD1  ILE  33          1HD1      ILE  33   5.768  -4.462  -4.728
  247   2HD1  ILE  33          2HD1      ILE  33   5.334  -4.352  -3.023
  248   3HD1  ILE  33          3HD1      ILE  33   4.432  -5.444  -4.086
  249    H    ASP  34           H        ASP  34   0.570  -2.908  -7.654
  250    HA   ASP  34           HA       ASP  34   1.640  -4.493  -9.963
  251   1HB   ASP  34          2HB       ASP  34  -0.770  -4.890  -9.737
  252   2HB   ASP  34          3HB       ASP  34  -1.062  -3.136  -9.798
  253    H    LEU  35           H        LEU  35   2.890  -3.349 -11.242
  254    HA   LEU  35           HA       LEU  35   3.296  -0.500 -10.841
  255   1HB   LEU  35          2HB       LEU  35   4.603  -2.616 -12.536
  256   2HB   LEU  35          3HB       LEU  35   4.883  -0.914 -12.883
  257    HG   LEU  35           HG       LEU  35   6.630  -1.958 -11.517
  258   1HD1  LEU  35          1HD1      LEU  35   5.242   0.315 -10.037
  259   2HD1  LEU  35          2HD1      LEU  35   6.945  -0.144  -9.940
  260   3HD1  LEU  35          3HD1      LEU  35   6.287   0.490 -11.456
  261   1HD2  LEU  35          1HD2      LEU  35   5.231  -3.470 -10.147
  262   2HD2  LEU  35          2HD2      LEU  35   6.323  -2.471  -9.172
  263   3HD2  LEU  35          3HD2      LEU  35   4.603  -2.068  -9.255
  264    HA   PRO  36           HA       PRO  36   1.948  -0.067 -15.380
  265   1HB   PRO  36          2HB       PRO  36   0.032  -1.856 -16.389
  266   2HB   PRO  36          3HB       PRO  36   1.789  -1.878 -16.707
  267   1HG   PRO  36          2HG       PRO  36   0.248  -3.461 -14.654
  268   2HG   PRO  36          3HG       PRO  36   1.547  -4.032 -15.735
  269   1HD   PRO  36          2HD       PRO  36   2.046  -3.455 -13.187
  270   2HD   PRO  36          3HD       PRO  36   3.215  -2.936 -14.432
  271    H    ASN  37           H        ASN  37  -0.523  -1.483 -13.167
  272    HA   ASN  37           HA       ASN  37  -2.492   0.574 -13.941
  273   1HB   ASN  37          2HB       ASN  37  -2.667  -1.618 -11.843
  274   2HB   ASN  37          3HB       ASN  37  -3.972  -0.580 -12.406
  275   1HD2  ASN  37          1HD2      ASN  37  -1.756  -3.173 -13.377
  276   2HD2  ASN  37          2HD2      ASN  37  -2.754  -3.766 -14.712
  277    H    LYS  38           H        LYS  38   0.181   0.516 -11.809
  278    HA   LYS  38           HA       LYS  38   0.752   1.512  -9.948
  279   1HB   LYS  38          2HB       LYS  38  -1.105   3.772 -10.790
  280   2HB   LYS  38          3HB       LYS  38   0.208   3.784  -9.603
  281   1HG   LYS  38          2HG       LYS  38   1.332   4.670 -11.407
  282   2HG   LYS  38          3HG       LYS  38   1.709   2.952 -11.583
  283   1HD   LYS  38          2HD       LYS  38  -0.346   2.855 -13.162
  284   2HD   LYS  38          3HD       LYS  38  -0.358   4.616 -13.097
  285   1HE   LYS  38          2HE       LYS  38   1.885   4.695 -14.096
  286   2HE   LYS  38          3HE       LYS  38   2.075   2.941 -13.904
  287   1HZ   LYS  38          1HZ       LYS  38   0.094   4.199 -15.673
  288   2HZ   LYS  38          2HZ       LYS  38   1.497   3.469 -16.145
  289   3HZ   LYS  38          3HZ       LYS  38   0.310   2.583 -15.427
  290    H    LYS  39           H        LYS  39  -0.486  -0.402  -9.139
  291    HA   LYS  39           HA       LYS  39  -2.656   0.488  -7.295
  292   1HB   LYS  39          2HB       LYS  39  -3.040  -1.270  -9.377
  293   2HB   LYS  39          3HB       LYS  39  -2.438  -2.383  -8.146
  294   1HG   LYS  39          2HG       LYS  39  -4.724  -2.466  -7.828
  295   2HG   LYS  39          3HG       LYS  39  -4.221  -1.318  -6.582
  296   1HD   LYS  39          2HD       LYS  39  -4.718   0.559  -8.285
  297   2HD   LYS  39          3HD       LYS  39  -5.406  -0.667  -9.344
  298   1HE   LYS  39          2HE       LYS  39  -6.324   0.027  -6.515
  299   2HE   LYS  39          3HE       LYS  39  -7.143   0.516  -8.013
  300   1HZ   LYS  39          1HZ       LYS  39  -6.796  -2.234  -6.994
  301   2HZ   LYS  39          2HZ       LYS  39  -8.187  -1.404  -7.014
  302   3HZ   LYS  39          3HZ       LYS  39  -7.497  -1.879  -8.436
  303    H    VAL  40           H        VAL  40  -2.482  -0.275  -5.115
  304    HA   VAL  40           HA       VAL  40  -0.409  -2.292  -4.555
  305    HB   VAL  40           HB       VAL  40  -1.193   0.298  -3.199
  306   1HG1  VAL  40          1HG1      VAL  40  -0.298  -0.540  -1.052
  307   2HG1  VAL  40          2HG1      VAL  40  -1.843  -1.256  -1.547
  308   3HG1  VAL  40          3HG1      VAL  40  -0.335  -2.196  -1.715
  309   1HG2  VAL  40          1HG2      VAL  40   1.444  -1.206  -3.331
  310   2HG2  VAL  40          2HG2      VAL  40   0.897  -0.063  -4.571
  311   3HG2  VAL  40          3HG2      VAL  40   1.164   0.512  -2.912
  312    H    CYS  41           H        CYS  41  -1.264  -4.001  -3.415
  313    HA   CYS  41           HA       CYS  41  -3.886  -3.592  -2.186
  314   1HB   CYS  41          2HB       CYS  41  -5.059  -5.296  -3.134
  315   2HB   CYS  41          3HB       CYS  41  -4.151  -4.748  -4.549
  316    HG   CYS  41           HG       CYS  41  -4.308  -7.269  -4.638
  317    H    ILE  42           H        ILE  42  -4.290  -5.218  -0.497
  318    HA   ILE  42           HA       ILE  42  -1.733  -6.250   0.651
  319    HB   ILE  42           HB       ILE  42  -3.810  -4.532   2.089
  320   1HG1  ILE  42          2HG1      ILE  42  -1.010  -3.810   1.092
  321   2HG1  ILE  42          3HG1      ILE  42  -2.541  -3.124   0.527
  322   1HG2  ILE  42          1HG2      ILE  42  -2.175  -4.611   3.960
  323   2HG2  ILE  42          2HG2      ILE  42  -2.650  -6.236   3.514
  324   3HG2  ILE  42          3HG2      ILE  42  -1.095  -5.583   2.949
  325   1HD1  ILE  42          1HD1      ILE  42  -1.561  -1.526   1.967
  326   2HD1  ILE  42          2HD1      ILE  42  -2.948  -2.218   2.829
  327   3HD1  ILE  42          3HD1      ILE  42  -1.296  -2.710   3.255
  328    H    GLU  43           H        GLU  43  -2.022  -8.093   1.901
  329    HA   GLU  43           HA       GLU  43  -4.787  -9.164   2.246
  330   1HB   GLU  43          2HB       GLU  43  -3.525 -10.009   0.137
  331   2HB   GLU  43          3HB       GLU  43  -2.489 -10.890   1.262
  332   1HG   GLU  43          2HG       GLU  43  -5.530 -11.127   1.064
  333   2HG   GLU  43          3HG       GLU  43  -4.368 -12.239   0.329
  334    H    SER  44           H        SER  44  -4.659  -8.610   4.482
  335    HA   SER  44           HA       SER  44  -3.052 -10.386   6.111
  336   1HB   SER  44          2HB       SER  44  -2.437  -7.400   6.117
  337   2HB   SER  44          3HB       SER  44  -1.937  -8.516   7.403
  338    HG   SER  44           HG       SER  44  -1.273  -9.459   4.948
  339    H    GLU  45           H        GLU  45  -3.877 -10.598   8.177
  340    HA   GLU  45           HA       GLU  45  -6.337  -9.236   8.920
  341   1HB   GLU  45          2HB       GLU  45  -4.460 -11.046  10.505
  342   2HB   GLU  45          3HB       GLU  45  -6.069 -10.514  11.006
  343   1HG   GLU  45          2HG       GLU  45  -7.058 -11.633   9.012
  344   2HG   GLU  45          3HG       GLU  45  -5.454 -12.238   8.555
  345    H    HIS  46           H        HIS  46  -5.149  -7.112   8.436
  346    HA   HIS  46           HA       HIS  46  -4.261  -5.945  11.042
  347   1HB   HIS  46          2HB       HIS  46  -3.228  -5.380   8.238
  348   2HB   HIS  46          3HB       HIS  46  -3.107  -4.195   9.539
  349    HD1  HIS  46           1HD      HIS  46  -1.929  -5.695  11.915
  350    HD2  HIS  46           2HD      HIS  46  -0.776  -6.118   7.902
  351    HE1  HIS  46           1HE      HIS  46   0.549  -6.306  11.922
  352    H    SER  47           H        SER  47  -5.096  -3.783  11.337
  353    HA   SER  47           HA       SER  47  -7.730  -3.391  10.198
  354   1HB   SER  47          2HB       SER  47  -7.232  -2.591  12.457
  355   2HB   SER  47          3HB       SER  47  -5.981  -1.508  11.805
  356    HG   SER  47           HG       SER  47  -7.951  -0.398  12.085
  357    H    MET  48           H        MET  48  -8.233  -2.386   8.372
  358    HA   MET  48           HA       MET  48  -6.470  -1.521   6.373
  359   1HB   MET  48          2HB       MET  48  -9.290  -0.476   6.904
  360   2HB   MET  48          3HB       MET  48  -8.382  -0.398   5.381
  361   1HG   MET  48          2HG       MET  48  -8.223  -2.965   5.563
  362   2HG   MET  48          3HG       MET  48  -9.505  -2.839   6.773
  363   1HE   MET  48          1HE       MET  48 -11.231  -0.377   5.508
  364   2HE   MET  48          2HE       MET  48 -12.438  -1.334   4.625
  365   3HE   MET  48          3HE       MET  48 -11.913  -1.853   6.244
  366    H    ASP  49           H        ASP  49  -8.095   0.337   8.946
  367    HA   ASP  49           HA       ASP  49  -7.238   2.908   8.164
  368   1HB   ASP  49          2HB       ASP  49  -8.969   2.610   9.863
  369   2HB   ASP  49          3HB       ASP  49  -7.803   1.842  10.962
  370    H    THR  50           H        THR  50  -5.767   0.772  10.532
  371    HA   THR  50           HA       THR  50  -3.481   2.266  11.096
  372    HB   THR  50           HB       THR  50  -3.607  -0.778  10.960
  373    HG1  THR  50           1HG      THR  50  -4.144  -0.267  13.295
  374   1HG2  THR  50          1HG2      THR  50  -1.973  -0.657  12.812
  375   2HG2  THR  50          2HG2      THR  50  -1.338   0.133  11.363
  376   3HG2  THR  50          3HG2      THR  50  -1.962   1.119  12.701
  377    H    LEU  51           H        LEU  51  -3.873  -0.247   8.517
  378    HA   LEU  51           HA       LEU  51  -1.232  -0.001   7.461
  379   1HB   LEU  51          2HB       LEU  51  -3.834  -0.632   6.003
  380   2HB   LEU  51          3HB       LEU  51  -2.210  -0.787   5.305
  381    HG   LEU  51           HG       LEU  51  -3.058  -2.217   7.864
  382   1HD1  LEU  51          1HD1      LEU  51  -3.428  -4.225   6.303
  383   2HD1  LEU  51          2HD1      LEU  51  -4.653  -2.949   6.276
  384   3HD1  LEU  51          3HD1      LEU  51  -3.454  -3.048   4.977
  385   1HD2  LEU  51          1HD2      LEU  51  -0.631  -2.155   7.467
  386   2HD2  LEU  51          2HD2      LEU  51  -1.227  -3.791   7.171
  387   3HD2  LEU  51          3HD2      LEU  51  -0.864  -2.718   5.800
  388    H    LEU  52           H        LEU  52  -4.279   1.576   6.368
  389    HA   LEU  52           HA       LEU  52  -3.348   3.134   4.314
  390   1HB   LEU  52          2HB       LEU  52  -5.614   2.554   5.062
  391   2HB   LEU  52          3HB       LEU  52  -5.500   3.687   6.398
  392    HG   LEU  52           HG       LEU  52  -5.340   4.452   3.442
  393   1HD1  LEU  52          1HD1      LEU  52  -7.747   5.041   3.812
  394   2HD1  LEU  52          2HD1      LEU  52  -7.430   3.307   4.078
  395   3HD1  LEU  52          3HD1      LEU  52  -7.617   4.382   5.468
  396   1HD2  LEU  52          1HD2      LEU  52  -5.665   6.020   6.043
  397   2HD2  LEU  52          2HD2      LEU  52  -4.368   6.195   4.840
  398   3HD2  LEU  52          3HD2      LEU  52  -6.014   6.707   4.436
  399    H    ALA  53           H        ALA  53  -3.816   4.162   7.732
  400    HA   ALA  53           HA       ALA  53  -2.663   6.704   7.480
  401   1HB   ALA  53          1HB       ALA  53  -2.880   4.919   9.948
  402   2HB   ALA  53          2HB       ALA  53  -2.636   6.678   9.960
  403   3HB   ALA  53          3HB       ALA  53  -4.153   5.996   9.337
  404    H    THR  54           H        THR  54  -1.103   3.582   8.205
  405    HA   THR  54           HA       THR  54   1.488   4.721   8.750
  406    HB   THR  54           HB       THR  54   0.681   1.966   7.732
  407    HG1  THR  54           1HG      THR  54  -0.097   2.379   9.738
  408   1HG2  THR  54          1HG2      THR  54   2.949   2.344   7.102
  409   2HG2  THR  54          2HG2      THR  54   3.350   3.065   8.686
  410   3HG2  THR  54          3HG2      THR  54   2.960   1.342   8.541
  411    H    LEU  55           H        LEU  55   0.205   3.132   5.788
  412    HA   LEU  55           HA       LEU  55   2.524   3.617   4.301
  413   1HB   LEU  55          2HB       LEU  55   1.475   2.688   2.496
  414   2HB   LEU  55          3HB       LEU  55   1.073   1.826   3.947
  415    HG   LEU  55           HG       LEU  55  -1.152   3.006   3.924
  416   1HD1  LEU  55          1HD1      LEU  55  -1.708   3.525   1.398
  417   2HD1  LEU  55          2HD1      LEU  55  -0.907   4.751   2.393
  418   3HD1  LEU  55          3HD1      LEU  55   0.069   3.754   1.298
  419   1HD2  LEU  55          1HD2      LEU  55  -0.371   1.130   1.649
  420   2HD2  LEU  55          2HD2      LEU  55  -0.744   0.625   3.316
  421   3HD2  LEU  55          3HD2      LEU  55  -2.013   1.332   2.294
  422    H    LYS  56           H        LYS  56  -0.378   5.482   4.543
  423    HA   LYS  56           HA       LYS  56  -0.291   7.485   2.807
  424   1HB   LYS  56          2HB       LYS  56  -1.607   7.214   5.094
  425   2HB   LYS  56          3HB       LYS  56  -0.356   8.270   5.745
  426   1HG   LYS  56          2HG       LYS  56  -1.013   9.908   3.893
  427   2HG   LYS  56          3HG       LYS  56  -2.283   8.735   3.447
  428   1HD   LYS  56          2HD       LYS  56  -3.179   8.856   5.778
  429   2HD   LYS  56          3HD       LYS  56  -1.981  10.113   6.152
  430   1HE   LYS  56          2HE       LYS  56  -2.975  11.591   4.417
  431   2HE   LYS  56          3HE       LYS  56  -4.105  10.312   3.943
  432   1HZ   LYS  56          1HZ       LYS  56  -5.146  11.910   5.363
  433   2HZ   LYS  56          2HZ       LYS  56  -5.103  10.452   6.117
  434   3HZ   LYS  56          3HZ       LYS  56  -4.063  11.646   6.570
  435    H    LYS  57           H        LYS  57   2.091   7.073   5.395
  436    HA   LYS  57           HA       LYS  57   3.240   9.669   5.344
  437   1HB   LYS  57          2HB       LYS  57   4.322   6.986   6.238
  438   2HB   LYS  57          3HB       LYS  57   5.096   8.550   6.573
  439   1HG   LYS  57          2HG       LYS  57   2.968   9.279   7.705
  440   2HG   LYS  57          3HG       LYS  57   2.314   7.648   7.434
  441   1HD   LYS  57          2HD       LYS  57   4.432   6.784   8.657
  442   2HD   LYS  57          3HD       LYS  57   4.646   8.445   9.215
  443   1HE   LYS  57          2HE       LYS  57   2.371   6.490   9.773
  444   2HE   LYS  57          3HE       LYS  57   3.456   7.246  10.941
  445   1HZ   LYS  57          1HZ       LYS  57   1.318   8.542   9.381
  446   2HZ   LYS  57          2HZ       LYS  57   1.314   8.251  10.994
  447   3HZ   LYS  57          3HZ       LYS  57   2.361   9.362  10.375
  448    H    THR  58           H        THR  58   3.504   7.212   2.891
  449    HA   THR  58           HA       THR  58   6.032   7.925   1.775
  450    HB   THR  58           HB       THR  58   4.831   7.419  -0.427
  451    HG1  THR  58           1HG      THR  58   2.701   7.990   0.434
  452   1HG2  THR  58          1HG2      THR  58   4.595   5.424   1.838
  453   2HG2  THR  58          2HG2      THR  58   4.578   5.027   0.104
  454   3HG2  THR  58          3HG2      THR  58   6.043   5.713   0.853
  455    H    GLY  59           H        GLY  59   3.021   9.754   2.065
  456   1HA   GLY  59          2HA       GLY  59   2.560  11.912   1.518
  457   2HA   GLY  59          3HA       GLY  59   4.289  12.158   1.170
  458    H    LYS  60           H        LYS  60   1.978   9.869  -0.288
  459    HA   LYS  60           HA       LYS  60   2.061  11.218  -2.922
  460   1HB   LYS  60          2HB       LYS  60   2.553   8.289  -2.194
  461   2HB   LYS  60          3HB       LYS  60   2.222   8.807  -3.832
  462   1HG   LYS  60          2HG       LYS  60   4.606   9.677  -2.101
  463   2HG   LYS  60          3HG       LYS  60   4.610   8.468  -3.364
  464   1HD   LYS  60          2HD       LYS  60   4.320  11.485  -3.622
  465   2HD   LYS  60          3HD       LYS  60   5.560  10.433  -4.318
  466   1HE   LYS  60          2HE       LYS  60   3.706   9.362  -5.731
  467   2HE   LYS  60          3HE       LYS  60   2.617  10.625  -5.140
  468   1HZ   LYS  60          1HZ       LYS  60   3.249  11.443  -7.029
  469   2HZ   LYS  60          2HZ       LYS  60   4.425  12.169  -6.129
  470   3HZ   LYS  60          3HZ       LYS  60   4.732  10.813  -7.077
  471    H    THR  61           H        THR  61   0.272  10.363  -4.317
  472    HA   THR  61           HA       THR  61  -2.199  10.364  -3.031
  473    HB   THR  61           HB       THR  61  -1.715   9.411  -5.832
  474    HG1  THR  61           1HG      THR  61  -0.948  11.377  -6.458
  475   1HG2  THR  61          1HG2      THR  61  -4.034   9.934  -5.069
  476   2HG2  THR  61          2HG2      THR  61  -3.516  11.594  -4.688
  477   3HG2  THR  61          3HG2      THR  61  -3.509  11.023  -6.371
  478    H    VAL  62           H        VAL  62  -1.163   8.290  -1.734
  479    HA   VAL  62           HA       VAL  62  -2.081   5.726  -2.882
  480    HB   VAL  62           HB       VAL  62  -1.656   5.037  -0.407
  481   1HG1  VAL  62          1HG1      VAL  62   0.682   4.532  -1.028
  482   2HG1  VAL  62          2HG1      VAL  62  -0.469   4.236  -2.350
  483   3HG1  VAL  62          3HG1      VAL  62   0.552   5.700  -2.368
  484   1HG2  VAL  62          1HG2      VAL  62   0.261   7.390  -0.544
  485   2HG2  VAL  62          2HG2      VAL  62  -1.237   7.389   0.428
  486   3HG2  VAL  62          3HG2      VAL  62   0.067   6.227   0.762
  487    H    SER  63           H        SER  63  -4.135   6.105  -3.343
  488    HA   SER  63           HA       SER  63  -6.072   6.936  -1.241
  489   1HB   SER  63          2HB       SER  63  -6.441   6.131  -4.153
  490   2HB   SER  63          3HB       SER  63  -7.717   6.749  -3.078
  491    HG   SER  63           HG       SER  63  -6.708   8.389  -4.408
  492    H    TYR  64           H        TYR  64  -7.637   5.463  -0.425
  493    HA   TYR  64           HA       TYR  64  -7.043   2.550  -0.695
  494   1HB   TYR  64          2HB       TYR  64  -6.896   3.262   1.573
  495   2HB   TYR  64          3HB       TYR  64  -8.311   4.296   1.421
  496    HD1  TYR  64           HD1      TYR  64  -7.491   0.642   0.892
  497    HD2  TYR  64           HD2      TYR  64 -10.314   3.563   2.342
  498    HE1  TYR  64           HE1      TYR  64  -9.174  -1.127   1.201
  499    HE2  TYR  64           HE2      TYR  64 -12.001   1.794   2.621
  500    HH   TYR  64           HH       TYR  64 -12.537  -0.397   2.187
  501    H    LEU  65           H        LEU  65  -8.520   1.302  -1.829
  502    HA   LEU  65           HA       LEU  65 -11.332   2.039  -1.902
  503   1HB   LEU  65          2HB       LEU  65 -11.316   1.950  -4.452
  504   2HB   LEU  65          3HB       LEU  65 -10.981   3.437  -3.596
  505    HG   LEU  65           HG       LEU  65  -9.591   3.073  -5.553
  506   1HD1  LEU  65          1HD1      LEU  65  -8.933   4.489  -3.557
  507   2HD1  LEU  65          2HD1      LEU  65  -7.702   3.220  -3.330
  508   3HD1  LEU  65          3HD1      LEU  65  -7.756   4.141  -4.831
  509   1HD2  LEU  65          1HD2      LEU  65  -8.198   0.840  -4.098
  510   2HD2  LEU  65          2HD2      LEU  65  -9.183   0.711  -5.580
  511   3HD2  LEU  65          3HD2      LEU  65  -7.674   1.615  -5.596
  512    H    GLY  66           H        GLY  66 -11.200  -0.119  -0.745
  513   1HA   GLY  66          2HA       GLY  66 -12.899  -1.740  -1.844
  514   2HA   GLY  66          3HA       GLY  66 -11.490  -2.338  -2.730
  515    H    LEU  67           H        LEU  67 -13.327  -3.419  -0.398
  516    HA   LEU  67           HA       LEU  67 -11.184  -4.536   1.300
  517   1HB   LEU  67          2HB       LEU  67 -12.367  -3.110   2.774
  518   2HB   LEU  67          3HB       LEU  67 -13.877  -3.282   1.882
  519    HG   LEU  67           HG       LEU  67 -14.158  -5.551   2.654
  520   1HD1  LEU  67          1HD1      LEU  67 -12.801  -6.399   4.577
  521   2HD1  LEU  67          2HD1      LEU  67 -11.767  -6.179   3.159
  522   3HD1  LEU  67          3HD1      LEU  67 -11.742  -4.983   4.464
  523   1HD2  LEU  67          1HD2      LEU  67 -13.774  -3.527   4.893
  524   2HD2  LEU  67          2HD2      LEU  67 -15.203  -3.680   3.848
  525   3HD2  LEU  67          3HD2      LEU  67 -14.783  -4.986   4.969
  526    H    GLU  68           H        GLU  68 -11.190  -6.795   0.984
  527    HA   GLU  68           HA       GLU  68 -13.510  -8.112  -0.293
  528   1HB   GLU  68          2HB       GLU  68 -10.539  -7.874  -0.802
  529   2HB   GLU  68          3HB       GLU  68 -11.357  -9.358  -1.202
  530   1HG   GLU  68          2HG       GLU  68 -12.690  -8.281  -2.897
  531   2HG   GLU  68          3HG       GLU  68 -12.456  -6.683  -2.170
  Start of MODEL   14
    1   1H    MET   1           H1       MET   1 -11.937  -9.222   6.918
    2   2H    MET   1           H2       MET   1 -13.000 -10.166   6.062
    3   3H    MET   1           H3       MET   1 -11.421 -10.650   6.261
    4    HA   MET   1           HA       MET   1 -11.740  -9.846   4.094
    5   1HB   MET   1          2HB       MET   1 -12.797  -7.378   5.539
    6   2HB   MET   1          3HB       MET   1 -12.334  -7.390   3.832
    7   1HG   MET   1          2HG       MET   1 -14.692  -7.724   3.893
    8   2HG   MET   1          3HG       MET   1 -13.955  -9.259   3.447
    9   1HE   MET   1          1HE       MET   1 -16.808  -9.562   4.046
   10   2HE   MET   1          2HE       MET   1 -15.711 -10.963   3.956
   11   3HE   MET   1          3HE       MET   1 -16.866 -10.820   5.303
   12    HA   PRO   2           HA       PRO   2  -7.691  -8.448   5.789
   13   1HB   PRO   2          2HB       PRO   2  -6.049 -10.286   4.727
   14   2HB   PRO   2          3HB       PRO   2  -7.209 -10.743   6.004
   15   1HG   PRO   2          2HG       PRO   2  -7.535 -11.048   3.001
   16   2HG   PRO   2          3HG       PRO   2  -7.764 -12.304   4.247
   17   1HD   PRO   2          2HD       PRO   2  -9.830 -10.802   3.214
   18   2HD   PRO   2          3HD       PRO   2  -9.830 -11.392   4.902
   19    H    LYS   3           H        LYS   3  -8.946  -8.528   2.508
   20    HA   LYS   3           HA       LYS   3  -6.412  -7.569   1.397
   21   1HB   LYS   3          2HB       LYS   3  -7.754  -9.420   0.318
   22   2HB   LYS   3          3HB       LYS   3  -8.900  -8.162  -0.145
   23   1HG   LYS   3          2HG       LYS   3  -6.852  -6.922  -1.196
   24   2HG   LYS   3          3HG       LYS   3  -5.934  -8.385  -0.832
   25   1HD   LYS   3          2HD       LYS   3  -6.550  -8.726  -3.066
   26   2HD   LYS   3          3HD       LYS   3  -7.774  -9.646  -2.167
   27   1HE   LYS   3          2HE       LYS   3  -9.218  -7.485  -2.296
   28   2HE   LYS   3          3HE       LYS   3  -8.054  -6.883  -3.475
   29   1HZ   LYS   3          1HZ       LYS   3  -8.717  -8.629  -4.956
   30   2HZ   LYS   3          2HZ       LYS   3  -9.541  -9.423  -3.735
   31   3HZ   LYS   3          3HZ       LYS   3 -10.132  -8.069  -4.251
   32    H    HIS   4           H        HIS   4  -6.068  -5.484   1.127
   33    HA   HIS   4           HA       HIS   4  -8.301  -3.519   1.063
   34   1HB   HIS   4          2HB       HIS   4  -5.565  -3.166   2.332
   35   2HB   HIS   4          3HB       HIS   4  -6.914  -2.033   2.322
   36    HD1  HIS   4           1HD      HIS   4  -5.733  -5.226   4.111
   37    HD2  HIS   4           2HD      HIS   4  -9.169  -2.883   3.648
   38    HE1  HIS   4           1HE      HIS   4  -7.299  -5.886   5.994
   39    H    GLU   5           H        GLU   5  -8.403  -2.771  -1.015
   40    HA   GLU   5           HA       GLU   5  -5.991  -2.701  -2.743
   41   1HB   GLU   5          2HB       GLU   5  -8.989  -2.550  -3.105
   42   2HB   GLU   5          3HB       GLU   5  -7.926  -1.927  -4.363
   43   1HG   GLU   5          2HG       GLU   5  -7.294  -4.653  -3.317
   44   2HG   GLU   5          3HG       GLU   5  -8.733  -4.442  -4.333
   45    H    PHE   6           H        PHE   6  -5.142  -0.835  -3.552
   46    HA   PHE   6           HA       PHE   6  -6.400   1.744  -2.858
   47   1HB   PHE   6          2HB       PHE   6  -3.453   1.005  -2.472
   48   2HB   PHE   6          3HB       PHE   6  -4.143   2.566  -2.102
   49    HD1  PHE   6           1HD      PHE   6  -3.936  -1.008  -1.066
   50    HD2  PHE   6           2HD      PHE   6  -5.171   2.961   0.086
   51    HE1  PHE   6           1HE      PHE   6  -4.134  -1.746   1.268
   52    HE2  PHE   6           2HE      PHE   6  -5.610   2.123   2.383
   53    HZ   PHE   6           HZ       PHE   6  -5.021  -0.198   3.005
   54    H    SER   7           H        SER   7  -6.184   3.241  -4.470
   55    HA   SER   7           HA       SER   7  -4.683   2.446  -6.937
   56   1HB   SER   7          2HB       SER   7  -7.143   3.083  -7.176
   57   2HB   SER   7          3HB       SER   7  -6.659   4.734  -6.699
   58    HG   SER   7           HG       SER   7  -6.630   4.432  -8.971
   59    H    VAL   8           H        VAL   8  -2.910   3.686  -7.537
   60    HA   VAL   8           HA       VAL   8  -2.055   5.866  -5.733
   61    HB   VAL   8           HB       VAL   8  -0.370   3.539  -6.816
   62   1HG1  VAL   8          1HG1      VAL   8   1.007   4.183  -4.757
   63   2HG1  VAL   8          2HG1      VAL   8   0.938   5.429  -6.000
   64   3HG1  VAL   8          3HG1      VAL   8  -0.081   5.571  -4.554
   65   1HG2  VAL   8          1HG2      VAL   8  -0.574   2.636  -4.405
   66   2HG2  VAL   8          2HG2      VAL   8  -2.003   3.659  -4.253
   67   3HG2  VAL   8          3HG2      VAL   8  -1.952   2.368  -5.471
   68    H    ASP   9           H        ASP   9  -0.166   7.071  -6.789
   69    HA   ASP   9           HA       ASP   9   0.206   6.363  -9.642
   70   1HB   ASP   9          2HB       ASP   9  -0.539   8.676  -9.586
   71   2HB   ASP   9          3HB       ASP   9   0.726   9.088  -8.412
   72    H    MET  10           H        MET  10   1.573   4.684  -8.997
   73    HA   MET  10           HA       MET  10   4.076   5.349  -7.572
   74   1HB   MET  10          2HB       MET  10   3.050   2.791  -8.866
   75   2HB   MET  10          3HB       MET  10   4.667   2.972  -8.180
   76   1HG   MET  10          2HG       MET  10   3.659   3.625  -5.997
   77   2HG   MET  10          3HG       MET  10   2.056   3.339  -6.678
   78   1HE   MET  10          1HE       MET  10   2.305   0.668  -8.283
   79   2HE   MET  10          2HE       MET  10   1.831  -0.475  -7.018
   80   3HE   MET  10          3HE       MET  10   1.006   1.089  -7.141
   81    H    THR  11           H        THR  11   4.693   7.089  -8.943
   82    HA   THR  11           HA       THR  11   4.550   6.959 -11.711
   83    HB   THR  11           HB       THR  11   6.512   8.804 -10.378
   84    HG1  THR  11           1HG      THR  11   3.782   9.189  -9.833
   85   1HG2  THR  11          1HG2      THR  11   5.247  10.517 -11.623
   86   2HG2  THR  11          2HG2      THR  11   5.771   9.205 -12.702
   87   3HG2  THR  11          3HG2      THR  11   4.082   9.290 -12.157
   88    H    CYS  12           H        CYS  12   7.056   5.768  -9.565
   89    HA   CYS  12           HA       CYS  12   8.775   5.035 -11.861
   90   1HB   CYS  12          2HB       CYS  12   9.775   7.151 -11.079
   91   2HB   CYS  12          3HB       CYS  12   9.696   6.593  -9.391
   92    HG   CYS  12           HG       CYS  12  12.158   6.514 -10.174
   93    H    GLY  13           H        GLY  13  10.033   3.121 -11.278
   94   1HA   GLY  13          2HA       GLY  13   8.941   1.168  -9.662
   95   2HA   GLY  13          3HA       GLY  13  10.668   1.292 -10.044
   96    H    GLY  14           H        GLY  14  11.274   3.723  -8.637
   97   1HA   GLY  14          2HA       GLY  14  11.741   2.701  -6.069
   98   2HA   GLY  14          3HA       GLY  14  11.900   4.416  -6.520
   99    H    CYS  15           H        CYS  15   8.842   4.234  -7.272
  100    HA   CYS  15           HA       CYS  15   7.748   5.140  -4.768
  101   1HB   CYS  15          2HB       CYS  15   6.344   4.234  -7.273
  102   2HB   CYS  15          3HB       CYS  15   5.585   4.950  -5.836
  103    HG   CYS  15           HG       CYS  15   8.075   6.292  -7.490
  104    H    ALA  16           H        ALA  16   7.908   2.008  -6.521
  105    HA   ALA  16           HA       ALA  16   6.168   0.581  -4.719
  106   1HB   ALA  16          1HB       ALA  16   8.359  -0.498  -6.558
  107   2HB   ALA  16          2HB       ALA  16   7.116  -1.438  -5.747
  108   3HB   ALA  16          3HB       ALA  16   6.650  -0.266  -6.999
  109    H    GLU  17           H        GLU  17   9.723   1.141  -4.890
  110    HA   GLU  17           HA       GLU  17  10.350  -0.352  -2.539
  111   1HB   GLU  17          2HB       GLU  17  11.689   2.123  -3.721
  112   2HB   GLU  17          3HB       GLU  17  12.147   1.394  -2.200
  113   1HG   GLU  17          2HG       GLU  17  12.292  -0.858  -3.565
  114   2HG   GLU  17          3HG       GLU  17  12.399   0.224  -4.963
  115    H    ALA  18           H        ALA  18   9.229   3.060  -2.886
  116    HA   ALA  18           HA       ALA  18   9.464   3.705  -0.136
  117   1HB   ALA  18          1HB       ALA  18   9.022   5.369  -1.927
  118   2HB   ALA  18          2HB       ALA  18   7.354   4.768  -2.061
  119   3HB   ALA  18          3HB       ALA  18   7.903   5.515  -0.554
  120    H    VAL  19           H        VAL  19   6.624   2.465  -1.930
  121    HA   VAL  19           HA       VAL  19   4.889   2.207   0.292
  122    HB   VAL  19           HB       VAL  19   5.009   0.691  -2.343
  123   1HG1  VAL  19          1HG1      VAL  19   2.649   0.099  -1.878
  124   2HG1  VAL  19          2HG1      VAL  19   3.720  -0.642  -0.706
  125   3HG1  VAL  19          3HG1      VAL  19   2.785   0.814  -0.262
  126   1HG2  VAL  19          1HG2      VAL  19   3.213   2.980  -1.402
  127   2HG2  VAL  19          2HG2      VAL  19   4.602   3.187  -2.478
  128   3HG2  VAL  19          3HG2      VAL  19   3.220   2.228  -3.010
  129    H    SER  20           H        SER  20   7.088  -0.198  -1.213
  130    HA   SER  20           HA       SER  20   6.467  -2.338   0.535
  131   1HB   SER  20          2HB       SER  20   7.756  -2.629  -1.586
  132   2HB   SER  20          3HB       SER  20   9.029  -1.555  -0.990
  133    HG   SER  20           HG       SER  20   9.678  -3.682  -0.813
  134    H    ARG  21           H        ARG  21   9.059   0.123   0.853
  135    HA   ARG  21           HA       ARG  21  10.051  -0.906   3.289
  136   1HB   ARG  21          2HB       ARG  21  10.200   1.842   2.006
  137   2HB   ARG  21          3HB       ARG  21  11.101   1.386   3.464
  138   1HG   ARG  21          2HG       ARG  21  12.238  -0.413   2.308
  139   2HG   ARG  21          3HG       ARG  21  11.273  -0.216   0.861
  140   1HD   ARG  21          2HD       ARG  21  12.173   2.022   0.468
  141   2HD   ARG  21          3HD       ARG  21  13.206   1.908   1.887
  142    HE   ARG  21           HE       ARG  21  13.632   0.709  -0.776
  143   1HH1  ARG  21          2HH2      ARG  21  14.431   0.248   2.623
  144   2HH1  ARG  21          1HH2      ARG  21  15.937  -0.565   2.288
  145   1HH2  ARG  21          2HH1      ARG  21  15.425  -0.275  -1.239
  146   2HH2  ARG  21          1HH1      ARG  21  16.559  -0.912  -0.049
  147    H    VAL  22           H        VAL  22   7.598   1.807   2.765
  148    HA   VAL  22           HA       VAL  22   7.261   2.232   5.498
  149    HB   VAL  22           HB       VAL  22   6.512   3.617   3.409
  150   1HG1  VAL  22          1HG1      VAL  22   4.109   3.478   2.919
  151   2HG1  VAL  22          2HG1      VAL  22   4.896   1.963   2.537
  152   3HG1  VAL  22          3HG1      VAL  22   3.946   2.110   4.036
  153   1HG2  VAL  22          1HG2      VAL  22   4.796   4.756   4.759
  154   2HG2  VAL  22          2HG2      VAL  22   4.828   3.400   5.909
  155   3HG2  VAL  22          3HG2      VAL  22   6.297   4.393   5.663
  156    H    LEU  23           H        LEU  23   5.437  -0.118   3.329
  157    HA   LEU  23           HA       LEU  23   3.860  -0.987   5.566
  158   1HB   LEU  23          2HB       LEU  23   4.344  -2.063   2.792
  159   2HB   LEU  23          3HB       LEU  23   3.520  -3.000   4.014
  160    HG   LEU  23           HG       LEU  23   1.794  -2.154   2.942
  161   1HD1  LEU  23          1HD1      LEU  23   1.549  -1.650   5.393
  162   2HD1  LEU  23          2HD1      LEU  23   2.012   0.036   5.031
  163   3HD1  LEU  23          3HD1      LEU  23   0.551  -0.648   4.327
  164   1HD2  LEU  23          1HD2      LEU  23   2.919  -0.696   1.475
  165   2HD2  LEU  23          2HD2      LEU  23   1.458   0.097   2.111
  166   3HD2  LEU  23          3HD2      LEU  23   3.057   0.553   2.731
  167    H    ASN  24           H        ASN  24   6.896  -2.312   4.206
  168    HA   ASN  24           HA       ASN  24   7.171  -4.547   5.891
  169   1HB   ASN  24          2HB       ASN  24   8.755  -4.276   4.162
  170   2HB   ASN  24          3HB       ASN  24   9.089  -2.603   4.599
  171   1HD2  ASN  24          1HD2      ASN  24  10.297  -2.082   6.409
  172   2HD2  ASN  24          2HD2      ASN  24  11.470  -3.231   7.075
  173    H    LYS  25           H        LYS  25   7.972  -1.120   6.488
  174    HA   LYS  25           HA       LYS  25   9.080  -1.355   9.047
  175   1HB   LYS  25          2HB       LYS  25   7.691   0.796   7.462
  176   2HB   LYS  25          3HB       LYS  25   7.781   1.054   9.190
  177   1HG   LYS  25          2HG       LYS  25  10.200   0.349   7.469
  178   2HG   LYS  25          3HG       LYS  25   9.669   2.011   7.754
  179   1HD   LYS  25          2HD       LYS  25   9.927   1.733  10.191
  180   2HD   LYS  25          3HD       LYS  25  10.460   0.059   9.974
  181   1HE   LYS  25          2HE       LYS  25  12.398   0.858   8.606
  182   2HE   LYS  25          3HE       LYS  25  11.891   2.532   8.888
  183   1HZ   LYS  25          1HZ       LYS  25  13.612   1.854  10.401
  184   2HZ   LYS  25          2HZ       LYS  25  12.237   2.165  11.244
  185   3HZ   LYS  25          3HZ       LYS  25  12.705   0.611  10.974
  186    H    LEU  26           H        LEU  26   5.693  -1.488   8.125
  187    HA   LEU  26           HA       LEU  26   4.554  -1.122  10.694
  188   1HB   LEU  26          2HB       LEU  26   3.531  -1.248   8.337
  189   2HB   LEU  26          3HB       LEU  26   3.450  -2.964   8.495
  190    HG   LEU  26           HG       LEU  26   1.425  -1.472   8.949
  191   1HD1  LEU  26          1HD1      LEU  26   0.395  -2.970  10.474
  192   2HD1  LEU  26          2HD1      LEU  26   1.348  -3.854   9.269
  193   3HD1  LEU  26          3HD1      LEU  26   1.970  -3.672  10.933
  194   1HD2  LEU  26          1HD2      LEU  26   2.523  -1.373  11.789
  195   2HD2  LEU  26          2HD2      LEU  26   2.556   0.013  10.674
  196   3HD2  LEU  26          3HD2      LEU  26   1.007  -0.686  11.182
  197    H    GLY  27           H        GLY  27   5.849  -3.958   9.012
  198   1HA   GLY  27          2HA       GLY  27   6.827  -5.300  11.133
  199   2HA   GLY  27          3HA       GLY  27   5.111  -5.745  11.232
  200    H    GLY  28           H        GLY  28   4.204  -7.151   9.700
  201   1HA   GLY  28          2HA       GLY  28   6.052  -8.501   7.762
  202   2HA   GLY  28          3HA       GLY  28   5.195  -9.419   9.010
  203    H    VAL  29           H        VAL  29   3.740  -6.632   7.575
  204    HA   VAL  29           HA       VAL  29   1.414  -7.877   6.559
  205    HB   VAL  29           HB       VAL  29   1.503  -5.528   7.161
  206   1HG1  VAL  29          1HG1      VAL  29   3.827  -4.960   6.719
  207   2HG1  VAL  29          2HG1      VAL  29   3.577  -5.191   4.989
  208   3HG1  VAL  29          3HG1      VAL  29   2.745  -3.874   5.854
  209   1HG2  VAL  29          1HG2      VAL  29   1.230  -5.600   4.131
  210   2HG2  VAL  29          2HG2      VAL  29  -0.034  -6.157   5.253
  211   3HG2  VAL  29          3HG2      VAL  29   0.482  -4.461   5.259
  212    H    LYS  30           H        LYS  30   0.848  -8.549   4.467
  213    HA   LYS  30           HA       LYS  30   3.019  -8.646   2.445
  214   1HB   LYS  30          2HB       LYS  30   1.553 -10.718   2.993
  215   2HB   LYS  30          3HB       LYS  30   0.364  -9.919   1.958
  216   1HG   LYS  30          2HG       LYS  30   3.144 -10.902   1.287
  217   2HG   LYS  30          3HG       LYS  30   1.608 -11.383   0.555
  218   1HD   LYS  30          2HD       LYS  30   1.453  -9.065  -0.512
  219   2HD   LYS  30          3HD       LYS  30   3.004  -8.677   0.256
  220   1HE   LYS  30          2HE       LYS  30   3.668  -9.093  -1.817
  221   2HE   LYS  30          3HE       LYS  30   4.087 -10.547  -0.915
  222   1HZ   LYS  30          1HZ       LYS  30   1.877 -10.166  -2.880
  223   2HZ   LYS  30          2HZ       LYS  30   3.117 -11.161  -3.005
  224   3HZ   LYS  30          3HZ       LYS  30   1.943 -11.489  -1.895
  225    H    TYR  31           H        TYR  31   3.077  -6.697   1.690
  226    HA   TYR  31           HA       TYR  31   0.758  -5.271   0.483
  227   1HB   TYR  31          2HB       TYR  31   2.589  -3.718  -0.313
  228   2HB   TYR  31          3HB       TYR  31   2.290  -3.762   1.417
  229    HD1  TYR  31           HD1      TYR  31   4.747  -4.679  -1.221
  230    HD2  TYR  31           HD2      TYR  31   3.834  -4.905   2.945
  231    HE1  TYR  31           HE1      TYR  31   7.125  -5.128  -0.732
  232    HE2  TYR  31           HE2      TYR  31   6.243  -5.257   3.478
  233    HH   TYR  31           HH       TYR  31   8.692  -4.707   1.048
  234    H    ASP  32           H        ASP  32   0.110  -6.014  -1.566
  235    HA   ASP  32           HA       ASP  32   2.322  -6.939  -3.334
  236   1HB   ASP  32          2HB       ASP  32   0.099  -8.398  -2.906
  237   2HB   ASP  32          3HB       ASP  32  -0.504  -7.336  -4.191
  238    H    ILE  33           H        ILE  33   1.994  -6.177  -5.605
  239    HA   ILE  33           HA       ILE  33   1.426  -3.237  -5.554
  240    HB   ILE  33           HB       ILE  33   4.244  -4.376  -5.727
  241   1HG1  ILE  33          2HG1      ILE  33   2.846  -2.734  -3.562
  242   2HG1  ILE  33          3HG1      ILE  33   3.506  -4.371  -3.400
  243   1HG2  ILE  33          1HG2      ILE  33   4.989  -2.119  -6.012
  244   2HG2  ILE  33          2HG2      ILE  33   3.707  -2.306  -7.187
  245   3HG2  ILE  33          3HG2      ILE  33   3.378  -1.472  -5.653
  246   1HD1  ILE  33          1HD1      ILE  33   5.780  -3.535  -3.702
  247   2HD1  ILE  33          2HD1      ILE  33   5.164  -1.861  -3.808
  248   3HD1  ILE  33          3HD1      ILE  33   4.954  -2.779  -2.325
  249    H    ASP  34           H        ASP  34   0.246  -3.170  -7.383
  250    HA   ASP  34           HA       ASP  34   1.286  -4.378  -9.892
  251   1HB   ASP  34          2HB       ASP  34  -1.128  -4.561  -9.385
  252   2HB   ASP  34          3HB       ASP  34  -1.219  -2.789  -9.348
  253    H    LEU  35           H        LEU  35   3.059  -3.194 -10.391
  254    HA   LEU  35           HA       LEU  35   3.216  -0.345 -10.061
  255   1HB   LEU  35          2HB       LEU  35   5.157  -1.823  -9.869
  256   2HB   LEU  35          3HB       LEU  35   5.032  -2.228 -11.583
  257    HG   LEU  35           HG       LEU  35   5.501   0.140 -12.180
  258   1HD1  LEU  35          1HD1      LEU  35   5.806   0.538  -9.164
  259   2HD1  LEU  35          2HD1      LEU  35   6.391   1.673 -10.389
  260   3HD1  LEU  35          3HD1      LEU  35   4.659   1.371 -10.240
  261   1HD2  LEU  35          1HD2      LEU  35   7.860   0.128 -11.552
  262   2HD2  LEU  35          2HD2      LEU  35   7.543  -1.020 -10.234
  263   3HD2  LEU  35          3HD2      LEU  35   7.340  -1.523 -11.929
  264    HA   PRO  36           HA       PRO  36   2.690  -0.168 -14.850
  265   1HB   PRO  36          2HB       PRO  36   0.897  -2.010 -15.968
  266   2HB   PRO  36          3HB       PRO  36   2.673  -2.064 -16.081
  267   1HG   PRO  36          2HG       PRO  36   0.882  -3.535 -14.176
  268   2HG   PRO  36          3HG       PRO  36   2.325  -4.145 -15.025
  269   1HD   PRO  36          2HD       PRO  36   2.424  -3.436 -12.461
  270   2HD   PRO  36          3HD       PRO  36   3.789  -3.025 -13.529
  271    H    ASN  37           H        ASN  37  -0.083  -1.544 -12.948
  272    HA   ASN  37           HA       ASN  37  -1.860   0.548 -14.065
  273   1HB   ASN  37          2HB       ASN  37  -2.453  -1.679 -12.106
  274   2HB   ASN  37          3HB       ASN  37  -3.617  -0.564 -12.785
  275   1HD2  ASN  37          1HD2      ASN  37  -2.090  -3.583 -13.299
  276   2HD2  ASN  37          2HD2      ASN  37  -2.486  -3.767 -15.010
  277    H    LYS  38           H        LYS  38   0.188   0.184 -11.245
  278    HA   LYS  38           HA       LYS  38   0.614   1.523  -9.557
  279   1HB   LYS  38          2HB       LYS  38  -1.169   3.644 -10.824
  280   2HB   LYS  38          3HB       LYS  38  -0.158   3.790  -9.410
  281   1HG   LYS  38          2HG       LYS  38   1.069   4.821 -11.135
  282   2HG   LYS  38          3HG       LYS  38   1.881   3.302 -10.743
  283   1HD   LYS  38          2HD       LYS  38   1.945   3.690 -13.083
  284   2HD   LYS  38          3HD       LYS  38   0.955   2.277 -12.752
  285   1HE   LYS  38          2HE       LYS  38  -1.116   3.672 -13.043
  286   2HE   LYS  38          3HE       LYS  38  -0.097   5.076 -13.397
  287   1HZ   LYS  38          1HZ       LYS  38  -0.942   3.880 -15.363
  288   2HZ   LYS  38          2HZ       LYS  38   0.708   3.931 -15.323
  289   3HZ   LYS  38          3HZ       LYS  38  -0.072   2.546 -14.917
  290    H    LYS  39           H        LYS  39  -0.886  -0.486  -9.035
  291    HA   LYS  39           HA       LYS  39  -2.950   0.580  -7.147
  292   1HB   LYS  39          2HB       LYS  39  -2.981  -2.208  -8.340
  293   2HB   LYS  39          3HB       LYS  39  -4.091  -1.519  -7.158
  294   1HG   LYS  39          2HG       LYS  39  -5.096  -0.063  -8.736
  295   2HG   LYS  39          3HG       LYS  39  -3.780  -0.270  -9.887
  296   1HD   LYS  39          2HD       LYS  39  -5.621  -1.496 -10.724
  297   2HD   LYS  39          3HD       LYS  39  -4.381  -2.647 -10.252
  298   1HE   LYS  39          2HE       LYS  39  -6.904  -1.974  -8.620
  299   2HE   LYS  39          3HE       LYS  39  -6.735  -3.333  -9.736
  300   1HZ   LYS  39          1HZ       LYS  39  -5.500  -3.018  -7.104
  301   2HZ   LYS  39          2HZ       LYS  39  -6.355  -4.211  -7.635
  302   3HZ   LYS  39          3HZ       LYS  39  -4.821  -4.046  -8.219
  303    H    VAL  40           H        VAL  40  -2.577  -0.018  -4.982
  304    HA   VAL  40           HA       VAL  40  -0.356  -1.903  -4.421
  305    HB   VAL  40           HB       VAL  40  -1.332   0.680  -3.181
  306   1HG1  VAL  40          1HG1      VAL  40  -0.068   0.103  -1.133
  307   2HG1  VAL  40          2HG1      VAL  40  -1.554  -0.823  -1.412
  308   3HG1  VAL  40          3HG1      VAL  40   0.034  -1.584  -1.723
  309   1HG2  VAL  40          1HG2      VAL  40   1.057   1.169  -3.115
  310   2HG2  VAL  40          2HG2      VAL  40   1.439  -0.477  -3.697
  311   3HG2  VAL  40          3HG2      VAL  40   0.597   0.668  -4.748
  312    H    CYS  41           H        CYS  41  -1.053  -3.641  -3.297
  313    HA   CYS  41           HA       CYS  41  -3.977  -3.872  -2.684
  314   1HB   CYS  41          2HB       CYS  41  -2.455  -5.949  -4.301
  315   2HB   CYS  41          3HB       CYS  41  -4.209  -5.753  -4.048
  316    HG   CYS  41           HG       CYS  41  -4.368  -3.479  -5.288
  317    H    ILE  42           H        ILE  42  -3.623  -3.993  -0.465
  318    HA   ILE  42           HA       ILE  42  -1.401  -5.702   0.514
  319    HB   ILE  42           HB       ILE  42  -3.346  -3.963   2.059
  320   1HG1  ILE  42          2HG1      ILE  42  -0.489  -3.424   1.099
  321   2HG1  ILE  42          3HG1      ILE  42  -1.944  -2.602   0.535
  322   1HG2  ILE  42          1HG2      ILE  42  -1.714  -4.269   3.914
  323   2HG2  ILE  42          2HG2      ILE  42  -2.357  -5.814   3.394
  324   3HG2  ILE  42          3HG2      ILE  42  -0.739  -5.310   2.864
  325   1HD1  ILE  42          1HD1      ILE  42  -0.703  -2.393   3.286
  326   2HD1  ILE  42          2HD1      ILE  42  -0.837  -1.146   2.041
  327   3HD1  ILE  42          3HD1      ILE  42  -2.298  -1.724   2.863
  328    H    GLU  43           H        GLU  43  -1.773  -7.631   1.586
  329    HA   GLU  43           HA       GLU  43  -4.579  -8.590   1.914
  330   1HB   GLU  43          2HB       GLU  43  -3.459  -9.299  -0.307
  331   2HB   GLU  43          3HB       GLU  43  -2.405 -10.319   0.680
  332   1HG   GLU  43          2HG       GLU  43  -5.465 -10.433   0.696
  333   2HG   GLU  43          3HG       GLU  43  -4.425 -11.469  -0.290
  334    H    SER  44           H        SER  44  -4.420  -8.295   4.160
  335    HA   SER  44           HA       SER  44  -2.842 -10.259   5.587
  336   1HB   SER  44          2HB       SER  44  -2.173  -7.298   5.909
  337   2HB   SER  44          3HB       SER  44  -1.658  -8.566   7.035
  338    HG   SER  44           HG       SER  44  -1.056  -9.301   4.533
  339    H    GLU  45           H        GLU  45  -3.530 -10.512   7.741
  340    HA   GLU  45           HA       GLU  45  -6.085  -9.381   8.473
  341   1HB   GLU  45          2HB       GLU  45  -5.509 -10.588  10.699
  342   2HB   GLU  45          3HB       GLU  45  -6.035 -11.470   9.265
  343   1HG   GLU  45          2HG       GLU  45  -3.862 -12.148   8.701
  344   2HG   GLU  45          3HG       GLU  45  -3.123 -11.019   9.877
  345    H    HIS  46           H        HIS  46  -5.136  -7.154   8.095
  346    HA   HIS  46           HA       HIS  46  -4.300  -5.995  10.713
  347   1HB   HIS  46          2HB       HIS  46  -3.279  -5.277   7.934
  348   2HB   HIS  46          3HB       HIS  46  -3.041  -4.275   9.369
  349    HD1  HIS  46           1HD      HIS  46  -2.150  -6.612  11.405
  350    HD2  HIS  46           2HD      HIS  46  -0.754  -5.846   7.520
  351    HE1  HIS  46           1HE      HIS  46   0.300  -7.334  11.348
  352    H    SER  47           H        SER  47  -5.291  -3.999  11.133
  353    HA   SER  47           HA       SER  47  -7.868  -3.650   9.927
  354   1HB   SER  47          2HB       SER  47  -7.388  -3.010  12.263
  355   2HB   SER  47          3HB       SER  47  -6.291  -1.739  11.687
  356    HG   SER  47           HG       SER  47  -8.363  -0.899  12.075
  357    H    MET  48           H        MET  48  -8.413  -2.569   8.141
  358    HA   MET  48           HA       MET  48  -6.959  -1.433   6.184
  359   1HB   MET  48          2HB       MET  48  -9.422  -1.954   6.326
  360   2HB   MET  48          3HB       MET  48  -9.649  -0.485   7.286
  361   1HG   MET  48          2HG       MET  48  -8.865   0.867   5.386
  362   2HG   MET  48          3HG       MET  48  -8.478  -0.616   4.498
  363   1HE   MET  48          1HE       MET  48 -11.330   1.680   5.900
  364   2HE   MET  48          2HE       MET  48 -12.793   0.809   5.381
  365   3HE   MET  48          3HE       MET  48 -11.775   0.130   6.667
  366    H    ASP  49           H        ASP  49  -8.333   0.256   9.013
  367    HA   ASP  49           HA       ASP  49  -7.526   2.906   8.660
  368   1HB   ASP  49          2HB       ASP  49  -8.849   2.540  10.562
  369   2HB   ASP  49          3HB       ASP  49  -7.941   1.104  11.051
  370    H    THR  50           H        THR  50  -5.833   0.438  10.428
  371    HA   THR  50           HA       THR  50  -3.611   2.004  11.039
  372    HB   THR  50           HB       THR  50  -3.807  -1.027  11.026
  373    HG1  THR  50           1HG      THR  50  -5.185   0.935  12.443
  374   1HG2  THR  50          1HG2      THR  50  -2.291   0.896  12.851
  375   2HG2  THR  50          2HG2      THR  50  -2.384  -0.867  13.039
  376   3HG2  THR  50          3HG2      THR  50  -1.557  -0.174  11.634
  377    H    LEU  51           H        LEU  51  -4.090  -0.394   8.416
  378    HA   LEU  51           HA       LEU  51  -1.455  -0.174   7.267
  379   1HB   LEU  51          2HB       LEU  51  -4.137  -0.516   5.859
  380   2HB   LEU  51          3HB       LEU  51  -2.538  -0.686   5.111
  381    HG   LEU  51           HG       LEU  51  -3.552  -2.371   7.469
  382   1HD1  LEU  51          1HD1      LEU  51  -4.968  -2.771   5.555
  383   2HD1  LEU  51          2HD1      LEU  51  -3.569  -2.979   4.491
  384   3HD1  LEU  51          3HD1      LEU  51  -3.898  -4.163   5.777
  385   1HD2  LEU  51          1HD2      LEU  51  -1.684  -3.904   6.684
  386   2HD2  LEU  51          2HD2      LEU  51  -1.111  -2.577   5.660
  387   3HD2  LEU  51          3HD2      LEU  51  -1.138  -2.399   7.428
  388    H    LEU  52           H        LEU  52  -4.483   1.653   6.607
  389    HA   LEU  52           HA       LEU  52  -3.462   3.521   4.827
  390   1HB   LEU  52          2HB       LEU  52  -5.838   3.168   6.345
  391   2HB   LEU  52          3HB       LEU  52  -5.359   4.817   6.626
  392    HG   LEU  52           HG       LEU  52  -5.348   3.710   3.805
  393   1HD1  LEU  52          1HD1      LEU  52  -7.747   4.305   3.591
  394   2HD1  LEU  52          2HD1      LEU  52  -7.447   2.922   4.659
  395   3HD1  LEU  52          3HD1      LEU  52  -7.827   4.518   5.354
  396   1HD2  LEU  52          1HD2      LEU  52  -4.491   5.993   4.236
  397   2HD2  LEU  52          2HD2      LEU  52  -5.927   5.984   3.197
  398   3HD2  LEU  52          3HD2      LEU  52  -6.083   6.447   4.904
  399    H    ALA  53           H        ALA  53  -3.545   3.830   8.393
  400    HA   ALA  53           HA       ALA  53  -2.246   6.350   8.548
  401   1HB   ALA  53          1HB       ALA  53  -1.949   5.789  10.929
  402   2HB   ALA  53          2HB       ALA  53  -3.577   5.317  10.396
  403   3HB   ALA  53          3HB       ALA  53  -2.313   4.085  10.592
  404    H    THR  54           H        THR  54  -0.875   3.047   8.577
  405    HA   THR  54           HA       THR  54   1.831   3.877   8.902
  406    HB   THR  54           HB       THR  54   0.698   1.533   7.296
  407    HG1  THR  54           1HG      THR  54   0.013   1.468   9.409
  408   1HG2  THR  54          1HG2      THR  54   3.448   1.824   8.537
  409   2HG2  THR  54          2HG2      THR  54   2.795   0.517   7.521
  410   3HG2  THR  54          3HG2      THR  54   3.103   2.079   6.807
  411    H    LEU  55           H        LEU  55   0.050   3.086   5.890
  412    HA   LEU  55           HA       LEU  55   2.290   3.689   4.303
  413   1HB   LEU  55          2HB       LEU  55   1.001   3.053   2.458
  414   2HB   LEU  55          3HB       LEU  55   0.685   2.011   3.806
  415    HG   LEU  55           HG       LEU  55  -1.412   3.311   4.229
  416   1HD1  LEU  55          1HD1      LEU  55  -2.010   4.214   1.683
  417   2HD1  LEU  55          2HD1      LEU  55  -1.543   5.236   3.045
  418   3HD1  LEU  55          3HD1      LEU  55  -0.294   4.667   1.913
  419   1HD2  LEU  55          1HD2      LEU  55  -1.078   1.795   1.606
  420   2HD2  LEU  55          2HD2      LEU  55  -1.337   1.063   3.209
  421   3HD2  LEU  55          3HD2      LEU  55  -2.615   2.041   2.469
  422    H    LYS  56           H        LYS  56  -0.498   5.576   5.060
  423    HA   LYS  56           HA       LYS  56  -0.552   7.820   3.626
  424   1HB   LYS  56          2HB       LYS  56  -0.623   7.335   6.583
  425   2HB   LYS  56          3HB       LYS  56  -0.351   9.001   6.140
  426   1HG   LYS  56          2HG       LYS  56  -2.401   8.982   4.716
  427   2HG   LYS  56          3HG       LYS  56  -2.744   7.355   5.308
  428   1HD   LYS  56          2HD       LYS  56  -2.359   8.506   7.713
  429   2HD   LYS  56          3HD       LYS  56  -2.575   9.996   6.812
  430   1HE   LYS  56          2HE       LYS  56  -4.713   9.493   7.720
  431   2HE   LYS  56          3HE       LYS  56  -4.825   9.094   6.000
  432   1HZ   LYS  56          1HZ       LYS  56  -4.412   7.180   8.221
  433   2HZ   LYS  56          2HZ       LYS  56  -5.793   7.384   7.364
  434   3HZ   LYS  56          3HZ       LYS  56  -4.453   6.776   6.628
  435    H    LYS  57           H        LYS  57   2.088   7.086   5.877
  436    HA   LYS  57           HA       LYS  57   3.360   9.599   5.868
  437   1HB   LYS  57          2HB       LYS  57   4.380   6.802   6.429
  438   2HB   LYS  57          3HB       LYS  57   5.297   8.287   6.785
  439   1HG   LYS  57          2HG       LYS  57   3.355   9.051   8.198
  440   2HG   LYS  57          3HG       LYS  57   2.565   7.504   7.907
  441   1HD   LYS  57          2HD       LYS  57   5.338   7.710   9.153
  442   2HD   LYS  57          3HD       LYS  57   3.843   7.816  10.104
  443   1HE   LYS  57          2HE       LYS  57   3.086   5.642   9.217
  444   2HE   LYS  57          3HE       LYS  57   4.601   5.448   8.318
  445   1HZ   LYS  57          1HZ       LYS  57   5.751   5.463  10.442
  446   2HZ   LYS  57          2HZ       LYS  57   4.322   5.624  11.249
  447   3HZ   LYS  57          3HZ       LYS  57   4.628   4.262  10.385
  448    H    THR  58           H        THR  58   3.334   7.298   3.206
  449    HA   THR  58           HA       THR  58   5.840   8.119   2.035
  450    HB   THR  58           HB       THR  58   4.718   7.398  -0.109
  451    HG1  THR  58           1HG      THR  58   2.536   7.900   0.598
  452   1HG2  THR  58          1HG2      THR  58   4.531   5.546   2.281
  453   2HG2  THR  58          2HG2      THR  58   4.540   5.021   0.581
  454   3HG2  THR  58          3HG2      THR  58   5.972   5.819   1.281
  455    H    GLY  59           H        GLY  59   2.701   9.680   2.361
  456   1HA   GLY  59          2HA       GLY  59   1.891  11.661   1.629
  457   2HA   GLY  59          3HA       GLY  59   3.585  12.187   1.485
  458    H    LYS  60           H        LYS  60   1.352   9.925  -0.226
  459    HA   LYS  60           HA       LYS  60   1.805  11.255  -2.816
  460   1HB   LYS  60          2HB       LYS  60   1.974   8.243  -2.295
  461   2HB   LYS  60          3HB       LYS  60   2.097   9.013  -3.876
  462   1HG   LYS  60          2HG       LYS  60   4.056   9.400  -1.567
  463   2HG   LYS  60          3HG       LYS  60   4.271   8.260  -2.864
  464   1HD   LYS  60          2HD       LYS  60   4.558   9.903  -4.525
  465   2HD   LYS  60          3HD       LYS  60   3.877  11.196  -3.547
  466   1HE   LYS  60          2HE       LYS  60   6.535   9.809  -2.961
  467   2HE   LYS  60          3HE       LYS  60   6.315  11.365  -3.769
  468   1HZ   LYS  60          1HZ       LYS  60   5.053  12.005  -1.663
  469   2HZ   LYS  60          2HZ       LYS  60   5.751  10.734  -0.949
  470   3HZ   LYS  60          3HZ       LYS  60   6.707  11.918  -1.563
  471    H    THR  61           H        THR  61   0.095  10.424  -4.405
  472    HA   THR  61           HA       THR  61  -2.464  10.571  -3.284
  473    HB   THR  61           HB       THR  61  -1.753   9.603  -6.057
  474    HG1  THR  61           1HG      THR  61  -1.399  12.271  -5.178
  475   1HG2  THR  61          1HG2      THR  61  -3.676  11.757  -5.044
  476   2HG2  THR  61          2HG2      THR  61  -3.476  11.248  -6.736
  477   3HG2  THR  61          3HG2      THR  61  -4.144  10.116  -5.544
  478    H    VAL  62           H        VAL  62  -1.412   8.341  -2.024
  479    HA   VAL  62           HA       VAL  62  -2.399   5.887  -3.341
  480    HB   VAL  62           HB       VAL  62  -0.380   5.639  -2.194
  481   1HG1  VAL  62          1HG1      VAL  62  -1.604   6.650   0.394
  482   2HG1  VAL  62          2HG1      VAL  62   0.021   5.977   0.150
  483   3HG1  VAL  62          3HG1      VAL  62  -0.399   7.497  -0.597
  484   1HG2  VAL  62          1HG2      VAL  62  -2.572   4.355  -0.524
  485   2HG2  VAL  62          2HG2      VAL  62  -1.926   3.746  -2.050
  486   3HG2  VAL  62          3HG2      VAL  62  -0.879   3.832  -0.631
  487    H    SER  63           H        SER  63  -4.538   6.336  -3.662
  488    HA   SER  63           HA       SER  63  -6.314   7.040  -1.402
  489   1HB   SER  63          2HB       SER  63  -6.850   6.397  -4.331
  490   2HB   SER  63          3HB       SER  63  -8.055   6.992  -3.167
  491    HG   SER  63           HG       SER  63  -7.018   8.656  -4.486
  492    H    TYR  64           H        TYR  64  -8.028   5.591  -0.724
  493    HA   TYR  64           HA       TYR  64  -7.339   2.696  -0.910
  494   1HB   TYR  64          2HB       TYR  64  -7.243   3.471   1.327
  495   2HB   TYR  64          3HB       TYR  64  -8.660   4.490   1.127
  496    HD1  TYR  64           HD1      TYR  64 -10.715   3.790   1.919
  497    HD2  TYR  64           HD2      TYR  64  -7.771   0.828   0.841
  498    HE1  TYR  64           HE1      TYR  64 -12.471   2.078   1.832
  499    HE2  TYR  64           HE2      TYR  64  -9.526  -0.892   0.795
  500    HH   TYR  64           HH       TYR  64 -12.979  -0.071   1.190
  501    H    LEU  65           H        LEU  65  -8.712   1.309  -1.986
  502    HA   LEU  65           HA       LEU  65 -11.559   1.818  -2.120
  503   1HB   LEU  65          2HB       LEU  65 -11.519   1.629  -4.664
  504   2HB   LEU  65          3HB       LEU  65 -11.295   3.169  -3.873
  505    HG   LEU  65           HG       LEU  65  -9.874   2.794  -5.810
  506   1HD1  LEU  65          1HD1      LEU  65  -9.357   4.379  -3.889
  507   2HD1  LEU  65          2HD1      LEU  65  -8.024   3.241  -3.579
  508   3HD1  LEU  65          3HD1      LEU  65  -8.142   4.065  -5.129
  509   1HD2  LEU  65          1HD2      LEU  65  -9.265   0.482  -5.702
  510   2HD2  LEU  65          2HD2      LEU  65  -7.829   1.483  -5.763
  511   3HD2  LEU  65          3HD2      LEU  65  -8.313   0.771  -4.223
  512    H    GLY  66           H        GLY  66 -11.288  -0.319  -0.886
  513   1HA   GLY  66          2HA       GLY  66 -12.818  -2.105  -1.983
  514   2HA   GLY  66          3HA       GLY  66 -11.331  -2.614  -2.790
  515    H    LEU  67           H        LEU  67 -13.227  -3.194  -0.051
  516    HA   LEU  67           HA       LEU  67 -10.991  -4.177   1.613
  517   1HB   LEU  67          2HB       LEU  67 -12.104  -2.423   2.774
  518   2HB   LEU  67          3HB       LEU  67 -13.678  -2.855   2.094
  519    HG   LEU  67           HG       LEU  67 -13.702  -4.915   3.360
  520   1HD1  LEU  67          1HD1      LEU  67 -11.228  -5.199   3.779
  521   2HD1  LEU  67          2HD1      LEU  67 -11.250  -3.718   4.761
  522   3HD1  LEU  67          3HD1      LEU  67 -12.113  -5.157   5.315
  523   1HD2  LEU  67          1HD2      LEU  67 -14.211  -3.854   5.551
  524   2HD2  LEU  67          2HD2      LEU  67 -13.370  -2.380   5.021
  525   3HD2  LEU  67          3HD2      LEU  67 -14.850  -2.912   4.191
  526    H    GLU  68           H        GLU  68 -10.978  -6.463   1.465
  527    HA   GLU  68           HA       GLU  68 -13.460  -7.934   0.793
  528   1HB   GLU  68          2HB       GLU  68 -12.406  -7.058  -1.326
  529   2HB   GLU  68          3HB       GLU  68 -10.914  -7.855  -0.844
  530   1HG   GLU  68          2HG       GLU  68 -12.197 -10.063  -0.955
  531   2HG   GLU  68          3HG       GLU  68 -13.512  -9.150  -1.725
  Start of MODEL   15
    1   1H    MET   1           H1       MET   1 -11.092 -11.118   1.542
    2   2H    MET   1           H2       MET   1 -12.502 -11.780   1.990
    3   3H    MET   1           H3       MET   1 -11.895 -10.397   2.709
    4    HA   MET   1           HA       MET   1 -11.490 -12.582   4.004
    5   1HB   MET   1          2HB       MET   1 -10.137 -13.105   1.698
    6   2HB   MET   1          3HB       MET   1  -8.846 -12.300   2.549
    7   1HG   MET   1          2HG       MET   1  -9.366 -14.041   4.462
    8   2HG   MET   1          3HG       MET   1 -10.485 -14.771   3.317
    9   1HE   MET   1          1HE       MET   1  -8.193 -16.347   4.821
   10   2HE   MET   1          2HE       MET   1  -9.330 -17.090   3.667
   11   3HE   MET   1          3HE       MET   1  -7.579 -17.356   3.490
   12    HA   PRO   2           HA       PRO   2  -9.421  -8.699   5.558
   13   1HB   PRO   2          2HB       PRO   2  -7.086  -8.992   6.782
   14   2HB   PRO   2          3HB       PRO   2  -8.484  -9.962   7.312
   15   1HG   PRO   2          2HG       PRO   2  -6.258 -10.834   5.439
   16   2HG   PRO   2          3HG       PRO   2  -6.853 -11.682   6.892
   17   1HD   PRO   2          2HD       PRO   2  -7.716 -12.252   4.366
   18   2HD   PRO   2          3HD       PRO   2  -8.779 -12.400   5.805
   19    H    LYS   3           H        LYS   3  -9.356  -8.414   2.874
   20    HA   LYS   3           HA       LYS   3  -6.651  -7.375   2.310
   21   1HB   LYS   3          2HB       LYS   3  -6.662  -9.403   1.237
   22   2HB   LYS   3          3HB       LYS   3  -8.340  -9.313   0.793
   23   1HG   LYS   3          2HG       LYS   3  -6.532  -7.258  -0.438
   24   2HG   LYS   3          3HG       LYS   3  -6.235  -8.911  -0.921
   25   1HD   LYS   3          2HD       LYS   3  -9.084  -7.875  -0.984
   26   2HD   LYS   3          3HD       LYS   3  -7.954  -7.386  -2.248
   27   1HE   LYS   3          2HE       LYS   3  -9.262  -9.400  -2.888
   28   2HE   LYS   3          3HE       LYS   3  -7.509  -9.664  -2.909
   29   1HZ   LYS   3          1HZ       LYS   3  -8.724 -11.488  -1.866
   30   2HZ   LYS   3          2HZ       LYS   3  -7.676 -10.803  -0.820
   31   3HZ   LYS   3          3HZ       LYS   3  -9.292 -10.471  -0.703
   32    H    HIS   4           H        HIS   4  -6.443  -5.582   1.162
   33    HA   HIS   4           HA       HIS   4  -8.896  -3.924   0.825
   34   1HB   HIS   4          2HB       HIS   4  -6.343  -3.149   2.262
   35   2HB   HIS   4          3HB       HIS   4  -7.850  -2.225   2.188
   36    HD1  HIS   4           1HD      HIS   4  -6.019  -4.740   4.246
   37    HD2  HIS   4           2HD      HIS   4 -10.029  -3.769   3.425
   38    HE1  HIS   4           1HE      HIS   4  -7.423  -5.913   6.016
   39    H    GLU   5           H        GLU   5  -8.822  -2.832  -1.127
   40    HA   GLU   5           HA       GLU   5  -6.284  -2.881  -2.706
   41   1HB   GLU   5          2HB       GLU   5  -9.218  -2.522  -3.451
   42   2HB   GLU   5          3HB       GLU   5  -7.887  -2.205  -4.548
   43   1HG   GLU   5          2HG       GLU   5  -7.216  -4.709  -3.699
   44   2HG   GLU   5          3HG       GLU   5  -8.983  -4.795  -3.627
   45    H    PHE   6           H        PHE   6  -5.296  -0.989  -3.376
   46    HA   PHE   6           HA       PHE   6  -6.665   1.576  -2.811
   47   1HB   PHE   6          2HB       PHE   6  -3.720   0.962  -2.226
   48   2HB   PHE   6          3HB       PHE   6  -4.544   2.459  -1.857
   49    HD1  PHE   6           1HD      PHE   6  -4.268  -1.152  -0.978
   50    HD2  PHE   6           2HD      PHE   6  -5.527   2.754   0.397
   51    HE1  PHE   6           1HE      PHE   6  -4.701  -2.061   1.252
   52    HE2  PHE   6           2HE      PHE   6  -6.152   1.763   2.554
   53    HZ   PHE   6           HZ       PHE   6  -5.688  -0.620   3.035
   54    H    SER   7           H        SER   7  -6.372   3.070  -4.393
   55    HA   SER   7           HA       SER   7  -4.760   2.284  -6.785
   56   1HB   SER   7          2HB       SER   7  -7.158   3.019  -7.138
   57   2HB   SER   7          3HB       SER   7  -6.661   4.638  -6.568
   58    HG   SER   7           HG       SER   7  -6.536   4.364  -8.868
   59    H    VAL   8           H        VAL   8  -3.118   3.711  -7.522
   60    HA   VAL   8           HA       VAL   8  -2.034   5.575  -5.459
   61    HB   VAL   8           HB       VAL   8  -0.762   3.138  -6.794
   62   1HG1  VAL   8          1HG1      VAL   8   0.905   4.739  -6.565
   63   2HG1  VAL   8          2HG1      VAL   8   0.392   5.204  -4.913
   64   3HG1  VAL   8          3HG1      VAL   8   1.116   3.605  -5.227
   65   1HG2  VAL   8          1HG2      VAL   8  -1.545   3.638  -3.899
   66   2HG2  VAL   8          2HG2      VAL   8  -2.244   2.411  -4.980
   67   3HG2  VAL   8          3HG2      VAL   8  -0.570   2.279  -4.464
   68    H    ASP   9           H        ASP   9  -0.855   7.333  -6.297
   69    HA   ASP   9           HA       ASP   9   0.208   6.963  -9.076
   70   1HB   ASP   9          2HB       ASP   9  -0.778   9.147  -8.959
   71   2HB   ASP   9          3HB       ASP   9   0.119   9.512  -7.468
   72    H    MET  10           H        MET  10   1.958   5.647  -8.774
   73    HA   MET  10           HA       MET  10   4.243   6.896  -7.332
   74   1HB   MET  10          2HB       MET  10   3.302   4.023  -7.623
   75   2HB   MET  10          3HB       MET  10   4.985   4.386  -7.311
   76   1HG   MET  10          2HG       MET  10   2.728   5.538  -5.614
   77   2HG   MET  10          3HG       MET  10   3.404   3.948  -5.325
   78   1HE   MET  10          1HE       MET  10   3.592   4.856  -2.795
   79   2HE   MET  10          2HE       MET  10   4.504   6.311  -2.337
   80   3HE   MET  10          3HE       MET  10   2.998   6.462  -3.275
   81    H    THR  11           H        THR  11   5.215   7.926  -9.046
   82    HA   THR  11           HA       THR  11   5.761   6.316 -11.511
   83    HB   THR  11           HB       THR  11   5.286   9.321 -11.454
   84    HG1  THR  11           1HG      THR  11   3.287   8.492 -10.947
   85   1HG2  THR  11          1HG2      THR  11   5.192   7.226 -13.687
   86   2HG2  THR  11          2HG2      THR  11   4.833   8.954 -13.864
   87   3HG2  THR  11          3HG2      THR  11   6.474   8.434 -13.481
   88    H    CYS  12           H        CYS  12   7.626   6.113  -9.411
   89    HA   CYS  12           HA       CYS  12   9.848   7.039 -11.046
   90   1HB   CYS  12          2HB       CYS  12   9.515   8.998  -9.487
   91   2HB   CYS  12          3HB       CYS  12   9.814   7.899  -8.123
   92    HG   CYS  12           HG       CYS  12  11.686   8.677 -10.723
   93    H    GLY  13           H        GLY  13   9.425   4.674 -11.208
   94   1HA   GLY  13          2HA       GLY  13   9.888   2.470 -10.754
   95   2HA   GLY  13          3HA       GLY  13  11.507   3.165 -10.679
   96    H    GLY  14           H        GLY  14  12.364   3.707  -8.558
   97   1HA   GLY  14          2HA       GLY  14  12.094   1.656  -6.621
   98   2HA   GLY  14          3HA       GLY  14  12.985   3.184  -6.416
   99    H    CYS  15           H        CYS  15  10.078   4.380  -7.125
  100    HA   CYS  15           HA       CYS  15   8.660   4.830  -4.803
  101   1HB   CYS  15          2HB       CYS  15   7.665   4.021  -7.533
  102   2HB   CYS  15          3HB       CYS  15   6.659   4.306  -6.097
  103    HG   CYS  15           HG       CYS  15   6.354   6.469  -7.081
  104    H    ALA  16           H        ALA  16   8.836   1.751  -6.677
  105    HA   ALA  16           HA       ALA  16   7.066   0.189  -5.156
  106   1HB   ALA  16          1HB       ALA  16   8.097  -0.548  -7.274
  107   2HB   ALA  16          2HB       ALA  16   9.688  -0.636  -6.485
  108   3HB   ALA  16          3HB       ALA  16   8.383  -1.736  -5.986
  109    H    GLU  17           H        GLU  17  10.526   0.958  -4.493
  110    HA   GLU  17           HA       GLU  17  10.593  -0.638  -2.062
  111   1HB   GLU  17          2HB       GLU  17  12.450   1.534  -3.137
  112   2HB   GLU  17          3HB       GLU  17  12.546   0.843  -1.529
  113   1HG   GLU  17          2HG       GLU  17  12.509  -1.490  -2.872
  114   2HG   GLU  17          3HG       GLU  17  13.174  -0.454  -4.150
  115    H    ALA  18           H        ALA  18   9.713   2.749  -2.881
  116    HA   ALA  18           HA       ALA  18   9.693   3.695  -0.181
  117   1HB   ALA  18          1HB       ALA  18   9.351   5.157  -2.200
  118   2HB   ALA  18          2HB       ALA  18   7.686   4.530  -2.315
  119   3HB   ALA  18          3HB       ALA  18   8.191   5.421  -0.881
  120    H    VAL  19           H        VAL  19   7.112   2.168  -2.135
  121    HA   VAL  19           HA       VAL  19   5.203   1.968  -0.038
  122    HB   VAL  19           HB       VAL  19   5.535   0.102  -2.435
  123   1HG1  VAL  19          1HG1      VAL  19   3.179  -0.417  -2.072
  124   2HG1  VAL  19          2HG1      VAL  19   4.071  -0.804  -0.605
  125   3HG1  VAL  19          3HG1      VAL  19   3.110   0.682  -0.674
  126   1HG2  VAL  19          1HG2      VAL  19   5.227   2.489  -3.134
  127   2HG2  VAL  19          2HG2      VAL  19   3.789   1.520  -3.473
  128   3HG2  VAL  19          3HG2      VAL  19   3.814   2.599  -2.064
  129    H    SER  20           H        SER  20   7.564  -0.478  -1.282
  130    HA   SER  20           HA       SER  20   6.792  -2.449   0.546
  131   1HB   SER  20          2HB       SER  20   8.252  -2.723  -1.543
  132   2HB   SER  20          3HB       SER  20   9.621  -2.135  -0.583
  133    HG   SER  20           HG       SER  20   9.343  -3.903   0.819
  134    H    ARG  21           H        ARG  21   9.318   0.025   0.999
  135    HA   ARG  21           HA       ARG  21  10.186  -0.970   3.523
  136   1HB   ARG  21          2HB       ARG  21  10.380   1.783   2.245
  137   2HB   ARG  21          3HB       ARG  21  11.177   1.320   3.759
  138   1HG   ARG  21          2HG       ARG  21  12.415  -0.476   2.618
  139   2HG   ARG  21          3HG       ARG  21  11.628  -0.112   1.091
  140   1HD   ARG  21          2HD       ARG  21  12.573   2.220   1.201
  141   2HD   ARG  21          3HD       ARG  21  13.479   1.715   2.652
  142    HE   ARG  21           HE       ARG  21  13.905   0.001   0.266
  143   1HH1  ARG  21          2HH2      ARG  21  14.966   3.008   1.786
  144   2HH1  ARG  21          1HH2      ARG  21  16.506   3.016   0.976
  145   1HH2  ARG  21          2HH1      ARG  21  15.755   0.051  -0.841
  146   2HH2  ARG  21          1HH1      ARG  21  16.991   1.257  -0.614
  147    H    VAL  22           H        VAL  22   7.777   1.761   2.745
  148    HA   VAL  22           HA       VAL  22   7.287   2.229   5.443
  149    HB   VAL  22           HB       VAL  22   6.752   3.646   3.359
  150   1HG1  VAL  22          1HG1      VAL  22   4.435   3.522   2.553
  151   2HG1  VAL  22          2HG1      VAL  22   5.255   1.995   2.253
  152   3HG1  VAL  22          3HG1      VAL  22   4.141   2.149   3.629
  153   1HG2  VAL  22          1HG2      VAL  22   6.236   4.357   5.592
  154   2HG2  VAL  22          2HG2      VAL  22   4.873   4.756   4.501
  155   3HG2  VAL  22          3HG2      VAL  22   4.742   3.368   5.601
  156    H    LEU  23           H        LEU  23   5.582  -0.084   3.196
  157    HA   LEU  23           HA       LEU  23   3.799  -1.002   5.246
  158   1HB   LEU  23          2HB       LEU  23   4.705  -2.032   2.539
  159   2HB   LEU  23          3HB       LEU  23   3.813  -3.074   3.612
  160    HG   LEU  23           HG       LEU  23   2.327  -2.111   2.022
  161   1HD1  LEU  23          1HD1      LEU  23   1.403  -2.701   4.222
  162   2HD1  LEU  23          2HD1      LEU  23   1.761  -1.067   4.832
  163   3HD1  LEU  23          3HD1      LEU  23   0.601  -1.280   3.529
  164   1HD2  LEU  23          1HD2      LEU  23   2.792   0.536   3.352
  165   2HD2  LEU  23          2HD2      LEU  23   3.513   0.067   1.787
  166   3HD2  LEU  23          3HD2      LEU  23   1.748   0.202   1.957
  167    H    ASN  24           H        ASN  24   6.991  -2.339   4.193
  168    HA   ASN  24           HA       ASN  24   7.039  -4.556   5.907
  169   1HB   ASN  24          2HB       ASN  24   8.746  -4.325   4.257
  170   2HB   ASN  24          3HB       ASN  24   9.145  -2.691   4.789
  171   1HD2  ASN  24          1HD2      ASN  24  10.257  -2.295   6.648
  172   2HD2  ASN  24          2HD2      ASN  24  11.307  -3.525   7.378
  173    H    LYS  25           H        LYS  25   7.934  -1.176   6.512
  174    HA   LYS  25           HA       LYS  25   8.975  -1.328   9.083
  175   1HB   LYS  25          2HB       LYS  25   7.551   0.763   7.425
  176   2HB   LYS  25          3HB       LYS  25   7.651   1.069   9.151
  177   1HG   LYS  25          2HG       LYS  25  10.083   0.335   7.467
  178   2HG   LYS  25          3HG       LYS  25   9.527   2.001   7.681
  179   1HD   LYS  25          2HD       LYS  25   9.761   1.830  10.125
  180   2HD   LYS  25          3HD       LYS  25  10.299   0.149   9.991
  181   1HE   LYS  25          2HE       LYS  25  12.258   0.891   8.623
  182   2HE   LYS  25          3HE       LYS  25  11.744   2.576   8.823
  183   1HZ   LYS  25          1HZ       LYS  25  12.523   0.747  11.005
  184   2HZ   LYS  25          2HZ       LYS  25  13.438   1.966  10.395
  185   3HZ   LYS  25          3HZ       LYS  25  12.047   2.311  11.199
  186    H    LEU  26           H        LEU  26   5.593  -1.495   8.120
  187    HA   LEU  26           HA       LEU  26   4.452  -1.037  10.683
  188   1HB   LEU  26          2HB       LEU  26   3.411  -0.996   8.453
  189   2HB   LEU  26          3HB       LEU  26   3.371  -2.728   8.346
  190    HG   LEU  26           HG       LEU  26   1.301  -1.439   8.937
  191   1HD1  LEU  26          1HD1      LEU  26   1.364  -3.828   9.116
  192   2HD1  LEU  26          2HD1      LEU  26   1.911  -3.712  10.811
  193   3HD1  LEU  26          3HD1      LEU  26   0.320  -3.066  10.331
  194   1HD2  LEU  26          1HD2      LEU  26   0.852  -0.799  11.237
  195   2HD2  LEU  26          2HD2      LEU  26   2.405  -1.437  11.789
  196   3HD2  LEU  26          3HD2      LEU  26   2.355   0.008  10.757
  197    H    GLY  27           H        GLY  27   5.733  -3.926   9.078
  198   1HA   GLY  27          2HA       GLY  27   6.410  -5.267  11.392
  199   2HA   GLY  27          3HA       GLY  27   4.712  -5.717  11.133
  200    H    GLY  28           H        GLY  28   4.150  -7.081   9.412
  201   1HA   GLY  28          2HA       GLY  28   6.250  -8.240   7.663
  202   2HA   GLY  28          3HA       GLY  28   5.491  -9.306   8.864
  203    H    VAL  29           H        VAL  29   4.084  -6.607   7.139
  204    HA   VAL  29           HA       VAL  29   1.667  -7.952   6.472
  205    HB   VAL  29           HB       VAL  29   1.695  -5.624   6.955
  206   1HG1  VAL  29          1HG1      VAL  29   3.504  -5.119   4.572
  207   2HG1  VAL  29          2HG1      VAL  29   2.740  -3.902   5.614
  208   3HG1  VAL  29          3HG1      VAL  29   3.975  -4.957   6.271
  209   1HG2  VAL  29          1HG2      VAL  29   1.186  -5.793   3.962
  210   2HG2  VAL  29          2HG2      VAL  29   0.073  -6.420   5.192
  211   3HG2  VAL  29          3HG2      VAL  29   0.438  -4.690   5.132
  212    H    LYS  30           H        LYS  30   1.093  -9.106   4.679
  213    HA   LYS  30           HA       LYS  30   2.861  -9.088   2.304
  214   1HB   LYS  30          2HB       LYS  30   2.017 -11.263   2.639
  215   2HB   LYS  30          3HB       LYS  30   0.376 -10.672   2.929
  216   1HG   LYS  30          2HG       LYS  30   0.496 -11.703   0.735
  217   2HG   LYS  30          3HG       LYS  30   0.138  -9.995   0.589
  218   1HD   LYS  30          2HD       LYS  30   2.818  -9.824   0.285
  219   2HD   LYS  30          3HD       LYS  30   2.667 -11.506  -0.173
  220   1HE   LYS  30          2HE       LYS  30   1.084  -9.186  -1.423
  221   2HE   LYS  30          3HE       LYS  30   2.668  -9.690  -2.006
  222   1HZ   LYS  30          1HZ       LYS  30   0.205 -11.288  -2.092
  223   2HZ   LYS  30          2HZ       LYS  30   1.045 -10.608  -3.337
  224   3HZ   LYS  30          3HZ       LYS  30   1.708 -11.850  -2.512
  225    H    TYR  31           H        TYR  31   2.646  -7.442   1.005
  226    HA   TYR  31           HA       TYR  31  -0.010  -6.541   0.219
  227   1HB   TYR  31          2HB       TYR  31   0.614  -4.239   0.137
  228   2HB   TYR  31          3HB       TYR  31   0.994  -4.761   1.782
  229    HD1  TYR  31           HD1      TYR  31   2.204  -3.104  -1.136
  230    HD2  TYR  31           HD2      TYR  31   3.531  -5.566   2.151
  231    HE1  TYR  31           HE1      TYR  31   4.540  -2.938  -1.926
  232    HE2  TYR  31           HE2      TYR  31   5.827  -5.539   1.239
  233    HH   TYR  31           HH       TYR  31   7.243  -4.652  -0.548
  234    H    ASP  32           H        ASP  32  -0.099  -6.004  -1.982
  235    HA   ASP  32           HA       ASP  32   2.261  -6.922  -3.537
  236   1HB   ASP  32          2HB       ASP  32  -0.068  -8.359  -3.336
  237   2HB   ASP  32          3HB       ASP  32  -0.467  -7.306  -4.697
  238    H    ILE  33           H        ILE  33   2.145  -6.154  -5.794
  239    HA   ILE  33           HA       ILE  33   1.430  -3.229  -5.778
  240    HB   ILE  33           HB       ILE  33   4.191  -4.172  -6.546
  241   1HG1  ILE  33          2HG1      ILE  33   4.562  -2.762  -4.264
  242   2HG1  ILE  33          3HG1      ILE  33   3.095  -3.603  -3.821
  243   1HG2  ILE  33          1HG2      ILE  33   4.741  -1.809  -6.335
  244   2HG2  ILE  33          2HG2      ILE  33   3.384  -1.994  -7.462
  245   3HG2  ILE  33          3HG2      ILE  33   3.091  -1.434  -5.802
  246   1HD1  ILE  33          1HD1      ILE  33   5.728  -4.815  -4.803
  247   2HD1  ILE  33          2HD1      ILE  33   5.028  -4.979  -3.189
  248   3HD1  ILE  33          3HD1      ILE  33   4.256  -5.782  -4.561
  249    H    ASP  34           H        ASP  34  -0.051  -3.408  -7.330
  250    HA   ASP  34           HA       ASP  34   0.529  -4.790  -9.899
  251   1HB   ASP  34          2HB       ASP  34  -1.748  -4.953  -8.981
  252   2HB   ASP  34          3HB       ASP  34  -1.835  -3.179  -8.950
  253    H    LEU  35           H        LEU  35   2.417  -3.529 -10.211
  254    HA   LEU  35           HA       LEU  35   2.385  -0.724 -10.078
  255   1HB   LEU  35          2HB       LEU  35   4.341  -2.193  -9.660
  256   2HB   LEU  35          3HB       LEU  35   4.487  -2.475 -11.393
  257    HG   LEU  35           HG       LEU  35   4.944  -0.063 -11.756
  258   1HD1  LEU  35          1HD1      LEU  35   3.752   1.015  -9.909
  259   2HD1  LEU  35          2HD1      LEU  35   4.735   0.133  -8.714
  260   3HD1  LEU  35          3HD1      LEU  35   5.472   1.368  -9.750
  261   1HD2  LEU  35          1HD2      LEU  35   6.811  -1.640 -11.331
  262   2HD2  LEU  35          2HD2      LEU  35   7.178  -0.027 -10.693
  263   3HD2  LEU  35          3HD2      LEU  35   6.689  -1.321  -9.587
  264    HA   PRO  36           HA       PRO  36   2.309  -0.378 -14.817
  265   1HB   PRO  36          2HB       PRO  36   1.651  -2.383 -16.500
  266   2HB   PRO  36          3HB       PRO  36   3.254  -2.309 -15.723
  267   1HG   PRO  36          2HG       PRO  36   0.843  -3.894 -14.793
  268   2HG   PRO  36          3HG       PRO  36   2.499  -4.505 -15.076
  269   1HD   PRO  36          2HD       PRO  36   1.575  -3.761 -12.632
  270   2HD   PRO  36          3HD       PRO  36   3.288  -3.509 -13.087
  271    H    ASN  37           H        ASN  37   0.308  -0.192 -12.879
  272    HA   ASN  37           HA       ASN  37  -2.158   0.394 -14.312
  273   1HB   ASN  37          2HB       ASN  37  -1.962  -1.735 -12.152
  274   2HB   ASN  37          3HB       ASN  37  -3.485  -0.940 -12.499
  275   1HD2  ASN  37          1HD2      ASN  37  -1.531  -3.594 -13.298
  276   2HD2  ASN  37          2HD2      ASN  37  -2.011  -3.835 -14.979
  277    H    LYS  38           H        LYS  38  -0.651  -0.221 -11.153
  278    HA   LYS  38           HA       LYS  38   0.189   1.184  -9.619
  279   1HB   LYS  38          2HB       LYS  38  -1.582   3.451 -10.568
  280   2HB   LYS  38          3HB       LYS  38  -0.293   3.458  -9.358
  281   1HG   LYS  38          2HG       LYS  38   1.430   3.197 -10.961
  282   2HG   LYS  38          3HG       LYS  38   0.288   2.902 -12.290
  283   1HD   LYS  38          2HD       LYS  38  -0.635   5.101 -12.175
  284   2HD   LYS  38          3HD       LYS  38   0.083   5.398 -10.593
  285   1HE   LYS  38          2HE       LYS  38   2.366   5.352 -11.622
  286   2HE   LYS  38          3HE       LYS  38   1.611   5.228 -13.219
  287   1HZ   LYS  38          1HZ       LYS  38   1.226   7.482 -11.296
  288   2HZ   LYS  38          2HZ       LYS  38   2.239   7.481 -12.512
  289   3HZ   LYS  38          3HZ       LYS  38   0.610   7.398 -12.831
  290    H    LYS  39           H        LYS  39  -1.372  -0.740  -9.058
  291    HA   LYS  39           HA       LYS  39  -3.191   0.434  -7.002
  292   1HB   LYS  39          2HB       LYS  39  -3.383  -2.456  -7.785
  293   2HB   LYS  39          3HB       LYS  39  -4.498  -1.445  -6.892
  294   1HG   LYS  39          2HG       LYS  39  -5.113  -0.285  -9.025
  295   2HG   LYS  39          3HG       LYS  39  -3.887  -1.251  -9.874
  296   1HD   LYS  39          2HD       LYS  39  -5.896  -2.386 -10.317
  297   2HD   LYS  39          3HD       LYS  39  -5.023  -3.348  -9.131
  298   1HE   LYS  39          2HE       LYS  39  -6.517  -2.117  -7.329
  299   2HE   LYS  39          3HE       LYS  39  -7.473  -1.567  -8.708
  300   1HZ   LYS  39          1HZ       LYS  39  -7.759  -4.018  -9.202
  301   2HZ   LYS  39          2HZ       LYS  39  -7.046  -4.319  -7.720
  302   3HZ   LYS  39          3HZ       LYS  39  -8.392  -3.520  -7.746
  303    H    VAL  40           H        VAL  40  -2.645  -0.125  -4.857
  304    HA   VAL  40           HA       VAL  40  -0.503  -2.135  -4.437
  305    HB   VAL  40           HB       VAL  40  -1.273   0.451  -3.077
  306   1HG1  VAL  40          1HG1      VAL  40  -0.181  -1.975  -1.658
  307   2HG1  VAL  40          2HG1      VAL  40  -0.087  -0.306  -1.027
  308   3HG1  VAL  40          3HG1      VAL  40  -1.669  -1.039  -1.337
  309   1HG2  VAL  40          1HG2      VAL  40   1.401  -0.943  -3.543
  310   2HG2  VAL  40          2HG2      VAL  40   0.706   0.293  -4.607
  311   3HG2  VAL  40          3HG2      VAL  40   1.163   0.719  -2.944
  312    H    CYS  41           H        CYS  41  -1.343  -3.888  -3.349
  313    HA   CYS  41           HA       CYS  41  -4.148  -3.687  -2.295
  314   1HB   CYS  41          2HB       CYS  41  -3.176  -5.873  -4.176
  315   2HB   CYS  41          3HB       CYS  41  -4.723  -5.823  -3.297
  316    HG   CYS  41           HG       CYS  41  -5.576  -5.049  -5.501
  317    H    ILE  42           H        ILE  42  -4.111  -4.199  -0.221
  318    HA   ILE  42           HA       ILE  42  -1.750  -5.673   0.827
  319    HB   ILE  42           HB       ILE  42  -3.768  -4.027   2.335
  320   1HG1  ILE  42          2HG1      ILE  42  -0.933  -3.310   1.435
  321   2HG1  ILE  42          3HG1      ILE  42  -2.394  -2.666   0.687
  322   1HG2  ILE  42          1HG2      ILE  42  -1.967  -4.195   4.127
  323   2HG2  ILE  42          2HG2      ILE  42  -2.686  -5.742   3.719
  324   3HG2  ILE  42          3HG2      ILE  42  -1.096  -5.306   3.068
  325   1HD1  ILE  42          1HD1      ILE  42  -3.015  -1.616   2.864
  326   2HD1  ILE  42          2HD1      ILE  42  -1.453  -2.149   3.507
  327   3HD1  ILE  42          3HD1      ILE  42  -1.509  -1.023   2.146
  328    H    GLU  43           H        GLU  43  -2.026  -7.639   1.910
  329    HA   GLU  43           HA       GLU  43  -4.786  -8.621   2.420
  330   1HB   GLU  43          2HB       GLU  43  -4.126  -9.326   0.151
  331   2HB   GLU  43          3HB       GLU  43  -2.681 -10.110   0.780
  332   1HG   GLU  43          2HG       GLU  43  -3.862 -11.885   1.686
  333   2HG   GLU  43          3HG       GLU  43  -5.336 -10.960   1.945
  334    H    SER  44           H        SER  44  -4.361  -8.306   4.624
  335    HA   SER  44           HA       SER  44  -2.754 -10.281   5.953
  336   1HB   SER  44          2HB       SER  44  -1.829  -7.382   5.946
  337   2HB   SER  44          3HB       SER  44  -1.342  -8.535   7.196
  338    HG   SER  44           HG       SER  44  -0.993  -9.247   4.502
  339    H    GLU  45           H        GLU  45  -3.247 -10.330   8.208
  340    HA   GLU  45           HA       GLU  45  -5.761  -9.181   9.006
  341   1HB   GLU  45          2HB       GLU  45  -3.609 -10.667  10.575
  342   2HB   GLU  45          3HB       GLU  45  -5.248 -10.317  11.140
  343   1HG   GLU  45          2HG       GLU  45  -6.203 -11.648   9.294
  344   2HG   GLU  45          3HG       GLU  45  -4.580 -12.016   8.681
  345    H    HIS  46           H        HIS  46  -4.942  -6.927   8.419
  346    HA   HIS  46           HA       HIS  46  -4.024  -5.552  10.909
  347   1HB   HIS  46          2HB       HIS  46  -3.227  -5.000   8.027
  348   2HB   HIS  46          3HB       HIS  46  -2.833  -3.956   9.401
  349    HD1  HIS  46           1HD      HIS  46  -2.021  -6.642  11.267
  350    HD2  HIS  46           2HD      HIS  46  -0.650  -5.461   7.481
  351    HE1  HIS  46           1HE      HIS  46   0.404  -7.436  11.084
  352    H    SER  47           H        SER  47  -5.105  -3.629  11.324
  353    HA   SER  47           HA       SER  47  -7.724  -3.395  10.176
  354   1HB   SER  47          2HB       SER  47  -7.251  -2.755  12.505
  355   2HB   SER  47          3HB       SER  47  -6.231  -1.422  11.932
  356    HG   SER  47           HG       SER  47  -8.345  -0.703  12.347
  357    H    MET  48           H        MET  48  -8.554  -1.870   8.874
  358    HA   MET  48           HA       MET  48  -7.064  -1.147   6.570
  359   1HB   MET  48          2HB       MET  48  -9.703   0.139   7.384
  360   2HB   MET  48          3HB       MET  48  -9.079  -0.189   5.760
  361   1HG   MET  48          2HG       MET  48  -9.219  -2.680   6.366
  362   2HG   MET  48          3HG       MET  48 -10.085  -2.183   7.826
  363   1HE   MET  48          1HE       MET  48 -11.340  -4.347   6.320
  364   2HE   MET  48          2HE       MET  48 -12.106  -3.505   7.684
  365   3HE   MET  48          3HE       MET  48 -13.020  -3.781   6.194
  366    H    ASP  49           H        ASP  49  -8.279   0.692   9.316
  367    HA   ASP  49           HA       ASP  49  -7.328   3.306   8.965
  368   1HB   ASP  49          2HB       ASP  49  -8.558   2.945  10.945
  369   2HB   ASP  49          3HB       ASP  49  -7.716   1.437  11.323
  370    H    THR  50           H        THR  50  -5.704   0.710  10.616
  371    HA   THR  50           HA       THR  50  -3.348   2.081  11.051
  372    HB   THR  50           HB       THR  50  -3.725  -0.931  10.974
  373    HG1  THR  50           1HG      THR  50  -4.853   1.071  12.542
  374   1HG2  THR  50          1HG2      THR  50  -1.388  -0.234  11.389
  375   2HG2  THR  50          2HG2      THR  50  -1.933   0.834  12.704
  376   3HG2  THR  50          3HG2      THR  50  -2.121  -0.928  12.846
  377    H    LEU  51           H        LEU  51  -4.122  -0.204   8.385
  378    HA   LEU  51           HA       LEU  51  -1.529  -0.084   7.129
  379   1HB   LEU  51          2HB       LEU  51  -4.272  -0.355   5.835
  380   2HB   LEU  51          3HB       LEU  51  -2.700  -0.594   5.038
  381    HG   LEU  51           HG       LEU  51  -3.681  -2.174   7.479
  382   1HD1  LEU  51          1HD1      LEU  51  -3.850  -2.929   4.551
  383   2HD1  LEU  51          2HD1      LEU  51  -4.162  -4.025   5.915
  384   3HD1  LEU  51          3HD1      LEU  51  -5.192  -2.610   5.658
  385   1HD2  LEU  51          1HD2      LEU  51  -1.882  -3.799   6.592
  386   2HD2  LEU  51          2HD2      LEU  51  -1.246  -2.417   5.696
  387   3HD2  LEU  51          3HD2      LEU  51  -1.339  -2.359   7.462
  388    H    LEU  52           H        LEU  52  -4.508   1.897   6.659
  389    HA   LEU  52           HA       LEU  52  -3.399   3.655   4.763
  390   1HB   LEU  52          2HB       LEU  52  -5.683   3.725   6.640
  391   2HB   LEU  52          3HB       LEU  52  -5.129   5.311   6.118
  392    HG   LEU  52           HG       LEU  52  -5.705   3.004   4.243
  393   1HD1  LEU  52          1HD1      LEU  52  -7.940   4.015   3.855
  394   2HD1  LEU  52          2HD1      LEU  52  -7.742   3.451   5.522
  395   3HD1  LEU  52          3HD1      LEU  52  -7.625   5.186   5.154
  396   1HD2  LEU  52          1HD2      LEU  52  -6.000   4.775   2.533
  397   2HD2  LEU  52          2HD2      LEU  52  -5.669   6.024   3.746
  398   3HD2  LEU  52          3HD2      LEU  52  -4.388   4.905   3.244
  399    H    ALA  53           H        ALA  53  -3.448   4.066   8.330
  400    HA   ALA  53           HA       ALA  53  -1.895   6.418   8.475
  401   1HB   ALA  53          1HB       ALA  53  -2.050   4.110  10.463
  402   2HB   ALA  53          2HB       ALA  53  -1.525   5.767  10.819
  403   3HB   ALA  53          3HB       ALA  53  -3.211   5.450  10.362
  404    H    THR  54           H        THR  54  -0.788   3.015   8.382
  405    HA   THR  54           HA       THR  54   1.965   3.611   8.597
  406    HB   THR  54           HB       THR  54   0.559   1.413   7.002
  407    HG1  THR  54           1HG      THR  54   0.090   1.359   9.182
  408   1HG2  THR  54          1HG2      THR  54   2.961   1.781   6.302
  409   2HG2  THR  54          2HG2      THR  54   3.416   1.407   7.982
  410   3HG2  THR  54          3HG2      THR  54   2.552   0.219   6.967
  411    H    LEU  55           H        LEU  55   0.036   3.109   5.578
  412    HA   LEU  55           HA       LEU  55   2.347   3.580   3.991
  413   1HB   LEU  55          2HB       LEU  55   1.003   2.886   2.211
  414   2HB   LEU  55          3HB       LEU  55   0.671   1.915   3.607
  415    HG   LEU  55           HG       LEU  55  -1.345   3.591   3.934
  416   1HD1  LEU  55          1HD1      LEU  55  -0.469   4.983   2.039
  417   2HD1  LEU  55          2HD1      LEU  55  -0.744   3.620   0.969
  418   3HD1  LEU  55          3HD1      LEU  55  -2.139   4.420   1.764
  419   1HD2  LEU  55          1HD2      LEU  55  -1.238   1.421   1.792
  420   2HD2  LEU  55          2HD2      LEU  55  -1.519   1.148   3.523
  421   3HD2  LEU  55          3HD2      LEU  55  -2.722   2.033   2.561
  422    H    LYS  56           H        LYS  56  -0.474   5.496   4.699
  423    HA   LYS  56           HA       LYS  56  -0.521   7.693   3.166
  424   1HB   LYS  56          2HB       LYS  56  -0.704   7.328   6.152
  425   2HB   LYS  56          3HB       LYS  56  -0.607   8.972   5.594
  426   1HG   LYS  56          2HG       LYS  56  -2.552   8.784   4.192
  427   2HG   LYS  56          3HG       LYS  56  -2.704   7.049   4.535
  428   1HD   LYS  56          2HD       LYS  56  -2.977   7.506   6.918
  429   2HD   LYS  56          3HD       LYS  56  -2.707   9.237   6.668
  430   1HE   LYS  56          2HE       LYS  56  -4.793   9.398   5.341
  431   2HE   LYS  56          3HE       LYS  56  -5.036   7.649   5.461
  432   1HZ   LYS  56          1HZ       LYS  56  -6.381   8.831   7.036
  433   2HZ   LYS  56          2HZ       LYS  56  -5.296   7.898   7.837
  434   3HZ   LYS  56          3HZ       LYS  56  -5.068   9.525   7.734
  435    H    LYS  57           H        LYS  57   1.972   7.119   5.591
  436    HA   LYS  57           HA       LYS  57   3.161   9.654   5.661
  437   1HB   LYS  57          2HB       LYS  57   4.298   6.899   6.157
  438   2HB   LYS  57          3HB       LYS  57   5.102   8.425   6.623
  439   1HG   LYS  57          2HG       LYS  57   2.876   8.940   7.891
  440   2HG   LYS  57          3HG       LYS  57   2.492   7.251   7.681
  441   1HD   LYS  57          2HD       LYS  57   4.912   8.475   9.103
  442   2HD   LYS  57          3HD       LYS  57   3.543   7.673   9.873
  443   1HE   LYS  57          2HE       LYS  57   5.687   6.383   8.106
  444   2HE   LYS  57          3HE       LYS  57   5.469   6.177   9.847
  445   1HZ   LYS  57          1HZ       LYS  57   4.542   4.329   8.684
  446   2HZ   LYS  57          2HZ       LYS  57   3.302   5.185   9.355
  447   3HZ   LYS  57          3HZ       LYS  57   3.595   5.283   7.744
  448    H    THR  58           H        THR  58   3.339   7.406   2.951
  449    HA   THR  58           HA       THR  58   5.850   8.337   1.896
  450    HB   THR  58           HB       THR  58   4.844   7.653  -0.300
  451    HG1  THR  58           1HG      THR  58   2.654   8.062   0.142
  452   1HG2  THR  58          1HG2      THR  58   4.563   5.719   2.020
  453   2HG2  THR  58          2HG2      THR  58   4.680   5.256   0.306
  454   3HG2  THR  58          3HG2      THR  58   6.051   6.060   1.112
  455    H    GLY  59           H        GLY  59   2.710   9.864   2.222
  456   1HA   GLY  59          2HA       GLY  59   2.059  11.983   1.766
  457   2HA   GLY  59          3HA       GLY  59   3.766  12.379   1.450
  458    H    LYS  60           H        LYS  60   1.552  10.087  -0.187
  459    HA   LYS  60           HA       LYS  60   1.719  11.606  -2.735
  460   1HB   LYS  60          2HB       LYS  60   2.337   8.707  -2.048
  461   2HB   LYS  60          3HB       LYS  60   1.818   9.111  -3.661
  462   1HG   LYS  60          2HG       LYS  60   4.213  10.368  -2.206
  463   2HG   LYS  60          3HG       LYS  60   4.304   8.997  -3.290
  464   1HD   LYS  60          2HD       LYS  60   3.476  11.857  -4.011
  465   2HD   LYS  60          3HD       LYS  60   4.993  11.061  -4.416
  466   1HE   LYS  60          2HE       LYS  60   3.814   9.421  -5.840
  467   2HE   LYS  60          3HE       LYS  60   2.248  10.164  -5.457
  468   1HZ   LYS  60          1HZ       LYS  60   2.942  12.155  -6.529
  469   2HZ   LYS  60          2HZ       LYS  60   4.384  11.471  -6.963
  470   3HZ   LYS  60          3HZ       LYS  60   2.963  10.870  -7.529
  471    H    THR  61           H        THR  61   0.059  11.078  -4.267
  472    HA   THR  61           HA       THR  61  -2.533  10.726  -3.293
  473    HB   THR  61           HB       THR  61  -1.550  10.242  -6.091
  474    HG1  THR  61           1HG      THR  61  -1.688  12.789  -4.865
  475   1HG2  THR  61          1HG2      THR  61  -3.514  11.624  -6.700
  476   2HG2  THR  61          2HG2      THR  61  -3.997  10.246  -5.688
  477   3HG2  THR  61          3HG2      THR  61  -3.876  11.872  -4.975
  478    H    VAL  62           H        VAL  62  -1.865   8.744  -2.074
  479    HA   VAL  62           HA       VAL  62  -2.793   6.353  -3.607
  480    HB   VAL  62           HB       VAL  62  -0.858   5.668  -2.514
  481   1HG1  VAL  62          1HG1      VAL  62  -0.454   7.475  -0.943
  482   2HG1  VAL  62          2HG1      VAL  62  -1.844   6.976   0.050
  483   3HG1  VAL  62          3HG1      VAL  62  -0.413   5.931  -0.109
  484   1HG2  VAL  62          1HG2      VAL  62  -1.631   3.906  -1.120
  485   2HG2  VAL  62          2HG2      VAL  62  -3.055   4.825  -0.589
  486   3HG2  VAL  62          3HG2      VAL  62  -2.946   4.228  -2.254
  487    H    SER  63           H        SER  63  -4.765   5.440  -3.059
  488    HA   SER  63           HA       SER  63  -6.333   6.618  -0.851
  489   1HB   SER  63          2HB       SER  63  -7.203   6.741  -3.779
  490   2HB   SER  63          3HB       SER  63  -8.194   7.201  -2.380
  491    HG   SER  63           HG       SER  63  -5.887   8.483  -2.142
  492    H    TYR  64           H        TYR  64  -8.283   5.328  -0.472
  493    HA   TYR  64           HA       TYR  64  -7.696   2.458  -0.897
  494   1HB   TYR  64          2HB       TYR  64  -7.760   3.144   1.393
  495   2HB   TYR  64          3HB       TYR  64  -9.205   4.109   1.139
  496    HD1  TYR  64           HD1      TYR  64  -8.151   0.503   0.674
  497    HD2  TYR  64           HD2      TYR  64 -11.235   3.272   1.874
  498    HE1  TYR  64           HE1      TYR  64  -9.763  -1.356   0.857
  499    HE2  TYR  64           HE2      TYR  64 -12.834   1.411   2.063
  500    HH   TYR  64           HH       TYR  64 -13.199  -0.832   1.684
  501    H    LEU  65           H        LEU  65  -9.040   1.148  -2.084
  502    HA   LEU  65           HA       LEU  65 -11.874   1.732  -2.362
  503   1HB   LEU  65          2HB       LEU  65 -11.647   1.472  -4.910
  504   2HB   LEU  65          3HB       LEU  65 -11.506   3.036  -4.132
  505    HG   LEU  65           HG       LEU  65  -9.965   2.661  -5.954
  506   1HD1  LEU  65          1HD1      LEU  65  -8.262   3.089  -3.609
  507   2HD1  LEU  65          2HD1      LEU  65  -8.259   3.918  -5.161
  508   3HD1  LEU  65          3HD1      LEU  65  -9.553   4.247  -4.008
  509   1HD2  LEU  65          1HD2      LEU  65  -8.507   0.629  -4.284
  510   2HD2  LEU  65          2HD2      LEU  65  -9.384   0.342  -5.806
  511   3HD2  LEU  65          3HD2      LEU  65  -7.938   1.336  -5.801
  512    H    GLY  66           H        GLY  66 -11.692  -0.394  -1.100
  513   1HA   GLY  66          2HA       GLY  66 -13.294  -2.069  -2.180
  514   2HA   GLY  66          3HA       GLY  66 -11.897  -2.616  -3.114
  515    H    LEU  67           H        LEU  67 -13.666  -3.733  -0.711
  516    HA   LEU  67           HA       LEU  67 -11.437  -4.676   1.000
  517   1HB   LEU  67          2HB       LEU  67 -12.766  -3.381   2.406
  518   2HB   LEU  67          3HB       LEU  67 -14.238  -3.684   1.475
  519    HG   LEU  67           HG       LEU  67 -14.336  -5.970   2.304
  520   1HD1  LEU  67          1HD1      LEU  67 -12.035  -5.096   4.128
  521   2HD1  LEU  67          2HD1      LEU  67 -12.946  -6.611   4.290
  522   3HD1  LEU  67          3HD1      LEU  67 -11.919  -6.343   2.877
  523   1HD2  LEU  67          1HD2      LEU  67 -15.657  -4.275   3.362
  524   2HD2  LEU  67          2HD2      LEU  67 -15.012  -5.323   4.639
  525   3HD2  LEU  67          3HD2      LEU  67 -14.289  -3.723   4.340
  526    H    GLU  68           H        GLU  68 -11.059  -6.778   0.483
  527    HA   GLU  68           HA       GLU  68 -13.155  -8.586   0.796
  528   1HB   GLU  68          2HB       GLU  68 -13.301  -8.184  -1.611
  529   2HB   GLU  68          3HB       GLU  68 -11.659  -8.756  -1.863
  530   1HG   GLU  68          2HG       GLU  68 -13.571 -10.450  -2.338
  531   2HG   GLU  68          3HG       GLU  68 -12.200 -11.015  -1.389
  Start of MODEL   16
    1   1H    MET   1           H1       MET   1  -5.873  -8.286   7.753
    2   2H    MET   1           H2       MET   1  -6.359  -7.343   9.010
    3   3H    MET   1           H3       MET   1  -6.544  -9.012   9.070
    4    HA   MET   1           HA       MET   1  -8.637  -8.556   8.395
    5   1HB   MET   1          2HB       MET   1  -7.288  -6.083   7.266
    6   2HB   MET   1          3HB       MET   1  -8.908  -6.506   6.718
    7   1HG   MET   1          2HG       MET   1  -8.136  -6.029   9.620
    8   2HG   MET   1          3HG       MET   1  -8.902  -4.857   8.539
    9   1HE   MET   1          1HE       MET   1 -10.731  -4.377  10.332
   10   2HE   MET   1          2HE       MET   1 -11.718  -5.644  11.098
   11   3HE   MET   1          3HE       MET   1  -9.971  -5.559  11.427
   12    HA   PRO   2           HA       PRO   2  -8.033 -10.578   4.377
   13   1HB   PRO   2          2HB       PRO   2 -10.459 -10.391   3.178
   14   2HB   PRO   2          3HB       PRO   2 -10.230 -11.299   4.674
   15   1HG   PRO   2          2HG       PRO   2 -11.154  -8.418   4.455
   16   2HG   PRO   2          3HG       PRO   2 -12.011  -9.769   5.253
   17   1HD   PRO   2          2HD       PRO   2 -10.387  -8.151   6.711
   18   2HD   PRO   2          3HD       PRO   2 -10.357  -9.909   6.978
   19    H    LYS   3           H        LYS   3  -9.411  -9.338   1.833
   20    HA   LYS   3           HA       LYS   3  -6.914  -7.882   1.492
   21   1HB   LYS   3          2HB       LYS   3  -7.599  -9.707  -0.002
   22   2HB   LYS   3          3HB       LYS   3  -8.930  -8.715  -0.618
   23   1HG   LYS   3          2HG       LYS   3  -7.484  -7.213  -1.703
   24   2HG   LYS   3          3HG       LYS   3  -6.162  -7.523  -0.573
   25   1HD   LYS   3          2HD       LYS   3  -5.888  -9.822  -1.561
   26   2HD   LYS   3          3HD       LYS   3  -7.056  -9.357  -2.821
   27   1HE   LYS   3          2HE       LYS   3  -5.657  -7.487  -3.498
   28   2HE   LYS   3          3HE       LYS   3  -4.541  -7.726  -2.139
   29   1HZ   LYS   3          1HZ       LYS   3  -4.793  -9.445  -4.496
   30   2HZ   LYS   3          2HZ       LYS   3  -3.476  -8.606  -3.951
   31   3HZ   LYS   3          3HZ       LYS   3  -3.961  -9.880  -3.131
   32    H    HIS   4           H        HIS   4  -6.677  -5.779   0.813
   33    HA   HIS   4           HA       HIS   4  -9.067  -4.039   0.421
   34   1HB   HIS   4          2HB       HIS   4  -6.481  -2.914   1.427
   35   2HB   HIS   4          3HB       HIS   4  -8.137  -2.389   1.730
   36    HD1  HIS   4           1HD      HIS   4  -5.597  -5.076   2.866
   37    HD2  HIS   4           2HD      HIS   4  -9.257  -3.356   3.970
   38    HE1  HIS   4           1HE      HIS   4  -5.985  -5.720   5.301
   39    H    GLU   5           H        GLU   5  -8.915  -2.755  -1.505
   40    HA   GLU   5           HA       GLU   5  -6.406  -2.935  -3.117
   41   1HB   GLU   5          2HB       GLU   5  -9.358  -2.650  -3.727
   42   2HB   GLU   5          3HB       GLU   5  -8.148  -2.308  -4.944
   43   1HG   GLU   5          2HG       GLU   5  -8.145  -4.966  -3.416
   44   2HG   GLU   5          3HG       GLU   5  -9.231  -4.672  -4.761
   45    H    PHE   6           H        PHE   6  -5.357  -1.041  -3.614
   46    HA   PHE   6           HA       PHE   6  -6.688   1.558  -3.034
   47   1HB   PHE   6          2HB       PHE   6  -3.751   0.874  -2.605
   48   2HB   PHE   6          3HB       PHE   6  -4.547   2.345  -2.092
   49    HD1  PHE   6           1HD      PHE   6  -2.627   0.740  -0.484
   50    HD2  PHE   6           2HD      PHE   6  -6.925   0.641  -0.643
   51    HE1  PHE   6           1HE      PHE   6  -2.709  -0.153   1.815
   52    HE2  PHE   6           2HE      PHE   6  -7.002  -0.159   1.678
   53    HZ   PHE   6           HZ       PHE   6  -4.891  -0.606   2.913
   54    H    SER   7           H        SER   7  -6.254   3.185  -4.477
   55    HA   SER   7           HA       SER   7  -4.624   2.543  -6.900
   56   1HB   SER   7          2HB       SER   7  -6.851   3.623  -7.239
   57   2HB   SER   7          3HB       SER   7  -6.250   5.042  -6.329
   58    HG   SER   7           HG       SER   7  -5.980   5.207  -8.633
   59    H    VAL   8           H        VAL   8  -2.744   3.774  -7.358
   60    HA   VAL   8           HA       VAL   8  -1.579   5.454  -5.223
   61    HB   VAL   8           HB       VAL   8  -0.351   2.911  -6.434
   62   1HG1  VAL   8          1HG1      VAL   8   0.664   5.008  -4.505
   63   2HG1  VAL   8          2HG1      VAL   8   1.415   3.398  -4.696
   64   3HG1  VAL   8          3HG1      VAL   8   1.340   4.489  -6.076
   65   1HG2  VAL   8          1HG2      VAL   8  -0.392   2.244  -3.941
   66   2HG2  VAL   8          2HG2      VAL   8  -1.444   3.617  -3.645
   67   3HG2  VAL   8          3HG2      VAL   8  -1.996   2.285  -4.683
   68    H    ASP   9           H        ASP   9  -1.695   7.290  -6.665
   69    HA   ASP   9           HA       ASP   9  -0.470   6.920  -9.294
   70   1HB   ASP   9          2HB       ASP   9  -2.341   8.641  -8.739
   71   2HB   ASP   9          3HB       ASP   9  -0.982   9.715  -8.358
   72    H    MET  10           H        MET  10   1.451   5.953  -8.320
   73    HA   MET  10           HA       MET  10   3.556   7.872  -8.724
   74   1HB   MET  10          2HB       MET  10   4.889   7.251  -6.703
   75   2HB   MET  10          3HB       MET  10   3.492   8.258  -6.392
   76   1HG   MET  10          2HG       MET  10   2.233   6.438  -5.487
   77   2HG   MET  10          3HG       MET  10   3.487   5.265  -5.900
   78   1HE   MET  10          1HE       MET  10   3.199   4.484  -3.331
   79   2HE   MET  10          2HE       MET  10   3.596   5.517  -1.937
   80   3HE   MET  10          3HE       MET  10   2.128   5.839  -2.882
   81    H    THR  11           H        THR  11   4.917   6.882 -10.110
   82    HA   THR  11           HA       THR  11   5.347   3.961 -10.001
   83    HB   THR  11           HB       THR  11   4.071   5.270 -12.442
   84    HG1  THR  11           1HG      THR  11   2.916   4.053 -10.184
   85   1HG2  THR  11          1HG2      THR  11   5.347   3.157 -12.835
   86   2HG2  THR  11          2HG2      THR  11   4.352   2.353 -11.597
   87   3HG2  THR  11          3HG2      THR  11   3.604   2.956 -13.087
   88    H    CYS  12           H        CYS  12   7.534   4.718  -9.592
   89    HA   CYS  12           HA       CYS  12   9.033   5.101 -12.110
   90   1HB   CYS  12          2HB       CYS  12   8.934   7.120  -9.857
   91   2HB   CYS  12          3HB       CYS  12  10.478   6.843 -10.680
   92    HG   CYS  12           HG       CYS  12   7.658   7.426 -12.243
   93    H    GLY  13           H        GLY  13   8.614   2.789 -10.785
   94   1HA   GLY  13          2HA       GLY  13   9.770   0.970 -10.039
   95   2HA   GLY  13          3HA       GLY  13  11.269   1.892 -10.227
   96    H    GLY  14           H        GLY  14  11.651   3.566  -8.463
   97   1HA   GLY  14          2HA       GLY  14  11.943   2.224  -5.988
   98   2HA   GLY  14          3HA       GLY  14  12.217   3.956  -6.265
   99    H    CYS  15           H        CYS  15   9.249   4.083  -7.195
  100    HA   CYS  15           HA       CYS  15   7.945   4.827  -4.795
  101   1HB   CYS  15          2HB       CYS  15   6.666   3.748  -7.337
  102   2HB   CYS  15          3HB       CYS  15   5.883   4.674  -6.036
  103    HG   CYS  15           HG       CYS  15   6.202   6.287  -7.997
  104    H    ALA  16           H        ALA  16   8.194   1.655  -6.468
  105    HA   ALA  16           HA       ALA  16   6.365   0.318  -4.684
  106   1HB   ALA  16          1HB       ALA  16   7.234  -1.744  -5.714
  107   2HB   ALA  16          2HB       ALA  16   6.846  -0.529  -6.947
  108   3HB   ALA  16          3HB       ALA  16   8.542  -0.829  -6.494
  109    H    GLU  17           H        GLU  17   9.923   0.784  -4.732
  110    HA   GLU  17           HA       GLU  17  10.473  -0.762  -2.389
  111   1HB   GLU  17          2HB       GLU  17  11.850   1.685  -3.587
  112   2HB   GLU  17          3HB       GLU  17  12.252   1.051  -2.013
  113   1HG   GLU  17          2HG       GLU  17  12.585  -1.241  -3.151
  114   2HG   GLU  17          3HG       GLU  17  12.600  -0.322  -4.670
  115    H    ALA  18           H        ALA  18   9.469   2.678  -2.788
  116    HA   ALA  18           HA       ALA  18   9.627   3.377  -0.066
  117   1HB   ALA  18          1HB       ALA  18   9.241   5.002  -1.917
  118   2HB   ALA  18          2HB       ALA  18   7.562   4.429  -2.047
  119   3HB   ALA  18          3HB       ALA  18   8.113   5.203  -0.560
  120    H    VAL  19           H        VAL  19   6.792   2.134  -1.894
  121    HA   VAL  19           HA       VAL  19   5.065   1.925   0.338
  122    HB   VAL  19           HB       VAL  19   5.103   0.233  -2.186
  123   1HG1  VAL  19          1HG1      VAL  19   3.803  -0.854  -0.324
  124   2HG1  VAL  19          2HG1      VAL  19   2.918   0.668  -0.090
  125   3HG1  VAL  19          3HG1      VAL  19   2.749  -0.258  -1.595
  126   1HG2  VAL  19          1HG2      VAL  19   4.778   2.692  -2.578
  127   2HG2  VAL  19          2HG2      VAL  19   3.318   1.759  -2.923
  128   3HG2  VAL  19          3HG2      VAL  19   3.446   2.682  -1.411
  129    H    SER  20           H        SER  20   7.086  -0.657  -1.187
  130    HA   SER  20           HA       SER  20   6.423  -2.696   0.593
  131   1HB   SER  20          2HB       SER  20   7.676  -3.111  -1.481
  132   2HB   SER  20          3HB       SER  20   9.007  -2.080  -0.946
  133    HG   SER  20           HG       SER  20   8.303  -4.476   0.400
  134    H    ARG  21           H        ARG  21   9.074  -0.352   0.920
  135    HA   ARG  21           HA       ARG  21  10.084  -1.396   3.352
  136   1HB   ARG  21          2HB       ARG  21  10.395   1.299   1.984
  137   2HB   ARG  21          3HB       ARG  21  11.331   0.790   3.402
  138   1HG   ARG  21          2HG       ARG  21  12.295  -1.087   2.222
  139   2HG   ARG  21          3HG       ARG  21  11.200  -0.924   0.875
  140   1HD   ARG  21          2HD       ARG  21  13.255  -0.163   0.111
  141   2HD   ARG  21          3HD       ARG  21  12.197   1.253   0.257
  142    HE   ARG  21           HE       ARG  21  13.502   1.264   2.642
  143   1HH1  ARG  21          2HH2      ARG  21  14.778   1.012  -0.721
  144   2HH1  ARG  21          1HH2      ARG  21  16.117   2.034  -0.409
  145   1HH2  ARG  21          2HH1      ARG  21  15.378   2.552   3.034
  146   2HH2  ARG  21          1HH1      ARG  21  16.511   2.858   1.759
  147    H    VAL  22           H        VAL  22   7.839   1.526   2.820
  148    HA   VAL  22           HA       VAL  22   7.644   2.004   5.565
  149    HB   VAL  22           HB       VAL  22   7.097   3.517   3.598
  150   1HG1  VAL  22          1HG1      VAL  22   4.353   2.257   3.888
  151   2HG1  VAL  22          2HG1      VAL  22   4.790   3.619   2.843
  152   3HG1  VAL  22          3HG1      VAL  22   5.435   2.016   2.500
  153   1HG2  VAL  22          1HG2      VAL  22   6.724   4.125   5.901
  154   2HG2  VAL  22          2HG2      VAL  22   5.403   4.732   4.860
  155   3HG2  VAL  22          3HG2      VAL  22   5.132   3.302   5.882
  156    H    LEU  23           H        LEU  23   5.563  -0.054   3.401
  157    HA   LEU  23           HA       LEU  23   3.798  -0.871   5.424
  158   1HB   LEU  23          2HB       LEU  23   4.663  -2.058   2.776
  159   2HB   LEU  23          3HB       LEU  23   3.663  -2.949   3.909
  160    HG   LEU  23           HG       LEU  23   2.361  -1.862   2.135
  161   1HD1  LEU  23          1HD1      LEU  23   1.311  -2.635   4.192
  162   2HD1  LEU  23          2HD1      LEU  23   1.740  -1.123   5.026
  163   3HD1  LEU  23          3HD1      LEU  23   0.582  -1.096   3.697
  164   1HD2  LEU  23          1HD2      LEU  23   1.804   0.483   2.358
  165   2HD2  LEU  23          2HD2      LEU  23   2.889   0.618   3.766
  166   3HD2  LEU  23          3HD2      LEU  23   3.553   0.325   2.144
  167    H    ASN  24           H        ASN  24   6.875  -2.418   4.335
  168    HA   ASN  24           HA       ASN  24   6.878  -4.588   6.139
  169   1HB   ASN  24          2HB       ASN  24   8.535  -4.585   4.469
  170   2HB   ASN  24          3HB       ASN  24   9.019  -2.927   4.811
  171   1HD2  ASN  24          1HD2      ASN  24  10.221  -2.415   6.624
  172   2HD2  ASN  24          2HD2      ASN  24  11.248  -3.637   7.404
  173    H    LYS  25           H        LYS  25   7.973  -1.227   6.592
  174    HA   LYS  25           HA       LYS  25   8.982  -1.445   9.200
  175   1HB   LYS  25          2HB       LYS  25   8.063   0.740   7.393
  176   2HB   LYS  25          3HB       LYS  25   7.851   1.117   9.092
  177   1HG   LYS  25          2HG       LYS  25  10.458   0.031   7.973
  178   2HG   LYS  25          3HG       LYS  25  10.073   1.760   7.998
  179   1HD   LYS  25          2HD       LYS  25   9.767   1.780  10.400
  180   2HD   LYS  25          3HD       LYS  25  10.024   0.047  10.544
  181   1HE   LYS  25          2HE       LYS  25  12.099   2.034   9.491
  182   2HE   LYS  25          3HE       LYS  25  11.994   1.504  11.177
  183   1HZ   LYS  25          1HZ       LYS  25  12.516  -0.266   8.884
  184   2HZ   LYS  25          2HZ       LYS  25  13.617   0.238   9.995
  185   3HZ   LYS  25          3HZ       LYS  25  12.385  -0.746  10.453
  186    H    LEU  26           H        LEU  26   5.615  -1.294   8.144
  187    HA   LEU  26           HA       LEU  26   4.507  -0.622  10.671
  188   1HB   LEU  26          2HB       LEU  26   3.428  -0.680   8.342
  189   2HB   LEU  26          3HB       LEU  26   3.232  -2.405   8.532
  190    HG   LEU  26           HG       LEU  26   1.327  -0.762   9.018
  191   1HD1  LEU  26          1HD1      LEU  26   0.243  -2.282  10.536
  192   2HD1  LEU  26          2HD1      LEU  26   1.162  -3.184   9.318
  193   3HD1  LEU  26          3HD1      LEU  26   1.799  -3.022  10.973
  194   1HD2  LEU  26          1HD2      LEU  26   1.017   0.014  11.281
  195   2HD2  LEU  26          2HD2      LEU  26   2.491  -0.787  11.835
  196   3HD2  LEU  26          3HD2      LEU  26   2.590   0.611  10.744
  197    H    GLY  27           H        GLY  27   5.488  -3.686   9.183
  198   1HA   GLY  27          2HA       GLY  27   5.968  -4.976  11.631
  199   2HA   GLY  27          3HA       GLY  27   4.289  -5.360  11.208
  200    H    GLY  28           H        GLY  28   3.859  -6.740   9.428
  201   1HA   GLY  28          2HA       GLY  28   6.064  -7.955   7.886
  202   2HA   GLY  28          3HA       GLY  28   5.302  -8.992   9.113
  203    H    VAL  29           H        VAL  29   4.045  -6.458   7.027
  204    HA   VAL  29           HA       VAL  29   1.571  -7.887   6.606
  205    HB   VAL  29           HB       VAL  29   1.301  -5.629   7.049
  206   1HG1  VAL  29          1HG1      VAL  29   3.429  -4.682   6.905
  207   2HG1  VAL  29          2HG1      VAL  29   3.566  -5.019   5.165
  208   3HG1  VAL  29          3HG1      VAL  29   2.434  -3.789   5.779
  209   1HG2  VAL  29          1HG2      VAL  29  -0.083  -6.329   5.117
  210   2HG2  VAL  29          2HG2      VAL  29   0.289  -4.607   5.126
  211   3HG2  VAL  29          3HG2      VAL  29   1.149  -5.679   4.015
  212    H    LYS  30           H        LYS  30   0.956  -9.088   4.886
  213    HA   LYS  30           HA       LYS  30   2.571  -9.262   2.455
  214   1HB   LYS  30          2HB       LYS  30   1.568 -11.257   3.025
  215   2HB   LYS  30          3HB       LYS  30   0.042 -10.508   3.454
  216   1HG   LYS  30          2HG       LYS  30  -0.219 -11.794   1.409
  217   2HG   LYS  30          3HG       LYS  30  -0.563 -10.120   1.142
  218   1HD   LYS  30          2HD       LYS  30   0.727 -11.053  -0.740
  219   2HD   LYS  30          3HD       LYS  30   1.593  -9.738   0.001
  220   1HE   LYS  30          2HE       LYS  30   3.074 -11.637  -0.535
  221   2HE   LYS  30          3HE       LYS  30   3.095 -11.239   1.186
  222   1HZ   LYS  30          1HZ       LYS  30   2.936 -13.607   0.815
  223   2HZ   LYS  30          2HZ       LYS  30   1.587 -13.057   1.578
  224   3HZ   LYS  30          3HZ       LYS  30   1.532 -13.427  -0.026
  225    H    TYR  31           H        TYR  31   2.609  -7.641   1.187
  226    HA   TYR  31           HA       TYR  31   0.149  -6.232   0.275
  227   1HB   TYR  31          2HB       TYR  31   1.835  -4.423  -0.403
  228   2HB   TYR  31          3HB       TYR  31   1.398  -4.563   1.291
  229    HD1  TYR  31           HD1      TYR  31   3.016  -4.828   2.942
  230    HD2  TYR  31           HD2      TYR  31   4.087  -5.741  -1.110
  231    HE1  TYR  31           HE1      TYR  31   5.421  -4.808   3.578
  232    HE2  TYR  31           HE2      TYR  31   6.473  -5.803  -0.473
  233    HH   TYR  31           HH       TYR  31   7.548  -4.385   2.532
  234    H    ASP  32           H        ASP  32   0.002  -5.827  -1.907
  235    HA   ASP  32           HA       ASP  32   1.862  -7.125  -3.831
  236   1HB   ASP  32          2HB       ASP  32  -1.120  -6.510  -3.941
  237   2HB   ASP  32          3HB       ASP  32  -0.208  -7.095  -5.306
  238    H    ILE  33           H        ILE  33   2.677  -5.543  -5.291
  239    HA   ILE  33           HA       ILE  33   1.462  -2.813  -5.253
  240    HB   ILE  33           HB       ILE  33   4.419  -3.367  -5.599
  241   1HG1  ILE  33          2HG1      ILE  33   4.263  -1.809  -3.374
  242   2HG1  ILE  33          3HG1      ILE  33   2.804  -2.768  -3.128
  243   1HG2  ILE  33          1HG2      ILE  33   2.847  -0.772  -5.272
  244   2HG2  ILE  33          2HG2      ILE  33   4.596  -0.937  -5.497
  245   3HG2  ILE  33          3HG2      ILE  33   3.496  -1.381  -6.800
  246   1HD1  ILE  33          1HD1      ILE  33   5.607  -3.872  -3.640
  247   2HD1  ILE  33          2HD1      ILE  33   4.834  -3.714  -2.057
  248   3HD1  ILE  33          3HD1      ILE  33   4.164  -4.843  -3.260
  249    H    ASP  34           H        ASP  34   0.699  -2.308  -7.218
  250    HA   ASP  34           HA       ASP  34   1.658  -3.813  -9.615
  251   1HB   ASP  34          2HB       ASP  34  -0.733  -4.097  -9.035
  252   2HB   ASP  34          3HB       ASP  34  -0.943  -2.339  -9.167
  253    H    LEU  35           H        LEU  35   3.127  -2.643 -10.643
  254    HA   LEU  35           HA       LEU  35   3.343   0.248 -10.400
  255   1HB   LEU  35          2HB       LEU  35   4.836  -1.837 -12.028
  256   2HB   LEU  35          3HB       LEU  35   5.098  -0.113 -12.251
  257    HG   LEU  35           HG       LEU  35   6.796  -1.174 -10.896
  258   1HD1  LEU  35          1HD1      LEU  35   6.954   0.445  -9.119
  259   2HD1  LEU  35          2HD1      LEU  35   6.280   1.225 -10.554
  260   3HD1  LEU  35          3HD1      LEU  35   5.216   0.793  -9.195
  261   1HD2  LEU  35          1HD2      LEU  35   6.442  -2.060  -8.701
  262   2HD2  LEU  35          2HD2      LEU  35   4.719  -1.651  -8.737
  263   3HD2  LEU  35          3HD2      LEU  35   5.362  -2.910  -9.814
  264    HA   PRO  36           HA       PRO  36   2.209   0.292 -15.059
  265   1HB   PRO  36          2HB       PRO  36   0.601  -1.767 -16.062
  266   2HB   PRO  36          3HB       PRO  36   2.368  -1.635 -16.255
  267   1HG   PRO  36          2HG       PRO  36   0.843  -3.204 -14.176
  268   2HG   PRO  36          3HG       PRO  36   2.235  -3.743 -15.158
  269   1HD   PRO  36          2HD       PRO  36   2.608  -2.943 -12.656
  270   2HD   PRO  36          3HD       PRO  36   3.739  -2.373 -13.919
  271    H    ASN  37           H        ASN  37  -0.209  -1.424 -12.967
  272    HA   ASN  37           HA       ASN  37  -2.326   0.352 -14.028
  273   1HB   ASN  37          2HB       ASN  37  -2.547  -1.835 -11.953
  274   2HB   ASN  37          3HB       ASN  37  -3.858  -0.960 -12.726
  275   1HD2  ASN  37          1HD2      ASN  37  -1.865  -3.736 -12.988
  276   2HD2  ASN  37          2HD2      ASN  37  -2.258  -4.141 -14.662
  277    H    LYS  38           H        LYS  38   0.063   0.694 -11.583
  278    HA   LYS  38           HA       LYS  38   0.369   2.300 -10.101
  279   1HB   LYS  38          2HB       LYS  38  -2.082   3.681 -11.280
  280   2HB   LYS  38          3HB       LYS  38  -0.754   4.385 -10.373
  281   1HG   LYS  38          2HG       LYS  38   0.800   3.621 -12.298
  282   2HG   LYS  38          3HG       LYS  38  -0.645   3.079 -13.145
  283   1HD   LYS  38          2HD       LYS  38  -0.285   5.169 -14.085
  284   2HD   LYS  38          3HD       LYS  38  -1.566   5.451 -12.891
  285   1HE   LYS  38          2HE       LYS  38   0.331   6.149 -11.269
  286   2HE   LYS  38          3HE       LYS  38   1.418   6.107 -12.655
  287   1HZ   LYS  38          1HZ       LYS  38   0.465   8.310 -12.102
  288   2HZ   LYS  38          2HZ       LYS  38   0.066   7.868 -13.661
  289   3HZ   LYS  38          3HZ       LYS  38  -0.996   7.815 -12.379
  290    H    LYS  39           H        LYS  39  -0.589   0.204  -8.900
  291    HA   LYS  39           HA       LYS  39  -2.598   1.250  -6.995
  292   1HB   LYS  39          2HB       LYS  39  -2.807  -1.421  -8.464
  293   2HB   LYS  39          3HB       LYS  39  -3.738  -0.995  -7.019
  294   1HG   LYS  39          2HG       LYS  39  -4.987   0.668  -8.156
  295   2HG   LYS  39          3HG       LYS  39  -3.902   0.659  -9.542
  296   1HD   LYS  39          2HD       LYS  39  -5.946  -0.463 -10.102
  297   2HD   LYS  39          3HD       LYS  39  -4.608  -1.601 -10.183
  298   1HE   LYS  39          2HE       LYS  39  -6.414  -1.359  -7.716
  299   2HE   LYS  39          3HE       LYS  39  -6.854  -2.364  -9.097
  300   1HZ   LYS  39          1HZ       LYS  39  -5.812  -3.595  -7.390
  301   2HZ   LYS  39          2HZ       LYS  39  -4.893  -3.676  -8.755
  302   3HZ   LYS  39          3HZ       LYS  39  -4.431  -2.741  -7.476
  303    H    VAL  40           H        VAL  40  -2.672  -0.050  -4.953
  304    HA   VAL  40           HA       VAL  40  -0.584  -2.067  -4.591
  305    HB   VAL  40           HB       VAL  40  -1.330   0.416  -2.978
  306   1HG1  VAL  40          1HG1      VAL  40  -0.266  -2.149  -1.803
  307   2HG1  VAL  40          2HG1      VAL  40  -0.261  -0.555  -0.993
  308   3HG1  VAL  40          3HG1      VAL  40  -1.802  -1.292  -1.477
  309   1HG2  VAL  40          1HG2      VAL  40   1.055   0.690  -2.775
  310   2HG2  VAL  40          2HG2      VAL  40   1.350  -0.941  -3.437
  311   3HG2  VAL  40          3HG2      VAL  40   0.696   0.339  -4.479
  312    H    CYS  41           H        CYS  41  -1.435  -3.775  -3.278
  313    HA   CYS  41           HA       CYS  41  -4.028  -3.300  -2.083
  314   1HB   CYS  41          2HB       CYS  41  -5.220  -5.123  -3.101
  315   2HB   CYS  41          3HB       CYS  41  -4.751  -3.923  -4.318
  316    HG   CYS  41           HG       CYS  41  -4.849  -6.180  -5.319
  317    H    ILE  42           H        ILE  42  -4.469  -4.735  -0.374
  318    HA   ILE  42           HA       ILE  42  -2.019  -6.214   0.511
  319    HB   ILE  42           HB       ILE  42  -3.424  -4.055   2.131
  320   1HG1  ILE  42          2HG1      ILE  42  -0.984  -3.862   0.323
  321   2HG1  ILE  42          3HG1      ILE  42  -2.444  -2.851   0.329
  322   1HG2  ILE  42          1HG2      ILE  42  -1.510  -4.276   3.622
  323   2HG2  ILE  42          2HG2      ILE  42  -2.180  -5.878   3.373
  324   3HG2  ILE  42          3HG2      ILE  42  -0.715  -5.382   2.496
  325   1HD1  ILE  42          1HD1      ILE  42  -0.182  -2.891   2.335
  326   2HD1  ILE  42          2HD1      ILE  42  -0.687  -1.560   1.289
  327   3HD1  ILE  42          3HD1      ILE  42  -1.726  -2.058   2.647
  328    H    GLU  43           H        GLU  43  -2.371  -7.910   1.823
  329    HA   GLU  43           HA       GLU  43  -5.082  -8.473   2.888
  330   1HB   GLU  43          2HB       GLU  43  -4.882  -9.307   0.494
  331   2HB   GLU  43          3HB       GLU  43  -3.583 -10.383   1.020
  332   1HG   GLU  43          2HG       GLU  43  -6.413 -10.407   2.168
  333   2HG   GLU  43          3HG       GLU  43  -5.869 -11.434   0.837
  334    H    SER  44           H        SER  44  -4.214  -8.328   4.989
  335    HA   SER  44           HA       SER  44  -2.561 -10.468   5.849
  336   1HB   SER  44          2HB       SER  44  -1.041  -8.396   4.840
  337   2HB   SER  44          3HB       SER  44  -1.140  -7.948   6.548
  338    HG   SER  44           HG       SER  44  -0.487 -10.348   6.830
  339    H    GLU  45           H        GLU  45  -2.081 -10.229   8.189
  340    HA   GLU  45           HA       GLU  45  -4.572  -9.897   9.443
  341   1HB   GLU  45          2HB       GLU  45  -1.923 -10.508  10.815
  342   2HB   GLU  45          3HB       GLU  45  -3.542 -11.060  11.239
  343   1HG   GLU  45          2HG       GLU  45  -2.779 -12.961  10.235
  344   2HG   GLU  45          3HG       GLU  45  -3.395 -12.194   8.775
  345    H    HIS  46           H        HIS  46  -3.305  -7.258   8.722
  346    HA   HIS  46           HA       HIS  46  -3.199  -5.948  11.419
  347   1HB   HIS  46          2HB       HIS  46  -2.291  -4.964   8.692
  348   2HB   HIS  46          3HB       HIS  46  -2.271  -4.007  10.174
  349    HD1  HIS  46           1HD      HIS  46  -0.426  -4.730  12.065
  350    HD2  HIS  46           2HD      HIS  46  -0.277  -6.671   8.343
  351    HE1  HIS  46           1HE      HIS  46   1.874  -5.817  11.904
  352    H    SER  47           H        SER  47  -4.216  -3.583  11.053
  353    HA   SER  47           HA       SER  47  -6.972  -3.994   9.995
  354   1HB   SER  47          2HB       SER  47  -6.812  -3.417  12.366
  355   2HB   SER  47          3HB       SER  47  -5.913  -1.945  11.957
  356    HG   SER  47           HG       SER  47  -7.715  -1.044  11.522
  357    H    MET  48           H        MET  48  -7.817  -2.654   8.430
  358    HA   MET  48           HA       MET  48  -6.207  -1.623   6.466
  359   1HB   MET  48          2HB       MET  48  -8.666  -2.255   6.383
  360   2HB   MET  48          3HB       MET  48  -9.035  -0.723   7.191
  361   1HG   MET  48          2HG       MET  48  -7.926   0.493   5.326
  362   2HG   MET  48          3HG       MET  48  -7.506  -1.063   4.597
  363   1HE   MET  48          1HE       MET  48 -10.405   1.444   5.462
  364   2HE   MET  48          2HE       MET  48 -11.817   0.613   4.767
  365   3HE   MET  48          3HE       MET  48 -11.025  -0.054   6.207
  366    H    ASP  49           H        ASP  49  -7.781   0.071   9.190
  367    HA   ASP  49           HA       ASP  49  -7.218   2.726   8.426
  368   1HB   ASP  49          2HB       ASP  49  -7.782   3.335  10.645
  369   2HB   ASP  49          3HB       ASP  49  -8.826   1.973  10.236
  370    H    THR  50           H        THR  50  -5.518   0.546  10.487
  371    HA   THR  50           HA       THR  50  -3.323   2.112  11.247
  372    HB   THR  50           HB       THR  50  -3.550  -0.922  10.982
  373    HG1  THR  50           1HG      THR  50  -5.230   0.236  12.252
  374   1HG2  THR  50          1HG2      THR  50  -1.967  -0.980  12.873
  375   2HG2  THR  50          2HG2      THR  50  -1.244  -0.283  11.415
  376   3HG2  THR  50          3HG2      THR  50  -1.757   0.780  12.749
  377    H    LEU  51           H        LEU  51  -3.591  -0.304   8.580
  378    HA   LEU  51           HA       LEU  51  -0.970   0.099   7.499
  379   1HB   LEU  51          2HB       LEU  51  -3.567  -0.562   6.044
  380   2HB   LEU  51          3HB       LEU  51  -1.943  -0.646   5.339
  381    HG   LEU  51           HG       LEU  51  -2.819  -2.257   7.787
  382   1HD1  LEU  51          1HD1      LEU  51  -4.252  -2.907   5.951
  383   2HD1  LEU  51          2HD1      LEU  51  -2.878  -2.988   4.837
  384   3HD1  LEU  51          3HD1      LEU  51  -3.029  -4.170   6.160
  385   1HD2  LEU  51          1HD2      LEU  51  -0.462  -2.511   5.880
  386   2HD2  LEU  51          2HD2      LEU  51  -0.384  -2.059   7.594
  387   3HD2  LEU  51          3HD2      LEU  51  -0.873  -3.692   7.140
  388    H    LEU  52           H        LEU  52  -4.097   1.589   6.566
  389    HA   LEU  52           HA       LEU  52  -3.174   3.315   4.602
  390   1HB   LEU  52          2HB       LEU  52  -5.583   2.783   5.521
  391   2HB   LEU  52          3HB       LEU  52  -5.347   4.316   6.351
  392    HG   LEU  52           HG       LEU  52  -6.406   4.696   4.296
  393   1HD1  LEU  52          1HD1      LEU  52  -3.538   5.482   3.690
  394   2HD1  LEU  52          2HD1      LEU  52  -5.020   6.255   3.114
  395   3HD1  LEU  52          3HD1      LEU  52  -4.603   6.336   4.835
  396   1HD2  LEU  52          1HD2      LEU  52  -5.850   2.572   3.168
  397   2HD2  LEU  52          2HD2      LEU  52  -5.735   3.985   2.106
  398   3HD2  LEU  52          3HD2      LEU  52  -4.263   3.229   2.723
  399    H    ALA  53           H        ALA  53  -3.696   4.154   8.056
  400    HA   ALA  53           HA       ALA  53  -2.650   6.746   7.976
  401   1HB   ALA  53          1HB       ALA  53  -3.985   5.835   9.852
  402   2HB   ALA  53          2HB       ALA  53  -2.647   4.750  10.288
  403   3HB   ALA  53          3HB       ALA  53  -2.451   6.509  10.439
  404    H    THR  54           H        THR  54  -0.937   3.665   8.527
  405    HA   THR  54           HA       THR  54   1.616   4.869   9.041
  406    HB   THR  54           HB       THR  54   0.888   2.131   7.907
  407    HG1  THR  54           1HG      THR  54   0.122   2.385   9.928
  408   1HG2  THR  54          1HG2      THR  54   3.170   2.614   7.288
  409   2HG2  THR  54          2HG2      THR  54   3.530   3.257   8.912
  410   3HG2  THR  54          3HG2      THR  54   3.186   1.533   8.683
  411    H    LEU  55           H        LEU  55   0.313   3.408   5.992
  412    HA   LEU  55           HA       LEU  55   2.682   3.978   4.550
  413   1HB   LEU  55          2HB       LEU  55   1.580   3.098   2.703
  414   2HB   LEU  55          3HB       LEU  55   1.243   2.153   4.136
  415    HG   LEU  55           HG       LEU  55  -0.975   3.558   4.200
  416   1HD1  LEU  55          1HD1      LEU  55  -1.697   4.148   1.931
  417   2HD1  LEU  55          2HD1      LEU  55  -0.182   4.986   2.349
  418   3HD1  LEU  55          3HD1      LEU  55  -0.114   3.572   1.302
  419   1HD2  LEU  55          1HD2      LEU  55  -0.483   1.346   2.167
  420   2HD2  LEU  55          2HD2      LEU  55  -0.785   1.092   3.900
  421   3HD2  LEU  55          3HD2      LEU  55  -2.050   1.808   2.878
  422    H    LYS  56           H        LYS  56  -0.294   5.745   4.913
  423    HA   LYS  56           HA       LYS  56  -0.287   7.822   3.277
  424   1HB   LYS  56          2HB       LYS  56  -1.534   7.459   5.592
  425   2HB   LYS  56          3HB       LYS  56  -0.251   8.470   6.251
  426   1HG   LYS  56          2HG       LYS  56  -0.935  10.174   4.444
  427   2HG   LYS  56          3HG       LYS  56  -2.287   9.051   4.097
  428   1HD   LYS  56          2HD       LYS  56  -2.972   9.192   6.510
  429   2HD   LYS  56          3HD       LYS  56  -1.719  10.401   6.791
  430   1HE   LYS  56          2HE       LYS  56  -4.124  10.649   4.900
  431   2HE   LYS  56          3HE       LYS  56  -3.971  11.412   6.488
  432   1HZ   LYS  56          1HZ       LYS  56  -2.101  12.670   5.632
  433   2HZ   LYS  56          2HZ       LYS  56  -2.274  11.980   4.146
  434   3HZ   LYS  56          3HZ       LYS  56  -3.458  12.947   4.747
  435    H    LYS  57           H        LYS  57   2.218   7.332   5.725
  436    HA   LYS  57           HA       LYS  57   3.379   9.892   5.837
  437   1HB   LYS  57          2HB       LYS  57   4.464   7.119   6.306
  438   2HB   LYS  57          3HB       LYS  57   5.378   8.599   6.693
  439   1HG   LYS  57          2HG       LYS  57   3.579   9.320   8.197
  440   2HG   LYS  57          3HG       LYS  57   2.591   7.936   7.701
  441   1HD   LYS  57          2HD       LYS  57   4.289   6.365   8.568
  442   2HD   LYS  57          3HD       LYS  57   5.200   7.740   9.236
  443   1HE   LYS  57          2HE       LYS  57   3.273   8.362  10.653
  444   2HE   LYS  57          3HE       LYS  57   2.259   7.133   9.882
  445   1HZ   LYS  57          1HZ       LYS  57   3.657   5.439  10.818
  446   2HZ   LYS  57          2HZ       LYS  57   4.625   6.563  11.538
  447   3HZ   LYS  57          3HZ       LYS  57   3.055   6.405  11.999
  448    H    THR  58           H        THR  58   3.532   7.605   3.119
  449    HA   THR  58           HA       THR  58   5.994   8.624   2.009
  450    HB   THR  58           HB       THR  58   5.118   7.750  -0.128
  451    HG1  THR  58           1HG      THR  58   2.951   8.107   0.004
  452   1HG2  THR  58          1HG2      THR  58   4.666   5.906   2.244
  453   2HG2  THR  58          2HG2      THR  58   4.951   5.399   0.566
  454   3HG2  THR  58          3HG2      THR  58   6.228   6.251   1.472
  455    H    GLY  59           H        GLY  59   2.801   9.982   2.353
  456   1HA   GLY  59          2HA       GLY  59   2.018  12.039   1.881
  457   2HA   GLY  59          3HA       GLY  59   3.693  12.524   1.528
  458    H    LYS  60           H        LYS  60   1.802  10.010  -0.148
  459    HA   LYS  60           HA       LYS  60   1.670  11.661  -2.615
  460   1HB   LYS  60          2HB       LYS  60   2.705   8.863  -2.106
  461   2HB   LYS  60          3HB       LYS  60   2.085   9.252  -3.681
  462   1HG   LYS  60          2HG       LYS  60   4.288  10.750  -2.198
  463   2HG   LYS  60          3HG       LYS  60   4.557   9.531  -3.412
  464   1HD   LYS  60          2HD       LYS  60   3.230  12.276  -3.894
  465   2HD   LYS  60          3HD       LYS  60   4.903  11.880  -4.136
  466   1HE   LYS  60          2HE       LYS  60   3.874  11.945  -6.274
  467   2HE   LYS  60          3HE       LYS  60   4.382  10.296  -5.925
  468   1HZ   LYS  60          1HZ       LYS  60   2.201  10.318  -6.944
  469   2HZ   LYS  60          2HZ       LYS  60   2.073   9.775  -5.457
  470   3HZ   LYS  60          3HZ       LYS  60   1.560  11.300  -5.810
  471    H    THR  61           H        THR  61   0.387  10.701  -4.258
  472    HA   THR  61           HA       THR  61  -2.275  10.699  -3.676
  473    HB   THR  61           HB       THR  61  -1.106   9.594  -6.207
  474    HG1  THR  61           1HG      THR  61  -0.566  12.004  -6.547
  475   1HG2  THR  61          1HG2      THR  61  -3.491  10.327  -6.089
  476   2HG2  THR  61          2HG2      THR  61  -2.960  11.969  -5.668
  477   3HG2  THR  61          3HG2      THR  61  -2.579  11.288  -7.264
  478    H    VAL  62           H        VAL  62  -1.563   8.637  -2.091
  479    HA   VAL  62           HA       VAL  62  -2.552   6.161  -3.382
  480    HB   VAL  62           HB       VAL  62  -0.708   5.673  -2.038
  481   1HG1  VAL  62          1HG1      VAL  62  -0.504   7.606  -0.592
  482   2HG1  VAL  62          2HG1      VAL  62  -2.021   7.202   0.248
  483   3HG1  VAL  62          3HG1      VAL  62  -0.594   6.157   0.391
  484   1HG2  VAL  62          1HG2      VAL  62  -1.603   4.036  -0.558
  485   2HG2  VAL  62          2HG2      VAL  62  -3.104   4.947  -0.310
  486   3HG2  VAL  62          3HG2      VAL  62  -2.770   4.184  -1.876
  487    H    SER  63           H        SER  63  -4.627   5.406  -2.985
  488    HA   SER  63           HA       SER  63  -6.260   6.581  -0.853
  489   1HB   SER  63          2HB       SER  63  -6.955   6.935  -3.808
  490   2HB   SER  63          3HB       SER  63  -8.099   7.182  -2.478
  491    HG   SER  63           HG       SER  63  -5.745   8.520  -2.083
  492    H    TYR  64           H        TYR  64  -8.289   5.340  -0.639
  493    HA   TYR  64           HA       TYR  64  -7.738   2.508  -1.241
  494   1HB   TYR  64          2HB       TYR  64  -7.804   2.635   1.029
  495   2HB   TYR  64          3HB       TYR  64  -8.831   4.053   1.039
  496    HD1  TYR  64           HD1      TYR  64 -11.034   3.902   1.731
  497    HD2  TYR  64           HD2      TYR  64  -9.071   0.354   0.247
  498    HE1  TYR  64           HE1      TYR  64 -12.994   2.551   2.368
  499    HE2  TYR  64           HE2      TYR  64 -11.031  -0.994   0.923
  500    HH   TYR  64           HH       TYR  64 -13.922   0.442   2.448
  501    H    LEU  65           H        LEU  65  -9.052   1.268  -2.463
  502    HA   LEU  65           HA       LEU  65 -11.872   1.907  -2.823
  503   1HB   LEU  65          2HB       LEU  65 -11.514   1.694  -5.369
  504   2HB   LEU  65          3HB       LEU  65 -11.417   3.237  -4.543
  505    HG   LEU  65           HG       LEU  65  -9.779   2.968  -6.276
  506   1HD1  LEU  65          1HD1      LEU  65  -8.169   3.218  -3.846
  507   2HD1  LEU  65          2HD1      LEU  65  -8.099   4.135  -5.347
  508   3HD1  LEU  65          3HD1      LEU  65  -9.428   4.420  -4.227
  509   1HD2  LEU  65          1HD2      LEU  65  -8.399   0.824  -4.696
  510   2HD2  LEU  65          2HD2      LEU  65  -9.285   0.609  -6.222
  511   3HD2  LEU  65          3HD2      LEU  65  -7.826   1.592  -6.187
  512    H    GLY  66           H        GLY  66 -11.729  -0.209  -1.570
  513   1HA   GLY  66          2HA       GLY  66 -13.331  -1.908  -2.557
  514   2HA   GLY  66          3HA       GLY  66 -11.972  -2.425  -3.572
  515    H    LEU  67           H        LEU  67 -13.356  -4.052  -1.533
  516    HA   LEU  67           HA       LEU  67 -11.002  -5.012  -0.307
  517   1HB   LEU  67          2HB       LEU  67 -11.636  -4.919   2.008
  518   2HB   LEU  67          3HB       LEU  67 -11.678  -3.275   1.391
  519    HG   LEU  67           HG       LEU  67 -14.068  -5.099   1.945
  520   1HD1  LEU  67          1HD1      LEU  67 -12.901  -4.237   3.942
  521   2HD1  LEU  67          2HD1      LEU  67 -13.062  -2.578   3.328
  522   3HD1  LEU  67          3HD1      LEU  67 -14.508  -3.510   3.770
  523   1HD2  LEU  67          1HD2      LEU  67 -14.779  -3.671   0.134
  524   2HD2  LEU  67          2HD2      LEU  67 -15.416  -2.970   1.618
  525   3HD2  LEU  67          3HD2      LEU  67 -13.982  -2.254   0.855
  526    H    GLU  68           H        GLU  68 -11.299  -7.176   0.536
  527    HA   GLU  68           HA       GLU  68 -13.864  -8.512   0.217
  528   1HB   GLU  68          2HB       GLU  68 -12.720  -8.325  -2.126
  529   2HB   GLU  68          3HB       GLU  68 -11.502  -9.424  -1.474
  530   1HG   GLU  68          2HG       GLU  68 -13.008 -10.840  -2.591
  531   2HG   GLU  68          3HG       GLU  68 -13.517 -10.985  -0.901
  Start of MODEL   17
    1   1H    MET   1           H1       MET   1  -7.668  -6.669   6.371
    2   2H    MET   1           H2       MET   1  -6.770  -6.532   7.754
    3   3H    MET   1           H3       MET   1  -6.314  -7.576   6.604
    4    HA   MET   1           HA       MET   1  -7.192  -8.786   8.374
    5   1HB   MET   1          2HB       MET   1  -9.655  -7.110   7.926
    6   2HB   MET   1          3HB       MET   1  -9.731  -8.734   8.670
    7   1HG   MET   1          2HG       MET   1  -8.153  -8.031  10.391
    8   2HG   MET   1          3HG       MET   1  -8.038  -6.417   9.676
    9   1HE   MET   1          1HE       MET   1 -11.252  -5.873   8.989
   10   2HE   MET   1          2HE       MET   1 -11.599  -4.961  10.471
   11   3HE   MET   1          3HE       MET   1 -10.062  -4.704   9.618
   12    HA   PRO   2           HA       PRO   2  -8.569 -10.977   4.511
   13   1HB   PRO   2          2HB       PRO   2 -10.713 -10.472   3.051
   14   2HB   PRO   2          3HB       PRO   2 -10.905 -11.114   4.691
   15   1HG   PRO   2          2HG       PRO   2 -11.101  -8.180   3.923
   16   2HG   PRO   2          3HG       PRO   2 -12.276  -9.149   4.846
   17   1HD   PRO   2          2HD       PRO   2 -10.307  -7.595   5.970
   18   2HD   PRO   2          3HD       PRO   2 -10.928  -9.079   6.761
   19    H    LYS   3           H        LYS   3  -9.921  -8.929   2.170
   20    HA   LYS   3           HA       LYS   3  -7.176  -8.197   1.310
   21   1HB   LYS   3          2HB       LYS   3  -8.225  -9.859  -0.058
   22   2HB   LYS   3          3HB       LYS   3  -9.735  -8.989  -0.108
   23   1HG   LYS   3          2HG       LYS   3  -8.765  -7.194  -1.446
   24   2HG   LYS   3          3HG       LYS   3  -7.151  -7.918  -1.267
   25   1HD   LYS   3          2HD       LYS   3  -7.868  -9.899  -2.546
   26   2HD   LYS   3          3HD       LYS   3  -9.537  -9.309  -2.590
   27   1HE   LYS   3          2HE       LYS   3  -8.328  -8.887  -4.734
   28   2HE   LYS   3          3HE       LYS   3  -8.913  -7.400  -3.979
   29   1HZ   LYS   3          1HZ       LYS   3  -6.769  -6.997  -3.131
   30   2HZ   LYS   3          2HZ       LYS   3  -6.139  -8.378  -3.718
   31   3HZ   LYS   3          3HZ       LYS   3  -6.685  -7.118  -4.727
   32    H    HIS   4           H        HIS   4  -6.684  -6.110   0.873
   33    HA   HIS   4           HA       HIS   4  -8.878  -4.106   0.719
   34   1HB   HIS   4          2HB       HIS   4  -6.255  -3.724   2.185
   35   2HB   HIS   4          3HB       HIS   4  -7.617  -2.604   2.088
   36    HD1  HIS   4           1HD      HIS   4 -10.020  -4.320   2.929
   37    HD2  HIS   4           2HD      HIS   4  -6.165  -4.909   4.480
   38    HE1  HIS   4           1HE      HIS   4 -10.302  -5.522   5.155
   39    H    GLU   5           H        GLU   5  -8.745  -2.820  -1.076
   40    HA   GLU   5           HA       GLU   5  -6.322  -2.974  -2.801
   41   1HB   GLU   5          2HB       GLU   5  -9.284  -2.453  -3.132
   42   2HB   GLU   5          3HB       GLU   5  -8.180  -1.949  -4.395
   43   1HG   GLU   5          2HG       GLU   5  -8.171  -4.786  -3.224
   44   2HG   GLU   5          3HG       GLU   5  -9.236  -4.298  -4.532
   45    H    PHE   6           H        PHE   6  -5.246  -1.136  -3.504
   46    HA   PHE   6           HA       PHE   6  -6.252   1.500  -2.637
   47   1HB   PHE   6          2HB       PHE   6  -3.388   0.569  -2.206
   48   2HB   PHE   6          3HB       PHE   6  -4.078   2.094  -1.686
   49    HD1  PHE   6           1HD      PHE   6  -5.044   2.253   0.589
   50    HD2  PHE   6           2HD      PHE   6  -4.137  -1.603  -1.155
   51    HE1  PHE   6           1HE      PHE   6  -5.639   1.129   2.697
   52    HE2  PHE   6           2HE      PHE   6  -4.643  -2.681   0.989
   53    HZ   PHE   6           HZ       PHE   6  -5.425  -1.322   2.930
   54    H    SER   7           H        SER   7  -5.837   3.103  -4.057
   55    HA   SER   7           HA       SER   7  -4.477   2.473  -6.627
   56   1HB   SER   7          2HB       SER   7  -6.727   3.650  -6.574
   57   2HB   SER   7          3HB       SER   7  -5.925   5.022  -5.787
   58    HG   SER   7           HG       SER   7  -4.604   5.175  -7.673
   59    H    VAL   8           H        VAL   8  -2.492   3.509  -7.164
   60    HA   VAL   8           HA       VAL   8  -1.216   5.258  -5.134
   61    HB   VAL   8           HB       VAL   8  -0.043   2.736  -6.435
   62   1HG1  VAL   8          1HG1      VAL   8   1.624   4.356  -6.087
   63   2HG1  VAL   8          2HG1      VAL   8   1.043   4.766  -4.452
   64   3HG1  VAL   8          3HG1      VAL   8   1.795   3.182  -4.784
   65   1HG2  VAL   8          1HG2      VAL   8  -1.629   2.040  -4.673
   66   2HG2  VAL   8          2HG2      VAL   8   0.009   1.934  -4.019
   67   3HG2  VAL   8          3HG2      VAL   8  -1.010   3.305  -3.589
   68    H    ASP   9           H        ASP   9  -1.581   7.050  -6.650
   69    HA   ASP   9           HA       ASP   9  -0.335   6.689  -9.296
   70   1HB   ASP   9          2HB       ASP   9  -2.346   8.267  -8.853
   71   2HB   ASP   9          3HB       ASP   9  -1.091   9.460  -8.471
   72    H    MET  10           H        MET  10   1.569   5.905  -8.378
   73    HA   MET  10           HA       MET  10   3.633   7.998  -7.796
   74   1HB   MET  10          2HB       MET  10   3.761   4.965  -7.957
   75   2HB   MET  10          3HB       MET  10   5.147   6.029  -7.647
   76   1HG   MET  10          2HG       MET  10   2.814   6.206  -5.754
   77   2HG   MET  10          3HG       MET  10   3.829   4.764  -5.711
   78   1HE   MET  10          1HE       MET  10   4.609   4.856  -3.378
   79   2HE   MET  10          2HE       MET  10   5.192   6.313  -2.556
   80   3HE   MET  10          3HE       MET  10   3.500   6.222  -3.108
   81    H    THR  11           H        THR  11   5.477   7.962  -9.333
   82    HA   THR  11           HA       THR  11   4.920   6.831 -12.043
   83    HB   THR  11           HB       THR  11   5.650   8.994 -12.996
   84    HG1  THR  11           1HG      THR  11   6.869   9.761 -11.315
   85   1HG2  THR  11          1HG2      THR  11   3.217   8.632 -12.656
   86   2HG2  THR  11          2HG2      THR  11   3.322   9.428 -11.067
   87   3HG2  THR  11          3HG2      THR  11   3.684  10.337 -12.540
   88    H    CYS  12           H        CYS  12   6.650   5.596 -10.099
   89    HA   CYS  12           HA       CYS  12   9.115   5.709 -11.663
   90   1HB   CYS  12          2HB       CYS  12   9.468   7.521  -9.950
   91   2HB   CYS  12          3HB       CYS  12   9.126   6.337  -8.667
   92    HG   CYS  12           HG       CYS  12  11.470   6.286 -10.993
   93    H    GLY  13           H        GLY  13  10.277   3.690 -11.398
   94   1HA   GLY  13          2HA       GLY  13   8.870   1.363 -10.605
   95   2HA   GLY  13          3HA       GLY  13  10.634   1.513 -10.742
   96    H    GLY  14           H        GLY  14  11.103   3.487  -8.864
   97   1HA   GLY  14          2HA       GLY  14  11.338   2.247  -6.393
   98   2HA   GLY  14          3HA       GLY  14  11.414   3.994  -6.671
   99    H    CYS  15           H        CYS  15   8.373   3.455  -7.708
  100    HA   CYS  15           HA       CYS  15   6.843   4.110  -5.482
  101   1HB   CYS  15          2HB       CYS  15   4.963   3.114  -6.588
  102   2HB   CYS  15          3HB       CYS  15   5.949   3.987  -7.778
  103    HG   CYS  15           HG       CYS  15   7.076   1.903  -8.772
  104    H    ALA  16           H        ALA  16   7.993   0.900  -6.634
  105    HA   ALA  16           HA       ALA  16   6.637  -0.544  -4.587
  106   1HB   ALA  16          1HB       ALA  16   7.303  -1.618  -6.697
  107   2HB   ALA  16          2HB       ALA  16   9.019  -1.315  -6.354
  108   3HB   ALA  16          3HB       ALA  16   8.097  -2.451  -5.349
  109    H    GLU  17           H        GLU  17  10.057   0.604  -4.919
  110    HA   GLU  17           HA       GLU  17  11.029  -0.445  -2.554
  111   1HB   GLU  17          2HB       GLU  17  11.594   2.117  -4.092
  112   2HB   GLU  17          3HB       GLU  17  12.579   1.635  -2.729
  113   1HG   GLU  17          2HG       GLU  17  12.045  -0.464  -4.866
  114   2HG   GLU  17          3HG       GLU  17  13.149   0.849  -5.206
  115    H    ALA  18           H        ALA  18   9.237   2.584  -3.081
  116    HA   ALA  18           HA       ALA  18   9.497   3.593  -0.409
  117   1HB   ALA  18          1HB       ALA  18   7.706   5.153  -1.086
  118   2HB   ALA  18          2HB       ALA  18   8.965   5.026  -2.334
  119   3HB   ALA  18          3HB       ALA  18   7.411   4.197  -2.554
  120    H    VAL  19           H        VAL  19   6.742   1.977  -2.092
  121    HA   VAL  19           HA       VAL  19   5.030   1.821   0.152
  122    HB   VAL  19           HB       VAL  19   5.285   0.041  -2.287
  123   1HG1  VAL  19          1HG1      VAL  19   3.084   0.126  -0.168
  124   2HG1  VAL  19          2HG1      VAL  19   3.001  -0.763  -1.702
  125   3HG1  VAL  19          3HG1      VAL  19   4.163  -1.253  -0.478
  126   1HG2  VAL  19          1HG2      VAL  19   3.229   2.179  -1.549
  127   2HG2  VAL  19          2HG2      VAL  19   4.593   2.457  -2.640
  128   3HG2  VAL  19          3HG2      VAL  19   3.341   1.288  -3.082
  129    H    SER  20           H        SER  20   7.379  -0.581  -1.122
  130    HA   SER  20           HA       SER  20   6.938  -2.554   0.796
  131   1HB   SER  20          2HB       SER  20   8.263  -2.785  -1.322
  132   2HB   SER  20          3HB       SER  20   9.577  -1.850  -0.588
  133    HG   SER  20           HG       SER  20  10.024  -4.015  -0.327
  134    H    ARG  21           H        ARG  21   9.433   0.114   1.011
  135    HA   ARG  21           HA       ARG  21  10.263  -0.510   3.604
  136   1HB   ARG  21          2HB       ARG  21  10.060   2.106   2.083
  137   2HB   ARG  21          3HB       ARG  21  10.820   1.989   3.684
  138   1HG   ARG  21          2HG       ARG  21  12.447   0.431   2.942
  139   2HG   ARG  21          3HG       ARG  21  11.597   0.078   1.470
  140   1HD   ARG  21          2HD       ARG  21  12.025   2.434   0.655
  141   2HD   ARG  21          3HD       ARG  21  12.894   2.763   2.154
  142    HE   ARG  21           HE       ARG  21  14.751   1.902   1.178
  143   1HH1  ARG  21          2HH2      ARG  21  11.958   0.341  -0.392
  144   2HH1  ARG  21          1HH2      ARG  21  12.977  -0.648  -1.430
  145   1HH2  ARG  21          2HH1      ARG  21  16.012   0.867  -0.503
  146   2HH2  ARG  21          1HH1      ARG  21  15.154   0.067  -1.788
  147    H    VAL  22           H        VAL  22   7.620   1.954   2.806
  148    HA   VAL  22           HA       VAL  22   7.178   2.467   5.498
  149    HB   VAL  22           HB       VAL  22   6.555   3.808   3.431
  150   1HG1  VAL  22          1HG1      VAL  22   5.241   2.038   2.324
  151   2HG1  VAL  22          2HG1      VAL  22   4.026   2.158   3.620
  152   3HG1  VAL  22          3HG1      VAL  22   4.306   3.517   2.523
  153   1HG2  VAL  22          1HG2      VAL  22   4.516   3.455   5.631
  154   2HG2  VAL  22          2HG2      VAL  22   5.955   4.519   5.636
  155   3HG2  VAL  22          3HG2      VAL  22   4.602   4.828   4.506
  156    H    LEU  23           H        LEU  23   5.602  -0.011   3.381
  157    HA   LEU  23           HA       LEU  23   3.828  -0.970   5.365
  158   1HB   LEU  23          2HB       LEU  23   4.986  -2.080   2.785
  159   2HB   LEU  23          3HB       LEU  23   4.028  -3.079   3.850
  160    HG   LEU  23           HG       LEU  23   2.738  -2.072   1.977
  161   1HD1  LEU  23          1HD1      LEU  23   1.905  -1.674   4.878
  162   2HD1  LEU  23          2HD1      LEU  23   0.814  -1.479   3.515
  163   3HD1  LEU  23          3HD1      LEU  23   1.570  -3.063   3.816
  164   1HD2  LEU  23          1HD2      LEU  23   1.862   0.151   2.218
  165   2HD2  LEU  23          2HD2      LEU  23   2.756   0.373   3.739
  166   3HD2  LEU  23          3HD2      LEU  23   3.626   0.249   2.186
  167    H    ASN  24           H        ASN  24   7.180  -2.160   4.539
  168    HA   ASN  24           HA       ASN  24   7.159  -4.225   6.478
  169   1HB   ASN  24          2HB       ASN  24   9.315  -2.561   5.136
  170   2HB   ASN  24          3HB       ASN  24   9.705  -3.600   6.491
  171   1HD2  ASN  24          1HD2      ASN  24   8.200  -3.665   3.272
  172   2HD2  ASN  24          2HD2      ASN  24   8.519  -5.354   2.951
  173    H    LYS  25           H        LYS  25   7.915  -0.769   6.740
  174    HA   LYS  25           HA       LYS  25   8.736  -0.655   9.439
  175   1HB   LYS  25          2HB       LYS  25   7.688   1.246   7.384
  176   2HB   LYS  25          3HB       LYS  25   7.262   1.668   9.032
  177   1HG   LYS  25          2HG       LYS  25   9.372   2.727   8.443
  178   2HG   LYS  25          3HG       LYS  25   9.603   1.551   9.744
  179   1HD   LYS  25          2HD       LYS  25  10.388  -0.119   7.982
  180   2HD   LYS  25          3HD       LYS  25  10.275   1.182   6.786
  181   1HE   LYS  25          2HE       LYS  25  11.948   2.508   8.034
  182   2HE   LYS  25          3HE       LYS  25  11.975   1.303   9.332
  183   1HZ   LYS  25          1HZ       LYS  25  13.831   1.046   7.869
  184   2HZ   LYS  25          2HZ       LYS  25  12.873  -0.284   7.789
  185   3HZ   LYS  25          3HZ       LYS  25  12.855   0.819   6.566
  186    H    LEU  26           H        LEU  26   5.488  -1.161   8.190
  187    HA   LEU  26           HA       LEU  26   4.120  -0.551  10.635
  188   1HB   LEU  26          2HB       LEU  26   3.206  -0.855   8.305
  189   2HB   LEU  26          3HB       LEU  26   3.304  -2.580   8.481
  190    HG   LEU  26           HG       LEU  26   1.089  -1.438   8.803
  191   1HD1  LEU  26          1HD1      LEU  26   0.289  -2.954  10.480
  192   2HD1  LEU  26          2HD1      LEU  26   1.479  -3.770   9.453
  193   3HD1  LEU  26          3HD1      LEU  26   1.924  -3.246  11.093
  194   1HD2  LEU  26          1HD2      LEU  26   0.491  -0.394  10.866
  195   2HD2  LEU  26          2HD2      LEU  26   2.035  -0.813  11.626
  196   3HD2  LEU  26          3HD2      LEU  26   1.969   0.404  10.335
  197    H    GLY  27           H        GLY  27   5.681  -3.473   9.309
  198   1HA   GLY  27          2HA       GLY  27   6.498  -4.629  11.593
  199   2HA   GLY  27          3HA       GLY  27   4.780  -5.079  11.600
  200    H    GLY  28           H        GLY  28   3.989  -6.618  10.124
  201   1HA   GLY  28          2HA       GLY  28   5.964  -8.083   8.415
  202   2HA   GLY  28          3HA       GLY  28   5.083  -8.917   9.705
  203    H    VAL  29           H        VAL  29   3.763  -6.297   7.832
  204    HA   VAL  29           HA       VAL  29   1.403  -7.629   7.031
  205    HB   VAL  29           HB       VAL  29   1.514  -5.226   7.288
  206   1HG1  VAL  29          1HG1      VAL  29   3.624  -5.232   5.101
  207   2HG1  VAL  29          2HG1      VAL  29   2.795  -3.790   5.715
  208   3HG1  VAL  29          3HG1      VAL  29   3.836  -4.727   6.776
  209   1HG2  VAL  29          1HG2      VAL  29  -0.029  -6.122   5.508
  210   2HG2  VAL  29          2HG2      VAL  29   0.479  -4.444   5.280
  211   3HG2  VAL  29          3HG2      VAL  29   1.211  -5.716   4.299
  212    H    LYS  30           H        LYS  30   0.756  -8.519   5.023
  213    HA   LYS  30           HA       LYS  30   2.900  -8.827   2.986
  214   1HB   LYS  30          2HB       LYS  30   1.497 -10.877   3.797
  215   2HB   LYS  30          3HB       LYS  30   0.277 -10.235   2.693
  216   1HG   LYS  30          2HG       LYS  30   3.038 -11.324   2.114
  217   2HG   LYS  30          3HG       LYS  30   1.489 -11.764   1.379
  218   1HD   LYS  30          2HD       LYS  30   1.492  -9.444   0.258
  219   2HD   LYS  30          3HD       LYS  30   3.127  -9.230   0.918
  220   1HE   LYS  30          2HE       LYS  30   3.579  -9.737  -1.142
  221   2HE   LYS  30          3HE       LYS  30   3.844 -11.292  -0.345
  222   1HZ   LYS  30          1HZ       LYS  30   1.951 -12.123  -1.520
  223   2HZ   LYS  30          2HZ       LYS  30   1.231 -10.620  -1.523
  224   3HZ   LYS  30          3HZ       LYS  30   2.370 -10.859  -2.556
  225    H    TYR  31           H        TYR  31   2.899  -7.233   1.591
  226    HA   TYR  31           HA       TYR  31   0.433  -5.949   0.529
  227   1HB   TYR  31          2HB       TYR  31   1.898  -3.984   0.121
  228   2HB   TYR  31          3HB       TYR  31   1.731  -4.356   1.833
  229    HD1  TYR  31           HD1      TYR  31   4.078  -4.207  -1.002
  230    HD2  TYR  31           HD2      TYR  31   3.570  -5.559   3.031
  231    HE1  TYR  31           HE1      TYR  31   6.500  -4.768  -0.873
  232    HE2  TYR  31           HE2      TYR  31   5.988  -6.062   3.193
  233    HH   TYR  31           HH       TYR  31   8.267  -5.161   0.672
  234    H    ASP  32           H        ASP  32   0.484  -5.558  -1.757
  235    HA   ASP  32           HA       ASP  32   2.658  -6.824  -3.366
  236   1HB   ASP  32          2HB       ASP  32  -0.321  -7.259  -3.293
  237   2HB   ASP  32          3HB       ASP  32   0.554  -7.588  -4.768
  238    H    ILE  33           H        ILE  33   3.323  -5.357  -4.873
  239    HA   ILE  33           HA       ILE  33   1.731  -2.871  -5.240
  240    HB   ILE  33           HB       ILE  33   4.642  -3.321  -5.941
  241   1HG1  ILE  33          2HG1      ILE  33   4.664  -1.671  -3.737
  242   2HG1  ILE  33          3HG1      ILE  33   3.403  -2.802  -3.265
  243   1HG2  ILE  33          1HG2      ILE  33   3.056  -0.775  -5.425
  244   2HG2  ILE  33          2HG2      ILE  33   4.754  -0.893  -5.923
  245   3HG2  ILE  33          3HG2      ILE  33   3.475  -1.398  -7.031
  246   1HD1  ILE  33          1HD1      ILE  33   6.196  -3.586  -4.243
  247   2HD1  ILE  33          2HD1      ILE  33   5.729  -3.411  -2.549
  248   3HD1  ILE  33          3HD1      ILE  33   4.976  -4.680  -3.545
  249    H    ASP  34           H        ASP  34   0.902  -2.368  -7.199
  250    HA   ASP  34           HA       ASP  34   1.621  -3.988  -9.601
  251   1HB   ASP  34          2HB       ASP  34  -0.741  -4.153  -8.905
  252   2HB   ASP  34          3HB       ASP  34  -0.878  -2.387  -9.000
  253    H    LEU  35           H        LEU  35   3.055  -2.905 -10.759
  254    HA   LEU  35           HA       LEU  35   3.454  -0.027 -10.595
  255   1HB   LEU  35          2HB       LEU  35   4.756  -2.304 -12.104
  256   2HB   LEU  35          3HB       LEU  35   4.978  -0.642 -12.661
  257    HG   LEU  35           HG       LEU  35   5.863   0.029 -10.490
  258   1HD1  LEU  35          1HD1      LEU  35   5.581  -2.928  -9.767
  259   2HD1  LEU  35          2HD1      LEU  35   6.539  -1.744  -8.855
  260   3HD1  LEU  35          3HD1      LEU  35   4.786  -1.553  -8.965
  261   1HD2  LEU  35          1HD2      LEU  35   7.377  -0.727 -12.278
  262   2HD2  LEU  35          2HD2      LEU  35   8.016  -1.147 -10.679
  263   3HD2  LEU  35          3HD2      LEU  35   7.257  -2.399 -11.686
  264    HA   PRO  36           HA       PRO  36   2.073   0.013 -15.175
  265   1HB   PRO  36          2HB       PRO  36   0.306  -1.964 -16.069
  266   2HB   PRO  36          3HB       PRO  36   2.069  -1.941 -16.338
  267   1HG   PRO  36          2HG       PRO  36   0.544  -3.381 -14.165
  268   2HG   PRO  36          3HG       PRO  36   1.860  -4.018 -15.194
  269   1HD   PRO  36          2HD       PRO  36   2.372  -3.198 -12.722
  270   2HD   PRO  36          3HD       PRO  36   3.496  -2.723 -14.029
  271    H    ASN  37           H        ASN  37  -0.338  -1.539 -12.948
  272    HA   ASN  37           HA       ASN  37  -2.401   0.336 -13.944
  273   1HB   ASN  37          2HB       ASN  37  -2.650  -1.785 -11.803
  274   2HB   ASN  37          3HB       ASN  37  -3.942  -0.868 -12.567
  275   1HD2  ASN  37          1HD2      ASN  37  -2.087  -3.745 -12.793
  276   2HD2  ASN  37          2HD2      ASN  37  -2.564  -4.190 -14.436
  277    H    LYS  38           H        LYS  38   0.091   0.483 -11.557
  278    HA   LYS  38           HA       LYS  38   0.565   2.030 -10.028
  279   1HB   LYS  38          2HB       LYS  38  -1.681   3.585 -11.385
  280   2HB   LYS  38          3HB       LYS  38  -0.526   4.246 -10.245
  281   1HG   LYS  38          2HG       LYS  38   1.317   3.974 -11.742
  282   2HG   LYS  38          3HG       LYS  38   0.448   2.811 -12.739
  283   1HD   LYS  38          2HD       LYS  38   0.535   4.874 -13.971
  284   2HD   LYS  38          3HD       LYS  38  -1.119   4.470 -13.528
  285   1HE   LYS  38          2HE       LYS  38  -0.915   6.815 -13.183
  286   2HE   LYS  38          3HE       LYS  38  -0.963   6.094 -11.584
  287   1HZ   LYS  38          1HZ       LYS  38   1.482   6.398 -11.481
  288   2HZ   LYS  38          2HZ       LYS  38   1.458   7.019 -13.007
  289   3HZ   LYS  38          3HZ       LYS  38   0.691   7.784 -11.781
  290    H    LYS  39           H        LYS  39  -0.487   0.056  -8.847
  291    HA   LYS  39           HA       LYS  39  -2.419   1.150  -6.891
  292   1HB   LYS  39          2HB       LYS  39  -2.799  -1.504  -8.355
  293   2HB   LYS  39          3HB       LYS  39  -3.717  -0.961  -6.938
  294   1HG   LYS  39          2HG       LYS  39  -4.793   0.782  -8.169
  295   2HG   LYS  39          3HG       LYS  39  -3.737   0.550  -9.556
  296   1HD   LYS  39          2HD       LYS  39  -5.926  -0.402  -9.962
  297   2HD   LYS  39          3HD       LYS  39  -4.680  -1.643 -10.042
  298   1HE   LYS  39          2HE       LYS  39  -6.292  -1.145  -7.487
  299   2HE   LYS  39          3HE       LYS  39  -6.936  -2.146  -8.790
  300   1HZ   LYS  39          1HZ       LYS  39  -4.405  -2.710  -7.403
  301   2HZ   LYS  39          2HZ       LYS  39  -5.843  -3.369  -7.059
  302   3HZ   LYS  39          3HZ       LYS  39  -5.147  -3.668  -8.525
  303    H    VAL  40           H        VAL  40  -2.581  -0.359  -4.945
  304    HA   VAL  40           HA       VAL  40  -0.559  -2.452  -4.714
  305    HB   VAL  40           HB       VAL  40  -1.217  -0.018  -2.993
  306   1HG1  VAL  40          1HG1      VAL  40  -1.791  -1.743  -1.545
  307   2HG1  VAL  40          2HG1      VAL  40  -0.295  -2.667  -1.883
  308   3HG1  VAL  40          3HG1      VAL  40  -0.222  -1.105  -1.021
  309   1HG2  VAL  40          1HG2      VAL  40   1.411  -1.461  -3.430
  310   2HG2  VAL  40          2HG2      VAL  40   0.816  -0.127  -4.445
  311   3HG2  VAL  40          3HG2      VAL  40   1.145   0.154  -2.722
  312    H    CYS  41           H        CYS  41  -1.415  -4.242  -3.745
  313    HA   CYS  41           HA       CYS  41  -4.090  -3.922  -2.509
  314   1HB   CYS  41          2HB       CYS  41  -4.796  -5.996  -2.955
  315   2HB   CYS  41          3HB       CYS  41  -4.268  -5.523  -4.562
  316    HG   CYS  41           HG       CYS  41  -3.902  -8.142  -3.381
  317    H    ILE  42           H        ILE  42  -4.285  -5.057  -0.523
  318    HA   ILE  42           HA       ILE  42  -1.803  -6.246   0.565
  319    HB   ILE  42           HB       ILE  42  -3.452  -4.275   2.133
  320   1HG1  ILE  42          2HG1      ILE  42  -0.766  -3.769   0.743
  321   2HG1  ILE  42          3HG1      ILE  42  -2.304  -3.029   0.284
  322   1HG2  ILE  42          1HG2      ILE  42  -0.652  -5.296   2.682
  323   2HG2  ILE  42          2HG2      ILE  42  -1.722  -4.441   3.796
  324   3HG2  ILE  42          3HG2      ILE  42  -2.113  -6.083   3.320
  325   1HD1  ILE  42          1HD1      ILE  42  -0.930  -2.576   2.923
  326   2HD1  ILE  42          2HD1      ILE  42  -0.910  -1.477   1.533
  327   3HD1  ILE  42          3HD1      ILE  42  -2.431  -1.806   2.376
  328    H    GLU  43           H        GLU  43  -2.304  -8.129   1.446
  329    HA   GLU  43           HA       GLU  43  -5.098  -8.828   2.184
  330   1HB   GLU  43          2HB       GLU  43  -3.042  -9.866   0.182
  331   2HB   GLU  43          3HB       GLU  43  -4.079 -10.991   1.003
  332   1HG   GLU  43          2HG       GLU  43  -6.050 -10.053   0.054
  333   2HG   GLU  43          3HG       GLU  43  -5.259  -8.494  -0.250
  334    H    SER  44           H        SER  44  -4.440  -8.464   4.419
  335    HA   SER  44           HA       SER  44  -2.623 -10.404   5.561
  336   1HB   SER  44          2HB       SER  44  -1.258  -8.456   4.462
  337   2HB   SER  44          3HB       SER  44  -1.910  -7.451   5.763
  338    HG   SER  44           HG       SER  44  -0.485  -9.905   6.133
  339    H    GLU  45           H        GLU  45  -2.533  -9.983   7.972
  340    HA   GLU  45           HA       GLU  45  -5.133  -9.960   8.962
  341   1HB   GLU  45          2HB       GLU  45  -2.511  -9.539  10.461
  342   2HB   GLU  45          3HB       GLU  45  -4.053 -10.025  11.175
  343   1HG   GLU  45          2HG       GLU  45  -4.058 -12.085   9.791
  344   2HG   GLU  45          3HG       GLU  45  -2.483 -11.648   9.108
  345    H    HIS  46           H        HIS  46  -2.963  -7.232   8.567
  346    HA   HIS  46           HA       HIS  46  -3.882  -5.688  10.791
  347   1HB   HIS  46          2HB       HIS  46  -2.576  -4.727   8.226
  348   2HB   HIS  46          3HB       HIS  46  -2.636  -3.852   9.755
  349    HD1  HIS  46           1HD      HIS  46  -1.219  -5.105  11.854
  350    HD2  HIS  46           2HD      HIS  46  -0.571  -6.394   7.903
  351    HE1  HIS  46           1HE      HIS  46   0.982  -6.395  11.859
  352    H    SER  47           H        SER  47  -5.235  -3.667  10.792
  353    HA   SER  47           HA       SER  47  -7.577  -4.063   9.067
  354   1HB   SER  47          2HB       SER  47  -7.766  -3.382  11.496
  355   2HB   SER  47          3HB       SER  47  -7.203  -1.771  10.998
  356    HG   SER  47           HG       SER  47  -9.185  -1.447  10.350
  357    H    MET  48           H        MET  48  -8.534  -2.188   8.025
  358    HA   MET  48           HA       MET  48  -6.894  -1.209   5.879
  359   1HB   MET  48          2HB       MET  48  -9.494   0.026   6.908
  360   2HB   MET  48          3HB       MET  48  -8.785   0.148   5.282
  361   1HG   MET  48          2HG       MET  48  -8.981  -2.430   5.229
  362   2HG   MET  48          3HG       MET  48 -10.076  -2.258   6.610
  363   1HE   MET  48          1HE       MET  48 -12.305  -0.704   6.481
  364   2HE   MET  48          2HE       MET  48 -11.471   0.624   5.632
  365   3HE   MET  48          3HE       MET  48 -12.949  -0.079   4.943
  366    H    ASP  49           H        ASP  49  -8.092   0.153   8.926
  367    HA   ASP  49           HA       ASP  49  -7.143   2.763   8.794
  368   1HB   ASP  49          2HB       ASP  49  -7.167   1.153  11.386
  369   2HB   ASP  49          3HB       ASP  49  -7.588   2.847  11.122
  370    H    THR  50           H        THR  50  -5.702  -0.059  10.255
  371    HA   THR  50           HA       THR  50  -3.275   0.910  11.197
  372    HB   THR  50           HB       THR  50  -3.603  -1.845   9.958
  373    HG1  THR  50           1HG      THR  50  -4.797  -0.929  12.352
  374   1HG2  THR  50          1HG2      THR  50  -1.482  -1.406  11.078
  375   2HG2  THR  50          2HG2      THR  50  -2.322  -0.878  12.551
  376   3HG2  THR  50          3HG2      THR  50  -2.430  -2.569  12.018
  377    H    LEU  51           H        LEU  51  -4.013  -0.603   8.008
  378    HA   LEU  51           HA       LEU  51  -1.362  -0.266   6.959
  379   1HB   LEU  51          2HB       LEU  51  -4.017  -0.481   5.486
  380   2HB   LEU  51          3HB       LEU  51  -2.408  -0.616   4.748
  381    HG   LEU  51           HG       LEU  51  -3.429  -2.427   7.022
  382   1HD1  LEU  51          1HD1      LEU  51  -3.839  -4.135   5.298
  383   2HD1  LEU  51          2HD1      LEU  51  -4.898  -2.726   5.142
  384   3HD1  LEU  51          3HD1      LEU  51  -3.524  -2.916   4.042
  385   1HD2  LEU  51          1HD2      LEU  51  -1.618  -3.943   6.197
  386   2HD2  LEU  51          2HD2      LEU  51  -1.014  -2.588   5.215
  387   3HD2  LEU  51          3HD2      LEU  51  -1.046  -2.474   6.984
  388    H    LEU  52           H        LEU  52  -4.344   1.625   6.313
  389    HA   LEU  52           HA       LEU  52  -3.338   3.631   4.714
  390   1HB   LEU  52          2HB       LEU  52  -5.542   3.483   6.734
  391   2HB   LEU  52          3HB       LEU  52  -5.161   5.051   6.023
  392    HG   LEU  52           HG       LEU  52  -5.591   2.602   4.302
  393   1HD1  LEU  52          1HD1      LEU  52  -7.952   3.225   4.042
  394   2HD1  LEU  52          2HD1      LEU  52  -7.593   2.793   5.716
  395   3HD1  LEU  52          3HD1      LEU  52  -7.763   4.503   5.264
  396   1HD2  LEU  52          1HD2      LEU  52  -6.237   4.313   2.608
  397   2HD2  LEU  52          2HD2      LEU  52  -5.990   5.596   3.800
  398   3HD2  LEU  52          3HD2      LEU  52  -4.616   4.641   3.216
  399    H    ALA  53           H        ALA  53  -3.470   3.711   8.305
  400    HA   ALA  53           HA       ALA  53  -2.117   6.186   8.623
  401   1HB   ALA  53          1HB       ALA  53  -1.731   5.402  10.942
  402   2HB   ALA  53          2HB       ALA  53  -3.391   5.029  10.430
  403   3HB   ALA  53          3HB       ALA  53  -2.162   3.745  10.464
  404    H    THR  54           H        THR  54  -0.753   2.940   8.089
  405    HA   THR  54           HA       THR  54   1.908   4.019   8.446
  406    HB   THR  54           HB       THR  54   1.089   1.465   8.454
  407    HG1  THR  54           1HG      THR  54   3.454   1.227   8.588
  408   1HG2  THR  54          1HG2      THR  54   2.495   0.366   6.734
  409   2HG2  THR  54          2HG2      THR  54   1.167   1.249   6.012
  410   3HG2  THR  54          3HG2      THR  54   2.813   1.943   6.014
  411    H    LEU  55           H        LEU  55   0.137   2.982   5.528
  412    HA   LEU  55           HA       LEU  55   2.211   3.752   3.827
  413   1HB   LEU  55          2HB       LEU  55   0.739   3.395   1.985
  414   2HB   LEU  55          3HB       LEU  55   0.742   2.144   3.188
  415    HG   LEU  55           HG       LEU  55  -1.408   2.947   4.053
  416   1HD1  LEU  55          1HD1      LEU  55  -2.540   4.341   2.010
  417   2HD1  LEU  55          2HD1      LEU  55  -1.778   5.117   3.402
  418   3HD1  LEU  55          3HD1      LEU  55  -0.840   4.904   1.914
  419   1HD2  LEU  55          1HD2      LEU  55  -1.255   2.141   1.129
  420   2HD2  LEU  55          2HD2      LEU  55  -1.183   1.046   2.526
  421   3HD2  LEU  55          3HD2      LEU  55  -2.673   1.944   2.190
  422    H    LYS  56           H        LYS  56  -0.448   5.664   4.908
  423    HA   LYS  56           HA       LYS  56  -0.388   7.980   3.517
  424   1HB   LYS  56          2HB       LYS  56  -0.663   7.283   6.429
  425   2HB   LYS  56          3HB       LYS  56  -0.490   8.979   6.099
  426   1HG   LYS  56          2HG       LYS  56  -2.368   8.982   4.532
  427   2HG   LYS  56          3HG       LYS  56  -2.573   7.228   4.734
  428   1HD   LYS  56          2HD       LYS  56  -2.938   7.534   7.137
  429   2HD   LYS  56          3HD       LYS  56  -2.699   9.282   6.984
  430   1HE   LYS  56          2HE       LYS  56  -4.698   9.413   5.475
  431   2HE   LYS  56          3HE       LYS  56  -4.919   7.661   5.608
  432   1HZ   LYS  56          1HZ       LYS  56  -6.384   8.850   7.067
  433   2HZ   LYS  56          2HZ       LYS  56  -5.335   7.954   7.958
  434   3HZ   LYS  56          3HZ       LYS  56  -5.131   9.584   7.833
  435    H    LYS  57           H        LYS  57   2.152   7.003   5.819
  436    HA   LYS  57           HA       LYS  57   3.570   9.415   6.091
  437   1HB   LYS  57          2HB       LYS  57   4.226   6.529   6.203
  438   2HB   LYS  57          3HB       LYS  57   5.577   7.683   6.306
  439   1HG   LYS  57          2HG       LYS  57   4.532   8.756   8.225
  440   2HG   LYS  57          3HG       LYS  57   3.110   7.723   8.056
  441   1HD   LYS  57          2HD       LYS  57   5.903   6.588   8.615
  442   2HD   LYS  57          3HD       LYS  57   4.765   7.055   9.901
  443   1HE   LYS  57          2HE       LYS  57   3.034   5.647   8.865
  444   2HE   LYS  57          3HE       LYS  57   4.229   4.994   7.706
  445   1HZ   LYS  57          1HZ       LYS  57   5.420   4.074   9.571
  446   2HZ   LYS  57          2HZ       LYS  57   4.207   4.544  10.592
  447   3HZ   LYS  57          3HZ       LYS  57   3.904   3.464   9.378
  448    H    THR  58           H        THR  58   3.420   7.367   3.142
  449    HA   THR  58           HA       THR  58   5.903   8.313   2.046
  450    HB   THR  58           HB       THR  58   4.906   7.691  -0.145
  451    HG1  THR  58           1HG      THR  58   2.656   8.196   0.619
  452   1HG2  THR  58          1HG2      THR  58   4.493   5.695   2.094
  453   2HG2  THR  58          2HG2      THR  58   4.659   5.294   0.370
  454   3HG2  THR  58          3HG2      THR  58   6.028   6.015   1.256
  455    H    GLY  59           H        GLY  59   2.732   9.821   2.394
  456   1HA   GLY  59          2HA       GLY  59   1.862  11.777   1.643
  457   2HA   GLY  59          3HA       GLY  59   3.534  12.385   1.650
  458    H    LYS  60           H        LYS  60   1.526  10.118  -0.306
  459    HA   LYS  60           HA       LYS  60   2.175  11.486  -2.837
  460   1HB   LYS  60          2HB       LYS  60   2.451   8.497  -2.249
  461   2HB   LYS  60          3HB       LYS  60   2.621   9.224  -3.844
  462   1HG   LYS  60          2HG       LYS  60   4.386   9.788  -1.423
  463   2HG   LYS  60          3HG       LYS  60   4.779   8.665  -2.684
  464   1HD   LYS  60          2HD       LYS  60   5.080  10.325  -4.332
  465   2HD   LYS  60          3HD       LYS  60   4.261  11.574  -3.404
  466   1HE   LYS  60          2HE       LYS  60   6.943  10.335  -2.637
  467   2HE   LYS  60          3HE       LYS  60   6.684  11.893  -3.428
  468   1HZ   LYS  60          1HZ       LYS  60   5.240  12.406  -1.405
  469   2HZ   LYS  60          2HZ       LYS  60   5.956  11.157  -0.671
  470   3HZ   LYS  60          3HZ       LYS  60   6.884  12.411  -1.185
  471    H    THR  61           H        THR  61   0.776  10.280  -4.607
  472    HA   THR  61           HA       THR  61  -1.914  10.538  -3.867
  473    HB   THR  61           HB       THR  61  -1.132   9.210  -6.388
  474    HG1  THR  61           1HG      THR  61   0.427  10.402  -6.939
  475   1HG2  THR  61          1HG2      THR  61  -2.489  11.885  -5.803
  476   2HG2  THR  61          2HG2      THR  61  -2.392  11.110  -7.394
  477   3HG2  THR  61          3HG2      THR  61  -3.331  10.344  -6.097
  478    H    VAL  62           H        VAL  62  -1.032   8.565  -2.201
  479    HA   VAL  62           HA       VAL  62  -2.061   5.992  -3.216
  480    HB   VAL  62           HB       VAL  62  -0.039   5.740  -2.059
  481   1HG1  VAL  62          1HG1      VAL  62   0.293   6.309   0.310
  482   2HG1  VAL  62          2HG1      VAL  62   0.064   7.757  -0.663
  483   3HG1  VAL  62          3HG1      VAL  62  -1.265   7.153   0.350
  484   1HG2  VAL  62          1HG2      VAL  62  -0.684   4.108  -0.402
  485   2HG2  VAL  62          2HG2      VAL  62  -2.277   4.870  -0.191
  486   3HG2  VAL  62          3HG2      VAL  62  -1.882   4.060  -1.707
  487    H    SER  63           H        SER  63  -4.141   5.308  -2.747
  488    HA   SER  63           HA       SER  63  -5.403   6.186  -0.294
  489   1HB   SER  63          2HB       SER  63  -5.982   8.092  -1.819
  490   2HB   SER  63          3HB       SER  63  -6.793   6.933  -2.898
  491    HG   SER  63           HG       SER  63  -8.243   7.887  -1.374
  492    H    TYR  64           H        TYR  64  -7.619   5.178  -0.157
  493    HA   TYR  64           HA       TYR  64  -7.234   2.280  -0.765
  494   1HB   TYR  64          2HB       TYR  64  -7.287   2.602   1.542
  495   2HB   TYR  64          3HB       TYR  64  -8.479   3.892   1.447
  496    HD1  TYR  64           HD1      TYR  64  -8.089   0.179   1.007
  497    HD2  TYR  64           HD2      TYR  64 -10.777   3.486   1.689
  498    HE1  TYR  64           HE1      TYR  64  -9.977  -1.399   1.295
  499    HE2  TYR  64           HE2      TYR  64 -12.660   1.914   1.919
  500    HH   TYR  64           HH       TYR  64 -13.340  -0.271   1.789
  501    H    LEU  65           H        LEU  65  -8.721   1.156  -2.032
  502    HA   LEU  65           HA       LEU  65 -11.471   1.993  -2.077
  503   1HB   LEU  65          2HB       LEU  65 -11.662   2.147  -4.492
  504   2HB   LEU  65          3HB       LEU  65 -10.790   3.455  -3.722
  505    HG   LEU  65           HG       LEU  65  -9.488   3.278  -5.478
  506   1HD1  LEU  65          1HD1      LEU  65  -8.225   1.003  -3.979
  507   2HD1  LEU  65          2HD1      LEU  65  -7.531   1.885  -5.330
  508   3HD1  LEU  65          3HD1      LEU  65  -7.884   2.762  -3.813
  509   1HD2  LEU  65          1HD2      LEU  65 -10.873   1.252  -6.433
  510   2HD2  LEU  65          2HD2      LEU  65  -9.217   1.563  -7.008
  511   3HD2  LEU  65          3HD2      LEU  65  -9.488   0.305  -5.808
  512    H    GLY  66           H        GLY  66 -11.429  -0.162  -0.934
  513   1HA   GLY  66          2HA       GLY  66 -13.143  -1.752  -2.074
  514   2HA   GLY  66          3HA       GLY  66 -11.723  -2.379  -2.917
  515    H    LEU  67           H        LEU  67 -13.666  -3.071  -0.386
  516    HA   LEU  67           HA       LEU  67 -11.582  -4.390   1.253
  517   1HB   LEU  67          2HB       LEU  67 -12.746  -2.999   2.746
  518   2HB   LEU  67          3HB       LEU  67 -14.233  -3.050   1.795
  519    HG   LEU  67           HG       LEU  67 -14.660  -5.336   2.495
  520   1HD1  LEU  67          1HD1      LEU  67 -12.274  -6.022   3.048
  521   2HD1  LEU  67          2HD1      LEU  67 -12.333  -4.897   4.424
  522   3HD1  LEU  67          3HD1      LEU  67 -13.390  -6.322   4.388
  523   1HD2  LEU  67          1HD2      LEU  67 -14.248  -3.353   4.770
  524   2HD2  LEU  67          2HD2      LEU  67 -15.662  -3.452   3.699
  525   3HD2  LEU  67          3HD2      LEU  67 -15.307  -4.779   4.818
  526    H    GLU  68           H        GLU  68 -11.564  -6.641   0.720
  527    HA   GLU  68           HA       GLU  68 -14.003  -7.888  -0.359
  528   1HB   GLU  68          2HB       GLU  68 -11.081  -7.756  -1.255
  529   2HB   GLU  68          3HB       GLU  68 -12.085  -9.153  -1.530
  530   1HG   GLU  68          2HG       GLU  68 -13.711  -7.186  -2.542
  531   2HG   GLU  68          3HG       GLU  68 -12.147  -6.401  -2.752
  Start of MODEL   18
    1   1H    MET   1           H1       MET   1  -6.472 -10.174   6.538
    2   2H    MET   1           H2       MET   1  -6.585 -11.165   7.842
    3   3H    MET   1           H3       MET   1  -6.746 -11.687   6.248
    4    HA   MET   1           HA       MET   1  -8.919 -11.479   7.504
    5   1HB   MET   1          2HB       MET   1  -9.678  -9.302   8.102
    6   2HB   MET   1          3HB       MET   1  -8.030  -9.421   8.627
    7   1HG   MET   1          2HG       MET   1  -7.373  -8.281   6.381
    8   2HG   MET   1          3HG       MET   1  -9.044  -7.757   6.321
    9   1HE   MET   1          1HE       MET   1  -9.615  -7.304   9.504
   10   2HE   MET   1          2HE       MET   1  -9.280  -5.561   9.574
   11   3HE   MET   1          3HE       MET   1 -10.176  -6.235   8.190
   12    HA   PRO   2           HA       PRO   2  -9.982 -10.890   3.020
   13   1HB   PRO   2          2HB       PRO   2 -11.394  -8.661   2.419
   14   2HB   PRO   2          3HB       PRO   2 -12.161 -10.141   3.074
   15   1HG   PRO   2          2HG       PRO   2 -11.320  -7.653   4.590
   16   2HG   PRO   2          3HG       PRO   2 -12.871  -8.534   4.723
   17   1HD   PRO   2          2HD       PRO   2 -10.933  -8.899   6.507
   18   2HD   PRO   2          3HD       PRO   2 -11.826 -10.319   5.925
   19    H    LYS   3           H        LYS   3  -9.151  -9.591   1.178
   20    HA   LYS   3           HA       LYS   3  -6.822  -7.986   2.101
   21   1HB   LYS   3          2HB       LYS   3  -6.221  -7.920  -0.366
   22   2HB   LYS   3          3HB       LYS   3  -5.934  -9.416   0.505
   23   1HG   LYS   3          2HG       LYS   3  -7.769 -10.500  -0.353
   24   2HG   LYS   3          3HG       LYS   3  -8.558  -8.979  -0.784
   25   1HD   LYS   3          2HD       LYS   3  -6.113 -10.055  -2.254
   26   2HD   LYS   3          3HD       LYS   3  -7.796 -10.277  -2.777
   27   1HE   LYS   3          2HE       LYS   3  -8.005  -7.670  -2.593
   28   2HE   LYS   3          3HE       LYS   3  -6.241  -7.666  -2.558
   29   1HZ   LYS   3          1HZ       LYS   3  -7.163  -7.321  -4.704
   30   2HZ   LYS   3          2HZ       LYS   3  -6.296  -8.728  -4.728
   31   3HZ   LYS   3          3HZ       LYS   3  -7.948  -8.772  -4.683
   32    H    HIS   4           H        HIS   4  -6.433  -5.978   0.913
   33    HA   HIS   4           HA       HIS   4  -8.905  -4.380   0.554
   34   1HB   HIS   4          2HB       HIS   4  -7.208  -2.779   2.028
   35   2HB   HIS   4          3HB       HIS   4  -8.613  -3.661   2.618
   36    HD1  HIS   4           1HD      HIS   4  -7.885  -6.334   3.634
   37    HD2  HIS   4           2HD      HIS   4  -5.039  -3.226   3.377
   38    HE1  HIS   4           1HE      HIS   4  -5.963  -6.964   5.143
   39    H    GLU   5           H        GLU   5  -8.758  -2.743  -0.907
   40    HA   GLU   5           HA       GLU   5  -6.469  -3.010  -2.810
   41   1HB   GLU   5          2HB       GLU   5  -9.387  -2.223  -3.014
   42   2HB   GLU   5          3HB       GLU   5  -8.284  -2.076  -4.373
   43   1HG   GLU   5          2HG       GLU   5  -8.678  -4.736  -2.913
   44   2HG   GLU   5          3HG       GLU   5  -9.775  -4.184  -4.177
   45    H    PHE   6           H        PHE   6  -5.351  -1.164  -3.554
   46    HA   PHE   6           HA       PHE   6  -6.280   1.507  -2.675
   47   1HB   PHE   6          2HB       PHE   6  -3.451   0.377  -2.382
   48   2HB   PHE   6          3HB       PHE   6  -3.934   1.996  -1.944
   49    HD1  PHE   6           1HD      PHE   6  -4.437  -1.628  -1.106
   50    HD2  PHE   6           2HD      PHE   6  -4.487   2.438   0.372
   51    HE1  PHE   6           1HE      PHE   6  -4.793  -2.455   1.178
   52    HE2  PHE   6           2HE      PHE   6  -4.650   1.573   2.666
   53    HZ   PHE   6           HZ       PHE   6  -4.914  -0.849   3.091
   54    H    SER   7           H        SER   7  -5.843   3.125  -4.132
   55    HA   SER   7           HA       SER   7  -4.453   2.415  -6.684
   56   1HB   SER   7          2HB       SER   7  -6.698   3.587  -6.748
   57   2HB   SER   7          3HB       SER   7  -5.895   5.006  -6.030
   58    HG   SER   7           HG       SER   7  -4.510   4.996  -7.880
   59    H    VAL   8           H        VAL   8  -2.568   3.636  -7.343
   60    HA   VAL   8           HA       VAL   8  -1.180   5.095  -5.148
   61    HB   VAL   8           HB       VAL   8  -0.225   2.812  -6.923
   62   1HG1  VAL   8          1HG1      VAL   8   1.607   4.297  -6.418
   63   2HG1  VAL   8          2HG1      VAL   8   1.157   4.382  -4.701
   64   3HG1  VAL   8          3HG1      VAL   8   1.783   2.870  -5.400
   65   1HG2  VAL   8          1HG2      VAL   8  -0.030   1.589  -4.746
   66   2HG2  VAL   8          2HG2      VAL   8  -0.893   2.910  -3.951
   67   3HG2  VAL   8          3HG2      VAL   8  -1.702   1.920  -5.183
   68    H    ASP   9           H        ASP   9   0.015   6.830  -5.759
   69    HA   ASP   9           HA       ASP   9   0.383   7.579  -8.589
   70   1HB   ASP   9          2HB       ASP   9   0.357   9.492  -7.253
   71   2HB   ASP   9          3HB       ASP   9   1.202   8.698  -5.903
   72    H    MET  10           H        MET  10   1.839   6.597  -9.810
   73    HA   MET  10           HA       MET  10   4.346   5.520  -8.591
   74   1HB   MET  10          2HB       MET  10   2.827   4.376 -10.958
   75   2HB   MET  10          3HB       MET  10   4.353   3.789 -10.284
   76   1HG   MET  10          2HG       MET  10   3.066   3.562  -8.040
   77   2HG   MET  10          3HG       MET  10   1.602   3.653  -9.022
   78   1HE   MET  10          1HE       MET  10   2.548   1.170  -7.050
   79   2HE   MET  10          2HE       MET  10   0.985   1.231  -7.904
   80   3HE   MET  10          3HE       MET  10   2.024  -0.188  -8.075
   81    H    THR  11           H        THR  11   4.150   8.206  -9.338
   82    HA   THR  11           HA       THR  11   5.172   8.490 -12.010
   83    HB   THR  11           HB       THR  11   5.320  10.413  -9.653
   84    HG1  THR  11           1HG      THR  11   3.230   9.880 -10.039
   85   1HG2  THR  11          1HG2      THR  11   5.233  12.155 -11.461
   86   2HG2  THR  11          2HG2      THR  11   6.751  11.253 -11.460
   87   3HG2  THR  11          3HG2      THR  11   5.497  10.880 -12.666
   88    H    CYS  12           H        CYS  12   6.779   7.159  -9.261
   89    HA   CYS  12           HA       CYS  12   9.201   7.183 -10.968
   90   1HB   CYS  12          2HB       CYS  12   9.665   8.775  -9.141
   91   2HB   CYS  12          3HB       CYS  12   9.163   7.561  -7.937
   92    HG   CYS  12           HG       CYS  12  11.583   7.377 -10.175
   93    H    GLY  13           H        GLY  13   9.983   5.057 -11.150
   94   1HA   GLY  13          2HA       GLY  13   8.389   2.833 -10.547
   95   2HA   GLY  13          3HA       GLY  13  10.144   2.786 -10.804
   96    H    GLY  14           H        GLY  14  11.000   4.349  -8.663
   97   1HA   GLY  14          2HA       GLY  14  11.131   2.551  -6.530
   98   2HA   GLY  14          3HA       GLY  14  11.616   4.260  -6.458
   99    H    CYS  15           H        CYS  15   8.439   4.550  -7.274
  100    HA   CYS  15           HA       CYS  15   7.172   4.990  -4.869
  101   1HB   CYS  15          2HB       CYS  15   5.092   4.502  -5.917
  102   2HB   CYS  15          3HB       CYS  15   6.122   5.410  -7.027
  103    HG   CYS  15           HG       CYS  15   6.917   3.320  -8.393
  104    H    ALA  16           H        ALA  16   7.841   1.873  -6.556
  105    HA   ALA  16           HA       ALA  16   6.400   0.194  -4.775
  106   1HB   ALA  16          1HB       ALA  16   7.698  -1.628  -5.839
  107   2HB   ALA  16          2HB       ALA  16   7.099  -0.481  -7.054
  108   3HB   ALA  16          3HB       ALA  16   8.804  -0.434  -6.555
  109    H    GLU  17           H        GLU  17   9.792   1.325  -4.761
  110    HA   GLU  17           HA       GLU  17  10.659  -0.242  -2.519
  111   1HB   GLU  17          2HB       GLU  17  11.620   2.501  -3.459
  112   2HB   GLU  17          3HB       GLU  17  12.452   1.421  -2.345
  113   1HG   GLU  17          2HG       GLU  17  12.796  -0.242  -4.065
  114   2HG   GLU  17          3HG       GLU  17  11.834   0.690  -5.224
  115    H    ALA  18           H        ALA  18   9.155   2.988  -2.901
  116    HA   ALA  18           HA       ALA  18   9.350   3.794  -0.181
  117   1HB   ALA  18          1HB       ALA  18   7.619   5.423  -0.689
  118   2HB   ALA  18          2HB       ALA  18   8.778   5.335  -2.032
  119   3HB   ALA  18          3HB       ALA  18   7.181   4.570  -2.174
  120    H    VAL  19           H        VAL  19   6.603   2.271  -1.929
  121    HA   VAL  19           HA       VAL  19   4.967   1.912   0.351
  122    HB   VAL  19           HB       VAL  19   5.065   0.311  -2.230
  123   1HG1  VAL  19          1HG1      VAL  19   3.964  -1.022  -0.444
  124   2HG1  VAL  19          2HG1      VAL  19   2.979   0.386   0.004
  125   3HG1  VAL  19          3HG1      VAL  19   2.762  -0.405  -1.570
  126   1HG2  VAL  19          1HG2      VAL  19   3.186   2.528  -1.270
  127   2HG2  VAL  19          2HG2      VAL  19   4.475   2.756  -2.462
  128   3HG2  VAL  19          3HG2      VAL  19   3.116   1.688  -2.832
  129    H    SER  20           H        SER  20   7.226  -0.427  -1.238
  130    HA   SER  20           HA       SER  20   6.809  -2.553   0.507
  131   1HB   SER  20          2HB       SER  20   8.128  -2.594  -1.633
  132   2HB   SER  20          3HB       SER  20   9.454  -1.759  -0.805
  133    HG   SER  20           HG       SER  20   9.853  -3.947  -0.766
  134    H    ARG  21           H        ARG  21   9.298   0.035   0.860
  135    HA   ARG  21           HA       ARG  21  10.341  -0.815   3.317
  136   1HB   ARG  21          2HB       ARG  21  10.113   1.909   2.010
  137   2HB   ARG  21          3HB       ARG  21  11.044   1.622   3.496
  138   1HG   ARG  21          2HG       ARG  21  12.486   0.035   2.419
  139   2HG   ARG  21          3HG       ARG  21  11.503  -0.049   0.980
  140   1HD   ARG  21          2HD       ARG  21  13.502   1.204   0.534
  141   2HD   ARG  21          3HD       ARG  21  12.097   2.211   0.302
  142    HE   ARG  21           HE       ARG  21  14.190   2.356   2.404
  143   1HH1  ARG  21          2HH2      ARG  21  11.116   3.661   1.289
  144   2HH1  ARG  21          1HH2      ARG  21  11.323   5.230   2.008
  145   1HH2  ARG  21          2HH1      ARG  21  14.505   4.413   3.397
  146   2HH2  ARG  21          1HH1      ARG  21  13.290   5.642   3.278
  147    H    VAL  22           H        VAL  22   7.699   1.755   2.874
  148    HA   VAL  22           HA       VAL  22   7.424   2.034   5.647
  149    HB   VAL  22           HB       VAL  22   6.722   3.568   3.717
  150   1HG1  VAL  22          1HG1      VAL  22   4.135   1.990   3.938
  151   2HG1  VAL  22          2HG1      VAL  22   4.409   3.439   2.960
  152   3HG1  VAL  22          3HG1      VAL  22   5.250   1.954   2.548
  153   1HG2  VAL  22          1HG2      VAL  22   4.928   4.567   5.035
  154   2HG2  VAL  22          2HG2      VAL  22   4.828   3.077   6.005
  155   3HG2  VAL  22          3HG2      VAL  22   6.319   4.066   6.036
  156    H    LEU  23           H        LEU  23   5.685  -0.199   3.372
  157    HA   LEU  23           HA       LEU  23   3.982  -1.279   5.328
  158   1HB   LEU  23          2HB       LEU  23   5.093  -2.219   2.658
  159   2HB   LEU  23          3HB       LEU  23   4.165  -3.294   3.680
  160    HG   LEU  23           HG       LEU  23   2.845  -2.115   1.887
  161   1HD1  LEU  23          1HD1      LEU  23   1.759  -3.375   3.559
  162   2HD1  LEU  23          2HD1      LEU  23   2.113  -2.177   4.830
  163   3HD1  LEU  23          3HD1      LEU  23   0.938  -1.795   3.575
  164   1HD2  LEU  23          1HD2      LEU  23   2.845   0.110   3.937
  165   2HD2  LEU  23          2HD2      LEU  23   3.644   0.197   2.348
  166   3HD2  LEU  23          3HD2      LEU  23   1.889   0.032   2.442
  167    H    ASN  24           H        ASN  24   7.349  -2.275   4.414
  168    HA   ASN  24           HA       ASN  24   7.404  -4.498   6.220
  169   1HB   ASN  24          2HB       ASN  24   9.486  -2.813   4.792
  170   2HB   ASN  24          3HB       ASN  24   9.947  -3.912   6.078
  171   1HD2  ASN  24          1HD2      ASN  24   8.123  -3.855   3.021
  172   2HD2  ASN  24          2HD2      ASN  24   8.450  -5.515   2.579
  173    H    LYS  25           H        LYS  25   8.029  -1.009   6.628
  174    HA   LYS  25           HA       LYS  25   8.895  -1.205   9.377
  175   1HB   LYS  25          2HB       LYS  25   7.593   1.019   7.750
  176   2HB   LYS  25          3HB       LYS  25   7.969   1.193   9.446
  177   1HG   LYS  25          2HG       LYS  25   9.955   0.653   7.182
  178   2HG   LYS  25          3HG       LYS  25   9.707   2.158   8.061
  179   1HD   LYS  25          2HD       LYS  25  11.465   1.472   9.311
  180   2HD   LYS  25          3HD       LYS  25  10.238   0.544  10.174
  181   1HE   LYS  25          2HE       LYS  25  10.816  -1.342   8.347
  182   2HE   LYS  25          3HE       LYS  25  12.243  -0.358   8.050
  183   1HZ   LYS  25          1HZ       LYS  25  12.659  -2.090   9.636
  184   2HZ   LYS  25          2HZ       LYS  25  12.815  -0.635  10.387
  185   3HZ   LYS  25          3HZ       LYS  25  11.470  -1.558  10.632
  186    H    LEU  26           H        LEU  26   5.636  -0.858   7.961
  187    HA   LEU  26           HA       LEU  26   4.284  -0.860  10.434
  188   1HB   LEU  26          2HB       LEU  26   3.480  -0.496   8.051
  189   2HB   LEU  26          3HB       LEU  26   3.172  -2.197   7.924
  190    HG   LEU  26           HG       LEU  26   1.222  -0.665   8.487
  191   1HD1  LEU  26          1HD1      LEU  26   1.672  -2.948  10.443
  192   2HD1  LEU  26          2HD1      LEU  26   0.121  -2.288   9.894
  193   3HD1  LEU  26          3HD1      LEU  26   1.175  -3.143   8.748
  194   1HD2  LEU  26          1HD2      LEU  26   2.387   0.664  10.311
  195   2HD2  LEU  26          2HD2      LEU  26   0.782   0.040  10.714
  196   3HD2  LEU  26          3HD2      LEU  26   2.222  -0.762  11.355
  197    H    GLY  27           H        GLY  27   5.053  -3.633   8.293
  198   1HA   GLY  27          2HA       GLY  27   6.472  -5.197   9.424
  199   2HA   GLY  27          3HA       GLY  27   5.383  -5.128  10.795
  200    H    GLY  28           H        GLY  28   3.225  -6.312  10.559
  201   1HA   GLY  28          2HA       GLY  28   3.956  -8.966   9.506
  202   2HA   GLY  28          3HA       GLY  28   2.632  -8.545  10.604
  203    H    VAL  29           H        VAL  29   3.658  -7.750   7.266
  204    HA   VAL  29           HA       VAL  29   0.782  -7.770   6.423
  205    HB   VAL  29           HB       VAL  29   1.823  -5.570   7.139
  206   1HG1  VAL  29          1HG1      VAL  29   4.099  -5.797   6.331
  207   2HG1  VAL  29          2HG1      VAL  29   3.542  -5.924   4.665
  208   3HG1  VAL  29          3HG1      VAL  29   3.308  -4.418   5.567
  209   1HG2  VAL  29          1HG2      VAL  29   0.935  -5.659   4.250
  210   2HG2  VAL  29          2HG2      VAL  29  -0.138  -5.673   5.675
  211   3HG2  VAL  29          3HG2      VAL  29   0.887  -4.284   5.389
  212    H    LYS  30           H        LYS  30   0.307  -8.362   4.245
  213    HA   LYS  30           HA       LYS  30   2.688  -8.778   2.504
  214   1HB   LYS  30          2HB       LYS  30   1.766 -10.955   2.961
  215   2HB   LYS  30          3HB       LYS  30   0.140 -10.409   2.512
  216   1HG   LYS  30          2HG       LYS  30   1.278 -11.729   0.756
  217   2HG   LYS  30          3HG       LYS  30   0.787 -10.131   0.188
  218   1HD   LYS  30          2HD       LYS  30   3.030  -9.331   0.066
  219   2HD   LYS  30          3HD       LYS  30   3.598 -10.502   1.268
  220   1HE   LYS  30          2HE       LYS  30   4.469 -11.104  -0.890
  221   2HE   LYS  30          3HE       LYS  30   3.341 -12.338  -0.308
  222   1HZ   LYS  30          1HZ       LYS  30   1.651 -11.015  -1.804
  223   2HZ   LYS  30          2HZ       LYS  30   2.901 -10.392  -2.513
  224   3HZ   LYS  30          3HZ       LYS  30   2.745 -12.007  -2.533
  225    H    TYR  31           H        TYR  31   2.742  -7.148   1.277
  226    HA   TYR  31           HA       TYR  31   0.318  -5.883   0.101
  227   1HB   TYR  31          2HB       TYR  31   1.828  -3.993  -0.417
  228   2HB   TYR  31          3HB       TYR  31   1.637  -4.269   1.309
  229    HD1  TYR  31           HD1      TYR  31   3.994  -4.360  -1.512
  230    HD2  TYR  31           HD2      TYR  31   3.450  -5.334   2.619
  231    HE1  TYR  31           HE1      TYR  31   6.422  -4.870  -1.319
  232    HE2  TYR  31           HE2      TYR  31   5.867  -5.892   2.823
  233    HH   TYR  31           HH       TYR  31   8.168  -5.159   0.296
  234    H    ASP  32           H        ASP  32   0.200  -5.830  -2.118
  235    HA   ASP  32           HA       ASP  32   2.334  -7.095  -3.749
  236   1HB   ASP  32          2HB       ASP  32  -0.565  -7.867  -3.367
  237   2HB   ASP  32          3HB       ASP  32   0.181  -8.085  -4.955
  238    H    ILE  33           H        ILE  33   2.945  -5.687  -5.145
  239    HA   ILE  33           HA       ILE  33   1.436  -3.194  -5.560
  240    HB   ILE  33           HB       ILE  33   4.294  -4.020  -6.176
  241   1HG1  ILE  33          2HG1      ILE  33   4.002  -1.956  -4.132
  242   2HG1  ILE  33          3HG1      ILE  33   3.112  -3.391  -3.639
  243   1HG2  ILE  33          1HG2      ILE  33   2.995  -1.271  -6.215
  244   2HG2  ILE  33          2HG2      ILE  33   4.729  -1.598  -6.414
  245   3HG2  ILE  33          3HG2      ILE  33   3.585  -2.168  -7.634
  246   1HD1  ILE  33          1HD1      ILE  33   5.525  -3.323  -2.920
  247   2HD1  ILE  33          2HD1      ILE  33   5.077  -4.784  -3.830
  248   3HD1  ILE  33          3HD1      ILE  33   5.998  -3.472  -4.616
  249    H    ASP  34           H        ASP  34   0.080  -3.210  -7.301
  250    HA   ASP  34           HA       ASP  34   0.772  -4.693  -9.775
  251   1HB   ASP  34          2HB       ASP  34  -1.554  -4.769  -8.995
  252   2HB   ASP  34          3HB       ASP  34  -1.627  -3.000  -9.071
  253    H    LEU  35           H        LEU  35   2.483  -3.643 -10.633
  254    HA   LEU  35           HA       LEU  35   2.751  -0.801 -10.564
  255   1HB   LEU  35          2HB       LEU  35   4.597  -2.673 -10.752
  256   2HB   LEU  35          3HB       LEU  35   4.322  -2.487 -12.485
  257    HG   LEU  35           HG       LEU  35   4.582   0.123 -11.880
  258   1HD1  LEU  35          1HD1      LEU  35   6.171   0.536 -10.077
  259   2HD1  LEU  35          2HD1      LEU  35   4.824  -0.385  -9.383
  260   3HD1  LEU  35          3HD1      LEU  35   6.348  -1.198  -9.759
  261   1HD2  LEU  35          1HD2      LEU  35   6.993  -0.045 -12.379
  262   2HD2  LEU  35          2HD2      LEU  35   6.936  -1.798 -12.092
  263   3HD2  LEU  35          3HD2      LEU  35   6.031  -1.083 -13.447
  264    HA   PRO  36           HA       PRO  36   1.635  -0.975 -15.258
  265   1HB   PRO  36          2HB       PRO  36  -0.261  -2.868 -16.051
  266   2HB   PRO  36          3HB       PRO  36   1.500  -2.981 -16.297
  267   1HG   PRO  36          2HG       PRO  36  -0.153  -4.197 -14.096
  268   2HG   PRO  36          3HG       PRO  36   1.162  -4.957 -15.033
  269   1HD   PRO  36          2HD       PRO  36   1.589  -4.028 -12.588
  270   2HD   PRO  36          3HD       PRO  36   2.826  -3.744 -13.840
  271    H    ASN  37           H        ASN  37  -0.910  -2.087 -12.924
  272    HA   ASN  37           HA       ASN  37  -2.787  -0.092 -14.069
  273   1HB   ASN  37          2HB       ASN  37  -3.224  -2.119 -11.870
  274   2HB   ASN  37          3HB       ASN  37  -4.434  -1.081 -12.603
  275   1HD2  ASN  37          1HD2      ASN  37  -2.955  -4.149 -12.851
  276   2HD2  ASN  37          2HD2      ASN  37  -3.466  -4.527 -14.499
  277    H    LYS  38           H        LYS  38  -0.353  -0.043 -11.673
  278    HA   LYS  38           HA       LYS  38   0.215   1.419 -10.140
  279   1HB   LYS  38          2HB       LYS  38  -1.793   3.336 -11.407
  280   2HB   LYS  38          3HB       LYS  38  -0.621   3.710 -10.173
  281   1HG   LYS  38          2HG       LYS  38   0.419   4.469 -12.078
  282   2HG   LYS  38          3HG       LYS  38   1.243   2.974 -11.619
  283   1HD   LYS  38          2HD       LYS  38   1.015   3.151 -14.019
  284   2HD   LYS  38          3HD       LYS  38   0.175   1.746 -13.383
  285   1HE   LYS  38          2HE       LYS  38  -2.004   2.981 -13.533
  286   2HE   LYS  38          3HE       LYS  38  -1.146   4.391 -14.167
  287   1HZ   LYS  38          1HZ       LYS  38  -0.539   3.053 -16.072
  288   2HZ   LYS  38          2HZ       LYS  38  -1.176   1.701 -15.399
  289   3HZ   LYS  38          3HZ       LYS  38  -2.172   2.933 -15.864
  290    H    LYS  39           H        LYS  39  -1.079  -0.489  -9.121
  291    HA   LYS  39           HA       LYS  39  -2.763   0.768  -7.019
  292   1HB   LYS  39          2HB       LYS  39  -3.350  -1.881  -8.407
  293   2HB   LYS  39          3HB       LYS  39  -4.088  -1.310  -6.907
  294   1HG   LYS  39          2HG       LYS  39  -5.166   0.532  -8.054
  295   2HG   LYS  39          3HG       LYS  39  -4.295   0.185  -9.554
  296   1HD   LYS  39          2HD       LYS  39  -6.611  -0.666  -9.628
  297   2HD   LYS  39          3HD       LYS  39  -5.407  -1.957  -9.810
  298   1HE   LYS  39          2HE       LYS  39  -5.712  -2.643  -7.451
  299   2HE   LYS  39          3HE       LYS  39  -6.809  -1.283  -7.165
  300   1HZ   LYS  39          1HZ       LYS  39  -7.866  -3.362  -7.453
  301   2HZ   LYS  39          2HZ       LYS  39  -8.360  -2.353  -8.657
  302   3HZ   LYS  39          3HZ       LYS  39  -7.275  -3.574  -8.962
  303    H    VAL  40           H        VAL  40  -2.671  -0.396  -4.979
  304    HA   VAL  40           HA       VAL  40  -0.687  -2.560  -4.751
  305    HB   VAL  40           HB       VAL  40  -1.159  -0.016  -3.183
  306   1HG1  VAL  40          1HG1      VAL  40  -0.357  -2.637  -1.914
  307   2HG1  VAL  40          2HG1      VAL  40  -0.104  -1.025  -1.186
  308   3HG1  VAL  40          3HG1      VAL  40  -1.751  -1.571  -1.554
  309   1HG2  VAL  40          1HG2      VAL  40   1.367  -1.649  -3.579
  310   2HG2  VAL  40          2HG2      VAL  40   0.771  -0.484  -4.777
  311   3HG2  VAL  40          3HG2      VAL  40   1.210   0.075  -3.150
  312    H    CYS  41           H        CYS  41  -1.553  -4.285  -3.709
  313    HA   CYS  41           HA       CYS  41  -4.231  -3.984  -2.453
  314   1HB   CYS  41          2HB       CYS  41  -5.011  -6.007  -3.304
  315   2HB   CYS  41          3HB       CYS  41  -4.378  -5.169  -4.729
  316    HG   CYS  41           HG       CYS  41  -1.996  -6.403  -4.518
  317    H    ILE  42           H        ILE  42  -4.388  -5.195  -0.484
  318    HA   ILE  42           HA       ILE  42  -1.830  -6.397   0.459
  319    HB   ILE  42           HB       ILE  42  -3.405  -4.316   2.008
  320   1HG1  ILE  42          2HG1      ILE  42  -0.929  -3.822   0.318
  321   2HG1  ILE  42          3HG1      ILE  42  -2.551  -3.149   0.066
  322   1HG2  ILE  42          1HG2      ILE  42  -1.465  -4.254   3.487
  323   2HG2  ILE  42          2HG2      ILE  42  -1.972  -5.922   3.311
  324   3HG2  ILE  42          3HG2      ILE  42  -0.567  -5.328   2.402
  325   1HD1  ILE  42          1HD1      ILE  42  -0.644  -2.524   2.307
  326   2HD1  ILE  42          2HD1      ILE  42  -1.282  -1.430   1.075
  327   3HD1  ILE  42          3HD1      ILE  42  -2.354  -2.051   2.346
  328    H    GLU  43           H        GLU  43  -2.106  -8.064   1.929
  329    HA   GLU  43           HA       GLU  43  -4.810  -8.394   3.120
  330   1HB   GLU  43          2HB       GLU  43  -3.907 -10.260   1.406
  331   2HB   GLU  43          3HB       GLU  43  -3.117 -10.835   2.877
  332   1HG   GLU  43          2HG       GLU  43  -6.132 -10.364   2.481
  333   2HG   GLU  43          3HG       GLU  43  -5.308 -11.916   2.601
  334    H    SER  44           H        SER  44  -4.606  -8.699   5.454
  335    HA   SER  44           HA       SER  44  -2.234  -9.525   6.688
  336   1HB   SER  44          2HB       SER  44  -1.540  -7.168   6.269
  337   2HB   SER  44          3HB       SER  44  -2.960  -6.604   7.164
  338    HG   SER  44           HG       SER  44  -0.667  -8.017   8.140
  339    H    GLU  45           H        GLU  45  -2.555  -9.167   9.138
  340    HA   GLU  45           HA       GLU  45  -5.404  -9.442   9.971
  341   1HB   GLU  45          2HB       GLU  45  -3.606 -11.007  10.871
  342   2HB   GLU  45          3HB       GLU  45  -2.909  -9.610  11.709
  343   1HG   GLU  45          2HG       GLU  45  -5.007  -9.321  12.973
  344   2HG   GLU  45          3HG       GLU  45  -5.779 -10.613  12.033
  345    H    HIS  46           H        HIS  46  -2.860  -7.165   9.413
  346    HA   HIS  46           HA       HIS  46  -3.434  -5.279  11.517
  347   1HB   HIS  46          2HB       HIS  46  -2.157  -4.910   8.777
  348   2HB   HIS  46          3HB       HIS  46  -2.258  -3.660  10.012
  349    HD1  HIS  46           1HD      HIS  46  -1.105  -4.732  12.545
  350    HD2  HIS  46           2HD      HIS  46   0.279  -5.733   8.711
  351    HE1  HIS  46           1HE      HIS  46   1.362  -5.352  12.784
  352    H    SER  47           H        SER  47  -4.944  -3.692  11.597
  353    HA   SER  47           HA       SER  47  -7.203  -3.810   9.861
  354   1HB   SER  47          2HB       SER  47  -7.405  -3.161  12.189
  355   2HB   SER  47          3HB       SER  47  -6.406  -1.721  11.913
  356    HG   SER  47           HG       SER  47  -8.073  -0.757  11.189
  357    H    MET  48           H        MET  48  -8.008  -2.330   8.448
  358    HA   MET  48           HA       MET  48  -6.202  -1.570   6.398
  359   1HB   MET  48          2HB       MET  48  -9.075  -0.645   6.791
  360   2HB   MET  48          3HB       MET  48  -8.158  -0.673   5.273
  361   1HG   MET  48          2HG       MET  48  -7.930  -3.185   5.573
  362   2HG   MET  48          3HG       MET  48  -9.073  -3.068   6.915
  363   1HE   MET  48          1HE       MET  48 -12.350  -1.909   5.072
  364   2HE   MET  48          2HE       MET  48 -11.586  -2.220   6.649
  365   3HE   MET  48          3HE       MET  48 -11.120  -0.789   5.690
  366    H    ASP  49           H        ASP  49  -7.863   0.256   8.912
  367    HA   ASP  49           HA       ASP  49  -7.203   2.902   8.104
  368   1HB   ASP  49          2HB       ASP  49  -7.892   3.578  10.262
  369   2HB   ASP  49          3HB       ASP  49  -8.951   2.240   9.810
  370    H    THR  50           H        THR  50  -5.711   0.680  10.286
  371    HA   THR  50           HA       THR  50  -3.542   2.229  11.171
  372    HB   THR  50           HB       THR  50  -3.745  -0.812  11.001
  373    HG1  THR  50           1HG      THR  50  -5.557   0.410  12.067
  374   1HG2  THR  50          1HG2      THR  50  -2.351  -0.758  13.039
  375   2HG2  THR  50          2HG2      THR  50  -1.492  -0.049  11.659
  376   3HG2  THR  50          3HG2      THR  50  -2.207   1.005  12.901
  377    H    LEU  51           H        LEU  51  -3.714  -0.206   8.519
  378    HA   LEU  51           HA       LEU  51  -1.062   0.204   7.519
  379   1HB   LEU  51          2HB       LEU  51  -3.629  -0.422   5.998
  380   2HB   LEU  51          3HB       LEU  51  -2.003  -0.454   5.296
  381    HG   LEU  51           HG       LEU  51  -2.820  -2.127   7.719
  382   1HD1  LEU  51          1HD1      LEU  51  -4.287  -2.748   5.885
  383   2HD1  LEU  51          2HD1      LEU  51  -2.907  -2.884   4.774
  384   3HD1  LEU  51          3HD1      LEU  51  -3.084  -4.022   6.132
  385   1HD2  LEU  51          1HD2      LEU  51  -0.559  -2.411   5.685
  386   2HD2  LEU  51          2HD2      LEU  51  -0.375  -1.879   7.366
  387   3HD2  LEU  51          3HD2      LEU  51  -0.892  -3.532   7.026
  388    H    LEU  52           H        LEU  52  -4.124   1.680   6.384
  389    HA   LEU  52           HA       LEU  52  -3.292   3.535   4.592
  390   1HB   LEU  52          2HB       LEU  52  -5.508   3.354   6.513
  391   2HB   LEU  52          3HB       LEU  52  -5.140   5.020   6.106
  392    HG   LEU  52           HG       LEU  52  -5.701   2.851   4.065
  393   1HD1  LEU  52          1HD1      LEU  52  -7.543   4.925   5.314
  394   2HD1  LEU  52          2HD1      LEU  52  -7.960   3.871   3.948
  395   3HD1  LEU  52          3HD1      LEU  52  -7.617   3.163   5.531
  396   1HD2  LEU  52          1HD2      LEU  52  -6.112   4.851   2.582
  397   2HD2  LEU  52          2HD2      LEU  52  -5.599   5.911   3.902
  398   3HD2  LEU  52          3HD2      LEU  52  -4.440   4.801   3.147
  399    H    ALA  53           H        ALA  53  -3.615   4.335   8.071
  400    HA   ALA  53           HA       ALA  53  -2.529   6.893   7.926
  401   1HB   ALA  53          1HB       ALA  53  -3.794   6.003   9.863
  402   2HB   ALA  53          2HB       ALA  53  -2.444   4.918  10.257
  403   3HB   ALA  53          3HB       ALA  53  -2.238   6.680  10.387
  404    H    THR  54           H        THR  54  -0.808   3.808   8.294
  405    HA   THR  54           HA       THR  54   1.746   5.191   8.659
  406    HB   THR  54           HB       THR  54   0.991   2.291   8.471
  407    HG1  THR  54           1HG      THR  54   0.923   3.050  10.464
  408   1HG2  THR  54          1HG2      THR  54   2.978   2.333   7.138
  409   2HG2  THR  54          2HG2      THR  54   3.782   3.501   8.221
  410   3HG2  THR  54          3HG2      THR  54   3.478   1.844   8.758
  411    H    LEU  55           H        LEU  55   0.260   3.417   5.878
  412    HA   LEU  55           HA       LEU  55   2.521   3.949   4.235
  413   1HB   LEU  55          2HB       LEU  55   1.241   3.313   2.371
  414   2HB   LEU  55          3HB       LEU  55   1.202   2.207   3.709
  415    HG   LEU  55           HG       LEU  55  -1.088   3.080   4.285
  416   1HD1  LEU  55          1HD1      LEU  55  -0.454   4.439   1.710
  417   2HD1  LEU  55          2HD1      LEU  55  -2.158   3.995   2.053
  418   3HD1  LEU  55          3HD1      LEU  55  -1.278   5.100   3.122
  419   1HD2  LEU  55          1HD2      LEU  55  -0.607   0.920   3.245
  420   2HD2  LEU  55          2HD2      LEU  55  -2.080   1.620   2.546
  421   3HD2  LEU  55          3HD2      LEU  55  -0.546   1.686   1.642
  422    H    LYS  56           H        LYS  56  -0.289   5.878   4.878
  423    HA   LYS  56           HA       LYS  56  -0.127   7.991   3.235
  424   1HB   LYS  56          2HB       LYS  56  -1.497   7.585   5.487
  425   2HB   LYS  56          3HB       LYS  56  -0.200   8.524   6.229
  426   1HG   LYS  56          2HG       LYS  56  -0.743  10.289   4.408
  427   2HG   LYS  56          3HG       LYS  56  -2.166   9.255   4.072
  428   1HD   LYS  56          2HD       LYS  56  -2.801   9.422   6.503
  429   2HD   LYS  56          3HD       LYS  56  -1.474  10.554   6.763
  430   1HE   LYS  56          2HE       LYS  56  -3.898  10.952   4.922
  431   2HE   LYS  56          3HE       LYS  56  -3.664  11.703   6.506
  432   1HZ   LYS  56          1HZ       LYS  56  -1.987  12.167   4.127
  433   2HZ   LYS  56          2HZ       LYS  56  -3.095  13.204   4.753
  434   3HZ   LYS  56          3HZ       LYS  56  -1.739  12.844   5.609
  435    H    LYS  57           H        LYS  57   2.225   7.220   5.772
  436    HA   LYS  57           HA       LYS  57   3.495   9.711   6.132
  437   1HB   LYS  57          2HB       LYS  57   4.510   6.894   6.435
  438   2HB   LYS  57          3HB       LYS  57   5.382   8.332   7.002
  439   1HG   LYS  57          2HG       LYS  57   3.535   8.908   8.470
  440   2HG   LYS  57          3HG       LYS  57   2.547   7.608   7.788
  441   1HD   LYS  57          2HD       LYS  57   4.097   5.893   8.563
  442   2HD   LYS  57          3HD       LYS  57   5.087   7.114   9.377
  443   1HE   LYS  57          2HE       LYS  57   3.450   7.555  11.012
  444   2HE   LYS  57          3HE       LYS  57   2.116   6.965  10.026
  445   1HZ   LYS  57          1HZ       LYS  57   2.696   5.503  11.862
  446   2HZ   LYS  57          2HZ       LYS  57   2.773   4.708  10.444
  447   3HZ   LYS  57          3HZ       LYS  57   4.162   5.194  11.196
  448    H    THR  58           H        THR  58   3.707   7.433   3.421
  449    HA   THR  58           HA       THR  58   6.266   8.313   2.415
  450    HB   THR  58           HB       THR  58   5.537   7.315   0.301
  451    HG1  THR  58           1HG      THR  58   3.064   6.750   1.581
  452   1HG2  THR  58          1HG2      THR  58   6.434   5.875   2.049
  453   2HG2  THR  58          2HG2      THR  58   4.815   5.664   2.741
  454   3HG2  THR  58          3HG2      THR  58   5.178   5.024   1.119
  455    H    GLY  59           H        GLY  59   3.099   9.797   2.430
  456   1HA   GLY  59          2HA       GLY  59   2.373  11.771   1.631
  457   2HA   GLY  59          3HA       GLY  59   4.081  12.232   1.439
  458    H    LYS  60           H        LYS  60   2.229   9.629  -0.170
  459    HA   LYS  60           HA       LYS  60   2.491  11.015  -2.804
  460   1HB   LYS  60          2HB       LYS  60   2.352   8.012  -2.402
  461   2HB   LYS  60          3HB       LYS  60   2.781   8.855  -3.872
  462   1HG   LYS  60          2HG       LYS  60   4.388   8.524  -1.306
  463   2HG   LYS  60          3HG       LYS  60   4.699   7.736  -2.840
  464   1HD   LYS  60          2HD       LYS  60   5.131  10.696  -2.198
  465   2HD   LYS  60          3HD       LYS  60   6.337   9.438  -2.349
  466   1HE   LYS  60          2HE       LYS  60   6.490  10.482  -4.439
  467   2HE   LYS  60          3HE       LYS  60   5.464   9.078  -4.772
  468   1HZ   LYS  60          1HZ       LYS  60   4.352  10.831  -5.761
  469   2HZ   LYS  60          2HZ       LYS  60   3.566  10.628  -4.436
  470   3HZ   LYS  60          3HZ       LYS  60   4.621  11.898  -4.500
  471    H    THR  61           H        THR  61   0.623  10.337  -4.330
  472    HA   THR  61           HA       THR  61  -1.886  10.240  -3.025
  473    HB   THR  61           HB       THR  61  -1.358   9.494  -5.880
  474    HG1  THR  61           1HG      THR  61  -1.043  12.128  -4.873
  475   1HG2  THR  61          1HG2      THR  61  -3.278  11.468  -4.577
  476   2HG2  THR  61          2HG2      THR  61  -3.233  11.041  -6.303
  477   3HG2  THR  61          3HG2      THR  61  -3.689   9.816  -5.097
  478    H    VAL  62           H        VAL  62  -0.656   8.155  -1.907
  479    HA   VAL  62           HA       VAL  62  -1.720   5.666  -3.124
  480    HB   VAL  62           HB       VAL  62   0.421   5.337  -2.191
  481   1HG1  VAL  62          1HG1      VAL  62   0.666   7.223  -0.672
  482   2HG1  VAL  62          2HG1      VAL  62  -0.570   6.559   0.417
  483   3HG1  VAL  62          3HG1      VAL  62   0.973   5.713   0.179
  484   1HG2  VAL  62          1HG2      VAL  62  -1.683   4.254  -0.279
  485   2HG2  VAL  62          2HG2      VAL  62  -1.288   3.582  -1.860
  486   3HG2  VAL  62          3HG2      VAL  62  -0.067   3.575  -0.577
  487    H    SER  63           H        SER  63  -3.808   5.114  -2.651
  488    HA   SER  63           HA       SER  63  -5.059   6.094  -0.162
  489   1HB   SER  63          2HB       SER  63  -6.055   6.896  -2.937
  490   2HB   SER  63          3HB       SER  63  -6.917   7.177  -1.413
  491    HG   SER  63           HG       SER  63  -4.447   8.101  -1.101
  492    H    TYR  64           H        TYR  64  -7.173   5.129   0.149
  493    HA   TYR  64           HA       TYR  64  -7.023   2.286  -0.607
  494   1HB   TYR  64          2HB       TYR  64  -6.863   2.807   1.722
  495   2HB   TYR  64          3HB       TYR  64  -8.248   3.901   1.636
  496    HD1  TYR  64           HD1      TYR  64 -10.366   3.129   2.290
  497    HD2  TYR  64           HD2      TYR  64  -7.378   0.296   1.002
  498    HE1  TYR  64           HE1      TYR  64 -11.967   1.272   2.641
  499    HE2  TYR  64           HE2      TYR  64  -8.984  -1.536   1.336
  500    HH   TYR  64           HH       TYR  64 -11.178  -1.987   1.463
  501    H    LEU  65           H        LEU  65  -8.581   1.286  -1.810
  502    HA   LEU  65           HA       LEU  65 -11.338   2.190  -1.808
  503   1HB   LEU  65          2HB       LEU  65 -11.339   2.171  -4.373
  504   2HB   LEU  65          3HB       LEU  65 -10.946   3.615  -3.470
  505    HG   LEU  65           HG       LEU  65  -9.592   3.264  -5.445
  506   1HD1  LEU  65          1HD1      LEU  65  -7.692   3.289  -3.220
  507   2HD1  LEU  65          2HD1      LEU  65  -7.703   4.244  -4.699
  508   3HD1  LEU  65          3HD1      LEU  65  -8.872   4.605  -3.423
  509   1HD2  LEU  65          1HD2      LEU  65  -8.242   0.941  -4.096
  510   2HD2  LEU  65          2HD2      LEU  65  -9.265   0.890  -5.553
  511   3HD2  LEU  65          3HD2      LEU  65  -7.728   1.741  -5.591
  512    H    GLY  66           H        GLY  66 -11.323  -0.023  -0.735
  513   1HA   GLY  66          2HA       GLY  66 -13.110  -1.488  -1.674
  514   2HA   GLY  66          3HA       GLY  66 -11.970  -2.002  -2.916
  515    H    LEU  67           H        LEU  67 -13.024  -4.012  -1.680
  516    HA   LEU  67           HA       LEU  67 -10.906  -5.122   0.003
  517   1HB   LEU  67          2HB       LEU  67 -13.894  -5.537   0.517
  518   2HB   LEU  67          3HB       LEU  67 -12.552  -6.351   1.319
  519    HG   LEU  67           HG       LEU  67 -11.822  -3.848   1.865
  520   1HD1  LEU  67          1HD1      LEU  67 -13.840  -2.506   2.512
  521   2HD1  LEU  67          2HD1      LEU  67 -13.797  -2.762   0.763
  522   3HD1  LEU  67          3HD1      LEU  67 -14.884  -3.732   1.773
  523   1HD2  LEU  67          1HD2      LEU  67 -12.948  -4.141   4.079
  524   2HD2  LEU  67          2HD2      LEU  67 -13.902  -5.471   3.388
  525   3HD2  LEU  67          3HD2      LEU  67 -12.132  -5.609   3.518
  526    H    GLU  68           H        GLU  68 -10.896  -7.535  -0.175
  527    HA   GLU  68           HA       GLU  68 -12.819  -8.775  -1.960
  528   1HB   GLU  68          2HB       GLU  68 -10.810  -7.931  -3.378
  529   2HB   GLU  68          3HB       GLU  68  -9.873  -9.169  -2.537
  530   1HG   GLU  68          2HG       GLU  68 -11.365 -10.921  -3.411
  531   2HG   GLU  68          3HG       GLU  68 -12.353  -9.687  -4.213
  Start of MODEL   19
    1   1H    MET   1           H1       MET   1  -7.057 -13.654   3.882
    2   2H    MET   1           H2       MET   1  -7.382 -14.783   5.046
    3   3H    MET   1           H3       MET   1  -8.608 -14.097   4.113
    4    HA   MET   1           HA       MET   1  -8.571 -13.111   6.313
    5   1HB   MET   1          2HB       MET   1  -5.707 -12.488   5.434
    6   2HB   MET   1          3HB       MET   1  -6.488 -11.638   6.753
    7   1HG   MET   1          2HG       MET   1  -5.238 -13.404   7.741
    8   2HG   MET   1          3HG       MET   1  -6.943 -13.843   7.850
    9   1HE   MET   1          1HE       MET   1  -5.576 -17.382   7.566
   10   2HE   MET   1          2HE       MET   1  -5.098 -16.014   8.603
   11   3HE   MET   1          3HE       MET   1  -6.817 -16.321   8.274
   12    HA   PRO   2           HA       PRO   2 -10.346  -9.768   4.125
   13   1HB   PRO   2          2HB       PRO   2  -9.788  -7.439   5.549
   14   2HB   PRO   2          3HB       PRO   2 -11.066  -8.619   5.955
   15   1HG   PRO   2          2HG       PRO   2  -8.256  -8.452   7.076
   16   2HG   PRO   2          3HG       PRO   2  -9.786  -8.657   7.984
   17   1HD   PRO   2          2HD       PRO   2  -8.270 -10.782   7.473
   18   2HD   PRO   2          3HD       PRO   2 -10.020 -10.914   7.192
   19    H    LYS   3           H        LYS   3  -9.796  -8.651   2.323
   20    HA   LYS   3           HA       LYS   3  -6.928  -7.913   1.929
   21   1HB   LYS   3          2HB       LYS   3  -7.322  -9.981   0.884
   22   2HB   LYS   3          3HB       LYS   3  -8.876  -9.487   0.222
   23   1HG   LYS   3          2HG       LYS   3  -6.439  -7.911  -0.607
   24   2HG   LYS   3          3HG       LYS   3  -6.615  -9.560  -1.228
   25   1HD   LYS   3          2HD       LYS   3  -8.762  -9.132  -2.188
   26   2HD   LYS   3          3HD       LYS   3  -8.897  -7.543  -1.423
   27   1HE   LYS   3          2HE       LYS   3  -7.061  -6.667  -2.748
   28   2HE   LYS   3          3HE       LYS   3  -6.790  -8.260  -3.508
   29   1HZ   LYS   3          1HZ       LYS   3  -8.113  -6.726  -4.862
   30   2HZ   LYS   3          2HZ       LYS   3  -9.058  -8.066  -4.424
   31   3HZ   LYS   3          3HZ       LYS   3  -9.280  -6.688  -3.689
   32    H    HIS   4           H        HIS   4  -6.576  -5.978   0.945
   33    HA   HIS   4           HA       HIS   4  -8.922  -4.162   0.593
   34   1HB   HIS   4          2HB       HIS   4  -6.197  -3.544   1.757
   35   2HB   HIS   4          3HB       HIS   4  -7.670  -2.576   1.887
   36    HD1  HIS   4           1HD      HIS   4  -5.915  -5.636   3.349
   37    HD2  HIS   4           2HD      HIS   4  -9.534  -3.530   3.705
   38    HE1  HIS   4           1HE      HIS   4  -6.988  -6.383   5.561
   39    H    GLU   5           H        GLU   5  -8.814  -2.708  -1.161
   40    HA   GLU   5           HA       GLU   5  -6.531  -3.025  -3.067
   41   1HB   GLU   5          2HB       GLU   5  -9.408  -2.123  -3.247
   42   2HB   GLU   5          3HB       GLU   5  -8.276  -1.857  -4.568
   43   1HG   GLU   5          2HG       GLU   5  -8.620  -4.628  -3.423
   44   2HG   GLU   5          3HG       GLU   5  -9.841  -3.963  -4.512
   45    H    PHE   6           H        PHE   6  -5.221  -1.288  -3.521
   46    HA   PHE   6           HA       PHE   6  -6.142   1.476  -2.872
   47   1HB   PHE   6          2HB       PHE   6  -3.375   0.226  -2.419
   48   2HB   PHE   6          3HB       PHE   6  -3.736   1.929  -2.240
   49    HD1  PHE   6           1HD      PHE   6  -4.481  -1.468  -0.836
   50    HD2  PHE   6           2HD      PHE   6  -4.398   2.785  -0.118
   51    HE1  PHE   6           1HE      PHE   6  -4.750  -1.863   1.593
   52    HE2  PHE   6           2HE      PHE   6  -4.693   2.374   2.307
   53    HZ   PHE   6           HZ       PHE   6  -4.895   0.050   3.168
   54    H    SER   7           H        SER   7  -5.590   2.958  -4.451
   55    HA   SER   7           HA       SER   7  -3.992   1.921  -6.740
   56   1HB   SER   7          2HB       SER   7  -6.427   3.293  -6.924
   57   2HB   SER   7          3HB       SER   7  -5.186   4.494  -7.282
   58    HG   SER   7           HG       SER   7  -4.296   2.716  -8.709
   59    H    VAL   8           H        VAL   8  -2.083   2.934  -7.246
   60    HA   VAL   8           HA       VAL   8  -1.023   4.603  -5.016
   61    HB   VAL   8           HB       VAL   8   0.195   2.315  -6.602
   62   1HG1  VAL   8          1HG1      VAL   8   1.337   4.059  -4.351
   63   2HG1  VAL   8          2HG1      VAL   8   2.066   2.538  -4.917
   64   3HG1  VAL   8          3HG1      VAL   8   1.973   3.920  -6.002
   65   1HG2  VAL   8          1HG2      VAL   8   0.232   1.244  -4.324
   66   2HG2  VAL   8          2HG2      VAL   8  -0.725   2.579  -3.692
   67   3HG2  VAL   8          3HG2      VAL   8  -1.409   1.503  -4.930
   68    H    ASP   9           H        ASP   9   0.715   5.975  -5.487
   69    HA   ASP   9           HA       ASP   9   0.644   7.162  -8.209
   70   1HB   ASP   9          2HB       ASP   9   0.017   8.589  -6.417
   71   2HB   ASP   9          3HB       ASP   9   1.382   8.091  -5.414
   72    H    MET  10           H        MET  10   1.867   5.447  -9.104
   73    HA   MET  10           HA       MET  10   4.726   5.341  -8.450
   74   1HB   MET  10          2HB       MET  10   3.158   4.101 -10.734
   75   2HB   MET  10          3HB       MET  10   4.889   3.903 -10.406
   76   1HG   MET  10          2HG       MET  10   4.041   2.062  -9.371
   77   2HG   MET  10          3HG       MET  10   4.118   3.175  -7.994
   78   1HE   MET  10          1HE       MET  10   1.165   0.544  -7.560
   79   2HE   MET  10          2HE       MET  10   2.689   0.306  -8.413
   80   3HE   MET  10          3HE       MET  10   2.687   1.138  -6.847
   81    H    THR  11           H        THR  11   4.730   7.778  -8.529
   82    HA   THR  11           HA       THR  11   4.918   9.017 -11.119
   83    HB   THR  11           HB       THR  11   6.444  10.462  -9.187
   84    HG1  THR  11           1HG      THR  11   4.053   9.598  -7.973
   85   1HG2  THR  11          1HG2      THR  11   4.458  11.939  -9.093
   86   2HG2  THR  11          2HG2      THR  11   4.883  11.488 -10.757
   87   3HG2  THR  11          3HG2      THR  11   3.505  10.710  -9.949
   88    H    CYS  12           H        CYS  12   7.166   7.306  -8.962
   89    HA   CYS  12           HA       CYS  12   9.081   7.152 -11.219
   90   1HB   CYS  12          2HB       CYS  12  10.022   8.817  -9.639
   91   2HB   CYS  12          3HB       CYS  12   9.791   7.680  -8.289
   92    HG   CYS  12           HG       CYS  12  12.305   7.712  -8.883
   93    H    GLY  13           H        GLY  13  10.095   5.028 -11.209
   94   1HA   GLY  13          2HA       GLY  13   8.660   2.805 -10.324
   95   2HA   GLY  13          3HA       GLY  13  10.411   2.827 -10.611
   96    H    GLY  14           H        GLY  14  11.207   4.661  -8.610
   97   1HA   GLY  14          2HA       GLY  14  11.399   2.945  -6.366
   98   2HA   GLY  14          3HA       GLY  14  11.937   4.638  -6.433
   99    H    CYS  15           H        CYS  15   8.721   5.002  -7.172
  100    HA   CYS  15           HA       CYS  15   7.815   5.567  -4.492
  101   1HB   CYS  15          2HB       CYS  15   6.270   5.051  -7.017
  102   2HB   CYS  15          3HB       CYS  15   5.565   5.477  -5.442
  103    HG   CYS  15           HG       CYS  15   5.487   7.677  -6.675
  104    H    ALA  16           H        ALA  16   7.925   2.652  -6.582
  105    HA   ALA  16           HA       ALA  16   6.274   1.025  -4.913
  106   1HB   ALA  16          1HB       ALA  16   6.880   0.439  -7.265
  107   2HB   ALA  16          2HB       ALA  16   8.557   0.151  -6.742
  108   3HB   ALA  16          3HB       ALA  16   7.248  -0.864  -6.116
  109    H    GLU  17           H        GLU  17   9.896   1.484  -4.980
  110    HA   GLU  17           HA       GLU  17  10.501  -0.048  -2.713
  111   1HB   GLU  17          2HB       GLU  17  11.662   2.514  -3.850
  112   2HB   GLU  17          3HB       GLU  17  12.305   1.742  -2.413
  113   1HG   GLU  17          2HG       GLU  17  11.821  -0.183  -4.642
  114   2HG   GLU  17          3HG       GLU  17  12.959   1.100  -5.028
  115    H    ALA  18           H        ALA  18   9.351   3.363  -2.887
  116    HA   ALA  18           HA       ALA  18   9.576   3.868  -0.099
  117   1HB   ALA  18          1HB       ALA  18   7.521   5.073  -2.002
  118   2HB   ALA  18          2HB       ALA  18   8.050   5.728  -0.445
  119   3HB   ALA  18          3HB       ALA  18   9.196   5.633  -1.799
  120    H    VAL  19           H        VAL  19   6.754   2.735  -1.985
  121    HA   VAL  19           HA       VAL  19   5.012   2.452   0.243
  122    HB   VAL  19           HB       VAL  19   4.990   1.248  -2.543
  123   1HG1  VAL  19          1HG1      VAL  19   2.580   0.808  -2.125
  124   2HG1  VAL  19          2HG1      VAL  19   3.610  -0.215  -1.119
  125   3HG1  VAL  19          3HG1      VAL  19   2.805   1.219  -0.417
  126   1HG2  VAL  19          1HG2      VAL  19   4.744   3.760  -2.332
  127   2HG2  VAL  19          2HG2      VAL  19   3.281   2.976  -2.933
  128   3HG2  VAL  19          3HG2      VAL  19   3.376   3.501  -1.243
  129    H    SER  20           H        SER  20   6.931  -0.087  -1.507
  130    HA   SER  20           HA       SER  20   6.114  -2.216   0.152
  131   1HB   SER  20          2HB       SER  20   8.346  -3.260  -0.525
  132   2HB   SER  20          3HB       SER  20   7.362  -2.687  -1.891
  133    HG   SER  20           HG       SER  20   8.664  -0.867  -1.991
  134    H    ARG  21           H        ARG  21   8.991  -0.152   0.480
  135    HA   ARG  21           HA       ARG  21   9.892  -1.195   2.929
  136   1HB   ARG  21          2HB       ARG  21  10.194   1.597   1.782
  137   2HB   ARG  21          3HB       ARG  21  11.060   1.004   3.206
  138   1HG   ARG  21          2HG       ARG  21  12.121  -0.787   1.923
  139   2HG   ARG  21          3HG       ARG  21  11.210  -0.368   0.475
  140   1HD   ARG  21          2HD       ARG  21  12.269   1.913   0.522
  141   2HD   ARG  21          3HD       ARG  21  13.252   1.368   1.892
  142    HE   ARG  21           HE       ARG  21  13.259  -0.062  -0.783
  143   1HH1  ARG  21          2HH2      ARG  21  15.163   1.720   1.627
  144   2HH1  ARG  21          1HH2      ARG  21  16.663   1.485   0.785
  145   1HH2  ARG  21          2HH1      ARG  21  15.186  -0.161  -1.977
  146   2HH2  ARG  21          1HH1      ARG  21  16.688   0.302  -1.256
  147    H    VAL  22           H        VAL  22   7.593   1.694   2.535
  148    HA   VAL  22           HA       VAL  22   7.354   2.030   5.285
  149    HB   VAL  22           HB       VAL  22   6.617   3.540   3.284
  150   1HG1  VAL  22          1HG1      VAL  22   4.769   2.008   2.459
  151   2HG1  VAL  22          2HG1      VAL  22   3.937   2.291   3.995
  152   3HG1  VAL  22          3HG1      VAL  22   4.239   3.619   2.852
  153   1HG2  VAL  22          1HG2      VAL  22   5.079   3.295   5.864
  154   2HG2  VAL  22          2HG2      VAL  22   6.579   4.225   5.566
  155   3HG2  VAL  22          3HG2      VAL  22   5.040   4.711   4.795
  156    H    LEU  23           H        LEU  23   5.353  -0.036   3.077
  157    HA   LEU  23           HA       LEU  23   3.600  -0.898   5.146
  158   1HB   LEU  23          2HB       LEU  23   4.369  -2.003   2.431
  159   2HB   LEU  23          3HB       LEU  23   3.468  -2.975   3.578
  160    HG   LEU  23           HG       LEU  23   1.941  -2.090   2.064
  161   1HD1  LEU  23          1HD1      LEU  23   1.533  -0.613   4.702
  162   2HD1  LEU  23          2HD1      LEU  23   0.302  -1.126   3.552
  163   3HD1  LEU  23          3HD1      LEU  23   1.232  -2.348   4.436
  164   1HD2  LEU  23          1HD2      LEU  23   2.828   0.639   2.962
  165   2HD2  LEU  23          2HD2      LEU  23   3.139  -0.132   1.385
  166   3HD2  LEU  23          3HD2      LEU  23   1.480   0.292   1.849
  167    H    ASN  24           H        ASN  24   6.709  -2.262   3.984
  168    HA   ASN  24           HA       ASN  24   6.781  -4.535   5.696
  169   1HB   ASN  24          2HB       ASN  24   8.397  -4.436   3.984
  170   2HB   ASN  24          3HB       ASN  24   8.856  -2.783   4.366
  171   1HD2  ASN  24          1HD2      ASN  24  10.077  -2.321   6.227
  172   2HD2  ASN  24          2HD2      ASN  24  11.147  -3.555   6.914
  173    H    LYS  25           H        LYS  25   7.874  -1.168   6.213
  174    HA   LYS  25           HA       LYS  25   8.981  -1.474   8.784
  175   1HB   LYS  25          2HB       LYS  25   7.755   0.836   7.249
  176   2HB   LYS  25          3HB       LYS  25   8.145   1.057   8.942
  177   1HG   LYS  25          2HG       LYS  25  10.179   0.039   6.911
  178   2HG   LYS  25          3HG       LYS  25   9.902   1.757   7.229
  179   1HD   LYS  25          2HD       LYS  25  10.408   1.416   9.638
  180   2HD   LYS  25          3HD       LYS  25  10.770  -0.291   9.327
  181   1HE   LYS  25          2HE       LYS  25  12.586   0.380   7.755
  182   2HE   LYS  25          3HE       LYS  25  12.232   2.086   8.079
  183   1HZ   LYS  25          1HZ       LYS  25  12.830   1.710  10.377
  184   2HZ   LYS  25          2HZ       LYS  25  13.160   0.125  10.078
  185   3HZ   LYS  25          3HZ       LYS  25  14.071   1.302   9.383
  186    H    LEU  26           H        LEU  26   5.603  -0.976   7.827
  187    HA   LEU  26           HA       LEU  26   4.475  -0.544  10.327
  188   1HB   LEU  26          2HB       LEU  26   3.401  -0.719   7.993
  189   2HB   LEU  26          3HB       LEU  26   3.251  -2.442   8.272
  190    HG   LEU  26           HG       LEU  26   1.244  -1.021   8.652
  191   1HD1  LEU  26          1HD1      LEU  26   0.365  -2.206  10.492
  192   2HD1  LEU  26          2HD1      LEU  26   1.363  -3.299   9.505
  193   3HD1  LEU  26          3HD1      LEU  26   1.967  -2.686  11.065
  194   1HD2  LEU  26          1HD2      LEU  26   2.446  -0.294  11.350
  195   2HD2  LEU  26          2HD2      LEU  26   2.503   0.796   9.952
  196   3HD2  LEU  26          3HD2      LEU  26   0.945   0.292  10.617
  197    H    GLY  27           H        GLY  27   5.529  -3.663   8.893
  198   1HA   GLY  27          2HA       GLY  27   6.287  -4.865  11.200
  199   2HA   GLY  27          3HA       GLY  27   4.532  -5.125  11.229
  200    H    GLY  28           H        GLY  28   3.565  -6.586   9.780
  201   1HA   GLY  28          2HA       GLY  28   5.319  -8.342   8.124
  202   2HA   GLY  28          3HA       GLY  28   4.516  -9.021   9.554
  203    H    VAL  29           H        VAL  29   3.407  -6.575   7.321
  204    HA   VAL  29           HA       VAL  29   0.839  -7.809   6.736
  205    HB   VAL  29           HB       VAL  29   1.218  -5.356   6.985
  206   1HG1  VAL  29          1HG1      VAL  29   3.050  -5.691   4.584
  207   2HG1  VAL  29          2HG1      VAL  29   2.410  -4.136   5.162
  208   3HG1  VAL  29          3HG1      VAL  29   3.483  -5.074   6.182
  209   1HG2  VAL  29          1HG2      VAL  29   0.386  -6.064   4.155
  210   2HG2  VAL  29          2HG2      VAL  29  -0.657  -6.026   5.604
  211   3HG2  VAL  29          3HG2      VAL  29   0.091  -4.548   4.996
  212    H    LYS  30           H        LYS  30   0.180  -8.402   4.406
  213    HA   LYS  30           HA       LYS  30   2.521  -8.763   2.603
  214   1HB   LYS  30          2HB       LYS  30   1.650 -10.941   2.942
  215   2HB   LYS  30          3HB       LYS  30  -0.024 -10.387   2.773
  216   1HG   LYS  30          2HG       LYS  30   0.768 -11.620   0.803
  217   2HG   LYS  30          3HG       LYS  30   0.241 -10.000   0.396
  218   1HD   LYS  30          2HD       LYS  30   2.270  -9.435  -0.462
  219   2HD   LYS  30          3HD       LYS  30   3.131  -9.988   0.978
  220   1HE   LYS  30          2HE       LYS  30   4.007 -11.270  -0.705
  221   2HE   LYS  30          3HE       LYS  30   2.877 -12.346   0.135
  222   1HZ   LYS  30          1HZ       LYS  30   1.278 -11.437  -1.776
  223   2HZ   LYS  30          2HZ       LYS  30   2.599 -11.055  -2.524
  224   3HZ   LYS  30          3HZ       LYS  30   2.371 -12.642  -2.149
  225    H    TYR  31           H        TYR  31   2.596  -7.239   1.189
  226    HA   TYR  31           HA       TYR  31   0.134  -6.076  -0.024
  227   1HB   TYR  31          2HB       TYR  31   1.621  -4.181  -0.681
  228   2HB   TYR  31          3HB       TYR  31   1.299  -4.288   1.045
  229    HD1  TYR  31           HD1      TYR  31   3.911  -4.812  -1.567
  230    HD2  TYR  31           HD2      TYR  31   3.004  -4.934   2.606
  231    HE1  TYR  31           HE1      TYR  31   6.339  -4.940  -1.050
  232    HE2  TYR  31           HE2      TYR  31   5.440  -4.891   3.158
  233    HH   TYR  31           HH       TYR  31   7.479  -4.007   2.053
  234    H    ASP  32           H        ASP  32  -0.028  -6.365  -2.202
  235    HA   ASP  32           HA       ASP  32   2.318  -7.451  -3.709
  236   1HB   ASP  32          2HB       ASP  32  -0.587  -8.245  -3.627
  237   2HB   ASP  32          3HB       ASP  32   0.318  -8.463  -5.120
  238    H    ILE  33           H        ILE  33   2.816  -6.289  -5.472
  239    HA   ILE  33           HA       ILE  33   1.433  -3.659  -5.739
  240    HB   ILE  33           HB       ILE  33   4.332  -4.494  -6.050
  241   1HG1  ILE  33          2HG1      ILE  33   3.531  -2.360  -4.104
  242   2HG1  ILE  33          3HG1      ILE  33   3.065  -4.005  -3.663
  243   1HG2  ILE  33          1HG2      ILE  33   3.026  -1.765  -6.428
  244   2HG2  ILE  33          2HG2      ILE  33   4.776  -2.030  -6.296
  245   3HG2  ILE  33          3HG2      ILE  33   3.888  -2.712  -7.659
  246   1HD1  ILE  33          1HD1      ILE  33   5.346  -4.780  -3.804
  247   2HD1  ILE  33          2HD1      ILE  33   5.894  -3.209  -4.451
  248   3HD1  ILE  33          3HD1      ILE  33   5.285  -3.323  -2.791
  249    H    ASP  34           H        ASP  34   0.359  -3.409  -7.574
  250    HA   ASP  34           HA       ASP  34   1.301  -4.653 -10.106
  251   1HB   ASP  34          2HB       ASP  34  -1.064  -4.995  -9.516
  252   2HB   ASP  34          3HB       ASP  34  -1.301  -3.240  -9.448
  253    H    LEU  35           H        LEU  35   2.913  -3.394 -10.817
  254    HA   LEU  35           HA       LEU  35   2.967  -0.520 -10.505
  255   1HB   LEU  35          2HB       LEU  35   4.962  -2.235 -10.696
  256   2HB   LEU  35          3HB       LEU  35   4.735  -2.013 -12.429
  257    HG   LEU  35           HG       LEU  35   4.781   0.592 -11.719
  258   1HD1  LEU  35          1HD1      LEU  35   6.319   1.016  -9.866
  259   2HD1  LEU  35          2HD1      LEU  35   5.005  -0.009  -9.248
  260   3HD1  LEU  35          3HD1      LEU  35   6.583  -0.717  -9.621
  261   1HD2  LEU  35          1HD2      LEU  35   7.267  -1.153 -11.963
  262   2HD2  LEU  35          2HD2      LEU  35   6.341  -0.443 -13.305
  263   3HD2  LEU  35          3HD2      LEU  35   7.208   0.610 -12.172
  264    HA   PRO  36           HA       PRO  36   2.147  -0.527 -15.253
  265   1HB   PRO  36          2HB       PRO  36   0.428  -2.489 -16.263
  266   2HB   PRO  36          3HB       PRO  36   2.205  -2.469 -16.406
  267   1HG   PRO  36          2HG       PRO  36   0.517  -3.922 -14.384
  268   2HG   PRO  36          3HG       PRO  36   1.939  -4.531 -15.272
  269   1HD   PRO  36          2HD       PRO  36   2.149  -3.720 -12.759
  270   2HD   PRO  36          3HD       PRO  36   3.432  -3.278 -13.913
  271    H    ASN  37           H        ASN  37  -0.462  -1.973 -13.212
  272    HA   ASN  37           HA       ASN  37  -2.435  -0.061 -14.312
  273   1HB   ASN  37          2HB       ASN  37  -2.769  -2.291 -12.282
  274   2HB   ASN  37          3HB       ASN  37  -4.049  -1.314 -12.968
  275   1HD2  ASN  37          1HD2      ASN  37  -2.306  -4.219 -13.383
  276   2HD2  ASN  37          2HD2      ASN  37  -2.749  -4.518 -15.065
  277    H    LYS  38           H        LYS  38  -0.228  -0.164 -11.613
  278    HA   LYS  38           HA       LYS  38   0.171   1.219 -10.035
  279   1HB   LYS  38          2HB       LYS  38  -1.818   3.178 -11.306
  280   2HB   LYS  38          3HB       LYS  38  -0.756   3.494  -9.956
  281   1HG   LYS  38          2HG       LYS  38   0.547   4.361 -11.582
  282   2HG   LYS  38          3HG       LYS  38   1.178   2.705 -11.527
  283   1HD   LYS  38          2HD       LYS  38  -0.439   2.144 -13.391
  284   2HD   LYS  38          3HD       LYS  38  -0.862   3.857 -13.497
  285   1HE   LYS  38          2HE       LYS  38   1.460   4.414 -14.096
  286   2HE   LYS  38          3HE       LYS  38   1.979   2.752 -13.760
  287   1HZ   LYS  38          1HZ       LYS  38   0.548   1.990 -15.520
  288   2HZ   LYS  38          2HZ       LYS  38   0.144   3.531 -15.923
  289   3HZ   LYS  38          3HZ       LYS  38   1.705   3.019 -16.092
  290    H    LYS  39           H        LYS  39  -0.971  -0.743  -9.182
  291    HA   LYS  39           HA       LYS  39  -2.821   0.229  -7.111
  292   1HB   LYS  39          2HB       LYS  39  -3.319  -2.100  -8.998
  293   2HB   LYS  39          3HB       LYS  39  -3.844  -2.192  -7.318
  294   1HG   LYS  39          2HG       LYS  39  -5.051   0.005  -7.629
  295   2HG   LYS  39          3HG       LYS  39  -4.739  -0.133  -9.371
  296   1HD   LYS  39          2HD       LYS  39  -5.954  -2.285  -9.424
  297   2HD   LYS  39          3HD       LYS  39  -6.054  -2.301  -7.654
  298   1HE   LYS  39          2HE       LYS  39  -7.404  -0.168  -7.753
  299   2HE   LYS  39          3HE       LYS  39  -7.497  -0.364  -9.513
  300   1HZ   LYS  39          1HZ       LYS  39  -9.404  -1.312  -8.292
  301   2HZ   LYS  39          2HZ       LYS  39  -8.585  -2.498  -9.104
  302   3HZ   LYS  39          3HZ       LYS  39  -8.391  -2.332  -7.498
  303    H    VAL  40           H        VAL  40  -2.711  -0.868  -5.117
  304    HA   VAL  40           HA       VAL  40  -0.786  -3.054  -4.910
  305    HB   VAL  40           HB       VAL  40  -1.105  -0.483  -3.354
  306   1HG1  VAL  40          1HG1      VAL  40  -0.352  -3.120  -2.115
  307   2HG1  VAL  40          2HG1      VAL  40   0.038  -1.523  -1.408
  308   3HG1  VAL  40          3HG1      VAL  40  -1.658  -1.963  -1.696
  309   1HG2  VAL  40          1HG2      VAL  40   1.267  -2.269  -3.974
  310   2HG2  VAL  40          2HG2      VAL  40   0.739  -0.902  -4.987
  311   3HG2  VAL  40          3HG2      VAL  40   1.344  -0.617  -3.337
  312    H    CYS  41           H        CYS  41  -1.696  -4.746  -3.924
  313    HA   CYS  41           HA       CYS  41  -4.398  -4.428  -2.689
  314   1HB   CYS  41          2HB       CYS  41  -4.922  -6.682  -3.355
  315   2HB   CYS  41          3HB       CYS  41  -4.593  -5.680  -4.786
  316    HG   CYS  41           HG       CYS  41  -2.485  -7.683  -3.250
  317    H    ILE  42           H        ILE  42  -4.440  -4.987  -0.553
  318    HA   ILE  42           HA       ILE  42  -1.989  -6.273   0.560
  319    HB   ILE  42           HB       ILE  42  -3.528  -4.091   1.968
  320   1HG1  ILE  42          2HG1      ILE  42  -1.192  -3.808   0.043
  321   2HG1  ILE  42          3HG1      ILE  42  -2.792  -3.043  -0.054
  322   1HG2  ILE  42          1HG2      ILE  42  -0.688  -5.145   2.251
  323   2HG2  ILE  42          2HG2      ILE  42  -1.460  -3.953   3.296
  324   3HG2  ILE  42          3HG2      ILE  42  -2.050  -5.611   3.299
  325   1HD1  ILE  42          1HD1      ILE  42  -2.215  -1.852   2.142
  326   2HD1  ILE  42          2HD1      ILE  42  -0.549  -2.419   1.870
  327   3HD1  ILE  42          3HD1      ILE  42  -1.319  -1.342   0.701
  328    H    GLU  43           H        GLU  43  -2.282  -7.920   1.876
  329    HA   GLU  43           HA       GLU  43  -4.948  -8.367   3.135
  330   1HB   GLU  43          2HB       GLU  43  -4.575  -9.934   1.216
  331   2HB   GLU  43          3HB       GLU  43  -3.114 -10.531   2.019
  332   1HG   GLU  43          2HG       GLU  43  -4.489 -11.239   3.961
  333   2HG   GLU  43          3HG       GLU  43  -5.947 -10.608   3.167
  334    H    SER  44           H        SER  44  -4.834  -8.669   5.293
  335    HA   SER  44           HA       SER  44  -2.720 -10.063   6.479
  336   1HB   SER  44          2HB       SER  44  -1.576  -7.834   6.423
  337   2HB   SER  44          3HB       SER  44  -2.885  -7.159   7.408
  338    HG   SER  44           HG       SER  44  -0.947  -9.140   8.053
  339    H    GLU  45           H        GLU  45  -3.131  -9.858   8.994
  340    HA   GLU  45           HA       GLU  45  -6.087 -10.074   9.426
  341   1HB   GLU  45          2HB       GLU  45  -4.415 -12.181   9.461
  342   2HB   GLU  45          3HB       GLU  45  -4.160 -11.670  11.118
  343   1HG   GLU  45          2HG       GLU  45  -6.511 -11.974  11.626
  344   2HG   GLU  45          3HG       GLU  45  -6.935 -12.096   9.908
  345    H    HIS  46           H        HIS  46  -5.197  -7.622   9.544
  346    HA   HIS  46           HA       HIS  46  -5.439  -6.944  12.331
  347   1HB   HIS  46          2HB       HIS  46  -3.489  -5.703  12.643
  348   2HB   HIS  46          3HB       HIS  46  -2.912  -7.210  11.945
  349    HD1  HIS  46           1HD      HIS  46  -3.766  -3.598  10.691
  350    HD2  HIS  46           2HD      HIS  46  -1.005  -6.752  10.178
  351    HE1  HIS  46           1HE      HIS  46  -1.803  -2.680   9.408
  352    H    SER  47           H        SER  47  -5.765  -4.454  12.472
  353    HA   SER  47           HA       SER  47  -7.823  -3.902  10.624
  354   1HB   SER  47          2HB       SER  47  -7.554  -2.978  13.004
  355   2HB   SER  47          3HB       SER  47  -6.558  -1.701  12.290
  356    HG   SER  47           HG       SER  47  -8.440  -0.875  11.366
  357    H    MET  48           H        MET  48  -8.046  -2.442   8.923
  358    HA   MET  48           HA       MET  48  -5.829  -2.124   7.192
  359   1HB   MET  48          2HB       MET  48  -8.053  -2.473   6.368
  360   2HB   MET  48          3HB       MET  48  -8.692  -1.094   7.287
  361   1HG   MET  48          2HG       MET  48  -7.545   0.474   5.942
  362   2HG   MET  48          3HG       MET  48  -6.555  -0.786   5.178
  363   1HE   MET  48          1HE       MET  48 -10.218   0.639   5.553
  364   2HE   MET  48          2HE       MET  48 -11.074  -0.298   4.305
  365   3HE   MET  48          3HE       MET  48 -10.468  -1.115   5.757
  366    H    ASP  49           H        ASP  49  -7.611   0.106   9.389
  367    HA   ASP  49           HA       ASP  49  -6.677   2.534   8.622
  368   1HB   ASP  49          2HB       ASP  49  -6.925   1.670  11.535
  369   2HB   ASP  49          3HB       ASP  49  -7.187   3.287  10.864
  370    H    THR  50           H        THR  50  -5.103   0.282  10.764
  371    HA   THR  50           HA       THR  50  -2.820   1.670  11.537
  372    HB   THR  50           HB       THR  50  -2.946  -1.298  10.902
  373    HG1  THR  50           1HG      THR  50  -4.129   0.082  13.073
  374   1HG2  THR  50          1HG2      THR  50  -1.685   0.246  13.219
  375   2HG2  THR  50          2HG2      THR  50  -1.670  -1.517  13.003
  376   3HG2  THR  50          3HG2      THR  50  -0.810  -0.480  11.855
  377    H    LEU  51           H        LEU  51  -3.426  -0.208   8.527
  378    HA   LEU  51           HA       LEU  51  -0.739   0.100   7.441
  379   1HB   LEU  51          2HB       LEU  51  -3.349  -0.328   5.910
  380   2HB   LEU  51          3HB       LEU  51  -1.711  -0.534   5.321
  381    HG   LEU  51           HG       LEU  51  -2.966  -2.185   7.575
  382   1HD1  LEU  51          1HD1      LEU  51  -4.228  -2.549   5.550
  383   2HD1  LEU  51          2HD1      LEU  51  -2.743  -2.749   4.612
  384   3HD1  LEU  51          3HD1      LEU  51  -3.189  -3.954   5.850
  385   1HD2  LEU  51          1HD2      LEU  51  -1.064  -3.744   6.975
  386   2HD2  LEU  51          2HD2      LEU  51  -0.464  -2.510   5.854
  387   3HD2  LEU  51          3HD2      LEU  51  -0.474  -2.193   7.592
  388    H    LEU  52           H        LEU  52  -3.937   1.547   6.766
  389    HA   LEU  52           HA       LEU  52  -3.265   3.279   4.809
  390   1HB   LEU  52          2HB       LEU  52  -5.477   2.501   5.982
  391   2HB   LEU  52          3HB       LEU  52  -5.358   3.983   6.907
  392    HG   LEU  52           HG       LEU  52  -5.132   4.068   3.871
  393   1HD1  LEU  52          1HD1      LEU  52  -7.676   3.641   5.478
  394   2HD1  LEU  52          2HD1      LEU  52  -7.616   4.062   3.745
  395   3HD1  LEU  52          3HD1      LEU  52  -6.942   2.516   4.318
  396   1HD2  LEU  52          1HD2      LEU  52  -6.449   5.881   5.938
  397   2HD2  LEU  52          2HD2      LEU  52  -4.844   6.122   5.207
  398   3HD2  LEU  52          3HD2      LEU  52  -6.303   6.204   4.193
  399    H    ALA  53           H        ALA  53  -3.445   4.084   8.274
  400    HA   ALA  53           HA       ALA  53  -2.553   6.774   8.166
  401   1HB   ALA  53          1HB       ALA  53  -2.286   4.710  10.397
  402   2HB   ALA  53          2HB       ALA  53  -2.149   6.471  10.582
  403   3HB   ALA  53          3HB       ALA  53  -3.702   5.748  10.117
  404    H    THR  54           H        THR  54  -0.699   3.730   8.341
  405    HA   THR  54           HA       THR  54   1.778   5.253   8.603
  406    HB   THR  54           HB       THR  54   1.198   2.325   8.331
  407    HG1  THR  54           1HG      THR  54   1.196   2.909  10.363
  408   1HG2  THR  54          1HG2      THR  54   3.894   3.731   8.062
  409   2HG2  THR  54          2HG2      THR  54   3.704   2.017   8.472
  410   3HG2  THR  54          3HG2      THR  54   3.126   2.607   6.914
  411    H    LEU  55           H        LEU  55   0.328   3.440   5.798
  412    HA   LEU  55           HA       LEU  55   2.543   4.110   4.194
  413   1HB   LEU  55          2HB       LEU  55   1.295   3.350   2.330
  414   2HB   LEU  55          3HB       LEU  55   1.223   2.291   3.716
  415    HG   LEU  55           HG       LEU  55  -1.067   3.573   4.181
  416   1HD1  LEU  55          1HD1      LEU  55  -2.113   4.218   2.068
  417   2HD1  LEU  55          2HD1      LEU  55  -0.549   5.065   2.240
  418   3HD1  LEU  55          3HD1      LEU  55  -0.658   3.664   1.178
  419   1HD2  LEU  55          1HD2      LEU  55  -2.168   1.727   2.955
  420   2HD2  LEU  55          2HD2      LEU  55  -0.655   1.412   2.072
  421   3HD2  LEU  55          3HD2      LEU  55  -0.731   1.151   3.829
  422    H    LYS  56           H        LYS  56  -0.416   5.862   4.732
  423    HA   LYS  56           HA       LYS  56  -0.320   8.021   3.099
  424   1HB   LYS  56          2HB       LYS  56  -0.920   7.587   5.997
  425   2HB   LYS  56          3HB       LYS  56  -0.663   9.262   5.577
  426   1HG   LYS  56          2HG       LYS  56  -2.393   9.225   3.892
  427   2HG   LYS  56          3HG       LYS  56  -2.639   7.471   4.114
  428   1HD   LYS  56          2HD       LYS  56  -3.329   7.740   6.362
  429   2HD   LYS  56          3HD       LYS  56  -2.796   9.426   6.437
  430   1HE   LYS  56          2HE       LYS  56  -4.572  10.124   4.882
  431   2HE   LYS  56          3HE       LYS  56  -5.045   8.447   4.590
  432   1HZ   LYS  56          1HZ       LYS  56  -5.301   9.860   7.165
  433   2HZ   LYS  56          2HZ       LYS  56  -6.524   9.526   6.120
  434   3HZ   LYS  56          3HZ       LYS  56  -5.745   8.299   6.883
  435    H    LYS  57           H        LYS  57   1.936   7.453   5.786
  436    HA   LYS  57           HA       LYS  57   3.112   9.970   6.112
  437   1HB   LYS  57          2HB       LYS  57   4.179   7.204   6.427
  438   2HB   LYS  57          3HB       LYS  57   5.051   8.643   7.003
  439   1HG   LYS  57          2HG       LYS  57   3.174   9.183   8.468
  440   2HG   LYS  57          3HG       LYS  57   2.235   7.837   7.804
  441   1HD   LYS  57          2HD       LYS  57   3.942   6.208   8.533
  442   2HD   LYS  57          3HD       LYS  57   4.820   7.492   9.372
  443   1HE   LYS  57          2HE       LYS  57   3.151   7.745  11.018
  444   2HE   LYS  57          3HE       LYS  57   1.879   7.052  10.020
  445   1HZ   LYS  57          1HZ       LYS  57   4.092   5.465  11.149
  446   2HZ   LYS  57          2HZ       LYS  57   2.600   5.606  11.815
  447   3HZ   LYS  57          3HZ       LYS  57   2.765   4.857  10.377
  448    H    THR  58           H        THR  58   3.589   7.619   3.466
  449    HA   THR  58           HA       THR  58   6.157   8.486   2.566
  450    HB   THR  58           HB       THR  58   5.452   7.576   0.371
  451    HG1  THR  58           1HG      THR  58   2.961   6.987   1.583
  452   1HG2  THR  58          1HG2      THR  58   4.707   5.857   2.750
  453   2HG2  THR  58          2HG2      THR  58   5.037   5.267   1.104
  454   3HG2  THR  58          3HG2      THR  58   6.322   6.052   2.049
  455    H    GLY  59           H        GLY  59   2.933   9.875   2.193
  456   1HA   GLY  59          2HA       GLY  59   2.221  11.858   1.409
  457   2HA   GLY  59          3HA       GLY  59   3.907  12.401   1.303
  458    H    LYS  60           H        LYS  60   2.769   9.522  -0.448
  459    HA   LYS  60           HA       LYS  60   2.975  10.901  -3.094
  460   1HB   LYS  60          2HB       LYS  60   3.104   8.029  -2.127
  461   2HB   LYS  60          3HB       LYS  60   2.799   8.433  -3.814
  462   1HG   LYS  60          2HG       LYS  60   5.188   7.947  -3.274
  463   2HG   LYS  60          3HG       LYS  60   4.871   9.468  -4.136
  464   1HD   LYS  60          2HD       LYS  60   5.158  10.775  -2.160
  465   2HD   LYS  60          3HD       LYS  60   5.158   9.307  -1.143
  466   1HE   LYS  60          2HE       LYS  60   7.338   8.681  -1.955
  467   2HE   LYS  60          3HE       LYS  60   7.349  10.025  -3.116
  468   1HZ   LYS  60          1HZ       LYS  60   8.532  10.457  -0.962
  469   2HZ   LYS  60          2HZ       LYS  60   7.374  11.564  -1.340
  470   3HZ   LYS  60          3HZ       LYS  60   7.057  10.437  -0.203
  471    H    THR  61           H        THR  61   1.168  10.503  -4.637
  472    HA   THR  61           HA       THR  61  -1.305  11.027  -3.311
  473    HB   THR  61           HB       THR  61  -0.981  10.531  -6.256
  474    HG1  THR  61           1HG      THR  61   0.844  11.683  -5.927
  475   1HG2  THR  61          1HG2      THR  61  -2.377  12.549  -6.395
  476   2HG2  THR  61          2HG2      THR  61  -3.139  11.356  -5.313
  477   3HG2  THR  61          3HG2      THR  61  -2.260  12.752  -4.632
  478    H    VAL  62           H        VAL  62  -0.673   8.560  -2.489
  479    HA   VAL  62           HA       VAL  62  -2.037   6.480  -4.075
  480    HB   VAL  62           HB       VAL  62  -0.110   5.675  -2.977
  481   1HG1  VAL  62          1HG1      VAL  62   0.447   7.334  -1.367
  482   2HG1  VAL  62          2HG1      VAL  62  -1.055   7.068  -0.448
  483   3HG1  VAL  62          3HG1      VAL  62   0.222   5.834  -0.477
  484   1HG2  VAL  62          1HG2      VAL  62  -2.356   4.855  -1.090
  485   2HG2  VAL  62          2HG2      VAL  62  -2.140   4.204  -2.728
  486   3HG2  VAL  62          3HG2      VAL  62  -0.892   3.946  -1.500
  487    H    SER  63           H        SER  63  -4.012   5.503  -3.405
  488    HA   SER  63           HA       SER  63  -5.386   6.668  -1.073
  489   1HB   SER  63          2HB       SER  63  -6.065   8.057  -3.099
  490   2HB   SER  63          3HB       SER  63  -6.771   6.577  -3.780
  491    HG   SER  63           HG       SER  63  -7.520   8.041  -1.484
  492    H    TYR  64           H        TYR  64  -7.620   5.495  -1.007
  493    HA   TYR  64           HA       TYR  64  -7.008   2.560  -1.012
  494   1HB   TYR  64          2HB       TYR  64  -6.768   3.404   1.233
  495   2HB   TYR  64          3HB       TYR  64  -8.232   4.375   1.088
  496    HD1  TYR  64           HD1      TYR  64  -7.231   0.776   0.591
  497    HD2  TYR  64           HD2      TYR  64 -10.191   3.546   2.062
  498    HE1  TYR  64           HE1      TYR  64  -8.891  -1.017   0.618
  499    HE2  TYR  64           HE2      TYR  64 -11.843   1.710   2.173
  500    HH   TYR  64           HH       TYR  64 -11.076  -1.522   0.879
  501    H    LEU  65           H        LEU  65  -8.544   1.361  -2.122
  502    HA   LEU  65           HA       LEU  65 -11.304   2.290  -2.325
  503   1HB   LEU  65          2HB       LEU  65 -11.149   2.244  -4.866
  504   2HB   LEU  65          3HB       LEU  65 -10.721   3.677  -3.965
  505    HG   LEU  65           HG       LEU  65  -9.281   3.217  -5.857
  506   1HD1  LEU  65          1HD1      LEU  65  -7.392   4.121  -5.020
  507   2HD1  LEU  65          2HD1      LEU  65  -8.595   4.529  -3.792
  508   3HD1  LEU  65          3HD1      LEU  65  -7.471   3.170  -3.540
  509   1HD2  LEU  65          1HD2      LEU  65  -7.505   1.573  -5.863
  510   2HD2  LEU  65          2HD2      LEU  65  -8.145   0.848  -4.383
  511   3HD2  LEU  65          3HD2      LEU  65  -9.089   0.820  -5.894
  512    H    GLY  66           H        GLY  66 -11.348   0.079  -1.182
  513   1HA   GLY  66          2HA       GLY  66 -13.124  -1.431  -2.204
  514   2HA   GLY  66          3HA       GLY  66 -11.850  -2.020  -3.279
  515    H    LEU  67           H        LEU  67 -13.261  -3.756  -1.469
  516    HA   LEU  67           HA       LEU  67 -11.020  -4.859  -0.130
  517   1HB   LEU  67          2HB       LEU  67 -11.867  -4.958   2.112
  518   2HB   LEU  67          3HB       LEU  67 -11.725  -3.273   1.657
  519    HG   LEU  67           HG       LEU  67 -14.307  -4.908   1.800
  520   1HD1  LEU  67          1HD1      LEU  67 -13.243  -2.654   3.552
  521   2HD1  LEU  67          2HD1      LEU  67 -14.796  -3.495   3.747
  522   3HD1  LEU  67          3HD1      LEU  67 -13.280  -4.380   3.982
  523   1HD2  LEU  67          1HD2      LEU  67 -13.890  -1.967   1.099
  524   2HD2  LEU  67          2HD2      LEU  67 -14.701  -3.210   0.114
  525   3HD2  LEU  67          3HD2      LEU  67 -15.442  -2.656   1.609
  526    H    GLU  68           H        GLU  68 -11.392  -7.097   0.575
  527    HA   GLU  68           HA       GLU  68 -13.871  -8.416  -0.248
  528   1HB   GLU  68          2HB       GLU  68 -10.920  -8.739  -0.966
  529   2HB   GLU  68          3HB       GLU  68 -12.031 -10.065  -0.997
  530   1HG   GLU  68          2HG       GLU  68 -12.810  -9.426  -3.076
  531   2HG   GLU  68          3HG       GLU  68 -13.177  -7.802  -2.485
  Start of MODEL   20
    1   1H    MET   1           H1       MET   1  -6.601  -7.479   7.246
    2   2H    MET   1           H2       MET   1  -7.828  -6.528   6.664
    3   3H    MET   1           H3       MET   1  -7.477  -6.554   8.282
    4    HA   MET   1           HA       MET   1  -7.998  -8.879   8.420
    5   1HB   MET   1          2HB       MET   1 -10.245  -7.149   7.342
    6   2HB   MET   1          3HB       MET   1 -10.462  -8.783   8.046
    7   1HG   MET   1          2HG       MET   1  -9.356  -8.003  10.118
    8   2HG   MET   1          3HG       MET   1  -9.327  -6.359   9.453
    9   1HE   MET   1          1HE       MET   1 -10.467  -5.533  11.674
   10   2HE   MET   1          2HE       MET   1 -11.997  -6.199  12.293
   11   3HE   MET   1          3HE       MET   1 -10.533  -7.209  12.279
   12    HA   PRO   2           HA       PRO   2  -7.999 -10.866   4.326
   13   1HB   PRO   2          2HB       PRO   2 -10.068 -10.986   2.633
   14   2HB   PRO   2          3HB       PRO   2 -10.173 -11.711   4.241
   15   1HG   PRO   2          2HG       PRO   2 -11.126  -8.947   3.468
   16   2HG   PRO   2          3HG       PRO   2 -12.099 -10.253   4.199
   17   1HD   PRO   2          2HD       PRO   2 -10.938  -8.349   5.707
   18   2HD   PRO   2          3HD       PRO   2 -10.984 -10.047   6.277
   19    H    LYS   3           H        LYS   3  -9.102  -9.658   1.547
   20    HA   LYS   3           HA       LYS   3  -6.590  -8.225   1.361
   21   1HB   LYS   3          2HB       LYS   3  -7.683  -9.922  -0.284
   22   2HB   LYS   3          3HB       LYS   3  -8.694  -8.558  -0.764
   23   1HG   LYS   3          2HG       LYS   3  -6.420  -7.318  -1.224
   24   2HG   LYS   3          3HG       LYS   3  -5.704  -8.930  -1.057
   25   1HD   LYS   3          2HD       LYS   3  -6.134  -8.833  -3.375
   26   2HD   LYS   3          3HD       LYS   3  -7.572  -9.676  -2.765
   27   1HE   LYS   3          2HE       LYS   3  -8.676  -7.307  -2.618
   28   2HE   LYS   3          3HE       LYS   3  -7.267  -6.740  -3.523
   29   1HZ   LYS   3          1HZ       LYS   3  -7.934  -8.280  -5.291
   30   2HZ   LYS   3          2HZ       LYS   3  -9.272  -8.699  -4.430
   31   3HZ   LYS   3          3HZ       LYS   3  -9.066  -7.144  -4.941
   32    H    HIS   4           H        HIS   4  -6.350  -6.017   1.041
   33    HA   HIS   4           HA       HIS   4  -8.756  -4.252   0.857
   34   1HB   HIS   4          2HB       HIS   4  -6.218  -3.766   2.486
   35   2HB   HIS   4          3HB       HIS   4  -7.604  -2.703   2.367
   36    HD1  HIS   4           1HD      HIS   4  -9.601  -5.472   2.665
   37    HD2  HIS   4           2HD      HIS   4  -6.570  -4.012   5.189
   38    HE1  HIS   4           1HE      HIS   4 -10.122  -6.333   4.996
   39    H    GLU   5           H        GLU   5  -8.638  -2.786  -0.813
   40    HA   GLU   5           HA       GLU   5  -6.168  -2.861  -2.495
   41   1HB   GLU   5          2HB       GLU   5  -9.109  -2.369  -3.078
   42   2HB   GLU   5          3HB       GLU   5  -7.830  -2.058  -4.247
   43   1HG   GLU   5          2HG       GLU   5  -7.104  -4.516  -3.721
   44   2HG   GLU   5          3HG       GLU   5  -8.709  -4.687  -2.996
   45    H    PHE   6           H        PHE   6  -5.212  -1.013  -3.283
   46    HA   PHE   6           HA       PHE   6  -6.342   1.609  -2.563
   47   1HB   PHE   6          2HB       PHE   6  -3.435   0.890  -2.054
   48   2HB   PHE   6          3HB       PHE   6  -4.259   2.370  -1.601
   49    HD1  PHE   6           1HD      PHE   6  -4.080  -1.319  -0.929
   50    HD2  PHE   6           2HD      PHE   6  -5.205   2.545   0.666
   51    HE1  PHE   6           1HE      PHE   6  -4.561  -2.347   1.253
   52    HE2  PHE   6           2HE      PHE   6  -5.800   1.461   2.788
   53    HZ   PHE   6           HZ       PHE   6  -5.457  -0.963   3.117
   54    H    SER   7           H        SER   7  -5.875   3.184  -4.113
   55    HA   SER   7           HA       SER   7  -4.320   2.343  -6.528
   56   1HB   SER   7          2HB       SER   7  -6.649   3.083  -6.960
   57   2HB   SER   7          3HB       SER   7  -6.289   4.636  -6.174
   58    HG   SER   7           HG       SER   7  -4.868   3.597  -8.424
   59    H    VAL   8           H        VAL   8  -2.611   3.676  -7.241
   60    HA   VAL   8           HA       VAL   8  -1.466   5.444  -5.135
   61    HB   VAL   8           HB       VAL   8  -0.140   3.374  -6.937
   62   1HG1  VAL   8          1HG1      VAL   8   1.857   3.853  -5.499
   63   2HG1  VAL   8          2HG1      VAL   8   1.372   5.113  -6.638
   64   3HG1  VAL   8          3HG1      VAL   8   1.010   5.303  -4.896
   65   1HG2  VAL   8          1HG2      VAL   8   0.374   2.237  -4.813
   66   2HG2  VAL   8          2HG2      VAL   8  -0.623   3.395  -3.928
   67   3HG2  VAL   8          3HG2      VAL   8  -1.371   2.279  -5.099
   68    H    ASP   9           H        ASP   9  -0.180   7.138  -5.805
   69    HA   ASP   9           HA       ASP   9  -0.495   8.132  -8.614
   70   1HB   ASP   9          2HB       ASP   9  -1.627   9.523  -7.048
   71   2HB   ASP   9          3HB       ASP   9  -0.286   9.447  -5.886
   72    H    MET  10           H        MET  10   1.452   6.435  -8.846
   73    HA   MET  10           HA       MET  10   4.013   7.916  -8.336
   74   1HB   MET  10          2HB       MET  10   3.396   4.956  -8.064
   75   2HB   MET  10          3HB       MET  10   5.000   5.690  -8.027
   76   1HG   MET  10          2HG       MET  10   2.875   6.522  -6.018
   77   2HG   MET  10          3HG       MET  10   3.829   5.073  -5.833
   78   1HE   MET  10          1HE       MET  10   4.833   5.613  -3.581
   79   2HE   MET  10          2HE       MET  10   5.481   7.199  -3.117
   80   3HE   MET  10          3HE       MET  10   3.752   7.026  -3.515
   81    H    THR  11           H        THR  11   5.617   7.679  -9.852
   82    HA   THR  11           HA       THR  11   5.204   5.928 -12.182
   83    HB   THR  11           HB       THR  11   5.813   8.877 -12.618
   84    HG1  THR  11           1HG      THR  11   3.642   9.151 -13.102
   85   1HG2  THR  11          1HG2      THR  11   4.659   6.706 -14.440
   86   2HG2  THR  11          2HG2      THR  11   5.023   8.379 -14.909
   87   3HG2  THR  11          3HG2      THR  11   6.340   7.277 -14.486
   88    H    CYS  12           H        CYS  12   7.062   5.370 -10.158
   89    HA   CYS  12           HA       CYS  12   9.475   5.583 -11.832
   90   1HB   CYS  12          2HB       CYS  12   9.738   7.465 -10.210
   91   2HB   CYS  12          3HB       CYS  12   9.442   6.334  -8.866
   92    HG   CYS  12           HG       CYS  12  11.973   6.807  -8.952
   93    H    GLY  13           H        GLY  13  10.741   3.646 -11.573
   94   1HA   GLY  13          2HA       GLY  13   9.502   1.281 -10.680
   95   2HA   GLY  13          3HA       GLY  13  11.253   1.519 -10.848
   96    H    GLY  14           H        GLY  14  11.702   3.518  -8.964
   97   1HA   GLY  14          2HA       GLY  14  11.929   2.108  -6.522
   98   2HA   GLY  14          3HA       GLY  14  12.188   3.846  -6.760
   99    H    CYS  15           H        CYS  15   9.066   3.559  -7.813
  100    HA   CYS  15           HA       CYS  15   7.864   4.448  -5.402
  101   1HB   CYS  15          2HB       CYS  15   5.891   4.443  -6.400
  102   2HB   CYS  15          3HB       CYS  15   6.988   4.763  -7.758
  103    HG   CYS  15           HG       CYS  15   5.351   2.048  -6.773
  104    H    ALA  16           H        ALA  16   8.449   1.278  -6.932
  105    HA   ALA  16           HA       ALA  16   6.736  -0.237  -5.263
  106   1HB   ALA  16          1HB       ALA  16   7.704  -1.108  -7.387
  107   2HB   ALA  16          2HB       ALA  16   9.324  -1.097  -6.655
  108   3HB   ALA  16          3HB       ALA  16   8.070  -2.185  -6.024
  109    H    GLU  17           H        GLU  17  10.257   0.527  -4.967
  110    HA   GLU  17           HA       GLU  17  10.655  -0.591  -2.411
  111   1HB   GLU  17          2HB       GLU  17  11.844   1.806  -3.861
  112   2HB   GLU  17          3HB       GLU  17  12.391   1.288  -2.273
  113   1HG   GLU  17          2HG       GLU  17  12.157  -0.954  -4.246
  114   2HG   GLU  17          3HG       GLU  17  13.313   0.298  -4.680
  115    H    ALA  18           H        ALA  18   9.371   2.655  -3.334
  116    HA   ALA  18           HA       ALA  18   9.356   3.715  -0.714
  117   1HB   ALA  18          1HB       ALA  18   7.323   4.320  -2.904
  118   2HB   ALA  18          2HB       ALA  18   7.705   5.319  -1.495
  119   3HB   ALA  18          3HB       ALA  18   8.932   5.062  -2.752
  120    H    VAL  19           H        VAL  19   6.671   2.067  -2.442
  121    HA   VAL  19           HA       VAL  19   4.926   2.036  -0.173
  122    HB   VAL  19           HB       VAL  19   4.963   0.248  -2.630
  123   1HG1  VAL  19          1HG1      VAL  19   3.658  -0.778  -0.756
  124   2HG1  VAL  19          2HG1      VAL  19   2.777   0.753  -0.550
  125   3HG1  VAL  19          3HG1      VAL  19   2.599  -0.203  -2.033
  126   1HG2  VAL  19          1HG2      VAL  19   3.339   2.751  -1.973
  127   2HG2  VAL  19          2HG2      VAL  19   4.649   2.664  -3.164
  128   3HG2  VAL  19          3HG2      VAL  19   3.163   1.745  -3.425
  129    H    SER  20           H        SER  20   7.037  -0.544  -1.579
  130    HA   SER  20           HA       SER  20   6.302  -2.531   0.265
  131   1HB   SER  20          2HB       SER  20   8.985  -2.162  -1.163
  132   2HB   SER  20          3HB       SER  20   8.396  -3.665  -0.423
  133    HG   SER  20           HG       SER  20   7.374  -2.257  -2.648
  134    H    ARG  21           H        ARG  21   8.963  -0.116   0.544
  135    HA   ARG  21           HA       ARG  21   9.932  -1.159   3.015
  136   1HB   ARG  21          2HB       ARG  21  10.198   1.595   1.759
  137   2HB   ARG  21          3HB       ARG  21  11.018   1.080   3.243
  138   1HG   ARG  21          2HG       ARG  21  12.080  -0.812   2.021
  139   2HG   ARG  21          3HG       ARG  21  11.337  -0.277   0.520
  140   1HD   ARG  21          2HD       ARG  21  12.489   1.961   0.832
  141   2HD   ARG  21          3HD       ARG  21  13.333   1.236   2.226
  142    HE   ARG  21           HE       ARG  21  13.520  -0.226  -0.355
  143   1HH1  ARG  21          2HH2      ARG  21  15.060   2.206   1.691
  144   2HH1  ARG  21          1HH2      ARG  21  16.619   2.070   0.934
  145   1HH2  ARG  21          2HH1      ARG  21  15.510  -0.257  -1.507
  146   2HH2  ARG  21          1HH1      ARG  21  16.895   0.566  -0.880
  147    H    VAL  22           H        VAL  22   7.613   1.710   2.449
  148    HA   VAL  22           HA       VAL  22   7.350   2.126   5.187
  149    HB   VAL  22           HB       VAL  22   6.801   3.658   3.242
  150   1HG1  VAL  22          1HG1      VAL  22   4.509   3.698   2.428
  151   2HG1  VAL  22          2HG1      VAL  22   5.231   2.130   2.071
  152   3HG1  VAL  22          3HG1      VAL  22   4.115   2.302   3.448
  153   1HG2  VAL  22          1HG2      VAL  22   6.351   4.296   5.493
  154   2HG2  VAL  22          2HG2      VAL  22   4.956   4.772   4.476
  155   3HG2  VAL  22          3HG2      VAL  22   4.838   3.345   5.517
  156    H    LEU  23           H        LEU  23   5.388  -0.019   2.998
  157    HA   LEU  23           HA       LEU  23   3.656  -0.880   5.101
  158   1HB   LEU  23          2HB       LEU  23   4.373  -1.941   2.350
  159   2HB   LEU  23          3HB       LEU  23   3.430  -2.905   3.464
  160    HG   LEU  23           HG       LEU  23   2.003  -1.784   1.902
  161   1HD1  LEU  23          1HD1      LEU  23   0.376  -0.919   3.540
  162   2HD1  LEU  23          2HD1      LEU  23   1.138  -2.417   4.133
  163   3HD1  LEU  23          3HD1      LEU  23   1.606  -0.830   4.784
  164   1HD2  LEU  23          1HD2      LEU  23   3.328   0.340   1.770
  165   2HD2  LEU  23          2HD2      LEU  23   1.579   0.564   1.977
  166   3HD2  LEU  23          3HD2      LEU  23   2.663   0.750   3.375
  167    H    ASN  24           H        ASN  24   6.732  -2.338   3.910
  168    HA   ASN  24           HA       ASN  24   6.774  -4.560   5.657
  169   1HB   ASN  24          2HB       ASN  24   8.462  -4.434   3.979
  170   2HB   ASN  24          3HB       ASN  24   8.891  -2.786   4.419
  171   1HD2  ASN  24          1HD2      ASN  24  10.047  -2.328   6.255
  172   2HD2  ASN  24          2HD2      ASN  24  11.105  -3.545   6.996
  173    H    LYS  25           H        LYS  25   7.777  -1.176   6.152
  174    HA   LYS  25           HA       LYS  25   8.902  -1.440   8.692
  175   1HB   LYS  25          2HB       LYS  25   7.697   0.825   7.100
  176   2HB   LYS  25          3HB       LYS  25   7.871   1.081   8.819
  177   1HG   LYS  25          2HG       LYS  25  10.082   0.331   6.862
  178   2HG   LYS  25          3HG       LYS  25   9.797   1.920   7.558
  179   1HD   LYS  25          2HD       LYS  25  10.908  -0.554   8.961
  180   2HD   LYS  25          3HD       LYS  25  11.652   0.993   8.654
  181   1HE   LYS  25          2HE       LYS  25  11.201   1.312  10.844
  182   2HE   LYS  25          3HE       LYS  25   9.708   1.977  10.181
  183   1HZ   LYS  25          1HZ       LYS  25   9.361   0.470  12.041
  184   2HZ   LYS  25          2HZ       LYS  25   8.648  -0.174  10.723
  185   3HZ   LYS  25          3HZ       LYS  25  10.081  -0.766  11.247
  186    H    LEU  26           H        LEU  26   5.505  -1.256   7.845
  187    HA   LEU  26           HA       LEU  26   4.438  -0.692  10.402
  188   1HB   LEU  26          2HB       LEU  26   3.286  -0.792   8.226
  189   2HB   LEU  26          3HB       LEU  26   3.305  -2.532   8.222
  190    HG   LEU  26           HG       LEU  26   1.213  -1.218   8.850
  191   1HD1  LEU  26          1HD1      LEU  26   2.008  -3.526  10.633
  192   2HD1  LEU  26          2HD1      LEU  26   0.365  -2.925  10.311
  193   3HD1  LEU  26          3HD1      LEU  26   1.316  -3.619   8.991
  194   1HD2  LEU  26          1HD2      LEU  26   2.376  -1.240  11.661
  195   2HD2  LEU  26          2HD2      LEU  26   2.327   0.212  10.639
  196   3HD2  LEU  26          3HD2      LEU  26   0.823  -0.587  11.114
  197    H    GLY  27           H        GLY  27   5.616  -3.720   8.942
  198   1HA   GLY  27          2HA       GLY  27   6.322  -4.927  11.350
  199   2HA   GLY  27          3HA       GLY  27   4.624  -5.382  11.087
  200    H    GLY  28           H        GLY  28   4.090  -6.771   9.377
  201   1HA   GLY  28          2HA       GLY  28   6.109  -7.855   7.544
  202   2HA   GLY  28          3HA       GLY  28   5.564  -8.970   8.818
  203    H    VAL  29           H        VAL  29   3.843  -6.398   7.107
  204    HA   VAL  29           HA       VAL  29   1.433  -7.888   6.752
  205    HB   VAL  29           HB       VAL  29   1.702  -5.396   7.032
  206   1HG1  VAL  29          1HG1      VAL  29   3.691  -5.201   5.407
  207   2HG1  VAL  29          2HG1      VAL  29   2.477  -5.321   4.109
  208   3HG1  VAL  29          3HG1      VAL  29   2.418  -3.987   5.281
  209   1HG2  VAL  29          1HG2      VAL  29  -0.433  -6.048   6.249
  210   2HG2  VAL  29          2HG2      VAL  29   0.110  -4.735   5.200
  211   3HG2  VAL  29          3HG2      VAL  29   0.167  -6.401   4.613
  212    H    LYS  30           H        LYS  30   0.541  -8.832   4.746
  213    HA   LYS  30           HA       LYS  30   2.573  -9.397   2.677
  214   1HB   LYS  30          2HB       LYS  30   0.755 -11.038   3.608
  215   2HB   LYS  30          3HB       LYS  30  -0.307 -10.228   2.450
  216   1HG   LYS  30          2HG       LYS  30   2.383 -11.524   1.820
  217   2HG   LYS  30          3HG       LYS  30   0.823 -12.317   1.606
  218   1HD   LYS  30          2HD       LYS  30   0.169 -10.922  -0.192
  219   2HD   LYS  30          3HD       LYS  30   1.358  -9.689   0.185
  220   1HE   LYS  30          2HE       LYS  30   3.210 -11.242  -0.374
  221   2HE   LYS  30          3HE       LYS  30   1.993 -12.400  -0.973
  222   1HZ   LYS  30          1HZ       LYS  30   2.439  -9.633  -1.953
  223   2HZ   LYS  30          2HZ       LYS  30   2.777 -10.984  -2.807
  224   3HZ   LYS  30          3HZ       LYS  30   1.243 -10.566  -2.473
  225    H    TYR  31           H        TYR  31   2.888  -7.821   1.281
  226    HA   TYR  31           HA       TYR  31   0.637  -6.105   0.307
  227   1HB   TYR  31          2HB       TYR  31   2.479  -4.580  -0.455
  228   2HB   TYR  31          3HB       TYR  31   2.224  -4.697   1.277
  229    HD1  TYR  31           HD1      TYR  31   4.096  -4.905   2.670
  230    HD2  TYR  31           HD2      TYR  31   4.422  -6.249  -1.414
  231    HE1  TYR  31           HE1      TYR  31   6.525  -5.160   2.945
  232    HE2  TYR  31           HE2      TYR  31   6.847  -6.493  -1.137
  233    HH   TYR  31           HH       TYR  31   8.639  -6.326   0.308
  234    H    ASP  32           H        ASP  32   0.383  -5.829  -1.952
  235    HA   ASP  32           HA       ASP  32   2.386  -6.990  -3.771
  236   1HB   ASP  32          2HB       ASP  32  -0.651  -7.330  -3.820
  237   2HB   ASP  32          3HB       ASP  32   0.326  -7.369  -5.289
  238    H    ILE  33           H        ILE  33   2.793  -5.568  -5.449
  239    HA   ILE  33           HA       ILE  33   1.448  -2.901  -5.393
  240    HB   ILE  33           HB       ILE  33   4.441  -3.395  -5.542
  241   1HG1  ILE  33          2HG1      ILE  33   4.101  -1.877  -3.330
  242   2HG1  ILE  33          3HG1      ILE  33   2.607  -2.797  -3.222
  243   1HG2  ILE  33          1HG2      ILE  33   4.603  -0.959  -5.322
  244   2HG2  ILE  33          2HG2      ILE  33   3.732  -1.393  -6.797
  245   3HG2  ILE  33          3HG2      ILE  33   2.843  -0.800  -5.379
  246   1HD1  ILE  33          1HD1      ILE  33   4.518  -3.778  -1.975
  247   2HD1  ILE  33          2HD1      ILE  33   3.910  -4.900  -3.208
  248   3HD1  ILE  33          3HD1      ILE  33   5.402  -3.985  -3.499
  249    H    ASP  34           H        ASP  34   0.392  -2.940  -7.278
  250    HA   ASP  34           HA       ASP  34   1.518  -4.131  -9.727
  251   1HB   ASP  34          2HB       ASP  34  -0.875  -4.386  -9.255
  252   2HB   ASP  34          3HB       ASP  34  -1.064  -2.625  -9.217
  253    H    LEU  35           H        LEU  35   3.141  -2.976 -10.469
  254    HA   LEU  35           HA       LEU  35   3.443  -0.136 -10.194
  255   1HB   LEU  35          2HB       LEU  35   5.337  -1.665 -10.173
  256   2HB   LEU  35          3HB       LEU  35   4.959  -2.228 -11.796
  257    HG   LEU  35           HG       LEU  35   5.447   0.077 -12.682
  258   1HD1  LEU  35          1HD1      LEU  35   6.425   0.555  -9.830
  259   2HD1  LEU  35          2HD1      LEU  35   6.730   1.625 -11.208
  260   3HD1  LEU  35          3HD1      LEU  35   5.076   1.411 -10.621
  261   1HD2  LEU  35          1HD2      LEU  35   7.140  -1.723 -12.706
  262   2HD2  LEU  35          2HD2      LEU  35   7.890  -0.138 -12.446
  263   3HD2  LEU  35          3HD2      LEU  35   7.676  -1.250 -11.078
  264    HA   PRO  36           HA       PRO  36   2.626  -0.006 -14.941
  265   1HB   PRO  36          2HB       PRO  36   0.817  -1.854 -16.000
  266   2HB   PRO  36          3HB       PRO  36   2.594  -1.928 -16.132
  267   1HG   PRO  36          2HG       PRO  36   0.817  -3.326 -14.142
  268   2HG   PRO  36          3HG       PRO  36   2.202  -3.998 -15.043
  269   1HD   PRO  36          2HD       PRO  36   2.474  -3.245 -12.509
  270   2HD   PRO  36          3HD       PRO  36   3.765  -2.846 -13.674
  271    H    ASN  37           H        ASN  37  -0.066  -1.398 -12.954
  272    HA   ASN  37           HA       ASN  37  -1.932   0.633 -14.031
  273   1HB   ASN  37          2HB       ASN  37  -2.429  -1.637 -12.082
  274   2HB   ASN  37          3HB       ASN  37  -3.637  -0.613 -12.829
  275   1HD2  ASN  37          1HD2      ASN  37  -2.022  -3.582 -13.153
  276   2HD2  ASN  37          2HD2      ASN  37  -2.381  -3.858 -14.859
  277    H    LYS  38           H        LYS  38   0.201   0.383 -11.336
  278    HA   LYS  38           HA       LYS  38   0.500   1.635  -9.492
  279   1HB   LYS  38          2HB       LYS  38  -1.333   3.716 -10.770
  280   2HB   LYS  38          3HB       LYS  38  -0.298   3.895  -9.354
  281   1HG   LYS  38          2HG       LYS  38   0.979   4.874 -10.949
  282   2HG   LYS  38          3HG       LYS  38   1.682   3.248 -10.859
  283   1HD   LYS  38          2HD       LYS  38   0.204   2.666 -12.857
  284   2HD   LYS  38          3HD       LYS  38  -0.263   4.369 -12.943
  285   1HE   LYS  38          2HE       LYS  38   2.092   4.984 -13.387
  286   2HE   LYS  38          3HE       LYS  38   2.609   3.317 -13.074
  287   1HZ   LYS  38          1HZ       LYS  38   2.453   3.632 -15.403
  288   2HZ   LYS  38          2HZ       LYS  38   1.249   2.606 -14.929
  289   3HZ   LYS  38          3HZ       LYS  38   0.892   4.163 -15.304
  290    H    LYS  39           H        LYS  39  -0.872  -0.364  -8.948
  291    HA   LYS  39           HA       LYS  39  -2.917   0.612  -7.024
  292   1HB   LYS  39          2HB       LYS  39  -3.170  -1.910  -8.724
  293   2HB   LYS  39          3HB       LYS  39  -4.033  -1.607  -7.213
  294   1HG   LYS  39          2HG       LYS  39  -4.986   0.501  -8.238
  295   2HG   LYS  39          3HG       LYS  39  -4.213   0.047  -9.761
  296   1HD   LYS  39          2HD       LYS  39  -6.532  -0.628  -9.828
  297   2HD   LYS  39          3HD       LYS  39  -5.520  -2.083  -9.776
  298   1HE   LYS  39          2HE       LYS  39  -6.021  -2.392  -7.367
  299   2HE   LYS  39          3HE       LYS  39  -6.873  -0.843  -7.312
  300   1HZ   LYS  39          1HZ       LYS  39  -8.555  -1.816  -8.723
  301   2HZ   LYS  39          2HZ       LYS  39  -7.698  -3.234  -8.825
  302   3HZ   LYS  39          3HZ       LYS  39  -8.289  -2.746  -7.393
  303    H    VAL  40           H        VAL  40  -2.933  -0.604  -5.036
  304    HA   VAL  40           HA       VAL  40  -0.696  -2.440  -4.592
  305    HB   VAL  40           HB       VAL  40  -1.567   0.148  -3.272
  306   1HG1  VAL  40          1HG1      VAL  40  -0.326  -0.485  -1.234
  307   2HG1  VAL  40          2HG1      VAL  40  -1.852  -1.350  -1.508
  308   3HG1  VAL  40          3HG1      VAL  40  -0.296  -2.176  -1.820
  309   1HG2  VAL  40          1HG2      VAL  40   0.404   0.006  -4.825
  310   2HG2  VAL  40          2HG2      VAL  40   0.801   0.577  -3.189
  311   3HG2  VAL  40          3HG2      VAL  40   1.168  -1.098  -3.671
  312    H    CYS  41           H        CYS  41  -1.396  -4.173  -3.341
  313    HA   CYS  41           HA       CYS  41  -4.163  -4.109  -2.264
  314   1HB   CYS  41          2HB       CYS  41  -3.144  -6.434  -3.955
  315   2HB   CYS  41          3HB       CYS  41  -4.721  -6.255  -3.144
  316    HG   CYS  41           HG       CYS  41  -5.261  -3.955  -4.451
  317    H    ILE  42           H        ILE  42  -4.244  -5.100  -0.267
  318    HA   ILE  42           HA       ILE  42  -1.702  -6.319   0.713
  319    HB   ILE  42           HB       ILE  42  -3.251  -4.081   2.061
  320   1HG1  ILE  42          2HG1      ILE  42  -0.772  -3.957   0.290
  321   2HG1  ILE  42          3HG1      ILE  42  -2.315  -3.110   0.064
  322   1HG2  ILE  42          1HG2      ILE  42  -1.918  -5.595   3.569
  323   2HG2  ILE  42          2HG2      ILE  42  -0.468  -5.167   2.631
  324   3HG2  ILE  42          3HG2      ILE  42  -1.344  -3.942   3.563
  325   1HD1  ILE  42          1HD1      ILE  42  -1.846  -1.800   2.149
  326   2HD1  ILE  42          2HD1      ILE  42  -0.246  -2.594   2.182
  327   3HD1  ILE  42          3HD1      ILE  42  -0.679  -1.537   0.844
  328    H    GLU  43           H        GLU  43  -1.936  -7.775   2.402
  329    HA   GLU  43           HA       GLU  43  -4.637  -8.247   3.533
  330   1HB   GLU  43          2HB       GLU  43  -4.321  -9.751   1.595
  331   2HB   GLU  43          3HB       GLU  43  -2.851 -10.411   2.331
  332   1HG   GLU  43          2HG       GLU  43  -5.562 -10.487   3.728
  333   2HG   GLU  43          3HG       GLU  43  -5.036 -11.739   2.595
  334    H    SER  44           H        SER  44  -4.386  -8.168   5.691
  335    HA   SER  44           HA       SER  44  -2.746  -9.979   6.937
  336   1HB   SER  44          2HB       SER  44  -0.967  -8.208   6.711
  337   2HB   SER  44          3HB       SER  44  -1.966  -7.171   7.731
  338    HG   SER  44           HG       SER  44  -0.818  -9.691   8.390
  339    H    GLU  45           H        GLU  45  -3.219  -9.984   9.330
  340    HA   GLU  45           HA       GLU  45  -6.054  -9.505   9.657
  341   1HB   GLU  45          2HB       GLU  45  -5.697 -10.778  11.825
  342   2HB   GLU  45          3HB       GLU  45  -5.579 -11.613  10.275
  343   1HG   GLU  45          2HG       GLU  45  -3.236 -11.641  10.296
  344   2HG   GLU  45          3HG       GLU  45  -3.159 -10.465  11.637
  345    H    HIS  46           H        HIS  46  -5.098  -7.052   9.505
  346    HA   HIS  46           HA       HIS  46  -5.789  -6.010  12.209
  347   1HB   HIS  46          2HB       HIS  46  -4.202  -4.107  11.906
  348   2HB   HIS  46          3HB       HIS  46  -3.405  -5.667  12.095
  349    HD1  HIS  46           1HD      HIS  46  -4.760  -4.207   8.742
  350    HD2  HIS  46           2HD      HIS  46  -1.221  -5.389  10.716
  351    HE1  HIS  46           1HE      HIS  46  -2.992  -4.464   6.979
  352    H    SER  47           H        SER  47  -6.108  -3.354  11.601
  353    HA   SER  47           HA       SER  47  -8.493  -3.457   9.940
  354   1HB   SER  47          2HB       SER  47  -8.387  -2.047  11.943
  355   2HB   SER  47          3HB       SER  47  -7.068  -1.102  11.232
  356    HG   SER  47           HG       SER  47  -9.194  -0.167  10.965
  357    H    MET  48           H        MET  48  -8.738  -1.523   8.479
  358    HA   MET  48           HA       MET  48  -6.803  -1.425   6.238
  359   1HB   MET  48          2HB       MET  48  -9.333   0.190   6.828
  360   2HB   MET  48          3HB       MET  48  -8.411   0.207   5.317
  361   1HG   MET  48          2HG       MET  48  -8.977  -2.134   4.915
  362   2HG   MET  48          3HG       MET  48  -9.812  -2.234   6.478
  363   1HE   MET  48          1HE       MET  48 -11.900  -3.282   5.363
  364   2HE   MET  48          2HE       MET  48 -12.766  -2.547   3.994
  365   3HE   MET  48          3HE       MET  48 -11.123  -3.192   3.761
  366    H    ASP  49           H        ASP  49  -8.083   0.418   8.975
  367    HA   ASP  49           HA       ASP  49  -6.987   2.940   8.675
  368   1HB   ASP  49          2HB       ASP  49  -8.495   2.496  10.494
  369   2HB   ASP  49          3HB       ASP  49  -7.408   1.273  11.185
  370    H    THR  50           H        THR  50  -5.524   0.262  10.366
  371    HA   THR  50           HA       THR  50  -3.046   1.105  11.059
  372    HB   THR  50           HB       THR  50  -3.599  -1.586   9.718
  373    HG1  THR  50           1HG      THR  50  -4.398  -0.632  12.261
  374   1HG2  THR  50          1HG2      THR  50  -1.891  -0.786  12.121
  375   2HG2  THR  50          2HG2      THR  50  -2.148  -2.443  11.535
  376   3HG2  THR  50          3HG2      THR  50  -1.306  -1.264  10.511
  377    H    LEU  51           H        LEU  51  -4.000  -0.047   7.791
  378    HA   LEU  51           HA       LEU  51  -1.303   0.192   6.705
  379   1HB   LEU  51          2HB       LEU  51  -3.998  -0.130   5.304
  380   2HB   LEU  51          3HB       LEU  51  -2.402  -0.261   4.557
  381    HG   LEU  51           HG       LEU  51  -3.461  -2.054   6.816
  382   1HD1  LEU  51          1HD1      LEU  51  -3.241  -2.467   3.822
  383   2HD1  LEU  51          2HD1      LEU  51  -3.535  -3.782   4.974
  384   3HD1  LEU  51          3HD1      LEU  51  -4.703  -2.468   4.824
  385   1HD2  LEU  51          1HD2      LEU  51  -0.853  -1.924   5.275
  386   2HD2  LEU  51          2HD2      LEU  51  -1.079  -1.996   7.037
  387   3HD2  LEU  51          3HD2      LEU  51  -1.379  -3.414   6.039
  388    H    LEU  52           H        LEU  52  -4.377   2.021   6.443
  389    HA   LEU  52           HA       LEU  52  -3.442   3.996   4.662
  390   1HB   LEU  52          2HB       LEU  52  -5.565   3.887   6.795
  391   2HB   LEU  52          3HB       LEU  52  -5.278   5.395   5.926
  392    HG   LEU  52           HG       LEU  52  -5.609   2.791   4.440
  393   1HD1  LEU  52          1HD1      LEU  52  -7.532   2.847   5.928
  394   2HD1  LEU  52          2HD1      LEU  52  -7.930   4.496   5.393
  395   3HD1  LEU  52          3HD1      LEU  52  -8.023   3.129   4.254
  396   1HD2  LEU  52          1HD2      LEU  52  -6.330   5.679   3.741
  397   2HD2  LEU  52          2HD2      LEU  52  -4.888   4.819   3.166
  398   3HD2  LEU  52          3HD2      LEU  52  -6.490   4.286   2.662
  399    H    ALA  53           H        ALA  53  -3.484   4.096   8.243
  400    HA   ALA  53           HA       ALA  53  -2.066   6.502   8.592
  401   1HB   ALA  53          1HB       ALA  53  -2.089   3.999  10.347
  402   2HB   ALA  53          2HB       ALA  53  -1.608   5.629  10.866
  403   3HB   ALA  53          3HB       ALA  53  -3.290   5.305  10.399
  404    H    THR  54           H        THR  54  -0.733   3.177   8.332
  405    HA   THR  54           HA       THR  54   1.994   3.931   8.511
  406    HB   THR  54           HB       THR  54   0.656   1.723   6.876
  407    HG1  THR  54           1HG      THR  54   0.278   1.480   9.022
  408   1HG2  THR  54          1HG2      THR  54   3.566   1.907   7.701
  409   2HG2  THR  54          2HG2      THR  54   2.746   0.625   6.773
  410   3HG2  THR  54          3HG2      THR  54   2.964   2.194   6.049
  411    H    LEU  55           H        LEU  55   0.153   3.387   5.457
  412    HA   LEU  55           HA       LEU  55   2.401   4.074   3.898
  413   1HB   LEU  55          2HB       LEU  55   0.996   3.643   2.037
  414   2HB   LEU  55          3HB       LEU  55   0.682   2.485   3.297
  415    HG   LEU  55           HG       LEU  55  -1.288   4.057   3.954
  416   1HD1  LEU  55          1HD1      LEU  55  -0.161   5.477   1.860
  417   2HD1  LEU  55          2HD1      LEU  55  -1.571   4.707   1.130
  418   3HD1  LEU  55          3HD1      LEU  55  -1.775   5.748   2.566
  419   1HD2  LEU  55          1HD2      LEU  55  -1.284   2.333   1.443
  420   2HD2  LEU  55          2HD2      LEU  55  -1.527   1.759   3.104
  421   3HD2  LEU  55          3HD2      LEU  55  -2.736   2.821   2.353
  422    H    LYS  56           H        LYS  56  -0.434   5.934   4.831
  423    HA   LYS  56           HA       LYS  56  -0.329   8.298   3.484
  424   1HB   LYS  56          2HB       LYS  56  -0.743   7.600   6.385
  425   2HB   LYS  56          3HB       LYS  56  -0.590   9.293   6.018
  426   1HG   LYS  56          2HG       LYS  56  -2.384   9.246   4.400
  427   2HG   LYS  56          3HG       LYS  56  -2.582   7.490   4.600
  428   1HD   LYS  56          2HD       LYS  56  -3.008   7.809   7.017
  429   2HD   LYS  56          3HD       LYS  56  -2.859   9.552   6.852
  430   1HE   LYS  56          2HE       LYS  56  -4.974   7.770   5.512
  431   2HE   LYS  56          3HE       LYS  56  -5.240   8.767   6.947
  432   1HZ   LYS  56          1HZ       LYS  56  -4.573   9.774   4.259
  433   2HZ   LYS  56          2HZ       LYS  56  -6.039   9.853   4.993
  434   3HZ   LYS  56          3HZ       LYS  56  -4.775  10.712   5.598
  435    H    LYS  57           H        LYS  57   2.083   7.287   5.904
  436    HA   LYS  57           HA       LYS  57   3.304   9.841   6.207
  437   1HB   LYS  57          2HB       LYS  57   4.201   7.014   6.743
  438   2HB   LYS  57          3HB       LYS  57   5.167   8.439   7.207
  439   1HG   LYS  57          2HG       LYS  57   3.165   9.256   8.498
  440   2HG   LYS  57          3HG       LYS  57   2.319   7.769   8.091
  441   1HD   LYS  57          2HD       LYS  57   4.998   7.778   9.546
  442   2HD   LYS  57          3HD       LYS  57   3.449   7.956  10.395
  443   1HE   LYS  57          2HE       LYS  57   2.625   5.850   9.427
  444   2HE   LYS  57          3HE       LYS  57   4.169   5.590   8.593
  445   1HZ   LYS  57          1HZ       LYS  57   4.018   4.355  10.627
  446   2HZ   LYS  57          2HZ       LYS  57   5.212   5.479  10.765
  447   3HZ   LYS  57          3HZ       LYS  57   3.759   5.715  11.511
  448    H    THR  58           H        THR  58   3.499   7.747   3.407
  449    HA   THR  58           HA       THR  58   6.104   8.695   2.542
  450    HB   THR  58           HB       THR  58   5.334   8.000   0.294
  451    HG1  THR  58           1HG      THR  58   3.078   8.434   0.607
  452   1HG2  THR  58          1HG2      THR  58   6.358   6.400   1.875
  453   2HG2  THR  58          2HG2      THR  58   4.739   6.018   2.508
  454   3HG2  THR  58          3HG2      THR  58   5.152   5.614   0.825
  455    H    GLY  59           H        GLY  59   2.959  10.179   2.813
  456   1HA   GLY  59          2HA       GLY  59   2.262  12.267   2.316
  457   2HA   GLY  59          3HA       GLY  59   3.947  12.692   1.932
  458    H    LYS  60           H        LYS  60   1.849  10.223   0.412
  459    HA   LYS  60           HA       LYS  60   1.809  11.695  -2.162
  460   1HB   LYS  60          2HB       LYS  60   2.812   8.948  -1.418
  461   2HB   LYS  60          3HB       LYS  60   2.108   9.155  -2.993
  462   1HG   LYS  60          2HG       LYS  60   4.361  10.896  -1.825
  463   2HG   LYS  60          3HG       LYS  60   4.594   9.490  -2.830
  464   1HD   LYS  60          2HD       LYS  60   3.318  12.166  -3.633
  465   2HD   LYS  60          3HD       LYS  60   4.829  11.469  -4.209
  466   1HE   LYS  60          2HE       LYS  60   3.614   9.611  -5.278
  467   2HE   LYS  60          3HE       LYS  60   2.053  10.265  -4.755
  468   1HZ   LYS  60          1HZ       LYS  60   2.741  10.656  -7.006
  469   2HZ   LYS  60          2HZ       LYS  60   2.040  11.858  -6.244
  470   3HZ   LYS  60          3HZ       LYS  60   3.708  11.909  -6.492
  471    H    THR  61           H        THR  61   0.156  11.238  -3.548
  472    HA   THR  61           HA       THR  61  -2.307  11.145  -2.292
  473    HB   THR  61           HB       THR  61  -2.077  10.942  -5.266
  474    HG1  THR  61           1HG      THR  61  -0.505  12.269  -5.449
  475   1HG2  THR  61          1HG2      THR  61  -3.197  13.113  -3.443
  476   2HG2  THR  61          2HG2      THR  61  -3.404  12.997  -5.202
  477   3HG2  THR  61          3HG2      THR  61  -4.140  11.774  -4.144
  478    H    VAL  62           H        VAL  62  -1.260   8.608  -1.813
  479    HA   VAL  62           HA       VAL  62  -2.640   6.686  -3.570
  480    HB   VAL  62           HB       VAL  62  -0.578   5.831  -2.888
  481   1HG1  VAL  62          1HG1      VAL  62   0.172   7.314  -1.193
  482   2HG1  VAL  62          2HG1      VAL  62  -1.137   6.837  -0.086
  483   3HG1  VAL  62          3HG1      VAL  62   0.174   5.703  -0.497
  484   1HG2  VAL  62          1HG2      VAL  62  -2.380   4.165  -2.582
  485   2HG2  VAL  62          2HG2      VAL  62  -1.045   3.904  -1.458
  486   3HG2  VAL  62          3HG2      VAL  62  -2.551   4.641  -0.889
  487    H    SER  63           H        SER  63  -4.526   5.527  -2.884
  488    HA   SER  63           HA       SER  63  -5.721   6.143  -0.276
  489   1HB   SER  63          2HB       SER  63  -6.814   7.322  -2.859
  490   2HB   SER  63          3HB       SER  63  -7.850   7.040  -1.449
  491    HG   SER  63           HG       SER  63  -5.422   8.394  -1.062
  492    H    TYR  64           H        TYR  64  -7.676   5.001   0.111
  493    HA   TYR  64           HA       TYR  64  -7.410   2.251  -0.732
  494   1HB   TYR  64          2HB       TYR  64  -7.658   2.754   1.572
  495   2HB   TYR  64          3HB       TYR  64  -9.066   3.777   1.291
  496    HD1  TYR  64           HD1      TYR  64  -7.849   0.243   1.152
  497    HD2  TYR  64           HD2      TYR  64 -11.273   2.864   1.265
  498    HE1  TYR  64           HE1      TYR  64  -9.338  -1.702   1.403
  499    HE2  TYR  64           HE2      TYR  64 -12.763   0.894   1.487
  500    HH   TYR  64           HH       TYR  64 -11.461  -2.381   1.128
  501    H    LEU  65           H        LEU  65  -8.787   1.051  -2.087
  502    HA   LEU  65           HA       LEU  65 -11.555   1.755  -2.311
  503   1HB   LEU  65          2HB       LEU  65 -11.618   1.796  -4.738
  504   2HB   LEU  65          3HB       LEU  65 -10.883   3.199  -3.975
  505    HG   LEU  65           HG       LEU  65  -9.482   3.053  -5.656
  506   1HD1  LEU  65          1HD1      LEU  65  -7.464   1.746  -5.364
  507   2HD1  LEU  65          2HD1      LEU  65  -7.936   2.669  -3.908
  508   3HD1  LEU  65          3HD1      LEU  65  -8.180   0.890  -4.012
  509   1HD2  LEU  65          1HD2      LEU  65  -9.046   1.331  -7.124
  510   2HD2  LEU  65          2HD2      LEU  65  -9.264   0.085  -5.898
  511   3HD2  LEU  65          3HD2      LEU  65 -10.695   0.904  -6.599
  512    H    GLY  66           H        GLY  66 -11.507  -0.401  -1.147
  513   1HA   GLY  66          2HA       GLY  66 -13.005  -2.105  -2.324
  514   2HA   GLY  66          3HA       GLY  66 -11.558  -2.617  -3.194
  515    H    LEU  67           H        LEU  67 -13.237  -4.235  -1.386
  516    HA   LEU  67           HA       LEU  67 -11.262  -5.085   0.616
  517   1HB   LEU  67          2HB       LEU  67 -12.827  -3.943   1.974
  518   2HB   LEU  67          3HB       LEU  67 -14.154  -4.238   0.848
  519    HG   LEU  67           HG       LEU  67 -14.205  -6.586   1.467
  520   1HD1  LEU  67          1HD1      LEU  67 -12.253  -5.750   3.687
  521   2HD1  LEU  67          2HD1      LEU  67 -13.050  -7.332   3.556
  522   3HD1  LEU  67          3HD1      LEU  67 -11.850  -6.846   2.352
  523   1HD2  LEU  67          1HD2      LEU  67 -15.712  -4.965   2.520
  524   2HD2  LEU  67          2HD2      LEU  67 -15.267  -6.230   3.677
  525   3HD2  LEU  67          3HD2      LEU  67 -14.508  -4.626   3.782
  526    H    GLU  68           H        GLU  68 -10.988  -7.329   0.326
  527    HA   GLU  68           HA       GLU  68 -13.207  -8.899  -0.784
  528   1HB   GLU  68          2HB       GLU  68 -11.672  -8.165  -2.701
  529   2HB   GLU  68          3HB       GLU  68 -10.410  -9.152  -1.952
  530   1HG   GLU  68          2HG       GLU  68 -11.809 -11.159  -2.209
  531   2HG   GLU  68          3HG       GLU  68 -13.114 -10.174  -2.898
  Start of MODEL   21
    1   1H    MET   1           H1       MET   1  -6.731 -10.222   7.056
    2   2H    MET   1           H2       MET   1  -6.383 -11.630   7.864
    3   3H    MET   1           H3       MET   1  -5.995 -11.420   6.286
    4    HA   MET   1           HA       MET   1  -7.715 -12.922   6.388
    5   1HB   MET   1          2HB       MET   1  -9.127 -10.865   8.073
    6   2HB   MET   1          3HB       MET   1 -10.032 -12.060   7.106
    7   1HG   MET   1          2HG       MET   1  -8.882 -13.888   8.245
    8   2HG   MET   1          3HG       MET   1  -7.919 -12.730   9.165
    9   1HE   MET   1          1HE       MET   1 -10.152 -14.199  11.957
   10   2HE   MET   1          2HE       MET   1  -9.375 -15.041  10.594
   11   3HE   MET   1          3HE       MET   1  -8.499 -13.762  11.469
   12    HA   PRO   2           HA       PRO   2  -9.669 -10.511   2.947
   13   1HB   PRO   2          2HB       PRO   2 -10.529  -7.973   3.078
   14   2HB   PRO   2          3HB       PRO   2 -11.482  -9.279   3.848
   15   1HG   PRO   2          2HG       PRO   2  -9.485  -7.410   5.172
   16   2HG   PRO   2          3HG       PRO   2 -11.148  -7.775   5.712
   17   1HD   PRO   2          2HD       PRO   2  -8.951  -9.058   6.717
   18   2HD   PRO   2          3HD       PRO   2 -10.527  -9.892   6.485
   19    H    LYS   3           H        LYS   3  -8.867  -8.964   1.239
   20    HA   LYS   3           HA       LYS   3  -6.379  -7.558   2.077
   21   1HB   LYS   3          2HB       LYS   3  -5.429  -7.797   0.008
   22   2HB   LYS   3          3HB       LYS   3  -6.283  -9.338   0.220
   23   1HG   LYS   3          2HG       LYS   3  -8.259  -8.009  -0.859
   24   2HG   LYS   3          3HG       LYS   3  -7.017  -6.903  -1.417
   25   1HD   LYS   3          2HD       LYS   3  -6.133  -8.435  -2.938
   26   2HD   LYS   3          3HD       LYS   3  -6.592  -9.852  -1.981
   27   1HE   LYS   3          2HE       LYS   3  -8.613  -8.055  -3.402
   28   2HE   LYS   3          3HE       LYS   3  -7.929  -9.508  -4.132
   29   1HZ   LYS   3          1HZ       LYS   3  -8.897 -10.818  -2.367
   30   2HZ   LYS   3          2HZ       LYS   3  -9.498  -9.504  -1.601
   31   3HZ   LYS   3          3HZ       LYS   3 -10.049  -9.917  -3.091
   32    H    HIS   4           H        HIS   4  -6.037  -5.456   1.313
   33    HA   HIS   4           HA       HIS   4  -8.542  -3.841   1.033
   34   1HB   HIS   4          2HB       HIS   4  -5.908  -2.999   2.286
   35   2HB   HIS   4          3HB       HIS   4  -7.500  -2.251   2.461
   36    HD1  HIS   4           1HD      HIS   4  -5.443  -5.276   3.658
   37    HD2  HIS   4           2HD      HIS   4  -9.222  -3.528   4.202
   38    HE1  HIS   4           1HE      HIS   4  -6.476  -6.396   5.712
   39    H    GLU   5           H        GLU   5  -8.553  -2.466  -0.816
   40    HA   GLU   5           HA       GLU   5  -6.104  -2.642  -2.518
   41   1HB   GLU   5          2HB       GLU   5  -9.043  -2.473  -3.253
   42   2HB   GLU   5          3HB       GLU   5  -7.691  -2.302  -4.376
   43   1HG   GLU   5          2HG       GLU   5  -6.883  -4.582  -3.359
   44   2HG   GLU   5          3HG       GLU   5  -8.537  -4.737  -2.756
   45    H    PHE   6           H        PHE   6  -5.152  -0.898  -3.266
   46    HA   PHE   6           HA       PHE   6  -6.370   1.772  -2.821
   47   1HB   PHE   6          2HB       PHE   6  -3.446   1.045  -2.358
   48   2HB   PHE   6          3HB       PHE   6  -4.230   2.536  -1.879
   49    HD1  PHE   6           1HD      PHE   6  -6.622   1.360  -0.389
   50    HD2  PHE   6           2HD      PHE   6  -2.431   0.446  -0.293
   51    HE1  PHE   6           1HE      PHE   6  -6.897   0.408   1.879
   52    HE2  PHE   6           2HE      PHE   6  -2.702  -0.484   1.983
   53    HZ   PHE   6           HZ       PHE   6  -4.929  -0.538   3.067
   54    H    SER   7           H        SER   7  -5.907   3.249  -4.452
   55    HA   SER   7           HA       SER   7  -4.245   2.287  -6.752
   56   1HB   SER   7          2HB       SER   7  -6.658   3.095  -7.195
   57   2HB   SER   7          3HB       SER   7  -6.037   4.721  -6.839
   58    HG   SER   7           HG       SER   7  -4.440   4.252  -8.525
   59    H    VAL   8           H        VAL   8  -2.425   3.472  -7.288
   60    HA   VAL   8           HA       VAL   8  -1.469   5.453  -5.285
   61    HB   VAL   8           HB       VAL   8  -0.066   3.145  -6.744
   62   1HG1  VAL   8          1HG1      VAL   8   1.789   3.625  -5.110
   63   2HG1  VAL   8          2HG1      VAL   8   1.526   4.949  -6.240
   64   3HG1  VAL   8          3HG1      VAL   8   0.912   5.076  -4.577
   65   1HG2  VAL   8          1HG2      VAL   8  -0.968   3.444  -3.831
   66   2HG2  VAL   8          2HG2      VAL   8  -1.548   2.233  -4.995
   67   3HG2  VAL   8          3HG2      VAL   8   0.116   2.183  -4.410
   68    H    ASP   9           H        ASP   9   0.038   7.021  -6.123
   69    HA   ASP   9           HA       ASP   9   0.217   7.258  -9.108
   70   1HB   ASP   9          2HB       ASP   9  -0.406   9.381  -8.202
   71   2HB   ASP   9          3HB       ASP   9   0.814   9.263  -6.913
   72    H    MET  10           H        MET  10   1.615   5.439  -9.316
   73    HA   MET  10           HA       MET  10   4.204   5.507  -7.884
   74   1HB   MET  10          2HB       MET  10   3.288   3.659 -10.108
   75   2HB   MET  10          3HB       MET  10   4.786   3.548  -9.179
   76   1HG   MET  10          2HG       MET  10   3.425   3.309  -7.082
   77   2HG   MET  10          3HG       MET  10   1.964   3.290  -8.087
   78   1HE   MET  10          1HE       MET  10   2.003  -0.397  -7.002
   79   2HE   MET  10          2HE       MET  10   2.380   1.034  -6.005
   80   3HE   MET  10          3HE       MET  10   1.039   1.077  -7.179
   81    H    THR  11           H        THR  11   4.793   7.658  -8.529
   82    HA   THR  11           HA       THR  11   4.824   8.472 -11.230
   83    HB   THR  11           HB       THR  11   6.705   9.773  -9.299
   84    HG1  THR  11           1HG      THR  11   3.919   9.804  -8.784
   85   1HG2  THR  11          1HG2      THR  11   5.980  10.854 -11.421
   86   2HG2  THR  11          2HG2      THR  11   4.295  10.816 -10.854
   87   3HG2  THR  11          3HG2      THR  11   5.502  11.797  -9.994
   88    H    CYS  12           H        CYS  12   7.131   6.639  -9.315
   89    HA   CYS  12           HA       CYS  12   8.846   6.266 -11.648
   90   1HB   CYS  12          2HB       CYS  12   9.962   8.183 -10.469
   91   2HB   CYS  12          3HB       CYS  12   9.936   7.246  -8.957
   92    HG   CYS  12           HG       CYS  12  11.422   6.597 -11.827
   93    H    GLY  13           H        GLY  13  10.030   4.196 -11.299
   94   1HA   GLY  13          2HA       GLY  13   8.594   2.117 -10.138
   95   2HA   GLY  13          3HA       GLY  13  10.341   2.089 -10.448
   96    H    GLY  14           H        GLY  14  11.217   4.077  -8.693
   97   1HA   GLY  14          2HA       GLY  14  11.542   2.754  -6.276
   98   2HA   GLY  14          3HA       GLY  14  11.811   4.489  -6.515
   99    H    CYS  15           H        CYS  15   8.720   4.584  -7.229
  100    HA   CYS  15           HA       CYS  15   7.681   5.298  -4.657
  101   1HB   CYS  15          2HB       CYS  15   6.266   4.555  -7.208
  102   2HB   CYS  15          3HB       CYS  15   5.479   5.097  -5.709
  103    HG   CYS  15           HG       CYS  15   7.919   6.675  -7.218
  104    H    ALA  16           H        ALA  16   7.637   2.292  -6.628
  105    HA   ALA  16           HA       ALA  16   5.906   0.831  -4.856
  106   1HB   ALA  16          1HB       ALA  16   7.924  -0.141  -6.943
  107   2HB   ALA  16          2HB       ALA  16   6.683  -1.139  -6.180
  108   3HB   ALA  16          3HB       ALA  16   6.202   0.206  -7.236
  109    H    GLU  17           H        GLU  17   9.452   1.096  -5.227
  110    HA   GLU  17           HA       GLU  17  10.179  -0.700  -3.163
  111   1HB   GLU  17          2HB       GLU  17  11.567   1.902  -3.947
  112   2HB   GLU  17          3HB       GLU  17  12.251   0.579  -3.009
  113   1HG   GLU  17          2HG       GLU  17  12.027  -0.959  -4.908
  114   2HG   GLU  17          3HG       GLU  17  11.317   0.334  -5.888
  115    H    ALA  18           H        ALA  18   9.353   2.801  -3.041
  116    HA   ALA  18           HA       ALA  18   9.894   3.174  -0.280
  117   1HB   ALA  18          1HB       ALA  18   8.508   5.171  -0.432
  118   2HB   ALA  18          2HB       ALA  18   9.521   5.033  -1.888
  119   3HB   ALA  18          3HB       ALA  18   7.790   4.619  -1.950
  120    H    VAL  19           H        VAL  19   6.812   2.433  -1.945
  121    HA   VAL  19           HA       VAL  19   5.163   2.126   0.300
  122    HB   VAL  19           HB       VAL  19   5.105   0.745  -2.399
  123   1HG1  VAL  19          1HG1      VAL  19   3.862  -0.677  -0.780
  124   2HG1  VAL  19          2HG1      VAL  19   2.966   0.753  -0.223
  125   3HG1  VAL  19          3HG1      VAL  19   2.768   0.154  -1.880
  126   1HG2  VAL  19          1HG2      VAL  19   4.734   3.253  -2.325
  127   2HG2  VAL  19          2HG2      VAL  19   3.312   2.347  -2.862
  128   3HG2  VAL  19          3HG2      VAL  19   3.394   2.979  -1.205
  129    H    SER  20           H        SER  20   7.102  -0.390  -1.412
  130    HA   SER  20           HA       SER  20   6.544  -2.544   0.295
  131   1HB   SER  20          2HB       SER  20   7.763  -2.705  -1.875
  132   2HB   SER  20          3HB       SER  20   9.149  -1.863  -1.183
  133    HG   SER  20           HG       SER  20   9.484  -4.075  -1.206
  134    H    ARG  21           H        ARG  21   9.223  -0.127   0.680
  135    HA   ARG  21           HA       ARG  21  10.211  -1.365   3.028
  136   1HB   ARG  21          2HB       ARG  21  10.407   1.606   2.360
  137   2HB   ARG  21          3HB       ARG  21  11.406   0.670   3.474
  138   1HG   ARG  21          2HG       ARG  21  11.836  -0.795   1.217
  139   2HG   ARG  21          3HG       ARG  21  11.433   0.767   0.495
  140   1HD   ARG  21          2HD       ARG  21  13.721   0.783   0.632
  141   2HD   ARG  21          3HD       ARG  21  13.175   1.852   1.946
  142    HE   ARG  21           HE       ARG  21  13.442  -0.725   3.044
  143   1HH1  ARG  21          2HH2      ARG  21  15.546   1.649   1.516
  144   2HH1  ARG  21          1HH2      ARG  21  17.018   1.074   2.234
  145   1HH2  ARG  21          2HH1      ARG  21  15.382  -1.548   4.021
  146   2HH2  ARG  21          1HH1      ARG  21  16.908  -0.784   3.717
  147    H    VAL  22           H        VAL  22   7.838   1.477   2.810
  148    HA   VAL  22           HA       VAL  22   7.687   1.652   5.595
  149    HB   VAL  22           HB       VAL  22   7.206   3.438   4.011
  150   1HG1  VAL  22          1HG1      VAL  22   5.013   3.619   2.952
  151   2HG1  VAL  22          2HG1      VAL  22   5.870   2.189   2.368
  152   3HG1  VAL  22          3HG1      VAL  22   4.565   2.018   3.561
  153   1HG2  VAL  22          1HG2      VAL  22   6.444   3.502   6.329
  154   2HG2  VAL  22          2HG2      VAL  22   5.328   4.366   5.231
  155   3HG2  VAL  22          3HG2      VAL  22   4.902   2.746   5.831
  156    H    LEU  23           H        LEU  23   5.597  -0.195   3.236
  157    HA   LEU  23           HA       LEU  23   3.860  -1.164   5.223
  158   1HB   LEU  23          2HB       LEU  23   4.597  -2.076   2.438
  159   2HB   LEU  23          3HB       LEU  23   3.634  -3.104   3.478
  160    HG   LEU  23           HG       LEU  23   2.259  -1.816   1.972
  161   1HD1  LEU  23          1HD1      LEU  23   0.585  -1.154   3.678
  162   2HD1  LEU  23          2HD1      LEU  23   1.343  -2.704   4.104
  163   3HD1  LEU  23          3HD1      LEU  23   1.803  -1.204   4.937
  164   1HD2  LEU  23          1HD2      LEU  23   2.943   0.544   3.714
  165   2HD2  LEU  23          2HD2      LEU  23   3.534   0.299   2.050
  166   3HD2  LEU  23          3HD2      LEU  23   1.802   0.508   2.346
  167    H    ASN  24           H        ASN  24   6.915  -2.596   3.988
  168    HA   ASN  24           HA       ASN  24   6.995  -4.883   5.648
  169   1HB   ASN  24          2HB       ASN  24   8.661  -4.642   3.950
  170   2HB   ASN  24          3HB       ASN  24   9.074  -3.024   4.464
  171   1HD2  ASN  24          1HD2      ASN  24  10.170  -2.652   6.398
  172   2HD2  ASN  24          2HD2      ASN  24  11.279  -3.881   7.042
  173    H    LYS  25           H        LYS  25   7.990  -1.510   6.296
  174    HA   LYS  25           HA       LYS  25   9.028  -1.949   8.895
  175   1HB   LYS  25          2HB       LYS  25   8.029   0.448   7.348
  176   2HB   LYS  25          3HB       LYS  25   8.230   0.632   9.068
  177   1HG   LYS  25          2HG       LYS  25  10.381  -0.201   7.073
  178   2HG   LYS  25          3HG       LYS  25  10.208   1.375   7.840
  179   1HD   LYS  25          2HD       LYS  25  11.081  -1.241   9.126
  180   2HD   LYS  25          3HD       LYS  25  11.976   0.266   8.960
  181   1HE   LYS  25          2HE       LYS  25  10.352   1.389  10.521
  182   2HE   LYS  25          3HE       LYS  25   9.510  -0.158  10.737
  183   1HZ   LYS  25          1HZ       LYS  25  11.491  -1.083  11.657
  184   2HZ   LYS  25          2HZ       LYS  25  12.303   0.341  11.484
  185   3HZ   LYS  25          3HZ       LYS  25  11.015   0.239  12.501
  186    H    LEU  26           H        LEU  26   5.698  -1.331   7.845
  187    HA   LEU  26           HA       LEU  26   4.564  -0.902  10.354
  188   1HB   LEU  26          2HB       LEU  26   3.486  -0.970   8.031
  189   2HB   LEU  26          3HB       LEU  26   3.281  -2.685   8.219
  190    HG   LEU  26           HG       LEU  26   1.367  -0.976   8.768
  191   1HD1  LEU  26          1HD1      LEU  26   0.313  -2.583  10.246
  192   2HD1  LEU  26          2HD1      LEU  26   1.155  -3.406   8.919
  193   3HD1  LEU  26          3HD1      LEU  26   1.873  -3.379  10.546
  194   1HD2  LEU  26          1HD2      LEU  26   2.654   0.258  10.580
  195   2HD2  LEU  26          2HD2      LEU  26   1.077  -0.370  11.066
  196   3HD2  LEU  26          3HD2      LEU  26   2.547  -1.212  11.566
  197    H    GLY  27           H        GLY  27   5.395  -3.984   8.766
  198   1HA   GLY  27          2HA       GLY  27   6.437  -5.381  10.679
  199   2HA   GLY  27          3HA       GLY  27   4.774  -5.385  11.295
  200    H    GLY  28           H        GLY  28   3.148  -6.674  10.335
  201   1HA   GLY  28          2HA       GLY  28   4.309  -9.029   8.873
  202   2HA   GLY  28          3HA       GLY  28   3.106  -9.068  10.168
  203    H    VAL  29           H        VAL  29   3.636  -7.493   6.996
  204    HA   VAL  29           HA       VAL  29   0.735  -7.812   6.409
  205    HB   VAL  29           HB       VAL  29   1.638  -5.505   7.237
  206   1HG1  VAL  29          1HG1      VAL  29   2.619  -4.040   5.680
  207   2HG1  VAL  29          2HG1      VAL  29   3.651  -5.481   5.658
  208   3HG1  VAL  29          3HG1      VAL  29   2.447  -5.206   4.361
  209   1HG2  VAL  29          1HG2      VAL  29  -0.554  -5.627   6.413
  210   2HG2  VAL  29          2HG2      VAL  29   0.207  -4.370   5.431
  211   3HG2  VAL  29          3HG2      VAL  29   0.003  -6.011   4.769
  212    H    LYS  30           H        LYS  30   0.243  -8.756   4.404
  213    HA   LYS  30           HA       LYS  30   2.562  -9.135   2.597
  214   1HB   LYS  30          2HB       LYS  30   0.938 -11.030   3.193
  215   2HB   LYS  30          3HB       LYS  30  -0.158 -10.232   2.058
  216   1HG   LYS  30          2HG       LYS  30   2.552 -11.500   1.568
  217   2HG   LYS  30          3HG       LYS  30   1.005 -11.837   0.773
  218   1HD   LYS  30          2HD       LYS  30   1.189  -9.493  -0.309
  219   2HD   LYS  30          3HD       LYS  30   2.818  -9.382   0.385
  220   1HE   LYS  30          2HE       LYS  30   3.129  -9.977  -1.781
  221   2HE   LYS  30          3HE       LYS  30   3.462 -11.461  -0.872
  222   1HZ   LYS  30          1HZ       LYS  30   1.576 -12.423  -1.881
  223   2HZ   LYS  30          2HZ       LYS  30   0.766 -10.965  -1.910
  224   3HZ   LYS  30          3HZ       LYS  30   1.853 -11.194  -3.003
  225    H    TYR  31           H        TYR  31   2.847  -7.269   1.666
  226    HA   TYR  31           HA       TYR  31   0.692  -5.718   0.330
  227   1HB   TYR  31          2HB       TYR  31   2.595  -4.248  -0.330
  228   2HB   TYR  31          3HB       TYR  31   2.305  -4.367   1.394
  229    HD1  TYR  31           HD1      TYR  31   4.639  -5.448  -1.328
  230    HD2  TYR  31           HD2      TYR  31   3.950  -5.369   2.910
  231    HE1  TYR  31           HE1      TYR  31   7.066  -5.627  -0.923
  232    HE2  TYR  31           HE2      TYR  31   6.369  -5.587   3.320
  233    HH   TYR  31           HH       TYR  31   8.666  -5.001   0.762
  234    H    ASP  32           H        ASP  32   0.106  -6.170  -1.767
  235    HA   ASP  32           HA       ASP  32   2.190  -7.271  -3.604
  236   1HB   ASP  32          2HB       ASP  32  -0.807  -7.567  -3.526
  237   2HB   ASP  32          3HB       ASP  32   0.094  -7.792  -5.012
  238    H    ILE  33           H        ILE  33   2.742  -5.873  -5.183
  239    HA   ILE  33           HA       ILE  33   1.482  -3.155  -5.184
  240    HB   ILE  33           HB       ILE  33   4.430  -3.919  -5.074
  241   1HG1  ILE  33          2HG1      ILE  33   2.790  -2.524  -2.912
  242   2HG1  ILE  33          3HG1      ILE  33   3.162  -4.244  -2.888
  243   1HG2  ILE  33          1HG2      ILE  33   4.815  -1.484  -4.866
  244   2HG2  ILE  33          2HG2      ILE  33   3.983  -1.838  -6.372
  245   3HG2  ILE  33          3HG2      ILE  33   3.080  -1.183  -4.991
  246   1HD1  ILE  33          1HD1      ILE  33   5.547  -3.807  -2.827
  247   2HD1  ILE  33          2HD1      ILE  33   5.250  -2.049  -2.806
  248   3HD1  ILE  33          3HD1      ILE  33   4.680  -3.053  -1.474
  249    H    ASP  34           H        ASP  34   0.560  -3.093  -7.214
  250    HA   ASP  34           HA       ASP  34   1.942  -4.418  -9.468
  251   1HB   ASP  34          2HB       ASP  34  -0.426  -4.928  -9.163
  252   2HB   ASP  34          3HB       ASP  34  -0.827  -3.206  -9.325
  253    H    LEU  35           H        LEU  35   3.207  -3.282 -10.689
  254    HA   LEU  35           HA       LEU  35   3.456  -0.410 -10.546
  255   1HB   LEU  35          2HB       LEU  35   4.843  -2.626 -12.061
  256   2HB   LEU  35          3HB       LEU  35   5.127  -0.946 -12.498
  257    HG   LEU  35           HG       LEU  35   6.811  -1.986 -10.983
  258   1HD1  LEU  35          1HD1      LEU  35   7.136  -0.011  -9.599
  259   2HD1  LEU  35          2HD1      LEU  35   6.620   0.449 -11.229
  260   3HD1  LEU  35          3HD1      LEU  35   5.467   0.512  -9.883
  261   1HD2  LEU  35          1HD2      LEU  35   5.261  -3.244  -9.496
  262   2HD2  LEU  35          2HD2      LEU  35   6.402  -2.215  -8.614
  263   3HD2  LEU  35          3HD2      LEU  35   4.716  -1.701  -8.793
  264    HA   PRO  36           HA       PRO  36   2.192  -0.428 -15.139
  265   1HB   PRO  36          2HB       PRO  36   0.380  -2.358 -16.044
  266   2HB   PRO  36          3HB       PRO  36   2.148  -2.362 -16.295
  267   1HG   PRO  36          2HG       PRO  36   0.568  -3.792 -14.158
  268   2HG   PRO  36          3HG       PRO  36   1.910  -4.430 -15.146
  269   1HD   PRO  36          2HD       PRO  36   2.319  -3.613 -12.647
  270   2HD   PRO  36          3HD       PRO  36   3.516  -3.188 -13.903
  271    H    ASN  37           H        ASN  37  -0.290  -1.791 -12.889
  272    HA   ASN  37           HA       ASN  37  -2.315   0.110 -13.871
  273   1HB   ASN  37          2HB       ASN  37  -2.457  -1.873 -11.570
  274   2HB   ASN  37          3HB       ASN  37  -3.780  -0.937 -12.252
  275   1HD2  ASN  37          1HD2      ASN  37  -1.467  -3.536 -12.945
  276   2HD2  ASN  37          2HD2      ASN  37  -2.424  -4.284 -14.231
  277    H    LYS  38           H        LYS  38   0.233   0.163 -11.479
  278    HA   LYS  38           HA       LYS  38   0.691   1.392  -9.727
  279   1HB   LYS  38          2HB       LYS  38  -1.152   3.545 -10.860
  280   2HB   LYS  38          3HB       LYS  38   0.096   3.680  -9.618
  281   1HG   LYS  38          2HG       LYS  38   1.311   4.447 -11.404
  282   2HG   LYS  38          3HG       LYS  38   1.695   2.718 -11.473
  283   1HD   LYS  38          2HD       LYS  38  -0.239   2.510 -13.142
  284   2HD   LYS  38          3HD       LYS  38  -0.337   4.272 -13.147
  285   1HE   LYS  38          2HE       LYS  38   1.927   4.431 -14.065
  286   2HE   LYS  38          3HE       LYS  38   2.221   2.709 -13.763
  287   1HZ   LYS  38          1HZ       LYS  38   0.541   2.152 -15.333
  288   2HZ   LYS  38          2HZ       LYS  38   0.255   3.735 -15.689
  289   3HZ   LYS  38          3HZ       LYS  38   1.717   3.057 -16.050
  290    H    LYS  39           H        LYS  39  -0.757  -0.553  -9.065
  291    HA   LYS  39           HA       LYS  39  -2.784   0.522  -7.161
  292   1HB   LYS  39          2HB       LYS  39  -3.024  -1.931  -8.952
  293   2HB   LYS  39          3HB       LYS  39  -3.774  -1.867  -7.359
  294   1HG   LYS  39          2HG       LYS  39  -4.916   0.316  -8.079
  295   2HG   LYS  39          3HG       LYS  39  -4.327  -0.031  -9.707
  296   1HD   LYS  39          2HD       LYS  39  -6.569  -0.856  -9.588
  297   2HD   LYS  39          3HD       LYS  39  -5.516  -2.281  -9.559
  298   1HE   LYS  39          2HE       LYS  39  -5.811  -2.413  -7.047
  299   2HE   LYS  39          3HE       LYS  39  -6.815  -0.962  -7.103
  300   1HZ   LYS  39          1HZ       LYS  39  -8.061  -3.004  -6.969
  301   2HZ   LYS  39          2HZ       LYS  39  -8.425  -2.238  -8.372
  302   3HZ   LYS  39          3HZ       LYS  39  -7.439  -3.566  -8.345
  303    H    VAL  40           H        VAL  40  -2.895  -0.615  -5.151
  304    HA   VAL  40           HA       VAL  40  -0.809  -2.622  -4.631
  305    HB   VAL  40           HB       VAL  40  -1.585   0.002  -3.287
  306   1HG1  VAL  40          1HG1      VAL  40  -0.464  -2.424  -1.893
  307   2HG1  VAL  40          2HG1      VAL  40  -0.445  -0.758  -1.239
  308   3HG1  VAL  40          3HG1      VAL  40  -1.999  -1.544  -1.605
  309   1HG2  VAL  40          1HG2      VAL  40   0.814   0.305  -3.073
  310   2HG2  VAL  40          2HG2      VAL  40   1.102  -1.339  -3.684
  311   3HG2  VAL  40          3HG2      VAL  40   0.426  -0.103  -4.757
  312    H    CYS  41           H        CYS  41  -1.634  -4.314  -3.516
  313    HA   CYS  41           HA       CYS  41  -4.277  -4.001  -2.265
  314   1HB   CYS  41          2HB       CYS  41  -5.084  -6.114  -2.971
  315   2HB   CYS  41          3HB       CYS  41  -4.796  -5.124  -4.407
  316    HG   CYS  41           HG       CYS  41  -2.755  -7.372  -3.105
  317    H    ILE  42           H        ILE  42  -4.161  -4.637  -0.192
  318    HA   ILE  42           HA       ILE  42  -1.710  -6.161   0.601
  319    HB   ILE  42           HB       ILE  42  -3.009  -3.961   2.184
  320   1HG1  ILE  42          2HG1      ILE  42  -0.851  -3.834   0.058
  321   2HG1  ILE  42          3HG1      ILE  42  -2.284  -2.804   0.277
  322   1HG2  ILE  42          1HG2      ILE  42  -0.288  -5.304   2.380
  323   2HG2  ILE  42          2HG2      ILE  42  -0.911  -4.046   3.453
  324   3HG2  ILE  42          3HG2      ILE  42  -1.696  -5.620   3.420
  325   1HD1  ILE  42          1HD1      ILE  42   0.279  -2.849   1.874
  326   2HD1  ILE  42          2HD1      ILE  42  -0.369  -1.500   0.931
  327   3HD1  ILE  42          3HD1      ILE  42  -1.174  -1.990   2.439
  328    H    GLU  43           H        GLU  43  -2.061  -7.904   1.714
  329    HA   GLU  43           HA       GLU  43  -4.707  -8.401   3.001
  330   1HB   GLU  43          2HB       GLU  43  -4.019  -9.909   1.105
  331   2HB   GLU  43          3HB       GLU  43  -2.714 -10.513   2.139
  332   1HG   GLU  43          2HG       GLU  43  -5.683 -10.546   2.916
  333   2HG   GLU  43          3HG       GLU  43  -4.854 -11.885   2.119
  334    H    SER  44           H        SER  44  -4.640  -8.463   5.247
  335    HA   SER  44           HA       SER  44  -2.607  -9.778   6.600
  336   1HB   SER  44          2HB       SER  44  -1.417  -7.619   6.336
  337   2HB   SER  44          3HB       SER  44  -2.733  -6.794   7.184
  338    HG   SER  44           HG       SER  44  -0.683  -8.432   8.195
  339    H    GLU  45           H        GLU  45  -3.043  -9.335   9.029
  340    HA   GLU  45           HA       GLU  45  -5.937  -8.829   9.586
  341   1HB   GLU  45          2HB       GLU  45  -3.916 -10.379  11.257
  342   2HB   GLU  45          3HB       GLU  45  -5.546  -9.909  11.776
  343   1HG   GLU  45          2HG       GLU  45  -6.520 -11.092   9.853
  344   2HG   GLU  45          3HG       GLU  45  -4.896 -11.638   9.342
  345    H    HIS  46           H        HIS  46  -2.943  -7.346   9.354
  346    HA   HIS  46           HA       HIS  46  -3.266  -5.434  11.544
  347   1HB   HIS  46          2HB       HIS  46  -1.886  -5.280   8.842
  348   2HB   HIS  46          3HB       HIS  46  -1.934  -3.945   9.993
  349    HD1  HIS  46           1HD      HIS  46  -0.916  -4.865  12.612
  350    HD2  HIS  46           2HD      HIS  46   0.438  -6.351   8.930
  351    HE1  HIS  46           1HE      HIS  46   1.468  -5.694  12.994
  352    H    SER  47           H        SER  47  -4.818  -3.857  11.625
  353    HA   SER  47           HA       SER  47  -7.015  -4.062   9.888
  354   1HB   SER  47          2HB       SER  47  -7.076  -3.230  12.273
  355   2HB   SER  47          3HB       SER  47  -6.390  -1.697  11.699
  356    HG   SER  47           HG       SER  47  -8.900  -2.861  11.109
  357    H    MET  48           H        MET  48  -7.820  -2.813   8.242
  358    HA   MET  48           HA       MET  48  -6.356  -1.603   6.309
  359   1HB   MET  48          2HB       MET  48  -8.802  -2.311   6.368
  360   2HB   MET  48          3HB       MET  48  -9.167  -0.820   7.240
  361   1HG   MET  48          2HG       MET  48  -8.330   0.502   5.342
  362   2HG   MET  48          3HG       MET  48  -7.794  -0.985   4.547
  363   1HE   MET  48          1HE       MET  48 -10.899   1.142   5.671
  364   2HE   MET  48          2HE       MET  48 -12.247   0.170   5.035
  365   3HE   MET  48          3HE       MET  48 -11.294  -0.436   6.403
  366    H    ASP  49           H        ASP  49  -7.950  -0.047   9.079
  367    HA   ASP  49           HA       ASP  49  -7.415   2.675   8.811
  368   1HB   ASP  49          2HB       ASP  49  -8.669   2.100  10.708
  369   2HB   ASP  49          3HB       ASP  49  -7.651   0.713  11.106
  370    H    THR  50           H        THR  50  -5.503   0.381  10.564
  371    HA   THR  50           HA       THR  50  -3.397   2.043  11.171
  372    HB   THR  50           HB       THR  50  -3.276  -0.990  10.955
  373    HG1  THR  50           1HG      THR  50  -4.911   0.670  12.511
  374   1HG2  THR  50          1HG2      THR  50  -1.202   0.161  11.739
  375   2HG2  THR  50          2HG2      THR  50  -2.145   0.960  13.018
  376   3HG2  THR  50          3HG2      THR  50  -1.956  -0.806  13.024
  377    H    LEU  51           H        LEU  51  -3.644  -0.419   8.553
  378    HA   LEU  51           HA       LEU  51  -1.065   0.023   7.403
  379   1HB   LEU  51          2HB       LEU  51  -3.671  -0.600   5.935
  380   2HB   LEU  51          3HB       LEU  51  -2.026  -0.727   5.283
  381    HG   LEU  51           HG       LEU  51  -3.212  -2.366   7.582
  382   1HD1  LEU  51          1HD1      LEU  51  -2.470  -3.086   4.727
  383   2HD1  LEU  51          2HD1      LEU  51  -2.955  -4.254   5.981
  384   3HD1  LEU  51          3HD1      LEU  51  -4.100  -3.022   5.421
  385   1HD2  LEU  51          1HD2      LEU  51  -0.883  -2.060   8.073
  386   2HD2  LEU  51          2HD2      LEU  51  -1.073  -3.667   7.400
  387   3HD2  LEU  51          3HD2      LEU  51  -0.420  -2.359   6.382
  388    H    LEU  52           H        LEU  52  -4.193   1.634   6.685
  389    HA   LEU  52           HA       LEU  52  -3.246   3.404   4.743
  390   1HB   LEU  52          2HB       LEU  52  -5.666   2.951   5.783
  391   2HB   LEU  52          3HB       LEU  52  -5.300   4.483   6.565
  392    HG   LEU  52           HG       LEU  52  -6.428   4.892   4.552
  393   1HD1  LEU  52          1HD1      LEU  52  -3.542   5.510   3.840
  394   2HD1  LEU  52          2HD1      LEU  52  -4.998   6.349   3.291
  395   3HD1  LEU  52          3HD1      LEU  52  -4.527   6.434   4.999
  396   1HD2  LEU  52          1HD2      LEU  52  -6.075   2.749   3.409
  397   2HD2  LEU  52          2HD2      LEU  52  -5.861   4.139   2.336
  398   3HD2  LEU  52          3HD2      LEU  52  -4.446   3.262   2.926
  399    H    ALA  53           H        ALA  53  -3.611   4.050   8.259
  400    HA   ALA  53           HA       ALA  53  -2.494   6.626   8.253
  401   1HB   ALA  53          1HB       ALA  53  -3.888   5.667  10.074
  402   2HB   ALA  53          2HB       ALA  53  -2.567   4.562  10.503
  403   3HB   ALA  53          3HB       ALA  53  -2.362   6.314  10.715
  404    H    THR  54           H        THR  54  -0.862   3.491   8.615
  405    HA   THR  54           HA       THR  54   1.746   4.599   9.107
  406    HB   THR  54           HB       THR  54   0.833   1.930   7.971
  407    HG1  THR  54           1HG      THR  54   1.767   2.805  10.510
  408   1HG2  THR  54          1HG2      THR  54   3.176   1.212   8.562
  409   2HG2  THR  54          2HG2      THR  54   3.083   2.289   7.172
  410   3HG2  THR  54          3HG2      THR  54   3.615   2.919   8.752
  411    H    LEU  55           H        LEU  55   0.239   3.319   6.042
  412    HA   LEU  55           HA       LEU  55   2.598   3.844   4.568
  413   1HB   LEU  55          2HB       LEU  55   1.493   3.063   2.729
  414   2HB   LEU  55          3HB       LEU  55   1.089   2.076   4.108
  415    HG   LEU  55           HG       LEU  55  -1.091   3.501   4.195
  416   1HD1  LEU  55          1HD1      LEU  55  -0.046   3.832   1.393
  417   2HD1  LEU  55          2HD1      LEU  55  -1.741   4.185   1.875
  418   3HD1  LEU  55          3HD1      LEU  55  -0.395   5.128   2.535
  419   1HD2  LEU  55          1HD2      LEU  55  -0.547   1.508   1.942
  420   2HD2  LEU  55          2HD2      LEU  55  -0.933   1.062   3.623
  421   3HD2  LEU  55          3HD2      LEU  55  -2.139   1.909   2.627
  422    H    LYS  56           H        LYS  56  -0.302   5.680   5.035
  423    HA   LYS  56           HA       LYS  56  -0.425   7.743   3.423
  424   1HB   LYS  56          2HB       LYS  56  -1.428   7.400   5.866
  425   2HB   LYS  56          3HB       LYS  56  -0.131   8.476   6.360
  426   1HG   LYS  56          2HG       LYS  56  -1.048  10.116   4.618
  427   2HG   LYS  56          3HG       LYS  56  -2.362   8.937   4.355
  428   1HD   LYS  56          2HD       LYS  56  -2.936   9.055   6.778
  429   2HD   LYS  56          3HD       LYS  56  -1.688  10.302   6.998
  430   1HE   LYS  56          2HE       LYS  56  -2.883  11.792   5.401
  431   2HE   LYS  56          3HE       LYS  56  -4.091  10.531   5.104
  432   1HZ   LYS  56          1HZ       LYS  56  -4.888  12.157   6.647
  433   2HZ   LYS  56          2HZ       LYS  56  -4.764  10.702   7.399
  434   3HZ   LYS  56          3HZ       LYS  56  -3.646  11.879   7.687
  435    H    LYS  57           H        LYS  57   2.217   7.372   5.712
  436    HA   LYS  57           HA       LYS  57   3.314   9.977   5.653
  437   1HB   LYS  57          2HB       LYS  57   4.606   7.300   6.262
  438   2HB   LYS  57          3HB       LYS  57   5.274   8.896   6.682
  439   1HG   LYS  57          2HG       LYS  57   3.139   9.342   7.977
  440   2HG   LYS  57          3HG       LYS  57   2.657   7.667   7.640
  441   1HD   LYS  57          2HD       LYS  57   5.051   7.108   8.669
  442   2HD   LYS  57          3HD       LYS  57   4.848   8.679   9.440
  443   1HE   LYS  57          2HE       LYS  57   3.306   6.096   9.785
  444   2HE   LYS  57          3HE       LYS  57   3.982   7.160  11.018
  445   1HZ   LYS  57          1HZ       LYS  57   2.172   8.749  10.321
  446   2HZ   LYS  57          2HZ       LYS  57   1.464   7.486   9.491
  447   3HZ   LYS  57          3HZ       LYS  57   1.684   7.393  11.105
  448    H    THR  58           H        THR  58   3.455   7.511   3.147
  449    HA   THR  58           HA       THR  58   5.852   8.331   1.837
  450    HB   THR  58           HB       THR  58   4.574   7.591  -0.242
  451    HG1  THR  58           1HG      THR  58   2.457   8.093   0.686
  452   1HG2  THR  58          1HG2      THR  58   4.590   5.749   2.170
  453   2HG2  THR  58          2HG2      THR  58   4.482   5.229   0.472
  454   3HG2  THR  58          3HG2      THR  58   5.951   6.045   1.063
  455    H    GLY  59           H        GLY  59   2.717   9.935   2.199
  456   1HA   GLY  59          2HA       GLY  59   1.988  11.962   1.482
  457   2HA   GLY  59          3HA       GLY  59   3.692  12.392   1.196
  458    H    LYS  60           H        LYS  60   1.584   9.901  -0.277
  459    HA   LYS  60           HA       LYS  60   1.827  11.141  -2.966
  460   1HB   LYS  60          2HB       LYS  60   2.206   8.247  -2.060
  461   2HB   LYS  60          3HB       LYS  60   1.967   8.676  -3.742
  462   1HG   LYS  60          2HG       LYS  60   4.273   9.620  -1.957
  463   2HG   LYS  60          3HG       LYS  60   4.325   8.341  -3.153
  464   1HD   LYS  60          2HD       LYS  60   4.074  11.339  -3.584
  465   2HD   LYS  60          3HD       LYS  60   5.326  10.238  -4.172
  466   1HE   LYS  60          2HE       LYS  60   3.526   9.103  -5.599
  467   2HE   LYS  60          3HE       LYS  60   2.421  10.407  -5.131
  468   1HZ   LYS  60          1HZ       LYS  60   4.202  11.920  -6.118
  469   2HZ   LYS  60          2HZ       LYS  60   4.700  10.526  -6.911
  470   3HZ   LYS  60          3HZ       LYS  60   3.205  11.037  -7.092
  471    H    THR  61           H        THR  61   0.121  10.317  -4.449
  472    HA   THR  61           HA       THR  61  -2.438  10.506  -3.353
  473    HB   THR  61           HB       THR  61  -1.704   9.445  -6.083
  474    HG1  THR  61           1HG      THR  61  -1.344  12.144  -5.312
  475   1HG2  THR  61          1HG2      THR  61  -3.628  11.645  -5.177
  476   2HG2  THR  61          2HG2      THR  61  -3.398  11.086  -6.849
  477   3HG2  THR  61          3HG2      THR  61  -4.096   9.994  -5.638
  478    H    VAL  62           H        VAL  62  -1.461   8.319  -1.995
  479    HA   VAL  62           HA       VAL  62  -2.417   5.841  -3.272
  480    HB   VAL  62           HB       VAL  62  -0.452   5.562  -2.114
  481   1HG1  VAL  62          1HG1      VAL  62  -0.072   5.920   0.240
  482   2HG1  VAL  62          2HG1      VAL  62  -0.453   7.446  -0.529
  483   3HG1  VAL  62          3HG1      VAL  62  -1.686   6.628   0.455
  484   1HG2  VAL  62          1HG2      VAL  62  -2.238   3.806  -1.981
  485   2HG2  VAL  62          2HG2      VAL  62  -1.020   3.715  -0.705
  486   3HG2  VAL  62          3HG2      VAL  62  -2.631   4.381  -0.354
  487    H    SER  63           H        SER  63  -4.540   6.184  -3.638
  488    HA   SER  63           HA       SER  63  -6.311   7.123  -1.431
  489   1HB   SER  63          2HB       SER  63  -6.558   8.077  -3.719
  490   2HB   SER  63          3HB       SER  63  -7.014   6.464  -4.313
  491    HG   SER  63           HG       SER  63  -8.841   7.768  -3.707
  492    H    TYR  64           H        TYR  64  -8.470   5.874  -1.386
  493    HA   TYR  64           HA       TYR  64  -7.814   3.001  -0.891
  494   1HB   TYR  64          2HB       TYR  64  -8.185   4.048   1.199
  495   2HB   TYR  64          3HB       TYR  64  -9.542   4.982   0.573
  496    HD1  TYR  64           HD1      TYR  64 -11.520   4.387   1.648
  497    HD2  TYR  64           HD2      TYR  64  -8.763   1.270   0.501
  498    HE1  TYR  64           HE1      TYR  64 -13.163   2.677   2.326
  499    HE2  TYR  64           HE2      TYR  64 -10.417  -0.430   1.175
  500    HH   TYR  64           HH       TYR  64 -13.632   0.424   2.476
  501    H    LEU  65           H        LEU  65  -8.824   1.554  -2.226
  502    HA   LEU  65           HA       LEU  65 -11.645   1.958  -2.843
  503   1HB   LEU  65          2HB       LEU  65 -11.141   1.529  -5.316
  504   2HB   LEU  65          3HB       LEU  65 -11.110   3.148  -4.648
  505    HG   LEU  65           HG       LEU  65  -9.387   2.760  -6.254
  506   1HD1  LEU  65          1HD1      LEU  65  -9.134   4.381  -4.324
  507   2HD1  LEU  65          2HD1      LEU  65  -7.861   3.260  -3.776
  508   3HD1  LEU  65          3HD1      LEU  65  -7.753   4.029  -5.357
  509   1HD2  LEU  65          1HD2      LEU  65  -8.081   0.770  -4.425
  510   2HD2  LEU  65          2HD2      LEU  65  -8.897   0.415  -5.965
  511   3HD2  LEU  65          3HD2      LEU  65  -7.434   1.385  -5.951
  512    H    GLY  66           H        GLY  66 -11.395  -0.007  -1.313
  513   1HA   GLY  66          2HA       GLY  66 -12.925  -1.828  -2.210
  514   2HA   GLY  66          3HA       GLY  66 -11.506  -2.419  -3.087
  515    H    LEU  67           H        LEU  67 -13.024  -3.819  -1.009
  516    HA   LEU  67           HA       LEU  67 -10.715  -4.666   0.467
  517   1HB   LEU  67          2HB       LEU  67 -11.568  -4.595   2.645
  518   2HB   LEU  67          3HB       LEU  67 -11.682  -2.962   1.997
  519    HG   LEU  67           HG       LEU  67 -13.977  -4.946   2.379
  520   1HD1  LEU  67          1HD1      LEU  67 -14.687  -3.386   4.132
  521   2HD1  LEU  67          2HD1      LEU  67 -13.053  -3.990   4.454
  522   3HD1  LEU  67          3HD1      LEU  67 -13.280  -2.351   3.808
  523   1HD2  LEU  67          1HD2      LEU  67 -15.448  -2.950   1.895
  524   2HD2  LEU  67          2HD2      LEU  67 -14.014  -2.089   1.304
  525   3HD2  LEU  67          3HD2      LEU  67 -14.596  -3.545   0.476
  526    H    GLU  68           H        GLU  68 -10.690  -6.866   0.361
  527    HA   GLU  68           HA       GLU  68 -13.143  -8.450   0.191
  528   1HB   GLU  68          2HB       GLU  68 -12.774  -7.495  -2.088
  529   2HB   GLU  68          3HB       GLU  68 -11.171  -8.190  -2.123
  530   1HG   GLU  68          2HG       GLU  68 -12.343 -10.497  -1.751
  531   2HG   GLU  68          3HG       GLU  68 -13.857  -9.640  -2.089
  Start of MODEL   22
    1   1H    MET   1           H1       MET   1  -7.792  -5.425   8.221
    2   2H    MET   1           H2       MET   1  -6.599  -6.161   7.430
    3   3H    MET   1           H3       MET   1  -8.111  -6.078   6.753
    4    HA   MET   1           HA       MET   1  -7.022  -7.584   9.006
    5   1HB   MET   1          2HB       MET   1  -8.906  -6.539   9.987
    6   2HB   MET   1          3HB       MET   1 -10.004  -7.153   8.761
    7   1HG   MET   1          2HG       MET   1  -9.427  -9.503   9.493
    8   2HG   MET   1          3HG       MET   1  -8.266  -8.829  10.639
    9   1HE   MET   1          1HE       MET   1 -12.029  -7.698   9.853
   10   2HE   MET   1          2HE       MET   1 -12.003  -9.481   9.798
   11   3HE   MET   1          3HE       MET   1 -12.843  -8.641  11.119
   12    HA   PRO   2           HA       PRO   2  -7.929 -10.495   5.502
   13   1HB   PRO   2          2HB       PRO   2  -9.938 -10.450   3.816
   14   2HB   PRO   2          3HB       PRO   2 -10.257 -10.807   5.520
   15   1HG   PRO   2          2HG       PRO   2 -10.645  -8.080   4.219
   16   2HG   PRO   2          3HG       PRO   2 -11.785  -8.995   5.228
   17   1HD   PRO   2          2HD       PRO   2 -10.043  -7.059   6.204
   18   2HD   PRO   2          3HD       PRO   2 -10.654  -8.445   7.160
   19    H    LYS   3           H        LYS   3  -9.289  -8.835   2.834
   20    HA   LYS   3           HA       LYS   3  -6.634  -7.801   2.102
   21   1HB   LYS   3          2HB       LYS   3  -8.191  -9.618   0.904
   22   2HB   LYS   3          3HB       LYS   3  -8.915  -8.152   0.225
   23   1HG   LYS   3          2HG       LYS   3  -6.674  -7.550  -0.748
   24   2HG   LYS   3          3HG       LYS   3  -6.019  -9.065  -0.064
   25   1HD   LYS   3          2HD       LYS   3  -7.920 -10.297  -1.205
   26   2HD   LYS   3          3HD       LYS   3  -8.338  -8.774  -2.025
   27   1HE   LYS   3          2HE       LYS   3  -6.177  -8.854  -3.219
   28   2HE   LYS   3          3HE       LYS   3  -5.754 -10.347  -2.344
   29   1HZ   LYS   3          1HZ       LYS   3  -6.757 -10.907  -4.477
   30   2HZ   LYS   3          2HZ       LYS   3  -7.824 -11.323  -3.266
   31   3HZ   LYS   3          3HZ       LYS   3  -8.127 -10.029  -4.098
   32    H    HIS   4           H        HIS   4  -6.487  -5.736   1.066
   33    HA   HIS   4           HA       HIS   4  -8.854  -3.951   1.102
   34   1HB   HIS   4          2HB       HIS   4  -6.219  -3.377   2.540
   35   2HB   HIS   4          3HB       HIS   4  -7.449  -2.180   2.226
   36    HD1  HIS   4           1HD      HIS   4 -10.026  -2.989   3.334
   37    HD2  HIS   4           2HD      HIS   4  -6.488  -4.819   4.705
   38    HE1  HIS   4           1HE      HIS   4 -10.627  -4.248   5.464
   39    H    GLU   5           H        GLU   5  -8.835  -2.498  -0.605
   40    HA   GLU   5           HA       GLU   5  -6.667  -2.869  -2.614
   41   1HB   GLU   5          2HB       GLU   5  -9.614  -2.189  -2.801
   42   2HB   GLU   5          3HB       GLU   5  -8.564  -2.329  -4.192
   43   1HG   GLU   5          2HG       GLU   5  -8.156  -4.758  -3.495
   44   2HG   GLU   5          3HG       GLU   5  -9.314  -4.537  -2.181
   45    H    PHE   6           H        PHE   6  -5.709  -1.083  -3.602
   46    HA   PHE   6           HA       PHE   6  -6.713   1.647  -2.993
   47   1HB   PHE   6          2HB       PHE   6  -3.854   0.632  -2.586
   48   2HB   PHE   6          3HB       PHE   6  -4.433   2.226  -2.191
   49    HD1  PHE   6           1HD      PHE   6  -5.270   2.659   0.054
   50    HD2  PHE   6           2HD      PHE   6  -4.569  -1.391  -1.252
   51    HE1  PHE   6           1HE      PHE   6  -5.542   1.827   2.383
   52    HE2  PHE   6           2HE      PHE   6  -4.892  -2.193   1.046
   53    HZ   PHE   6           HZ       PHE   6  -5.402  -0.584   2.879
   54    H    SER   7           H        SER   7  -6.492   3.030  -4.555
   55    HA   SER   7           HA       SER   7  -4.763   2.399  -6.900
   56   1HB   SER   7          2HB       SER   7  -7.157   4.183  -6.457
   57   2HB   SER   7          3HB       SER   7  -5.883   4.701  -7.509
   58    HG   SER   7           HG       SER   7  -7.360   2.271  -7.634
   59    H    VAL   8           H        VAL   8  -3.073   3.778  -7.373
   60    HA   VAL   8           HA       VAL   8  -2.110   5.561  -5.208
   61    HB   VAL   8           HB       VAL   8  -0.742   3.142  -6.529
   62   1HG1  VAL   8          1HG1      VAL   8   0.878   4.686  -6.095
   63   2HG1  VAL   8          2HG1      VAL   8   0.254   5.086  -4.460
   64   3HG1  VAL   8          3HG1      VAL   8   0.985   3.492  -4.803
   65   1HG2  VAL   8          1HG2      VAL   8  -2.370   2.306  -4.895
   66   2HG2  VAL   8          2HG2      VAL   8  -0.781   2.245  -4.141
   67   3HG2  VAL   8          3HG2      VAL   8  -1.887   3.551  -3.722
   68    H    ASP   9           H        ASP   9  -0.347   6.979  -5.956
   69    HA   ASP   9           HA       ASP   9   0.285   6.801  -8.848
   70   1HB   ASP   9          2HB       ASP   9  -1.008   8.866  -8.516
   71   2HB   ASP   9          3HB       ASP   9   0.151   9.406  -7.288
   72    H    MET  10           H        MET  10   1.872   5.341  -8.139
   73    HA   MET  10           HA       MET  10   4.345   6.651  -7.114
   74   1HB   MET  10          2HB       MET  10   3.245   3.839  -6.688
   75   2HB   MET  10          3HB       MET  10   4.902   4.298  -6.294
   76   1HG   MET  10          2HG       MET  10   2.474   5.767  -5.198
   77   2HG   MET  10          3HG       MET  10   3.216   4.425  -4.385
   78   1HE   MET  10          1HE       MET  10   6.155   4.778  -4.189
   79   2HE   MET  10          2HE       MET  10   6.486   6.103  -3.049
   80   3HE   MET  10          3HE       MET  10   5.237   4.899  -2.667
   81    H    THR  11           H        THR  11   5.162   7.217  -9.005
   82    HA   THR  11           HA       THR  11   5.314   5.279 -11.269
   83    HB   THR  11           HB       THR  11   4.529   8.231 -11.373
   84    HG1  THR  11           1HG      THR  11   2.647   7.533 -10.771
   85   1HG2  THR  11          1HG2      THR  11   5.369   7.467 -13.562
   86   2HG2  THR  11          2HG2      THR  11   4.387   5.995 -13.461
   87   3HG2  THR  11          3HG2      THR  11   3.610   7.582 -13.611
   88    H    CYS  12           H        CYS  12   7.428   5.531  -9.560
   89    HA   CYS  12           HA       CYS  12   9.464   6.523 -11.424
   90   1HB   CYS  12          2HB       CYS  12   8.983   8.561 -10.142
   91   2HB   CYS  12          3HB       CYS  12   9.299   7.706  -8.615
   92    HG   CYS  12           HG       CYS  12  11.743   7.111  -9.079
   93    H    GLY  13           H        GLY  13   9.334   4.077 -11.303
   94   1HA   GLY  13          2HA       GLY  13  10.288   2.069 -10.785
   95   2HA   GLY  13          3HA       GLY  13  11.738   3.067 -10.691
   96    H    GLY  14           H        GLY  14  12.467   3.766  -8.581
   97   1HA   GLY  14          2HA       GLY  14  12.349   1.779  -6.529
   98   2HA   GLY  14          3HA       GLY  14  13.069   3.399  -6.396
   99    H    CYS  15           H        CYS  15  10.187   4.360  -7.296
  100    HA   CYS  15           HA       CYS  15   8.771   4.839  -4.966
  101   1HB   CYS  15          2HB       CYS  15   6.902   5.204  -6.332
  102   2HB   CYS  15          3HB       CYS  15   8.283   5.553  -7.355
  103    HG   CYS  15           HG       CYS  15   6.292   2.920  -7.237
  104    H    ALA  16           H        ALA  16   8.922   1.768  -6.857
  105    HA   ALA  16           HA       ALA  16   7.017   0.352  -5.275
  106   1HB   ALA  16          1HB       ALA  16   8.039  -1.668  -6.270
  107   2HB   ALA  16          2HB       ALA  16   7.758  -0.407  -7.487
  108   3HB   ALA  16          3HB       ALA  16   9.401  -0.693  -6.868
  109    H    GLU  17           H        GLU  17  10.560   0.797  -4.888
  110    HA   GLU  17           HA       GLU  17  10.844  -0.902  -2.588
  111   1HB   GLU  17          2HB       GLU  17  12.472   1.498  -3.514
  112   2HB   GLU  17          3HB       GLU  17  12.723   0.621  -2.026
  113   1HG   GLU  17          2HG       GLU  17  12.577  -1.462  -3.894
  114   2HG   GLU  17          3HG       GLU  17  13.410  -0.174  -4.778
  115    H    ALA  18           H        ALA  18  10.000   2.564  -3.027
  116    HA   ALA  18           HA       ALA  18   9.935   3.210  -0.267
  117   1HB   ALA  18          1HB       ALA  18   9.778   4.899  -2.079
  118   2HB   ALA  18          2HB       ALA  18   8.110   4.373  -2.402
  119   3HB   ALA  18          3HB       ALA  18   8.519   5.088  -0.839
  120    H    VAL  19           H        VAL  19   7.248   2.039  -2.367
  121    HA   VAL  19           HA       VAL  19   5.344   1.901  -0.266
  122    HB   VAL  19           HB       VAL  19   5.422   0.205  -2.789
  123   1HG1  VAL  19          1HG1      VAL  19   3.904  -0.750  -1.059
  124   2HG1  VAL  19          2HG1      VAL  19   3.183   0.852  -0.807
  125   3HG1  VAL  19          3HG1      VAL  19   2.975   0.009  -2.353
  126   1HG2  VAL  19          1HG2      VAL  19   3.767   1.855  -3.627
  127   2HG2  VAL  19          2HG2      VAL  19   3.987   2.827  -2.157
  128   3HG2  VAL  19          3HG2      VAL  19   5.323   2.619  -3.309
  129    H    SER  20           H        SER  20   7.331  -0.801  -1.672
  130    HA   SER  20           HA       SER  20   6.365  -2.779   0.108
  131   1HB   SER  20          2HB       SER  20   8.606  -3.913  -0.349
  132   2HB   SER  20          3HB       SER  20   7.630  -3.525  -1.783
  133    HG   SER  20           HG       SER  20   8.946  -1.748  -2.138
  134    H    ARG  21           H        ARG  21   9.291  -0.777   0.441
  135    HA   ARG  21           HA       ARG  21  10.062  -1.674   2.980
  136   1HB   ARG  21          2HB       ARG  21  10.408   1.071   1.725
  137   2HB   ARG  21          3HB       ARG  21  11.177   0.557   3.228
  138   1HG   ARG  21          2HG       ARG  21  12.339  -1.286   2.091
  139   2HG   ARG  21          3HG       ARG  21  11.579  -0.871   0.556
  140   1HD   ARG  21          2HD       ARG  21  12.621   1.428   0.733
  141   2HD   ARG  21          3HD       ARG  21  13.460   0.857   2.196
  142    HE   ARG  21           HE       ARG  21  13.844  -0.694  -0.349
  143   1HH1  ARG  21          2HH2      ARG  21  15.188   1.858   1.705
  144   2HH1  ARG  21          1HH2      ARG  21  16.777   1.737   1.008
  145   1HH2  ARG  21          2HH1      ARG  21  15.760  -0.745  -1.317
  146   2HH2  ARG  21          1HH1      ARG  21  17.135   0.196  -0.812
  147    H    VAL  22           H        VAL  22   7.851   1.305   2.411
  148    HA   VAL  22           HA       VAL  22   7.590   1.636   5.165
  149    HB   VAL  22           HB       VAL  22   7.205   3.311   3.359
  150   1HG1  VAL  22          1HG1      VAL  22   4.995   3.571   2.404
  151   2HG1  VAL  22          2HG1      VAL  22   5.609   1.975   1.969
  152   3HG1  VAL  22          3HG1      VAL  22   4.412   2.141   3.272
  153   1HG2  VAL  22          1HG2      VAL  22   5.456   4.473   4.589
  154   2HG2  VAL  22          2HG2      VAL  22   5.011   2.960   5.412
  155   3HG2  VAL  22          3HG2      VAL  22   6.627   3.683   5.683
  156    H    LEU  23           H        LEU  23   5.477  -0.205   2.846
  157    HA   LEU  23           HA       LEU  23   3.589  -0.997   4.788
  158   1HB   LEU  23          2HB       LEU  23   4.502  -2.062   2.094
  159   2HB   LEU  23          3HB       LEU  23   3.422  -3.011   3.080
  160    HG   LEU  23           HG       LEU  23   2.224  -1.731   1.403
  161   1HD1  LEU  23          1HD1      LEU  23   1.541  -1.099   4.310
  162   2HD1  LEU  23          2HD1      LEU  23   0.459  -0.958   2.927
  163   3HD1  LEU  23          3HD1      LEU  23   1.076  -2.558   3.405
  164   1HD2  LEU  23          1HD2      LEU  23   2.819   0.640   3.173
  165   2HD2  LEU  23          2HD2      LEU  23   3.569   0.363   1.579
  166   3HD2  LEU  23          3HD2      LEU  23   1.821   0.630   1.704
  167    H    ASN  24           H        ASN  24   6.695  -2.552   3.861
  168    HA   ASN  24           HA       ASN  24   6.513  -4.796   5.599
  169   1HB   ASN  24          2HB       ASN  24   8.261  -4.776   3.985
  170   2HB   ASN  24          3HB       ASN  24   8.784  -3.167   4.432
  171   1HD2  ASN  24          1HD2      ASN  24   9.908  -2.786   6.330
  172   2HD2  ASN  24          2HD2      ASN  24  10.830  -4.083   7.113
  173    H    LYS  25           H        LYS  25   7.764  -1.489   6.114
  174    HA   LYS  25           HA       LYS  25   8.681  -1.824   8.747
  175   1HB   LYS  25          2HB       LYS  25   7.790   0.549   7.079
  176   2HB   LYS  25          3HB       LYS  25   8.042   0.789   8.787
  177   1HG   LYS  25          2HG       LYS  25  10.100  -0.204   6.770
  178   2HG   LYS  25          3HG       LYS  25  10.035   1.381   7.532
  179   1HD   LYS  25          2HD       LYS  25  10.790  -1.279   8.796
  180   2HD   LYS  25          3HD       LYS  25  11.764   0.175   8.612
  181   1HE   LYS  25          2HE       LYS  25  10.281   1.385  10.226
  182   2HE   LYS  25          3HE       LYS  25   9.314  -0.086  10.443
  183   1HZ   LYS  25          1HZ       LYS  25  10.882   0.154  12.181
  184   2HZ   LYS  25          2HZ       LYS  25  11.224  -1.192  11.310
  185   3HZ   LYS  25          3HZ       LYS  25  12.153   0.160  11.139
  186    H    LEU  26           H        LEU  26   5.415  -1.096   7.617
  187    HA   LEU  26           HA       LEU  26   4.177  -0.518  10.027
  188   1HB   LEU  26          2HB       LEU  26   3.153  -0.739   7.714
  189   2HB   LEU  26          3HB       LEU  26   3.083  -2.469   7.937
  190    HG   LEU  26           HG       LEU  26   1.051  -0.891   8.340
  191   1HD1  LEU  26          1HD1      LEU  26   1.543  -3.282  10.134
  192   2HD1  LEU  26          2HD1      LEU  26  -0.026  -2.556   9.715
  193   3HD1  LEU  26          3HD1      LEU  26   0.958  -3.323   8.454
  194   1HD2  LEU  26          1HD2      LEU  26   1.941  -1.115  11.238
  195   2HD2  LEU  26          2HD2      LEU  26   2.193   0.356  10.292
  196   3HD2  LEU  26          3HD2      LEU  26   0.559  -0.254  10.559
  197    H    GLY  27           H        GLY  27   5.207  -3.728   8.823
  198   1HA   GLY  27          2HA       GLY  27   5.656  -4.730  11.365
  199   2HA   GLY  27          3HA       GLY  27   3.965  -5.152  11.013
  200    H    GLY  28           H        GLY  28   3.527  -6.708   9.404
  201   1HA   GLY  28          2HA       GLY  28   5.757  -8.060   7.989
  202   2HA   GLY  28          3HA       GLY  28   4.858  -9.008   9.196
  203    H    VAL  29           H        VAL  29   3.809  -6.419   7.009
  204    HA   VAL  29           HA       VAL  29   1.354  -7.783   6.429
  205    HB   VAL  29           HB       VAL  29   1.801  -5.268   6.707
  206   1HG1  VAL  29          1HG1      VAL  29   2.550  -5.443   3.771
  207   2HG1  VAL  29          2HG1      VAL  29   2.506  -4.013   4.830
  208   3HG1  VAL  29          3HG1      VAL  29   3.755  -5.250   5.086
  209   1HG2  VAL  29          1HG2      VAL  29   0.176  -4.581   4.958
  210   2HG2  VAL  29          2HG2      VAL  29   0.250  -6.218   4.277
  211   3HG2  VAL  29          3HG2      VAL  29  -0.380  -5.958   5.910
  212    H    LYS  30           H        LYS  30   0.624  -8.516   4.417
  213    HA   LYS  30           HA       LYS  30   2.616  -9.152   2.301
  214   1HB   LYS  30          2HB       LYS  30   0.861 -10.843   3.169
  215   2HB   LYS  30          3HB       LYS  30  -0.317  -9.809   2.356
  216   1HG   LYS  30          2HG       LYS  30   1.891 -11.452   1.112
  217   2HG   LYS  30          3HG       LYS  30   0.137 -11.582   0.903
  218   1HD   LYS  30          2HD       LYS  30   0.313  -9.138  -0.120
  219   2HD   LYS  30          3HD       LYS  30   2.052  -9.488  -0.217
  220   1HE   LYS  30          2HE       LYS  30   1.186 -10.002  -2.253
  221   2HE   LYS  30          3HE       LYS  30   1.364 -11.606  -1.510
  222   1HZ   LYS  30          1HZ       LYS  30  -0.804 -10.913  -2.735
  223   2HZ   LYS  30          2HZ       LYS  30  -1.109 -11.631  -1.223
  224   3HZ   LYS  30          3HZ       LYS  30  -1.127 -10.012  -1.505
  225    H    TYR  31           H        TYR  31   2.869  -7.517   0.939
  226    HA   TYR  31           HA       TYR  31   0.650  -5.652   0.215
  227   1HB   TYR  31          2HB       TYR  31   2.573  -4.258  -0.672
  228   2HB   TYR  31          3HB       TYR  31   2.396  -4.384   1.065
  229    HD1  TYR  31           HD1      TYR  31   4.377  -5.904  -1.778
  230    HD2  TYR  31           HD2      TYR  31   4.224  -5.000   2.434
  231    HE1  TYR  31           HE1      TYR  31   6.763  -6.510  -1.546
  232    HE2  TYR  31           HE2      TYR  31   6.569  -5.651   2.669
  233    HH   TYR  31           HH       TYR  31   8.471  -6.387   1.589
  234    H    ASP  32           H        ASP  32  -0.010  -5.575  -1.910
  235    HA   ASP  32           HA       ASP  32   1.330  -7.280  -3.975
  236   1HB   ASP  32          2HB       ASP  32  -1.552  -6.425  -3.564
  237   2HB   ASP  32          3HB       ASP  32  -0.955  -7.253  -5.000
  238    H    ILE  33           H        ILE  33   2.668  -5.643  -4.845
  239    HA   ILE  33           HA       ILE  33   1.543  -2.900  -5.162
  240    HB   ILE  33           HB       ILE  33   4.385  -3.939  -5.133
  241   1HG1  ILE  33          2HG1      ILE  33   2.992  -2.262  -3.006
  242   2HG1  ILE  33          3HG1      ILE  33   2.976  -4.019  -2.938
  243   1HG2  ILE  33          1HG2      ILE  33   5.004  -1.528  -4.958
  244   2HG2  ILE  33          2HG2      ILE  33   4.165  -1.858  -6.472
  245   3HG2  ILE  33          3HG2      ILE  33   3.296  -1.081  -5.135
  246   1HD1  ILE  33          1HD1      ILE  33   4.727  -3.230  -1.556
  247   2HD1  ILE  33          2HD1      ILE  33   5.403  -4.125  -2.930
  248   3HD1  ILE  33          3HD1      ILE  33   5.493  -2.345  -2.893
  249    H    ASP  34           H        ASP  34   0.562  -2.695  -7.138
  250    HA   ASP  34           HA       ASP  34   1.572  -4.187  -9.459
  251   1HB   ASP  34          2HB       ASP  34  -0.834  -4.032  -9.020
  252   2HB   ASP  34          3HB       ASP  34  -0.753  -2.271  -9.174
  253    H    LEU  35           H        LEU  35   3.099  -3.386 -10.708
  254    HA   LEU  35           HA       LEU  35   4.115  -0.695 -10.393
  255   1HB   LEU  35          2HB       LEU  35   4.895  -3.132 -11.981
  256   2HB   LEU  35          3HB       LEU  35   5.525  -1.569 -12.486
  257    HG   LEU  35           HG       LEU  35   7.031  -2.871 -11.031
  258   1HD1  LEU  35          1HD1      LEU  35   7.829  -1.023  -9.730
  259   2HD1  LEU  35          2HD1      LEU  35   7.198  -0.391 -11.253
  260   3HD1  LEU  35          3HD1      LEU  35   6.250  -0.217  -9.760
  261   1HD2  LEU  35          1HD2      LEU  35   5.090  -2.250  -8.767
  262   2HD2  LEU  35          2HD2      LEU  35   5.349  -3.852  -9.493
  263   3HD2  LEU  35          3HD2      LEU  35   6.670  -3.038  -8.635
  264    HA   PRO  36           HA       PRO  36   2.659   0.097 -14.840
  265   1HB   PRO  36          2HB       PRO  36   0.735  -1.497 -16.037
  266   2HB   PRO  36          3HB       PRO  36   2.497  -1.712 -16.209
  267   1HG   PRO  36          2HG       PRO  36   0.641  -3.146 -14.298
  268   2HG   PRO  36          3HG       PRO  36   1.892  -3.856 -15.356
  269   1HD   PRO  36          2HD       PRO  36   2.387  -3.402 -12.765
  270   2HD   PRO  36          3HD       PRO  36   3.641  -3.026 -13.979
  271    H    ASN  37           H        ASN  37  -0.045  -1.480 -12.989
  272    HA   ASN  37           HA       ASN  37  -1.925   0.473 -14.077
  273   1HB   ASN  37          2HB       ASN  37  -2.387  -1.720 -12.026
  274   2HB   ASN  37          3HB       ASN  37  -3.616  -0.795 -12.877
  275   1HD2  ASN  37          1HD2      ASN  37  -1.846  -3.697 -12.979
  276   2HD2  ASN  37          2HD2      ASN  37  -2.167  -4.084 -14.670
  277    H    LYS  38           H        LYS  38   0.104   0.457 -11.320
  278    HA   LYS  38           HA       LYS  38   0.366   1.957  -9.630
  279   1HB   LYS  38          2HB       LYS  38  -1.913   3.644 -10.667
  280   2HB   LYS  38          3HB       LYS  38  -0.503   4.119  -9.749
  281   1HG   LYS  38          2HG       LYS  38  -0.257   3.192 -12.670
  282   2HG   LYS  38          3HG       LYS  38  -0.927   4.745 -12.251
  283   1HD   LYS  38          2HD       LYS  38   1.136   5.450 -12.574
  284   2HD   LYS  38          3HD       LYS  38   1.266   5.133 -10.854
  285   1HE   LYS  38          2HE       LYS  38   2.055   3.147 -13.063
  286   2HE   LYS  38          3HE       LYS  38   3.179   4.335 -12.393
  287   1HZ   LYS  38          1HZ       LYS  38   1.803   2.412 -10.704
  288   2HZ   LYS  38          2HZ       LYS  38   3.206   2.061 -11.430
  289   3HZ   LYS  38          3HZ       LYS  38   3.148   3.319 -10.337
  290    H    LYS  39           H        LYS  39  -0.971  -0.257  -9.063
  291    HA   LYS  39           HA       LYS  39  -3.030   0.705  -7.150
  292   1HB   LYS  39          2HB       LYS  39  -3.033  -1.751  -8.931
  293   2HB   LYS  39          3HB       LYS  39  -3.638  -1.925  -7.288
  294   1HG   LYS  39          2HG       LYS  39  -5.455  -1.498  -8.818
  295   2HG   LYS  39          3HG       LYS  39  -5.303  -0.216  -7.595
  296   1HD   LYS  39          2HD       LYS  39  -4.306   1.281  -9.136
  297   2HD   LYS  39          3HD       LYS  39  -4.061   0.021 -10.361
  298   1HE   LYS  39          2HE       LYS  39  -6.235   0.138 -11.104
  299   2HE   LYS  39          3HE       LYS  39  -6.892   0.536  -9.508
  300   1HZ   LYS  39          1HZ       LYS  39  -6.212   2.710  -9.686
  301   2HZ   LYS  39          2HZ       LYS  39  -5.287   2.451 -11.049
  302   3HZ   LYS  39          3HZ       LYS  39  -6.940   2.383 -11.125
  303    H    VAL  40           H        VAL  40  -2.936  -0.237  -5.047
  304    HA   VAL  40           HA       VAL  40  -0.811  -2.187  -4.549
  305    HB   VAL  40           HB       VAL  40  -1.673   0.304  -3.072
  306   1HG1  VAL  40          1HG1      VAL  40  -0.643  -0.595  -1.014
  307   2HG1  VAL  40          2HG1      VAL  40  -2.167  -1.354  -1.513
  308   3HG1  VAL  40          3HG1      VAL  40  -0.619  -2.209  -1.784
  309   1HG2  VAL  40          1HG2      VAL  40   1.032  -1.028  -3.450
  310   2HG2  VAL  40          2HG2      VAL  40   0.385   0.260  -4.485
  311   3HG2  VAL  40          3HG2      VAL  40   0.718   0.589  -2.770
  312    H    CYS  41           H        CYS  41  -1.784  -3.988  -3.672
  313    HA   CYS  41           HA       CYS  41  -4.402  -3.616  -2.318
  314   1HB   CYS  41          2HB       CYS  41  -3.627  -6.180  -3.779
  315   2HB   CYS  41          3HB       CYS  41  -4.992  -5.961  -2.677
  316    HG   CYS  41           HG       CYS  41  -6.235  -4.186  -4.048
  317    H    ILE  42           H        ILE  42  -4.469  -4.951  -0.350
  318    HA   ILE  42           HA       ILE  42  -1.803  -5.847   0.629
  319    HB   ILE  42           HB       ILE  42  -3.774  -4.132   2.213
  320   1HG1  ILE  42          2HG1      ILE  42  -1.073  -3.328   1.015
  321   2HG1  ILE  42          3HG1      ILE  42  -2.648  -2.763   0.449
  322   1HG2  ILE  42          1HG2      ILE  42  -2.370  -5.785   3.515
  323   2HG2  ILE  42          2HG2      ILE  42  -0.930  -5.021   2.800
  324   3HG2  ILE  42          3HG2      ILE  42  -1.981  -4.126   3.910
  325   1HD1  ILE  42          1HD1      ILE  42  -1.409  -2.148   3.136
  326   2HD1  ILE  42          2HD1      ILE  42  -1.756  -1.036   1.802
  327   3HD1  ILE  42          3HD1      ILE  42  -3.083  -1.776   2.715
  328    H    GLU  43           H        GLU  43  -2.022  -7.674   1.989
  329    HA   GLU  43           HA       GLU  43  -4.793  -8.853   2.263
  330   1HB   GLU  43          2HB       GLU  43  -3.568  -9.409   0.126
  331   2HB   GLU  43          3HB       GLU  43  -2.276 -10.104   1.091
  332   1HG   GLU  43          2HG       GLU  43  -3.796 -11.868   1.880
  333   2HG   GLU  43          3HG       GLU  43  -5.155 -11.113   1.022
  334    H    SER  44           H        SER  44  -4.631  -8.366   4.616
  335    HA   SER  44           HA       SER  44  -2.848 -10.142   6.085
  336   1HB   SER  44          2HB       SER  44  -2.274  -7.157   6.059
  337   2HB   SER  44          3HB       SER  44  -1.564  -8.305   7.211
  338    HG   SER  44           HG       SER  44  -1.192  -9.331   4.820
  339    H    GLU  45           H        GLU  45  -3.188 -10.304   8.224
  340    HA   GLU  45           HA       GLU  45  -5.464  -9.077   9.516
  341   1HB   GLU  45          2HB       GLU  45  -4.541 -11.410   9.924
  342   2HB   GLU  45          3HB       GLU  45  -3.228 -10.640  10.831
  343   1HG   GLU  45          2HG       GLU  45  -4.940  -9.595  12.331
  344   2HG   GLU  45          3HG       GLU  45  -6.227 -10.364  11.380
  345    H    HIS  46           H        HIS  46  -4.436  -6.962   8.636
  346    HA   HIS  46           HA       HIS  46  -3.572  -5.516  11.041
  347   1HB   HIS  46          2HB       HIS  46  -2.397  -5.169   8.242
  348   2HB   HIS  46          3HB       HIS  46  -2.308  -3.932   9.498
  349    HD1  HIS  46           1HD      HIS  46  -1.172  -5.232  11.961
  350    HD2  HIS  46           2HD      HIS  46  -0.034  -6.247   8.050
  351    HE1  HIS  46           1HE      HIS  46   1.223  -6.090  12.091
  352    H    SER  47           H        SER  47  -4.938  -3.637  11.186
  353    HA   SER  47           HA       SER  47  -7.308  -3.881   9.571
  354   1HB   SER  47          2HB       SER  47  -7.211  -3.066  12.009
  355   2HB   SER  47          3HB       SER  47  -6.819  -1.472  11.320
  356    HG   SER  47           HG       SER  47  -8.870  -1.326  10.751
  357    H    MET  48           H        MET  48  -8.196  -2.380   8.140
  358    HA   MET  48           HA       MET  48  -6.847  -1.197   6.058
  359   1HB   MET  48          2HB       MET  48  -9.280  -1.641   6.252
  360   2HB   MET  48          3HB       MET  48  -9.393  -0.501   7.590
  361   1HG   MET  48          2HG       MET  48  -8.570   1.286   5.927
  362   2HG   MET  48          3HG       MET  48  -8.822   0.052   4.687
  363   1HE   MET  48          1HE       MET  48 -12.137   2.096   7.219
  364   2HE   MET  48          2HE       MET  48 -11.078   0.886   7.959
  365   3HE   MET  48          3HE       MET  48 -10.398   2.423   7.378
  366    H    ASP  49           H        ASP  49  -8.007   0.234   9.117
  367    HA   ASP  49           HA       ASP  49  -7.329   2.871   8.700
  368   1HB   ASP  49          2HB       ASP  49  -7.283   1.589  11.460
  369   2HB   ASP  49          3HB       ASP  49  -7.883   3.177  10.984
  370    H    THR  50           H        THR  50  -5.621   0.485  10.596
  371    HA   THR  50           HA       THR  50  -3.359   1.880  11.345
  372    HB   THR  50           HB       THR  50  -3.312  -1.085  10.667
  373    HG1  THR  50           1HG      THR  50  -4.375  -1.146  12.871
  374   1HG2  THR  50          1HG2      THR  50  -2.075  -1.235  12.780
  375   2HG2  THR  50          2HG2      THR  50  -1.330   0.021  11.777
  376   3HG2  THR  50          3HG2      THR  50  -2.383   0.482  13.125
  377    H    LEU  51           H        LEU  51  -3.829  -0.234   8.465
  378    HA   LEU  51           HA       LEU  51  -1.229   0.134   7.348
  379   1HB   LEU  51          2HB       LEU  51  -3.890  -0.359   5.946
  380   2HB   LEU  51          3HB       LEU  51  -2.295  -0.469   5.182
  381    HG   LEU  51           HG       LEU  51  -3.001  -2.104   7.663
  382   1HD1  LEU  51          1HD1      LEU  51  -3.626  -3.973   6.131
  383   2HD1  LEU  51          2HD1      LEU  51  -4.768  -2.621   6.110
  384   3HD1  LEU  51          3HD1      LEU  51  -3.620  -2.817   4.778
  385   1HD2  LEU  51          1HD2      LEU  51  -0.634  -2.025   7.062
  386   2HD2  LEU  51          2HD2      LEU  51  -1.284  -3.636   6.746
  387   3HD2  LEU  51          3HD2      LEU  51  -1.006  -2.509   5.402
  388    H    LEU  52           H        LEU  52  -4.311   1.765   6.551
  389    HA   LEU  52           HA       LEU  52  -3.514   3.679   4.752
  390   1HB   LEU  52          2HB       LEU  52  -5.832   3.156   5.824
  391   2HB   LEU  52          3HB       LEU  52  -5.435   4.502   6.879
  392    HG   LEU  52           HG       LEU  52  -6.629   5.342   5.092
  393   1HD1  LEU  52          1HD1      LEU  52  -5.262   6.937   3.942
  394   2HD1  LEU  52          2HD1      LEU  52  -4.610   6.723   5.577
  395   3HD1  LEU  52          3HD1      LEU  52  -3.806   5.964   4.178
  396   1HD2  LEU  52          1HD2      LEU  52  -4.889   3.918   3.065
  397   2HD2  LEU  52          2HD2      LEU  52  -6.502   3.407   3.623
  398   3HD2  LEU  52          3HD2      LEU  52  -6.305   4.929   2.735
  399    H    ALA  53           H        ALA  53  -3.751   4.267   8.286
  400    HA   ALA  53           HA       ALA  53  -2.620   6.822   8.248
  401   1HB   ALA  53          1HB       ALA  53  -2.360   6.503  10.701
  402   2HB   ALA  53          2HB       ALA  53  -3.927   5.884  10.138
  403   3HB   ALA  53          3HB       ALA  53  -2.604   4.754  10.501
  404    H    THR  54           H        THR  54  -0.992   3.670   8.534
  405    HA   THR  54           HA       THR  54   1.618   4.780   9.039
  406    HB   THR  54           HB       THR  54   0.783   2.121   7.797
  407    HG1  THR  54           1HG      THR  54   0.018   2.308   9.828
  408   1HG2  THR  54          1HG2      THR  54   3.079   2.625   7.193
  409   2HG2  THR  54          2HG2      THR  54   3.452   3.121   8.865
  410   3HG2  THR  54          3HG2      THR  54   3.073   1.430   8.490
  411    H    LEU  55           H        LEU  55   0.192   3.424   6.010
  412    HA   LEU  55           HA       LEU  55   2.483   4.037   4.475
  413   1HB   LEU  55          2HB       LEU  55   1.301   3.274   2.637
  414   2HB   LEU  55          3HB       LEU  55   1.065   2.239   4.018
  415    HG   LEU  55           HG       LEU  55  -1.200   3.564   4.275
  416   1HD1  LEU  55          1HD1      LEU  55  -0.407   3.857   1.387
  417   2HD1  LEU  55          2HD1      LEU  55  -2.027   4.258   2.054
  418   3HD1  LEU  55          3HD1      LEU  55  -0.585   5.181   2.536
  419   1HD2  LEU  55          1HD2      LEU  55  -2.245   1.863   2.776
  420   2HD2  LEU  55          2HD2      LEU  55  -0.651   1.535   2.058
  421   3HD2  LEU  55          3HD2      LEU  55  -0.955   1.137   3.763
  422    H    LYS  56           H        LYS  56  -0.430   5.834   5.056
  423    HA   LYS  56           HA       LYS  56  -0.457   7.955   3.467
  424   1HB   LYS  56          2HB       LYS  56  -1.646   7.545   5.808
  425   2HB   LYS  56          3HB       LYS  56  -0.331   8.517   6.459
  426   1HG   LYS  56          2HG       LYS  56  -1.055  10.285   4.719
  427   2HG   LYS  56          3HG       LYS  56  -2.410   9.170   4.373
  428   1HD   LYS  56          2HD       LYS  56  -3.099   9.306   6.789
  429   2HD   LYS  56          3HD       LYS  56  -1.737  10.384   7.099
  430   1HE   LYS  56          2HE       LYS  56  -3.764  11.709   6.922
  431   2HE   LYS  56          3HE       LYS  56  -2.685  12.093   5.574
  432   1HZ   LYS  56          1HZ       LYS  56  -5.021  10.291   5.435
  433   2HZ   LYS  56          2HZ       LYS  56  -4.970  11.837   4.882
  434   3HZ   LYS  56          3HZ       LYS  56  -4.040  10.686   4.172
  435    H    LYS  57           H        LYS  57   2.105   7.376   5.850
  436    HA   LYS  57           HA       LYS  57   3.264   9.945   5.972
  437   1HB   LYS  57          2HB       LYS  57   4.412   7.174   6.360
  438   2HB   LYS  57          3HB       LYS  57   5.292   8.668   6.759
  439   1HG   LYS  57          2HG       LYS  57   3.467   9.309   8.297
  440   2HG   LYS  57          3HG       LYS  57   2.599   7.813   7.883
  441   1HD   LYS  57          2HD       LYS  57   4.621   6.495   8.636
  442   2HD   LYS  57          3HD       LYS  57   5.294   7.987   9.302
  443   1HE   LYS  57          2HE       LYS  57   2.663   6.606  10.069
  444   2HE   LYS  57          3HE       LYS  57   4.143   6.638  11.035
  445   1HZ   LYS  57          1HZ       LYS  57   2.564   8.227  11.821
  446   2HZ   LYS  57          2HZ       LYS  57   3.863   9.036  11.220
  447   3HZ   LYS  57          3HZ       LYS  57   2.460   8.957  10.355
  448    H    THR  58           H        THR  58   3.350   7.699   3.235
  449    HA   THR  58           HA       THR  58   5.795   8.650   2.060
  450    HB   THR  58           HB       THR  58   4.729   7.905  -0.061
  451    HG1  THR  58           1HG      THR  58   2.617   6.927   0.206
  452   1HG2  THR  58          1HG2      THR  58   4.381   5.970   2.262
  453   2HG2  THR  58          2HG2      THR  58   4.482   5.533   0.543
  454   3HG2  THR  58          3HG2      THR  58   5.876   6.273   1.359
  455    H    GLY  59           H        GLY  59   2.560  10.020   2.387
  456   1HA   GLY  59          2HA       GLY  59   1.633  11.980   1.726
  457   2HA   GLY  59          3HA       GLY  59   3.277  12.623   1.499
  458    H    LYS  60           H        LYS  60   1.162  10.136  -0.041
  459    HA   LYS  60           HA       LYS  60   1.543  11.339  -2.721
  460   1HB   LYS  60          2HB       LYS  60   1.918   8.397  -1.964
  461   2HB   LYS  60          3HB       LYS  60   1.985   9.034  -3.607
  462   1HG   LYS  60          2HG       LYS  60   3.883   9.811  -1.348
  463   2HG   LYS  60          3HG       LYS  60   4.227   8.568  -2.509
  464   1HD   LYS  60          2HD       LYS  60   4.359  10.033  -4.339
  465   2HD   LYS  60          3HD       LYS  60   3.570  11.361  -3.497
  466   1HE   LYS  60          2HE       LYS  60   6.344  10.281  -2.810
  467   2HE   LYS  60          3HE       LYS  60   5.973  11.738  -3.742
  468   1HZ   LYS  60          1HZ       LYS  60   6.316  12.512  -1.597
  469   2HZ   LYS  60          2HZ       LYS  60   4.660  12.419  -1.670
  470   3HZ   LYS  60          3HZ       LYS  60   5.499  11.287  -0.873
  471    H    THR  61           H        THR  61  -0.049  10.450  -4.292
  472    HA   THR  61           HA       THR  61  -2.631  10.565  -3.243
  473    HB   THR  61           HB       THR  61  -1.855   9.655  -6.015
  474    HG1  THR  61           1HG      THR  61  -1.550  12.316  -5.103
  475   1HG2  THR  61          1HG2      THR  61  -3.809  11.777  -5.002
  476   2HG2  THR  61          2HG2      THR  61  -3.555  11.314  -6.701
  477   3HG2  THR  61          3HG2      THR  61  -4.254  10.147  -5.561
  478    H    VAL  62           H        VAL  62  -1.637   8.354  -1.975
  479    HA   VAL  62           HA       VAL  62  -2.822   5.945  -3.228
  480    HB   VAL  62           HB       VAL  62  -0.856   5.412  -2.169
  481   1HG1  VAL  62          1HG1      VAL  62  -1.741   6.848   0.366
  482   2HG1  VAL  62          2HG1      VAL  62  -0.287   5.848   0.167
  483   3HG1  VAL  62          3HG1      VAL  62  -0.430   7.341  -0.731
  484   1HG2  VAL  62          1HG2      VAL  62  -2.976   4.667  -0.121
  485   2HG2  VAL  62          2HG2      VAL  62  -2.893   3.952  -1.737
  486   3HG2  VAL  62          3HG2      VAL  62  -1.544   3.740  -0.616
  487    H    SER  63           H        SER  63  -4.942   5.709  -3.185
  488    HA   SER  63           HA       SER  63  -6.476   6.715  -0.805
  489   1HB   SER  63          2HB       SER  63  -6.981   7.914  -2.985
  490   2HB   SER  63          3HB       SER  63  -7.525   6.356  -3.635
  491    HG   SER  63           HG       SER  63  -8.608   7.880  -1.504
  492    H    TYR  64           H        TYR  64  -8.516   5.333  -0.548
  493    HA   TYR  64           HA       TYR  64  -7.791   2.430  -0.768
  494   1HB   TYR  64          2HB       TYR  64  -7.678   3.057   1.522
  495   2HB   TYR  64          3HB       TYR  64  -9.149   4.023   1.418
  496    HD1  TYR  64           HD1      TYR  64 -11.238   3.079   2.003
  497    HD2  TYR  64           HD2      TYR  64  -7.984   0.460   0.935
  498    HE1  TYR  64           HE1      TYR  64 -12.583   1.128   2.693
  499    HE2  TYR  64           HE2      TYR  64  -9.370  -1.489   1.599
  500    HH   TYR  64           HH       TYR  64 -12.545  -1.147   3.149
  501    H    LEU  65           H        LEU  65  -9.178   1.263  -1.984
  502    HA   LEU  65           HA       LEU  65 -12.029   1.877  -2.084
  503   1HB   LEU  65          2HB       LEU  65 -11.862   1.759  -4.660
  504   2HB   LEU  65          3HB       LEU  65 -11.731   3.279  -3.788
  505    HG   LEU  65           HG       LEU  65 -10.256   3.117  -5.645
  506   1HD1  LEU  65          1HD1      LEU  65  -8.346   3.250  -3.388
  507   2HD1  LEU  65          2HD1      LEU  65  -8.508   4.281  -4.805
  508   3HD1  LEU  65          3HD1      LEU  65  -9.683   4.429  -3.509
  509   1HD2  LEU  65          1HD2      LEU  65  -8.716   0.907  -4.288
  510   2HD2  LEU  65          2HD2      LEU  65  -9.726   0.762  -5.747
  511   3HD2  LEU  65          3HD2      LEU  65  -8.276   1.755  -5.784
  512    H    GLY  66           H        GLY  66 -11.819  -0.258  -0.950
  513   1HA   GLY  66          2HA       GLY  66 -13.320  -2.048  -1.885
  514   2HA   GLY  66          3HA       GLY  66 -12.027  -2.425  -3.018
  515    H    LEU  67           H        LEU  67 -12.849  -4.467  -1.479
  516    HA   LEU  67           HA       LEU  67 -10.684  -5.159   0.177
  517   1HB   LEU  67          2HB       LEU  67 -11.796  -5.493   2.286
  518   2HB   LEU  67          3HB       LEU  67 -11.847  -3.788   1.867
  519    HG   LEU  67           HG       LEU  67 -14.161  -5.774   1.621
  520   1HD1  LEU  67          1HD1      LEU  67 -15.056  -4.600   3.591
  521   2HD1  LEU  67          2HD1      LEU  67 -13.475  -5.313   3.949
  522   3HD1  LEU  67          3HD1      LEU  67 -13.612  -3.566   3.649
  523   1HD2  LEU  67          1HD2      LEU  67 -14.594  -4.003   0.027
  524   2HD2  LEU  67          2HD2      LEU  67 -15.555  -3.656   1.458
  525   3HD2  LEU  67          3HD2      LEU  67 -14.051  -2.755   1.179
  526    H    GLU  68           H        GLU  68 -10.995  -7.456   1.007
  527    HA   GLU  68           HA       GLU  68 -12.955  -9.087  -0.413
  528   1HB   GLU  68          2HB       GLU  68 -10.599  -8.511  -1.717
  529   2HB   GLU  68          3HB       GLU  68 -10.065  -9.819  -0.635
  530   1HG   GLU  68          2HG       GLU  68 -11.701 -11.332  -1.680
  531   2HG   GLU  68          3HG       GLU  68 -12.169 -10.025  -2.795
  Start of MODEL   23
    1   1H    MET   1           H1       MET   1 -11.672  -7.672   4.352
    2   2H    MET   1           H2       MET   1 -12.131  -6.100   4.506
    3   3H    MET   1           H3       MET   1 -10.707  -6.538   3.761
    4    HA   MET   1           HA       MET   1 -10.202  -5.610   5.828
    5   1HB   MET   1          2HB       MET   1 -12.178  -5.898   7.039
    6   2HB   MET   1          3HB       MET   1 -12.092  -7.651   7.029
    7   1HG   MET   1          2HG       MET   1  -9.993  -7.553   8.372
    8   2HG   MET   1          3HG       MET   1 -10.048  -5.790   8.346
    9   1HE   MET   1          1HE       MET   1 -13.026  -5.024  10.745
   10   2HE   MET   1          2HE       MET   1 -11.730  -4.344   9.736
   11   3HE   MET   1          3HE       MET   1 -13.142  -5.130   8.978
   12    HA   PRO   2           HA       PRO   2  -7.821 -10.047   5.913
   13   1HB   PRO   2          2HB       PRO   2  -9.840 -10.856   3.760
   14   2HB   PRO   2          3HB       PRO   2  -8.701 -11.895   4.627
   15   1HG   PRO   2          2HG       PRO   2 -11.232 -11.703   5.512
   16   2HG   PRO   2          3HG       PRO   2  -9.900 -11.561   6.703
   17   1HD   PRO   2          2HD       PRO   2 -11.572  -9.385   5.486
   18   2HD   PRO   2          3HD       PRO   2 -10.930  -9.542   7.145
   19    H    LYS   3           H        LYS   3  -9.490  -8.944   2.920
   20    HA   LYS   3           HA       LYS   3  -6.913  -8.090   1.753
   21   1HB   LYS   3          2HB       LYS   3  -8.414  -9.723   0.507
   22   2HB   LYS   3          3HB       LYS   3  -9.558  -8.376   0.361
   23   1HG   LYS   3          2HG       LYS   3  -7.682  -7.052  -0.749
   24   2HG   LYS   3          3HG       LYS   3  -6.773  -8.558  -0.858
   25   1HD   LYS   3          2HD       LYS   3  -9.637  -8.289  -1.930
   26   2HD   LYS   3          3HD       LYS   3  -8.270  -7.676  -2.839
   27   1HE   LYS   3          2HE       LYS   3  -8.909  -9.869  -3.649
   28   2HE   LYS   3          3HE       LYS   3  -7.251  -9.873  -3.023
   29   1HZ   LYS   3          1HZ       LYS   3  -8.571 -11.808  -2.389
   30   2HZ   LYS   3          2HZ       LYS   3  -7.945 -11.057  -1.133
   31   3HZ   LYS   3          3HZ       LYS   3  -9.581 -10.924  -1.490
   32    H    HIS   4           H        HIS   4  -6.670  -5.938   1.104
   33    HA   HIS   4           HA       HIS   4  -8.884  -4.051   1.138
   34   1HB   HIS   4          2HB       HIS   4  -7.069  -2.512   2.358
   35   2HB   HIS   4          3HB       HIS   4  -8.384  -3.340   3.184
   36    HD1  HIS   4           1HD      HIS   4  -7.595  -5.817   4.401
   37    HD2  HIS   4           2HD      HIS   4  -4.782  -2.819   3.531
   38    HE1  HIS   4           1HE      HIS   4  -5.650  -6.180   5.948
   39    H    GLU   5           H        GLU   5  -8.619  -2.569  -0.483
   40    HA   GLU   5           HA       GLU   5  -6.284  -2.981  -2.289
   41   1HB   GLU   5          2HB       GLU   5  -9.222  -2.345  -2.715
   42   2HB   GLU   5          3HB       GLU   5  -8.057  -2.504  -4.019
   43   1HG   GLU   5          2HG       GLU   5  -7.636  -4.873  -3.259
   44   2HG   GLU   5          3HG       GLU   5  -8.815  -4.678  -1.958
   45    H    PHE   6           H        PHE   6  -5.349  -1.157  -3.349
   46    HA   PHE   6           HA       PHE   6  -6.322   1.530  -2.550
   47   1HB   PHE   6          2HB       PHE   6  -3.437   0.569  -2.313
   48   2HB   PHE   6          3HB       PHE   6  -4.024   2.161  -1.907
   49    HD1  PHE   6           1HD      PHE   6  -4.223  -1.460  -0.945
   50    HD2  PHE   6           2HD      PHE   6  -4.698   2.634   0.375
   51    HE1  PHE   6           1HE      PHE   6  -4.640  -2.238   1.339
   52    HE2  PHE   6           2HE      PHE   6  -4.903   1.840   2.680
   53    HZ   PHE   6           HZ       PHE   6  -4.992  -0.576   3.191
   54    H    SER   7           H        SER   7  -5.909   3.151  -3.989
   55    HA   SER   7           HA       SER   7  -4.504   2.453  -6.539
   56   1HB   SER   7          2HB       SER   7  -6.893   3.370  -6.714
   57   2HB   SER   7          3HB       SER   7  -6.223   4.900  -6.088
   58    HG   SER   7           HG       SER   7  -6.152   4.930  -8.321
   59    H    VAL   8           H        VAL   8  -2.587   3.526  -6.978
   60    HA   VAL   8           HA       VAL   8  -1.545   5.282  -4.814
   61    HB   VAL   8           HB       VAL   8  -0.113   2.947  -6.173
   62   1HG1  VAL   8          1HG1      VAL   8   1.152   4.877  -5.016
   63   2HG1  VAL   8          2HG1      VAL   8   0.318   4.428  -3.527
   64   3HG1  VAL   8          3HG1      VAL   8   1.421   3.272  -4.290
   65   1HG2  VAL   8          1HG2      VAL   8  -1.714   2.968  -3.574
   66   2HG2  VAL   8          2HG2      VAL   8  -1.893   1.871  -4.957
   67   3HG2  VAL   8          3HG2      VAL   8  -0.438   1.813  -3.951
   68    H    ASP   9           H        ASP   9  -1.655   7.225  -6.158
   69    HA   ASP   9           HA       ASP   9  -0.548   7.148  -8.817
   70   1HB   ASP   9          2HB       ASP   9  -2.213   8.807  -8.178
   71   2HB   ASP   9          3HB       ASP   9  -1.065   9.429  -6.969
   72    H    MET  10           H        MET  10   1.417   6.008  -8.331
   73    HA   MET  10           HA       MET  10   3.675   7.868  -7.725
   74   1HB   MET  10          2HB       MET  10   4.872   5.965  -6.796
   75   2HB   MET  10          3HB       MET  10   3.427   6.319  -5.849
   76   1HG   MET  10          2HG       MET  10   2.224   4.439  -6.898
   77   2HG   MET  10          3HG       MET  10   3.582   4.085  -7.935
   78   1HE   MET  10          1HE       MET  10   3.700   1.590  -7.296
   79   2HE   MET  10          2HE       MET  10   3.649   1.014  -5.615
   80   3HE   MET  10          3HE       MET  10   2.226   1.819  -6.319
   81    H    THR  11           H        THR  11   5.523   7.564  -9.113
   82    HA   THR  11           HA       THR  11   5.245   5.659 -11.341
   83    HB   THR  11           HB       THR  11   5.456   8.567 -12.132
   84    HG1  THR  11           1HG      THR  11   3.666   8.672 -10.920
   85   1HG2  THR  11          1HG2      THR  11   4.120   6.137 -13.411
   86   2HG2  THR  11          2HG2      THR  11   4.306   7.746 -14.140
   87   3HG2  THR  11          3HG2      THR  11   5.738   6.753 -13.814
   88    H    CYS  12           H        CYS  12   7.275   5.429  -9.525
   89    HA   CYS  12           HA       CYS  12   9.599   6.180 -11.242
   90   1HB   CYS  12          2HB       CYS  12   9.580   7.488  -9.092
   91   2HB   CYS  12          3HB       CYS  12   9.545   5.961  -8.198
   92    HG   CYS  12           HG       CYS  12  11.923   6.933  -8.060
   93    H    GLY  13           H        GLY  13  11.381   4.331 -10.817
   94   1HA   GLY  13          2HA       GLY  13  10.179   1.667 -10.587
   95   2HA   GLY  13          3HA       GLY  13  11.901   2.086 -10.524
   96    H    GLY  14           H        GLY  14  12.253   3.770  -8.564
   97   1HA   GLY  14          2HA       GLY  14  12.319   2.130  -6.300
   98   2HA   GLY  14          3HA       GLY  14  12.713   3.855  -6.332
   99    H    CYS  15           H        CYS  15   9.639   4.053  -7.346
  100    HA   CYS  15           HA       CYS  15   8.546   4.735  -4.810
  101   1HB   CYS  15          2HB       CYS  15   6.445   4.888  -5.741
  102   2HB   CYS  15          3HB       CYS  15   7.597   5.700  -6.818
  103    HG   CYS  15           HG       CYS  15   5.468   4.118  -7.803
  104    H    ALA  16           H        ALA  16   8.643   1.691  -6.707
  105    HA   ALA  16           HA       ALA  16   6.746   0.260  -5.106
  106   1HB   ALA  16          1HB       ALA  16   7.488  -0.514  -7.332
  107   2HB   ALA  16          2HB       ALA  16   9.135  -0.767  -6.713
  108   3HB   ALA  16          3HB       ALA  16   7.790  -1.754  -6.098
  109    H    GLU  17           H        GLU  17  10.297   0.670  -4.893
  110    HA   GLU  17           HA       GLU  17  10.717  -0.927  -2.585
  111   1HB   GLU  17          2HB       GLU  17  12.158   1.676  -3.225
  112   2HB   GLU  17          3HB       GLU  17  12.659   0.328  -2.202
  113   1HG   GLU  17          2HG       GLU  17  13.052  -1.104  -4.075
  114   2HG   GLU  17          3HG       GLU  17  12.340   0.068  -5.195
  115    H    ALA  18           H        ALA  18   9.792   2.527  -2.996
  116    HA   ALA  18           HA       ALA  18   9.951   3.256  -0.262
  117   1HB   ALA  18          1HB       ALA  18   8.003   4.386  -2.314
  118   2HB   ALA  18          2HB       ALA  18   8.549   5.151  -0.817
  119   3HB   ALA  18          3HB       ALA  18   9.705   4.877  -2.140
  120    H    VAL  19           H        VAL  19   7.116   2.127  -2.160
  121    HA   VAL  19           HA       VAL  19   5.294   2.050   0.007
  122    HB   VAL  19           HB       VAL  19   5.424   0.430  -2.566
  123   1HG1  VAL  19          1HG1      VAL  19   3.107   0.658  -0.597
  124   2HG1  VAL  19          2HG1      VAL  19   3.083  -0.153  -2.178
  125   3HG1  VAL  19          3HG1      VAL  19   4.059  -0.822  -0.879
  126   1HG2  VAL  19          1HG2      VAL  19   3.734   2.820  -1.669
  127   2HG2  VAL  19          2HG2      VAL  19   5.058   2.877  -2.846
  128   3HG2  VAL  19          3HG2      VAL  19   3.579   1.970  -3.213
  129    H    SER  20           H        SER  20   7.380  -0.573  -1.344
  130    HA   SER  20           HA       SER  20   6.615  -2.547   0.510
  131   1HB   SER  20          2HB       SER  20   7.994  -3.039  -1.494
  132   2HB   SER  20          3HB       SER  20   9.302  -2.016  -0.892
  133    HG   SER  20           HG       SER  20   8.416  -4.388   0.397
  134    H    ARG  21           H        ARG  21   9.296  -0.192   0.860
  135    HA   ARG  21           HA       ARG  21  10.080  -1.017   3.435
  136   1HB   ARG  21          2HB       ARG  21  10.265   1.666   2.011
  137   2HB   ARG  21          3HB       ARG  21  11.012   1.345   3.588
  138   1HG   ARG  21          2HG       ARG  21  12.318  -0.491   2.677
  139   2HG   ARG  21          3HG       ARG  21  11.552  -0.346   1.104
  140   1HD   ARG  21          2HD       ARG  21  12.457   1.931   0.845
  141   2HD   ARG  21          3HD       ARG  21  13.317   1.781   2.389
  142    HE   ARG  21           HE       ARG  21  14.400  -0.295   1.347
  143   1HH1  ARG  21          2HH2      ARG  21  13.772   2.665  -0.615
  144   2HH1  ARG  21          1HH2      ARG  21  14.510   1.889  -2.028
  145   1HH2  ARG  21          2HH1      ARG  21  15.515  -1.048  -0.605
  146   2HH2  ARG  21          1HH1      ARG  21  15.416   0.020  -2.007
  147    H    VAL  22           H        VAL  22   7.689   1.675   2.595
  148    HA   VAL  22           HA       VAL  22   7.231   2.232   5.284
  149    HB   VAL  22           HB       VAL  22   6.644   3.564   3.112
  150   1HG1  VAL  22          1HG1      VAL  22   4.290   3.527   2.490
  151   2HG1  VAL  22          2HG1      VAL  22   4.931   1.905   2.260
  152   3HG1  VAL  22          3HG1      VAL  22   3.964   2.270   3.701
  153   1HG2  VAL  22          1HG2      VAL  22   6.375   4.383   5.363
  154   2HG2  VAL  22          2HG2      VAL  22   4.950   4.827   4.379
  155   3HG2  VAL  22          3HG2      VAL  22   4.837   3.478   5.537
  156    H    LEU  23           H        LEU  23   5.496  -0.134   3.145
  157    HA   LEU  23           HA       LEU  23   3.676  -0.878   5.237
  158   1HB   LEU  23          2HB       LEU  23   4.514  -2.143   2.620
  159   2HB   LEU  23          3HB       LEU  23   3.594  -3.043   3.804
  160    HG   LEU  23           HG       LEU  23   2.098  -2.248   2.193
  161   1HD1  LEU  23          1HD1      LEU  23   0.427  -1.136   3.551
  162   2HD1  LEU  23          2HD1      LEU  23   1.250  -2.344   4.544
  163   3HD1  LEU  23          3HD1      LEU  23   1.629  -0.617   4.729
  164   1HD2  LEU  23          1HD2      LEU  23   3.368  -0.288   1.492
  165   2HD2  LEU  23          2HD2      LEU  23   1.652   0.093   1.782
  166   3HD2  LEU  23          3HD2      LEU  23   2.875   0.544   2.988
  167    H    ASN  24           H        ASN  24   6.809  -2.327   4.209
  168    HA   ASN  24           HA       ASN  24   6.897  -4.472   6.009
  169   1HB   ASN  24          2HB       ASN  24   8.562  -4.303   4.309
  170   2HB   ASN  24          3HB       ASN  24   8.970  -2.653   4.759
  171   1HD2  ASN  24          1HD2      ASN  24  10.133  -2.183   6.577
  172   2HD2  ASN  24          2HD2      ASN  24  11.200  -3.384   7.330
  173    H    LYS  25           H        LYS  25   7.850  -1.075   6.470
  174    HA   LYS  25           HA       LYS  25   8.899  -1.161   9.047
  175   1HB   LYS  25          2HB       LYS  25   7.495   0.906   7.340
  176   2HB   LYS  25          3HB       LYS  25   7.689   1.274   9.042
  177   1HG   LYS  25          2HG       LYS  25  10.012   0.394   7.272
  178   2HG   LYS  25          3HG       LYS  25   9.522   2.085   7.451
  179   1HD   LYS  25          2HD       LYS  25   9.868   1.976   9.894
  180   2HD   LYS  25          3HD       LYS  25  10.372   0.284   9.774
  181   1HE   LYS  25          2HE       LYS  25  12.266   0.957   8.286
  182   2HE   LYS  25          3HE       LYS  25  11.785   2.654   8.460
  183   1HZ   LYS  25          1HZ       LYS  25  13.554   2.071   9.957
  184   2HZ   LYS  25          2HZ       LYS  25  12.214   2.461  10.822
  185   3HZ   LYS  25          3HZ       LYS  25  12.659   0.885  10.654
  186    H    LEU  26           H        LEU  26   5.505  -1.228   8.095
  187    HA   LEU  26           HA       LEU  26   4.381  -0.655  10.645
  188   1HB   LEU  26          2HB       LEU  26   3.298  -0.705   8.416
  189   2HB   LEU  26          3HB       LEU  26   3.255  -2.443   8.415
  190    HG   LEU  26           HG       LEU  26   1.175  -1.223   8.952
  191   1HD1  LEU  26          1HD1      LEU  26   1.387  -3.589   9.456
  192   2HD1  LEU  26          2HD1      LEU  26   1.918  -3.193  11.110
  193   3HD1  LEU  26          3HD1      LEU  26   0.302  -2.719  10.556
  194   1HD2  LEU  26          1HD2      LEU  26   2.155   0.507  10.508
  195   2HD2  LEU  26          2HD2      LEU  26   0.735  -0.322  11.160
  196   3HD2  LEU  26          3HD2      LEU  26   2.348  -0.771  11.729
  197    H    GLY  27           H        GLY  27   5.612  -3.651   9.159
  198   1HA   GLY  27          2HA       GLY  27   6.229  -4.928  11.532
  199   2HA   GLY  27          3HA       GLY  27   4.524  -5.340  11.254
  200    H    GLY  28           H        GLY  28   3.960  -6.699   9.514
  201   1HA   GLY  28          2HA       GLY  28   6.026  -7.948   7.815
  202   2HA   GLY  28          3HA       GLY  28   5.314  -8.973   9.082
  203    H    VAL  29           H        VAL  29   4.035  -6.397   7.049
  204    HA   VAL  29           HA       VAL  29   1.494  -7.734   6.702
  205    HB   VAL  29           HB       VAL  29   1.316  -5.439   7.056
  206   1HG1  VAL  29          1HG1      VAL  29   2.508  -3.702   5.744
  207   2HG1  VAL  29          2HG1      VAL  29   3.473  -4.601   6.888
  208   3HG1  VAL  29          3HG1      VAL  29   3.600  -4.981   5.158
  209   1HG2  VAL  29          1HG2      VAL  29   0.291  -4.494   5.122
  210   2HG2  VAL  29          2HG2      VAL  29   1.141  -5.579   4.023
  211   3HG2  VAL  29          3HG2      VAL  29  -0.081  -6.221   5.129
  212    H    LYS  30           H        LYS  30   0.676  -8.750   4.908
  213    HA   LYS  30           HA       LYS  30   2.491  -9.157   2.584
  214   1HB   LYS  30          2HB       LYS  30   1.593 -11.146   3.290
  215   2HB   LYS  30          3HB       LYS  30  -0.023 -10.475   3.491
  216   1HG   LYS  30          2HG       LYS  30   0.085 -11.940   1.515
  217   2HG   LYS  30          3HG       LYS  30  -0.365 -10.322   1.094
  218   1HD   LYS  30          2HD       LYS  30   1.205 -11.183  -0.563
  219   2HD   LYS  30          3HD       LYS  30   1.902  -9.798   0.237
  220   1HE   LYS  30          2HE       LYS  30   3.552 -11.595  -0.077
  221   2HE   LYS  30          3HE       LYS  30   3.333 -11.219   1.633
  222   1HZ   LYS  30          1HZ       LYS  30   2.080 -13.485   0.224
  223   2HZ   LYS  30          2HZ       LYS  30   3.382 -13.581   1.227
  224   3HZ   LYS  30          3HZ       LYS  30   1.918 -13.136   1.826
  225    H    TYR  31           H        TYR  31   2.543  -7.423   1.483
  226    HA   TYR  31           HA       TYR  31   0.094  -6.232   0.263
  227   1HB   TYR  31          2HB       TYR  31   1.543  -4.285  -0.251
  228   2HB   TYR  31          3HB       TYR  31   1.266  -4.540   1.468
  229    HD1  TYR  31           HD1      TYR  31   3.779  -4.857  -1.248
  230    HD2  TYR  31           HD2      TYR  31   3.057  -5.197   2.962
  231    HE1  TYR  31           HE1      TYR  31   6.228  -5.104  -0.841
  232    HE2  TYR  31           HE2      TYR  31   5.484  -5.376   3.389
  233    HH   TYR  31           HH       TYR  31   7.573  -5.438   2.448
  234    H    ASP  32           H        ASP  32   0.139  -5.909  -2.007
  235    HA   ASP  32           HA       ASP  32   2.442  -6.946  -3.524
  236   1HB   ASP  32          2HB       ASP  32   0.529  -8.632  -3.579
  237   2HB   ASP  32          3HB       ASP  32  -0.478  -7.375  -4.304
  238    H    ILE  33           H        ILE  33   2.478  -5.910  -5.655
  239    HA   ILE  33           HA       ILE  33   1.484  -3.075  -5.538
  240    HB   ILE  33           HB       ILE  33   4.345  -3.821  -6.219
  241   1HG1  ILE  33          2HG1      ILE  33   4.542  -2.283  -3.998
  242   2HG1  ILE  33          3HG1      ILE  33   3.079  -3.155  -3.569
  243   1HG2  ILE  33          1HG2      ILE  33   2.946  -1.170  -5.730
  244   2HG2  ILE  33          2HG2      ILE  33   4.677  -1.387  -6.087
  245   3HG2  ILE  33          3HG2      ILE  33   3.468  -1.780  -7.311
  246   1HD1  ILE  33          1HD1      ILE  33   5.265  -4.202  -2.813
  247   2HD1  ILE  33          2HD1      ILE  33   4.270  -5.305  -3.786
  248   3HD1  ILE  33          3HD1      ILE  33   5.679  -4.484  -4.501
  249    H    ASP  34           H        ASP  34   0.136  -3.053  -7.262
  250    HA   ASP  34           HA       ASP  34   1.004  -4.203  -9.859
  251   1HB   ASP  34          2HB       ASP  34  -1.373  -4.398  -9.185
  252   2HB   ASP  34          3HB       ASP  34  -1.499  -2.631  -9.236
  253    H    LEU  35           H        LEU  35   2.880  -2.997  -9.961
  254    HA   LEU  35           HA       LEU  35   2.983  -0.180  -9.658
  255   1HB   LEU  35          2HB       LEU  35   4.929  -1.617  -9.367
  256   2HB   LEU  35          3HB       LEU  35   4.867  -2.116 -11.057
  257    HG   LEU  35           HG       LEU  35   5.400   0.203 -11.777
  258   1HD1  LEU  35          1HD1      LEU  35   5.667   0.756  -8.785
  259   2HD1  LEU  35          2HD1      LEU  35   6.220   1.827 -10.089
  260   3HD1  LEU  35          3HD1      LEU  35   4.494   1.513  -9.891
  261   1HD2  LEU  35          1HD2      LEU  35   7.196  -1.445 -11.438
  262   2HD2  LEU  35          2HD2      LEU  35   7.745   0.188 -11.020
  263   3HD2  LEU  35          3HD2      LEU  35   7.336  -0.965  -9.735
  264    HA   PRO  36           HA       PRO  36   2.791   0.158 -14.443
  265   1HB   PRO  36          2HB       PRO  36   1.288  -1.685 -15.854
  266   2HB   PRO  36          3HB       PRO  36   3.065  -1.728 -15.674
  267   1HG   PRO  36          2HG       PRO  36   1.003  -3.241 -14.075
  268   2HG   PRO  36          3HG       PRO  36   2.517  -3.866 -14.781
  269   1HD   PRO  36          2HD       PRO  36   2.339  -3.226 -12.209
  270   2HD   PRO  36          3HD       PRO  36   3.830  -2.818 -13.101
  271    H    ASN  37           H        ASN  37  -0.097  -1.530 -12.871
  272    HA   ASN  37           HA       ASN  37  -1.836   0.457 -14.141
  273   1HB   ASN  37          2HB       ASN  37  -2.513  -1.582 -12.011
  274   2HB   ASN  37          3HB       ASN  37  -3.636  -0.535 -12.826
  275   1HD2  ASN  37          1HD2      ASN  37  -1.451  -3.257 -13.330
  276   2HD2  ASN  37          2HD2      ASN  37  -2.118  -3.753 -14.892
  277    H    LYS  38           H        LYS  38  -0.020   0.323 -11.107
  278    HA   LYS  38           HA       LYS  38   0.404   1.927  -9.643
  279   1HB   LYS  38          2HB       LYS  38  -1.459   3.748 -11.246
  280   2HB   LYS  38          3HB       LYS  38  -0.539   4.192  -9.833
  281   1HG   LYS  38          2HG       LYS  38   1.573   3.661 -10.923
  282   2HG   LYS  38          3HG       LYS  38   0.751   2.981 -12.325
  283   1HD   LYS  38          2HD       LYS  38   1.709   5.257 -12.662
  284   2HD   LYS  38          3HD       LYS  38  -0.013   5.117 -13.075
  285   1HE   LYS  38          2HE       LYS  38  -0.712   6.328 -11.154
  286   2HE   LYS  38          3HE       LYS  38   0.810   6.027 -10.310
  287   1HZ   LYS  38          1HZ       LYS  38   0.617   8.280 -11.027
  288   2HZ   LYS  38          2HZ       LYS  38   1.919   7.564 -11.728
  289   3HZ   LYS  38          3HZ       LYS  38   0.539   7.843 -12.602
  290    H    LYS  39           H        LYS  39  -0.978  -0.128  -8.978
  291    HA   LYS  39           HA       LYS  39  -2.845   0.924  -6.956
  292   1HB   LYS  39          2HB       LYS  39  -3.385  -1.517  -8.740
  293   2HB   LYS  39          3HB       LYS  39  -4.116  -1.286  -7.162
  294   1HG   LYS  39          2HG       LYS  39  -5.786  -0.470  -8.460
  295   2HG   LYS  39          3HG       LYS  39  -4.917   1.008  -8.065
  296   1HD   LYS  39          2HD       LYS  39  -3.621   0.494 -10.305
  297   2HD   LYS  39          3HD       LYS  39  -4.995  -0.555 -10.658
  298   1HE   LYS  39          2HE       LYS  39  -6.538   1.394 -10.370
  299   2HE   LYS  39          3HE       LYS  39  -5.162   2.419  -9.911
  300   1HZ   LYS  39          1HZ       LYS  39  -5.723   2.774 -12.182
  301   2HZ   LYS  39          2HZ       LYS  39  -4.230   2.089 -12.071
  302   3HZ   LYS  39          3HZ       LYS  39  -5.514   1.179 -12.553
  303    H    VAL  40           H        VAL  40  -2.820  -0.380  -4.971
  304    HA   VAL  40           HA       VAL  40  -0.736  -2.459  -4.800
  305    HB   VAL  40           HB       VAL  40  -1.379  -0.027  -3.116
  306   1HG1  VAL  40          1HG1      VAL  40  -1.868  -1.693  -1.583
  307   2HG1  VAL  40          2HG1      VAL  40  -0.399  -2.638  -1.972
  308   3HG1  VAL  40          3HG1      VAL  40  -0.270  -1.048  -1.168
  309   1HG2  VAL  40          1HG2      VAL  40   1.242  -1.467  -3.668
  310   2HG2  VAL  40          2HG2      VAL  40   0.580  -0.164  -4.682
  311   3HG2  VAL  40          3HG2      VAL  40   1.010   0.164  -2.990
  312    H    CYS  41           H        CYS  41  -1.529  -4.268  -3.723
  313    HA   CYS  41           HA       CYS  41  -4.330  -4.153  -2.673
  314   1HB   CYS  41          2HB       CYS  41  -3.203  -6.203  -4.625
  315   2HB   CYS  41          3HB       CYS  41  -4.578  -6.525  -3.541
  316    HG   CYS  41           HG       CYS  41  -4.307  -4.004  -5.626
  317    H    ILE  42           H        ILE  42  -4.430  -5.049  -0.661
  318    HA   ILE  42           HA       ILE  42  -1.984  -6.453   0.310
  319    HB   ILE  42           HB       ILE  42  -3.747  -4.517   1.831
  320   1HG1  ILE  42          2HG1      ILE  42  -1.065  -4.092   0.443
  321   2HG1  ILE  42          3HG1      ILE  42  -2.574  -3.211   0.184
  322   1HG2  ILE  42          1HG2      ILE  42  -2.563  -6.315   3.164
  323   2HG2  ILE  42          2HG2      ILE  42  -1.022  -5.642   2.576
  324   3HG2  ILE  42          3HG2      ILE  42  -2.101  -4.679   3.588
  325   1HD1  ILE  42          1HD1      ILE  42  -2.385  -2.304   2.525
  326   2HD1  ILE  42          2HD1      ILE  42  -0.770  -3.051   2.615
  327   3HD1  ILE  42          3HD1      ILE  42  -1.100  -1.795   1.415
  328    H    GLU  43           H        GLU  43  -2.316  -8.255   1.445
  329    HA   GLU  43           HA       GLU  43  -5.075  -9.097   2.096
  330   1HB   GLU  43          2HB       GLU  43  -4.538  -9.904  -0.192
  331   2HB   GLU  43          3HB       GLU  43  -3.174 -10.825   0.459
  332   1HG   GLU  43          2HG       GLU  43  -4.643 -12.234   1.753
  333   2HG   GLU  43          3HG       GLU  43  -6.022 -11.145   1.510
  334    H    SER  44           H        SER  44  -4.638  -8.852   4.261
  335    HA   SER  44           HA       SER  44  -2.558 -10.460   5.531
  336   1HB   SER  44          2HB       SER  44  -1.584  -8.224   4.414
  337   2HB   SER  44          3HB       SER  44  -2.286  -7.453   5.830
  338    HG   SER  44           HG       SER  44  -0.905  -8.752   7.103
  339    H    GLU  45           H        GLU  45  -3.093 -10.660   7.784
  340    HA   GLU  45           HA       GLU  45  -5.714  -9.714   8.565
  341   1HB   GLU  45          2HB       GLU  45  -3.529 -11.124  10.159
  342   2HB   GLU  45          3HB       GLU  45  -5.210 -10.890  10.662
  343   1HG   GLU  45          2HG       GLU  45  -5.985 -12.195   8.688
  344   2HG   GLU  45          3HG       GLU  45  -4.301 -12.489   8.216
  345    H    HIS  46           H        HIS  46  -5.047  -7.388   8.098
  346    HA   HIS  46           HA       HIS  46  -4.268  -6.101  10.686
  347   1HB   HIS  46          2HB       HIS  46  -3.421  -5.249   7.887
  348   2HB   HIS  46          3HB       HIS  46  -3.167  -4.305   9.359
  349    HD1  HIS  46           1HD      HIS  46  -1.964  -6.445  11.306
  350    HD2  HIS  46           2HD      HIS  46  -1.024  -5.983   7.239
  351    HE1  HIS  46           1HE      HIS  46   0.432  -7.281  11.007
  352    H    SER  47           H        SER  47  -5.243  -4.090  11.076
  353    HA   SER  47           HA       SER  47  -7.858  -3.729   9.856
  354   1HB   SER  47          2HB       SER  47  -7.418  -3.245  12.264
  355   2HB   SER  47          3HB       SER  47  -6.412  -1.866  11.766
  356    HG   SER  47           HG       SER  47  -8.146  -0.795  11.375
  357    H    MET  48           H        MET  48  -8.436  -2.160   8.445
  358    HA   MET  48           HA       MET  48  -6.510  -1.611   6.408
  359   1HB   MET  48          2HB       MET  48  -9.332  -0.492   6.696
  360   2HB   MET  48          3HB       MET  48  -8.386  -0.652   5.204
  361   1HG   MET  48          2HG       MET  48  -8.326  -3.150   5.617
  362   2HG   MET  48          3HG       MET  48  -9.473  -2.922   6.935
  363   1HE   MET  48          1HE       MET  48 -11.462  -0.669   5.687
  364   2HE   MET  48          2HE       MET  48 -12.711  -1.780   5.088
  365   3HE   MET  48          3HE       MET  48 -11.945  -2.082   6.665
  366    H    ASP  49           H        ASP  49  -8.090   0.350   8.871
  367    HA   ASP  49           HA       ASP  49  -7.343   2.957   8.105
  368   1HB   ASP  49          2HB       ASP  49  -7.940   3.591  10.311
  369   2HB   ASP  49          3HB       ASP  49  -9.055   2.305   9.847
  370    H    THR  50           H        THR  50  -5.832   0.638  10.168
  371    HA   THR  50           HA       THR  50  -3.635   2.124  11.074
  372    HB   THR  50           HB       THR  50  -3.900  -0.900  10.744
  373    HG1  THR  50           1HG      THR  50  -5.636   0.307  11.937
  374   1HG2  THR  50          1HG2      THR  50  -1.608  -0.248  11.352
  375   2HG2  THR  50          2HG2      THR  50  -2.233   0.766  12.675
  376   3HG2  THR  50          3HG2      THR  50  -2.434  -0.997  12.731
  377    H    LEU  51           H        LEU  51  -3.842  -0.190   8.295
  378    HA   LEU  51           HA       LEU  51  -1.117   0.328   7.458
  379   1HB   LEU  51          2HB       LEU  51  -3.457  -0.558   5.736
  380   2HB   LEU  51          3HB       LEU  51  -1.736  -0.550   5.309
  381    HG   LEU  51           HG       LEU  51  -3.221  -2.308   7.292
  382   1HD1  LEU  51          1HD1      LEU  51  -1.194  -2.836   5.079
  383   2HD1  LEU  51          2HD1      LEU  51  -2.245  -4.042   5.874
  384   3HD1  LEU  51          3HD1      LEU  51  -2.933  -2.755   4.836
  385   1HD2  LEU  51          1HD2      LEU  51  -0.190  -1.932   7.124
  386   2HD2  LEU  51          2HD2      LEU  51  -1.213  -1.693   8.569
  387   3HD2  LEU  51          3HD2      LEU  51  -0.986  -3.313   7.903
  388    H    LEU  52           H        LEU  52  -4.274   1.675   6.345
  389    HA   LEU  52           HA       LEU  52  -3.411   3.607   4.574
  390   1HB   LEU  52          2HB       LEU  52  -5.595   3.415   6.565
  391   2HB   LEU  52          3HB       LEU  52  -5.208   5.063   6.098
  392    HG   LEU  52           HG       LEU  52  -5.967   2.804   4.221
  393   1HD1  LEU  52          1HD1      LEU  52  -7.612   5.106   5.310
  394   2HD1  LEU  52          2HD1      LEU  52  -8.135   3.953   4.062
  395   3HD1  LEU  52          3HD1      LEU  52  -7.790   3.379   5.701
  396   1HD2  LEU  52          1HD2      LEU  52  -6.339   4.730   2.598
  397   2HD2  LEU  52          2HD2      LEU  52  -5.604   5.819   3.783
  398   3HD2  LEU  52          3HD2      LEU  52  -4.639   4.536   3.025
  399    H    ALA  53           H        ALA  53  -3.498   4.039   8.146
  400    HA   ALA  53           HA       ALA  53  -2.177   6.529   8.222
  401   1HB   ALA  53          1HB       ALA  53  -1.771   6.036  10.586
  402   2HB   ALA  53          2HB       ALA  53  -3.414   5.539  10.134
  403   3HB   ALA  53          3HB       ALA  53  -2.137   4.321  10.322
  404    H    THR  54           H        THR  54  -0.708   3.261   8.335
  405    HA   THR  54           HA       THR  54   1.917   4.354   8.533
  406    HB   THR  54           HB       THR  54   1.012   1.815   8.617
  407    HG1  THR  54           1HG      THR  54   3.279   1.477   8.967
  408   1HG2  THR  54          1HG2      THR  54   1.154   1.514   6.168
  409   2HG2  THR  54          2HG2      THR  54   2.851   2.080   6.231
  410   3HG2  THR  54          3HG2      THR  54   2.371   0.558   6.990
  411    H    LEU  55           H        LEU  55   0.179   3.321   5.598
  412    HA   LEU  55           HA       LEU  55   2.432   3.926   3.965
  413   1HB   LEU  55          2HB       LEU  55   1.141   3.281   2.119
  414   2HB   LEU  55          3HB       LEU  55   1.054   2.160   3.455
  415    HG   LEU  55           HG       LEU  55  -1.186   3.557   3.982
  416   1HD1  LEU  55          1HD1      LEU  55  -2.249   4.209   1.889
  417   2HD1  LEU  55          2HD1      LEU  55  -0.661   5.015   2.038
  418   3HD1  LEU  55          3HD1      LEU  55  -0.828   3.607   0.980
  419   1HD2  LEU  55          1HD2      LEU  55  -0.952   1.117   3.680
  420   2HD2  LEU  55          2HD2      LEU  55  -2.371   1.737   2.813
  421   3HD2  LEU  55          3HD2      LEU  55  -0.883   1.334   1.921
  422    H    LYS  56           H        LYS  56  -0.467   5.730   4.665
  423    HA   LYS  56           HA       LYS  56  -0.481   7.904   3.092
  424   1HB   LYS  56          2HB       LYS  56  -0.747   7.503   6.052
  425   2HB   LYS  56          3HB       LYS  56  -0.569   9.164   5.566
  426   1HG   LYS  56          2HG       LYS  56  -2.483   8.997   4.015
  427   2HG   LYS  56          3HG       LYS  56  -2.718   7.303   4.497
  428   1HD   LYS  56          2HD       LYS  56  -2.801   8.090   6.892
  429   2HD   LYS  56          3HD       LYS  56  -2.736   9.757   6.318
  430   1HE   LYS  56          2HE       LYS  56  -4.880   9.409   5.066
  431   2HE   LYS  56          3HE       LYS  56  -4.920   7.717   5.595
  432   1HZ   LYS  56          1HZ       LYS  56  -6.340   9.090   6.930
  433   2HZ   LYS  56          2HZ       LYS  56  -5.129   8.483   7.858
  434   3HZ   LYS  56          3HZ       LYS  56  -5.092  10.058   7.377
  435    H    LYS  57           H        LYS  57   1.987   7.330   5.565
  436    HA   LYS  57           HA       LYS  57   3.342   9.758   5.638
  437   1HB   LYS  57          2HB       LYS  57   4.289   6.909   5.856
  438   2HB   LYS  57          3HB       LYS  57   5.321   8.306   6.264
  439   1HG   LYS  57          2HG       LYS  57   3.417   8.972   7.886
  440   2HG   LYS  57          3HG       LYS  57   2.786   7.345   7.668
  441   1HD   LYS  57          2HD       LYS  57   5.480   8.236   8.791
  442   2HD   LYS  57          3HD       LYS  57   4.188   7.427   9.669
  443   1HE   LYS  57          2HE       LYS  57   5.990   6.211   7.507
  444   2HE   LYS  57          3HE       LYS  57   6.082   5.914   9.244
  445   1HZ   LYS  57          1HZ       LYS  57   3.828   5.190   7.505
  446   2HZ   LYS  57          2HZ       LYS  57   4.925   4.133   8.104
  447   3HZ   LYS  57          3HZ       LYS  57   3.895   4.887   9.121
  448    H    THR  58           H        THR  58   3.325   7.513   2.872
  449    HA   THR  58           HA       THR  58   5.771   8.321   1.661
  450    HB   THR  58           HB       THR  58   4.523   7.743  -0.481
  451    HG1  THR  58           1HG      THR  58   2.398   8.287   0.448
  452   1HG2  THR  58          1HG2      THR  58   5.803   6.073   0.760
  453   2HG2  THR  58          2HG2      THR  58   4.414   5.774   1.826
  454   3HG2  THR  58          3HG2      THR  58   4.314   5.349   0.102
  455    H    GLY  59           H        GLY  59   2.716  10.025   2.075
  456   1HA   GLY  59          2HA       GLY  59   2.027  12.085   1.435
  457   2HA   GLY  59          3HA       GLY  59   3.749  12.498   1.241
  458    H    LYS  60           H        LYS  60   1.290  10.452  -0.425
  459    HA   LYS  60           HA       LYS  60   1.836  11.748  -3.028
  460   1HB   LYS  60          2HB       LYS  60   1.698   8.746  -2.449
  461   2HB   LYS  60          3HB       LYS  60   1.796   9.454  -4.056
  462   1HG   LYS  60          2HG       LYS  60   3.902   9.709  -1.854
  463   2HG   LYS  60          3HG       LYS  60   3.958   8.533  -3.140
  464   1HD   LYS  60          2HD       LYS  60   4.340  10.111  -4.833
  465   2HD   LYS  60          3HD       LYS  60   3.801  11.478  -3.873
  466   1HE   LYS  60          2HE       LYS  60   6.350   9.892  -3.314
  467   2HE   LYS  60          3HE       LYS  60   6.232  11.442  -4.157
  468   1HZ   LYS  60          1HZ       LYS  60   5.076  12.223  -2.023
  469   2HZ   LYS  60          2HZ       LYS  60   5.713  10.923  -1.306
  470   3HZ   LYS  60          3HZ       LYS  60   6.722  12.025  -1.980
  471    H    THR  61           H        THR  61   0.084  11.156  -4.620
  472    HA   THR  61           HA       THR  61  -2.544  11.230  -3.457
  473    HB   THR  61           HB       THR  61  -2.701  10.736  -6.165
  474    HG1  THR  61           1HG      THR  61  -0.915  11.589  -7.132
  475   1HG2  THR  61          1HG2      THR  61  -2.345  13.419  -4.770
  476   2HG2  THR  61          2HG2      THR  61  -3.031  13.186  -6.393
  477   3HG2  THR  61          3HG2      THR  61  -3.879  12.537  -4.976
  478    H    VAL  62           H        VAL  62  -1.825   9.255  -2.241
  479    HA   VAL  62           HA       VAL  62  -2.746   6.780  -3.634
  480    HB   VAL  62           HB       VAL  62  -0.617   6.401  -2.692
  481   1HG1  VAL  62          1HG1      VAL  62  -0.136   6.677  -0.260
  482   2HG1  VAL  62          2HG1      VAL  62  -0.349   8.198  -1.134
  483   3HG1  VAL  62          3HG1      VAL  62  -1.656   7.584  -0.095
  484   1HG2  VAL  62          1HG2      VAL  62  -1.030   4.553  -1.237
  485   2HG2  VAL  62          2HG2      VAL  62  -2.559   5.244  -0.655
  486   3HG2  VAL  62          3HG2      VAL  62  -2.427   4.660  -2.323
  487    H    SER  63           H        SER  63  -4.530   5.631  -2.834
  488    HA   SER  63           HA       SER  63  -5.767   6.455  -0.348
  489   1HB   SER  63          2HB       SER  63  -6.687   8.135  -2.044
  490   2HB   SER  63          3HB       SER  63  -7.445   6.756  -2.869
  491    HG   SER  63           HG       SER  63  -7.936   7.812  -0.294
  492    H    TYR  64           H        TYR  64  -8.013   5.235  -0.329
  493    HA   TYR  64           HA       TYR  64  -7.317   2.340  -0.687
  494   1HB   TYR  64          2HB       TYR  64  -7.204   2.779   1.594
  495   2HB   TYR  64          3HB       TYR  64  -8.522   3.949   1.545
  496    HD1  TYR  64           HD1      TYR  64 -10.770   3.342   1.895
  497    HD2  TYR  64           HD2      TYR  64  -7.793   0.273   1.314
  498    HE1  TYR  64           HE1      TYR  64 -12.452   1.620   2.425
  499    HE2  TYR  64           HE2      TYR  64  -9.488  -1.456   1.879
  500    HH   TYR  64           HH       TYR  64 -12.896  -0.605   2.555
  501    H    LEU  65           H        LEU  65  -8.759   1.133  -1.845
  502    HA   LEU  65           HA       LEU  65 -11.569   1.861  -2.134
  503   1HB   LEU  65          2HB       LEU  65 -11.237   1.666  -4.693
  504   2HB   LEU  65          3HB       LEU  65 -11.122   3.205  -3.850
  505    HG   LEU  65           HG       LEU  65  -9.523   2.957  -5.601
  506   1HD1  LEU  65          1HD1      LEU  65  -9.070   4.313  -3.490
  507   2HD1  LEU  65          2HD1      LEU  65  -7.811   3.081  -3.212
  508   3HD1  LEU  65          3HD1      LEU  65  -7.793   4.063  -4.670
  509   1HD2  LEU  65          1HD2      LEU  65  -8.179   0.715  -4.103
  510   2HD2  LEU  65          2HD2      LEU  65  -9.105   0.575  -5.617
  511   3HD2  LEU  65          3HD2      LEU  65  -7.610   1.488  -5.594
  512    H    GLY  66           H        GLY  66 -11.534  -0.269  -0.972
  513   1HA   GLY  66          2HA       GLY  66 -13.049  -2.015  -2.002
  514   2HA   GLY  66          3HA       GLY  66 -11.681  -2.468  -3.022
  515    H    LEU  67           H        LEU  67 -12.849  -4.363  -1.321
  516    HA   LEU  67           HA       LEU  67 -10.677  -5.086   0.358
  517   1HB   LEU  67          2HB       LEU  67 -11.761  -5.104   2.488
  518   2HB   LEU  67          3HB       LEU  67 -11.825  -3.463   1.904
  519    HG   LEU  67           HG       LEU  67 -14.241  -5.092   1.190
  520   1HD1  LEU  67          1HD1      LEU  67 -13.768  -6.136   3.320
  521   2HD1  LEU  67          2HD1      LEU  67 -13.570  -4.550   4.106
  522   3HD1  LEU  67          3HD1      LEU  67 -15.158  -5.059   3.482
  523   1HD2  LEU  67          1HD2      LEU  67 -14.023  -2.595   0.927
  524   2HD2  LEU  67          2HD2      LEU  67 -15.438  -3.151   1.842
  525   3HD2  LEU  67          3HD2      LEU  67 -14.043  -2.487   2.708
  526    H    GLU  68           H        GLU  68 -11.107  -7.135   1.506
  527    HA   GLU  68           HA       GLU  68 -13.623  -8.506   0.937
  528   1HB   GLU  68          2HB       GLU  68 -11.729  -9.319  -0.686
  529   2HB   GLU  68          3HB       GLU  68 -10.976 -10.011   0.769
  530   1HG   GLU  68          2HG       GLU  68 -12.974 -11.395   1.145
  531   2HG   GLU  68          3HG       GLU  68 -13.741 -10.689  -0.293
  Start of MODEL   24
    1   1H    MET   1           H1       MET   1  -9.196 -13.382   7.128
    2   2H    MET   1           H2       MET   1  -8.386 -12.871   8.497
    3   3H    MET   1           H3       MET   1  -9.613 -11.974   7.895
    4    HA   MET   1           HA       MET   1  -7.421 -11.086   7.433
    5   1HB   MET   1          2HB       MET   1  -6.302 -13.233   7.278
    6   2HB   MET   1          3HB       MET   1  -7.168 -13.633   5.787
    7   1HG   MET   1          2HG       MET   1  -6.125 -11.688   4.654
    8   2HG   MET   1          3HG       MET   1  -5.273 -11.286   6.143
    9   1HE   MET   1          1HE       MET   1  -3.361 -12.837   7.196
   10   2HE   MET   1          2HE       MET   1  -4.324 -14.336   7.087
   11   3HE   MET   1          3HE       MET   1  -2.702 -14.268   6.372
   12    HA   PRO   2           HA       PRO   2 -10.275  -9.908   4.035
   13   1HB   PRO   2          2HB       PRO   2 -10.258  -7.276   4.295
   14   2HB   PRO   2          3HB       PRO   2 -11.061  -8.280   5.543
   15   1HG   PRO   2          2HG       PRO   2  -8.284  -7.042   5.659
   16   2HG   PRO   2          3HG       PRO   2  -9.530  -7.041   6.939
   17   1HD   PRO   2          2HD       PRO   2  -7.445  -8.858   6.791
   18   2HD   PRO   2          3HD       PRO   2  -9.027  -9.246   7.539
   19    H    LYS   3           H        LYS   3 -10.030  -8.696   2.058
   20    HA   LYS   3           HA       LYS   3  -7.211  -8.214   1.197
   21   1HB   LYS   3          2HB       LYS   3  -8.258 -10.119   0.142
   22   2HB   LYS   3          3HB       LYS   3  -9.660  -9.179  -0.327
   23   1HG   LYS   3          2HG       LYS   3  -6.938  -8.228  -1.252
   24   2HG   LYS   3          3HG       LYS   3  -7.584  -9.717  -1.954
   25   1HD   LYS   3          2HD       LYS   3  -9.674  -8.605  -2.575
   26   2HD   LYS   3          3HD       LYS   3  -9.105  -7.070  -1.893
   27   1HE   LYS   3          2HE       LYS   3  -7.312  -6.959  -3.570
   28   2HE   LYS   3          3HE       LYS   3  -7.811  -8.528  -4.241
   29   1HZ   LYS   3          1HZ       LYS   3  -9.596  -6.185  -4.071
   30   2HZ   LYS   3          2HZ       LYS   3  -8.748  -6.536  -5.435
   31   3HZ   LYS   3          3HZ       LYS   3  -9.958  -7.529  -4.794
   32    H    HIS   4           H        HIS   4  -6.767  -6.151   0.376
   33    HA   HIS   4           HA       HIS   4  -8.975  -4.239  -0.002
   34   1HB   HIS   4          2HB       HIS   4  -7.541  -2.777   1.614
   35   2HB   HIS   4          3HB       HIS   4  -8.809  -3.836   2.216
   36    HD1  HIS   4           1HD      HIS   4  -7.422  -6.503   2.914
   37    HD2  HIS   4           2HD      HIS   4  -5.619  -2.712   3.285
   38    HE1  HIS   4           1HE      HIS   4  -5.578  -6.739   4.619
   39    H    GLU   5           H        GLU   5  -8.547  -2.746  -1.456
   40    HA   GLU   5           HA       GLU   5  -5.876  -2.715  -2.749
   41   1HB   GLU   5          2HB       GLU   5  -8.689  -2.202  -3.797
   42   2HB   GLU   5          3HB       GLU   5  -7.237  -1.782  -4.685
   43   1HG   GLU   5          2HG       GLU   5  -6.558  -4.269  -4.263
   44   2HG   GLU   5          3HG       GLU   5  -8.243  -4.499  -3.787
   45    H    PHE   6           H        PHE   6  -4.998  -0.837  -3.509
   46    HA   PHE   6           HA       PHE   6  -6.203   1.785  -2.881
   47   1HB   PHE   6          2HB       PHE   6  -3.288   1.063  -2.267
   48   2HB   PHE   6          3HB       PHE   6  -4.086   2.599  -1.973
   49    HD1  PHE   6           1HD      PHE   6  -4.558   3.083   0.288
   50    HD2  PHE   6           2HD      PHE   6  -4.218  -1.044  -0.934
   51    HE1  PHE   6           1HE      PHE   6  -4.855   2.346   2.635
   52    HE2  PHE   6           2HE      PHE   6  -4.601  -1.766   1.378
   53    HZ   PHE   6           HZ       PHE   6  -4.912  -0.075   3.190
   54    H    SER   7           H        SER   7  -6.084   3.057  -4.590
   55    HA   SER   7           HA       SER   7  -4.450   2.316  -6.901
   56   1HB   SER   7          2HB       SER   7  -6.197   4.708  -6.193
   57   2HB   SER   7          3HB       SER   7  -5.368   4.425  -7.703
   58    HG   SER   7           HG       SER   7  -7.544   3.659  -7.782
   59    H    VAL   8           H        VAL   8  -2.351   2.942  -7.103
   60    HA   VAL   8           HA       VAL   8  -1.218   5.051  -5.311
   61    HB   VAL   8           HB       VAL   8   0.042   2.507  -6.455
   62   1HG1  VAL   8          1HG1      VAL   8   1.133   4.741  -4.724
   63   2HG1  VAL   8          2HG1      VAL   8   1.875   3.122  -4.801
   64   3HG1  VAL   8          3HG1      VAL   8   1.745   4.079  -6.271
   65   1HG2  VAL   8          1HG2      VAL   8  -0.812   3.299  -3.617
   66   2HG2  VAL   8          2HG2      VAL   8  -1.541   1.997  -4.579
   67   3HG2  VAL   8          3HG2      VAL   8   0.123   1.859  -4.003
   68    H    ASP   9           H        ASP   9  -1.669   6.716  -6.896
   69    HA   ASP   9           HA       ASP   9  -0.627   6.330  -9.559
   70   1HB   ASP   9          2HB       ASP   9  -2.514   7.966  -8.921
   71   2HB   ASP   9          3HB       ASP   9  -1.224   9.098  -8.540
   72    H    MET  10           H        MET  10   1.445   5.596  -9.033
   73    HA   MET  10           HA       MET  10   3.472   7.767  -8.636
   74   1HB   MET  10          2HB       MET  10   3.563   4.793  -7.932
   75   2HB   MET  10          3HB       MET  10   4.908   5.933  -7.789
   76   1HG   MET  10          2HG       MET  10   2.253   6.228  -6.329
   77   2HG   MET  10          3HG       MET  10   3.647   5.431  -5.645
   78   1HE   MET  10          1HE       MET  10   5.873   6.696  -4.916
   79   2HE   MET  10          2HE       MET  10   6.126   7.401  -6.540
   80   3HE   MET  10          3HE       MET  10   6.136   8.443  -5.112
   81    H    THR  11           H        THR  11   5.311   7.597 -10.010
   82    HA   THR  11           HA       THR  11   5.548   5.345 -11.838
   83    HB   THR  11           HB       THR  11   5.349   8.126 -13.087
   84    HG1  THR  11           1HG      THR  11   3.447   6.193 -12.499
   85   1HG2  THR  11          1HG2      THR  11   6.614   6.427 -14.418
   86   2HG2  THR  11          2HG2      THR  11   5.248   5.305 -14.274
   87   3HG2  THR  11          3HG2      THR  11   5.068   6.822 -15.177
   88    H    CYS  12           H        CYS  12   7.049   5.884  -9.672
   89    HA   CYS  12           HA       CYS  12   9.572   7.138 -10.698
   90   1HB   CYS  12          2HB       CYS  12   8.821   8.031  -8.612
   91   2HB   CYS  12          3HB       CYS  12   8.601   6.418  -7.917
   92    HG   CYS  12           HG       CYS  12  10.671   7.561  -6.849
   93    H    GLY  13           H        GLY  13   8.049   4.039 -10.116
   94   1HA   GLY  13          2HA       GLY  13   8.907   1.902 -10.364
   95   2HA   GLY  13          3HA       GLY  13  10.500   2.562 -10.774
   96    H    GLY  14           H        GLY  14  11.473   3.876  -8.816
   97   1HA   GLY  14          2HA       GLY  14  11.913   2.312  -6.488
   98   2HA   GLY  14          3HA       GLY  14  12.201   4.057  -6.646
   99    H    CYS  15           H        CYS  15   9.192   4.257  -7.366
  100    HA   CYS  15           HA       CYS  15   7.894   4.825  -4.989
  101   1HB   CYS  15          2HB       CYS  15   5.809   4.488  -6.093
  102   2HB   CYS  15          3HB       CYS  15   6.956   5.291  -7.172
  103    HG   CYS  15           HG       CYS  15   7.680   2.768  -8.151
  104    H    ALA  16           H        ALA  16   8.300   1.602  -6.573
  105    HA   ALA  16           HA       ALA  16   6.661   0.205  -4.696
  106   1HB   ALA  16          1HB       ALA  16   7.715  -1.818  -5.710
  107   2HB   ALA  16          2HB       ALA  16   7.156  -0.681  -6.950
  108   3HB   ALA  16          3HB       ALA  16   8.885  -0.783  -6.552
  109    H    GLU  17           H        GLU  17  10.205   0.809  -4.932
  110    HA   GLU  17           HA       GLU  17  10.969  -0.730  -2.711
  111   1HB   GLU  17          2HB       GLU  17  12.092   1.796  -3.984
  112   2HB   GLU  17          3HB       GLU  17  12.893   1.006  -2.653
  113   1HG   GLU  17          2HG       GLU  17  12.093  -0.880  -4.835
  114   2HG   GLU  17          3HG       GLU  17  13.218   0.380  -5.318
  115    H    ALA  18           H        ALA  18   9.814   2.633  -2.934
  116    HA   ALA  18           HA       ALA  18  10.265   3.299  -0.171
  117   1HB   ALA  18          1HB       ALA  18   8.825   5.242  -0.641
  118   2HB   ALA  18          2HB       ALA  18  10.020   5.000  -1.932
  119   3HB   ALA  18          3HB       ALA  18   8.328   4.525  -2.186
  120    H    VAL  19           H        VAL  19   7.288   2.399  -1.962
  121    HA   VAL  19           HA       VAL  19   5.531   2.353   0.252
  122    HB   VAL  19           HB       VAL  19   5.535   0.893  -2.414
  123   1HG1  VAL  19          1HG1      VAL  19   3.248   1.091  -0.410
  124   2HG1  VAL  19          2HG1      VAL  19   3.177   0.438  -2.062
  125   3HG1  VAL  19          3HG1      VAL  19   4.115  -0.409  -0.837
  126   1HG2  VAL  19          1HG2      VAL  19   5.301   3.430  -2.404
  127   2HG2  VAL  19          2HG2      VAL  19   3.874   2.587  -3.026
  128   3HG2  VAL  19          3HG2      VAL  19   3.874   3.246  -1.378
  129    H    SER  20           H        SER  20   7.399  -0.336  -1.244
  130    HA   SER  20           HA       SER  20   6.668  -2.385   0.515
  131   1HB   SER  20          2HB       SER  20   8.068  -2.830  -1.473
  132   2HB   SER  20          3HB       SER  20   9.311  -1.712  -0.904
  133    HG   SER  20           HG       SER  20   8.698  -4.239   0.198
  134    H    ARG  21           H        ARG  21   9.472  -0.117   0.962
  135    HA   ARG  21           HA       ARG  21  10.119  -1.108   3.498
  136   1HB   ARG  21          2HB       ARG  21  10.515   1.598   2.180
  137   2HB   ARG  21          3HB       ARG  21  11.211   1.193   3.765
  138   1HG   ARG  21          2HG       ARG  21  12.451  -0.633   2.900
  139   2HG   ARG  21          3HG       ARG  21  11.563  -0.680   1.412
  140   1HD   ARG  21          2HD       ARG  21  12.536   1.553   0.751
  141   2HD   ARG  21          3HD       ARG  21  13.456   1.560   2.256
  142    HE   ARG  21           HE       ARG  21  15.043   0.299   1.219
  143   1HH1  ARG  21          2HH2      ARG  21  11.943  -0.373  -0.459
  144   2HH1  ARG  21          1HH2      ARG  21  12.771  -1.390  -1.649
  145   1HH2  ARG  21          2HH1      ARG  21  16.003  -0.921  -0.608
  146   2HH2  ARG  21          1HH1      ARG  21  14.878  -1.526  -1.811
  147    H    VAL  22           H        VAL  22   7.847   1.707   2.771
  148    HA   VAL  22           HA       VAL  22   7.391   2.140   5.485
  149    HB   VAL  22           HB       VAL  22   6.765   3.561   3.358
  150   1HG1  VAL  22          1HG1      VAL  22   4.939   2.042   2.525
  151   2HG1  VAL  22          2HG1      VAL  22   4.085   2.312   4.062
  152   3HG1  VAL  22          3HG1      VAL  22   4.354   3.648   2.933
  153   1HG2  VAL  22          1HG2      VAL  22   5.217   4.834   4.809
  154   2HG2  VAL  22          2HG2      VAL  22   5.142   3.434   5.912
  155   3HG2  VAL  22          3HG2      VAL  22   6.691   4.296   5.654
  156    H    LEU  23           H        LEU  23   5.518  -0.008   3.234
  157    HA   LEU  23           HA       LEU  23   3.685  -0.804   5.229
  158   1HB   LEU  23          2HB       LEU  23   4.579  -1.988   2.588
  159   2HB   LEU  23          3HB       LEU  23   3.613  -2.945   3.689
  160    HG   LEU  23           HG       LEU  23   2.198  -2.002   2.041
  161   1HD1  LEU  23          1HD1      LEU  23   1.626  -0.699   4.743
  162   2HD1  LEU  23          2HD1      LEU  23   0.475  -1.013   3.440
  163   3HD1  LEU  23          3HD1      LEU  23   1.222  -2.369   4.282
  164   1HD2  LEU  23          1HD2      LEU  23   2.923   0.690   3.159
  165   2HD2  LEU  23          2HD2      LEU  23   3.510   0.012   1.620
  166   3HD2  LEU  23          3HD2      LEU  23   1.781   0.358   1.835
  167    H    ASN  24           H        ASN  24   6.835  -2.253   4.282
  168    HA   ASN  24           HA       ASN  24   6.757  -4.480   6.020
  169   1HB   ASN  24          2HB       ASN  24   8.425  -4.324   4.304
  170   2HB   ASN  24          3HB       ASN  24   8.966  -2.748   4.866
  171   1HD2  ASN  24          1HD2      ASN  24   9.967  -2.552   6.890
  172   2HD2  ASN  24          2HD2      ASN  24  10.969  -3.872   7.525
  173    H    LYS  25           H        LYS  25   7.809  -1.108   6.545
  174    HA   LYS  25           HA       LYS  25   8.795  -1.317   9.176
  175   1HB   LYS  25          2HB       LYS  25   7.877   0.897   7.386
  176   2HB   LYS  25          3HB       LYS  25   7.566   1.187   9.084
  177   1HG   LYS  25          2HG       LYS  25   9.652   2.127   8.683
  178   2HG   LYS  25          3HG       LYS  25   9.926   0.661   9.643
  179   1HD   LYS  25          2HD       LYS  25  10.395  -0.530   7.400
  180   2HD   LYS  25          3HD       LYS  25  10.400   1.059   6.643
  181   1HE   LYS  25          2HE       LYS  25  12.258   0.055   8.866
  182   2HE   LYS  25          3HE       LYS  25  12.690   0.280   7.168
  183   1HZ   LYS  25          1HZ       LYS  25  12.295   2.645   7.450
  184   2HZ   LYS  25          2HZ       LYS  25  11.929   2.423   9.042
  185   3HZ   LYS  25          3HZ       LYS  25  13.443   2.102   8.495
  186    H    LEU  26           H        LEU  26   5.434  -1.249   8.043
  187    HA   LEU  26           HA       LEU  26   4.277  -0.538  10.533
  188   1HB   LEU  26          2HB       LEU  26   3.208  -0.626   8.255
  189   2HB   LEU  26          3HB       LEU  26   3.113  -2.363   8.357
  190    HG   LEU  26           HG       LEU  26   1.118  -0.870   8.880
  191   1HD1  LEU  26          1HD1      LEU  26   1.113  -3.327   9.153
  192   2HD1  LEU  26          2HD1      LEU  26   1.672  -3.137  10.827
  193   3HD1  LEU  26          3HD1      LEU  26   0.094  -2.486  10.338
  194   1HD2  LEU  26          1HD2      LEU  26   2.293   0.510  10.687
  195   2HD2  LEU  26          2HD2      LEU  26   0.718  -0.145  11.133
  196   3HD2  LEU  26          3HD2      LEU  26   2.191  -0.911  11.733
  197    H    GLY  27           H        GLY  27   5.377  -3.620   9.169
  198   1HA   GLY  27          2HA       GLY  27   5.922  -4.849  11.575
  199   2HA   GLY  27          3HA       GLY  27   4.188  -5.164  11.344
  200    H    GLY  28           H        GLY  28   3.489  -6.609   9.717
  201   1HA   GLY  28          2HA       GLY  28   5.537  -8.065   8.120
  202   2HA   GLY  28          3HA       GLY  28   4.629  -8.955   9.358
  203    H    VAL  29           H        VAL  29   3.490  -6.259   7.369
  204    HA   VAL  29           HA       VAL  29   1.138  -7.719   6.518
  205    HB   VAL  29           HB       VAL  29   1.273  -5.252   7.100
  206   1HG1  VAL  29          1HG1      VAL  29   2.237  -3.665   5.756
  207   2HG1  VAL  29          2HG1      VAL  29   3.465  -4.930   5.689
  208   3HG1  VAL  29          3HG1      VAL  29   2.305  -4.750   4.350
  209   1HG2  VAL  29          1HG2      VAL  29   0.167  -6.126   4.414
  210   2HG2  VAL  29          2HG2      VAL  29  -0.697  -5.961   5.960
  211   3HG2  VAL  29          3HG2      VAL  29  -0.136  -4.522   5.100
  212    H    LYS  30           H        LYS  30   0.904  -8.886   4.588
  213    HA   LYS  30           HA       LYS  30   3.079  -8.730   2.616
  214   1HB   LYS  30          2HB       LYS  30   1.810 -10.910   3.275
  215   2HB   LYS  30          3HB       LYS  30   0.581 -10.315   2.152
  216   1HG   LYS  30          2HG       LYS  30   3.450 -11.129   1.633
  217   2HG   LYS  30          3HG       LYS  30   1.971 -11.694   0.844
  218   1HD   LYS  30          2HD       LYS  30   1.786  -9.338  -0.213
  219   2HD   LYS  30          3HD       LYS  30   3.384  -8.999   0.475
  220   1HE   LYS  30          2HE       LYS  30   3.806  -9.482  -1.667
  221   2HE   LYS  30          3HE       LYS  30   4.315 -10.943  -0.812
  222   1HZ   LYS  30          1HZ       LYS  30   2.530 -12.093  -1.858
  223   2HZ   LYS  30          2HZ       LYS  30   1.603 -10.708  -1.930
  224   3HZ   LYS  30          3HZ       LYS  30   2.753 -10.844  -2.972
  225    H    TYR  31           H        TYR  31   2.985  -6.981   1.464
  226    HA   TYR  31           HA       TYR  31   0.473  -5.885   0.287
  227   1HB   TYR  31          2HB       TYR  31   1.902  -3.906  -0.206
  228   2HB   TYR  31          3HB       TYR  31   1.758  -4.235   1.519
  229    HD1  TYR  31           HD1      TYR  31   3.687  -5.124   2.808
  230    HD2  TYR  31           HD2      TYR  31   4.045  -4.358  -1.393
  231    HE1  TYR  31           HE1      TYR  31   6.090  -5.567   2.964
  232    HE2  TYR  31           HE2      TYR  31   6.465  -4.893  -1.272
  233    HH   TYR  31           HH       TYR  31   8.017  -5.935   1.771
  234    H    ASP  32           H        ASP  32   0.320  -5.912  -2.000
  235    HA   ASP  32           HA       ASP  32   2.674  -6.872  -3.572
  236   1HB   ASP  32          2HB       ASP  32  -0.269  -7.541  -3.716
  237   2HB   ASP  32          3HB       ASP  32   0.754  -7.679  -5.142
  238    H    ILE  33           H        ILE  33   3.141  -5.539  -5.279
  239    HA   ILE  33           HA       ILE  33   1.601  -2.975  -5.495
  240    HB   ILE  33           HB       ILE  33   4.575  -3.519  -5.747
  241   1HG1  ILE  33          2HG1      ILE  33   3.692  -1.540  -3.737
  242   2HG1  ILE  33          3HG1      ILE  33   3.141  -3.170  -3.359
  243   1HG2  ILE  33          1HG2      ILE  33   2.994  -0.919  -5.994
  244   2HG2  ILE  33          2HG2      ILE  33   4.764  -1.028  -5.901
  245   3HG2  ILE  33          3HG2      ILE  33   3.912  -1.727  -7.280
  246   1HD1  ILE  33          1HD1      ILE  33   5.363  -2.636  -2.380
  247   2HD1  ILE  33          2HD1      ILE  33   5.396  -4.047  -3.461
  248   3HD1  ILE  33          3HD1      ILE  33   6.029  -2.472  -4.014
  249    H    ASP  34           H        ASP  34   0.532  -2.976  -7.417
  250    HA   ASP  34           HA       ASP  34   1.759  -4.272  -9.801
  251   1HB   ASP  34          2HB       ASP  34  -0.626  -4.783  -9.303
  252   2HB   ASP  34          3HB       ASP  34  -1.006  -3.064  -9.534
  253    H    LEU  35           H        LEU  35   3.108  -2.955 -10.801
  254    HA   LEU  35           HA       LEU  35   3.142  -0.130 -10.297
  255   1HB   LEU  35          2HB       LEU  35   5.027  -2.034 -11.108
  256   2HB   LEU  35          3HB       LEU  35   4.815  -1.065 -12.556
  257    HG   LEU  35           HG       LEU  35   6.640  -0.224 -11.352
  258   1HD1  LEU  35          1HD1      LEU  35   5.176   1.469 -12.426
  259   2HD1  LEU  35          2HD1      LEU  35   4.352   1.736 -10.875
  260   3HD1  LEU  35          3HD1      LEU  35   6.075   2.111 -11.039
  261   1HD2  LEU  35          1HD2      LEU  35   5.998  -1.146  -9.119
  262   2HD2  LEU  35          2HD2      LEU  35   6.665   0.490  -9.084
  263   3HD2  LEU  35          3HD2      LEU  35   4.916   0.245  -8.892
  264    HA   PRO  36           HA       PRO  36   2.069   0.389 -14.929
  265   1HB   PRO  36          2HB       PRO  36   0.729  -1.611 -16.294
  266   2HB   PRO  36          3HB       PRO  36   2.501  -1.384 -16.293
  267   1HG   PRO  36          2HG       PRO  36   0.875  -3.251 -14.556
  268   2HG   PRO  36          3HG       PRO  36   2.356  -3.627 -15.479
  269   1HD   PRO  36          2HD       PRO  36   2.458  -3.104 -12.867
  270   2HD   PRO  36          3HD       PRO  36   3.710  -2.430 -13.945
  271    H    ASN  37           H        ASN  37  -0.214  -1.735 -13.049
  272    HA   ASN  37           HA       ASN  37  -2.487  -0.108 -13.970
  273   1HB   ASN  37          2HB       ASN  37  -2.420  -2.315 -11.887
  274   2HB   ASN  37          3HB       ASN  37  -3.839  -1.526 -12.558
  275   1HD2  ASN  37          1HD2      ASN  37  -1.140  -3.695 -13.351
  276   2HD2  ASN  37          2HD2      ASN  37  -1.896  -4.373 -14.795
  277    H    LYS  38           H        LYS  38  -0.031   0.464 -11.657
  278    HA   LYS  38           HA       LYS  38   0.160   1.947 -10.012
  279   1HB   LYS  38          2HB       LYS  38  -2.228   3.219 -11.451
  280   2HB   LYS  38          3HB       LYS  38  -1.250   3.999 -10.211
  281   1HG   LYS  38          2HG       LYS  38   0.787   3.570 -11.581
  282   2HG   LYS  38          3HG       LYS  38  -0.230   2.961 -12.899
  283   1HD   LYS  38          2HD       LYS  38  -1.322   5.132 -13.163
  284   2HD   LYS  38          3HD       LYS  38  -0.609   5.709 -11.656
  285   1HE   LYS  38          2HE       LYS  38   1.686   5.156 -12.851
  286   2HE   LYS  38          3HE       LYS  38   0.754   5.318 -14.334
  287   1HZ   LYS  38          1HZ       LYS  38   0.330   7.574 -13.784
  288   2HZ   LYS  38          2HZ       LYS  38   0.715   7.394 -12.222
  289   3HZ   LYS  38          3HZ       LYS  38   1.922   7.338 -13.338
  290    H    LYS  39           H        LYS  39  -0.717  -0.254  -8.978
  291    HA   LYS  39           HA       LYS  39  -2.660   0.664  -6.944
  292   1HB   LYS  39          2HB       LYS  39  -2.916  -1.884  -8.597
  293   2HB   LYS  39          3HB       LYS  39  -3.617  -1.711  -6.982
  294   1HG   LYS  39          2HG       LYS  39  -4.854   0.317  -7.759
  295   2HG   LYS  39          3HG       LYS  39  -4.320  -0.030  -9.417
  296   1HD   LYS  39          2HD       LYS  39  -5.428  -2.243  -9.303
  297   2HD   LYS  39          3HD       LYS  39  -5.816  -1.980  -7.590
  298   1HE   LYS  39          2HE       LYS  39  -7.188   0.028  -8.237
  299   2HE   LYS  39          3HE       LYS  39  -6.936  -0.391  -9.943
  300   1HZ   LYS  39          1HZ       LYS  39  -9.021  -1.268  -9.030
  301   2HZ   LYS  39          2HZ       LYS  39  -8.026  -2.517  -9.459
  302   3HZ   LYS  39          3HZ       LYS  39  -8.190  -2.111  -7.893
  303    H    VAL  40           H        VAL  40  -2.459  -0.297  -4.920
  304    HA   VAL  40           HA       VAL  40  -0.481  -2.437  -4.582
  305    HB   VAL  40           HB       VAL  40  -1.243  -0.001  -2.956
  306   1HG1  VAL  40          1HG1      VAL  40  -0.379  -1.076  -0.897
  307   2HG1  VAL  40          2HG1      VAL  40  -1.944  -1.667  -1.480
  308   3HG1  VAL  40          3HG1      VAL  40  -0.472  -2.654  -1.729
  309   1HG2  VAL  40          1HG2      VAL  40   1.090   0.129  -2.556
  310   2HG2  VAL  40          2HG2      VAL  40   1.368  -1.533  -3.140
  311   3HG2  VAL  40          3HG2      VAL  40   0.903  -0.255  -4.286
  312    H    CYS  41           H        CYS  41  -1.375  -4.243  -3.782
  313    HA   CYS  41           HA       CYS  41  -4.146  -4.134  -2.730
  314   1HB   CYS  41          2HB       CYS  41  -4.692  -6.245  -3.690
  315   2HB   CYS  41          3HB       CYS  41  -4.258  -5.134  -5.002
  316    HG   CYS  41           HG       CYS  41  -2.280  -7.336  -3.540
  317    H    ILE  42           H        ILE  42  -4.309  -5.059  -0.765
  318    HA   ILE  42           HA       ILE  42  -1.913  -6.463   0.335
  319    HB   ILE  42           HB       ILE  42  -3.737  -4.526   1.799
  320   1HG1  ILE  42          2HG1      ILE  42  -1.047  -4.000   0.476
  321   2HG1  ILE  42          3HG1      ILE  42  -2.596  -3.189   0.181
  322   1HG2  ILE  42          1HG2      ILE  42  -2.073  -4.674   3.568
  323   2HG2  ILE  42          2HG2      ILE  42  -2.521  -6.312   3.142
  324   3HG2  ILE  42          3HG2      ILE  42  -1.000  -5.627   2.527
  325   1HD1  ILE  42          1HD1      ILE  42  -2.526  -2.334   2.560
  326   2HD1  ILE  42          2HD1      ILE  42  -0.862  -2.958   2.659
  327   3HD1  ILE  42          3HD1      ILE  42  -1.265  -1.702   1.482
  328    H    GLU  43           H        GLU  43  -2.382  -8.278   1.470
  329    HA   GLU  43           HA       GLU  43  -5.115  -8.755   2.437
  330   1HB   GLU  43          2HB       GLU  43  -4.917  -9.729   0.104
  331   2HB   GLU  43          3HB       GLU  43  -3.711 -10.856   0.738
  332   1HG   GLU  43          2HG       GLU  43  -5.382 -11.698   2.375
  333   2HG   GLU  43          3HG       GLU  43  -6.586 -10.551   1.765
  334    H    SER  44           H        SER  44  -4.280  -8.440   4.483
  335    HA   SER  44           HA       SER  44  -2.838 -10.631   5.699
  336   1HB   SER  44          2HB       SER  44  -1.560  -7.918   5.295
  337   2HB   SER  44          3HB       SER  44  -1.121  -8.938   6.682
  338    HG   SER  44           HG       SER  44  -1.172 -10.077   4.109
  339    H    GLU  45           H        GLU  45  -3.200 -10.605   7.966
  340    HA   GLU  45           HA       GLU  45  -5.597  -9.085   8.615
  341   1HB   GLU  45          2HB       GLU  45  -5.176 -11.581   8.967
  342   2HB   GLU  45          3HB       GLU  45  -4.232 -11.131  10.393
  343   1HG   GLU  45          2HG       GLU  45  -6.178 -10.184  11.447
  344   2HG   GLU  45          3HG       GLU  45  -7.098 -10.169   9.933
  345    H    HIS  46           H        HIS  46  -4.186  -7.126   8.383
  346    HA   HIS  46           HA       HIS  46  -3.618  -6.145  11.144
  347   1HB   HIS  46          2HB       HIS  46  -2.411  -5.214   8.507
  348   2HB   HIS  46          3HB       HIS  46  -2.414  -4.237   9.974
  349    HD1  HIS  46           1HD      HIS  46  -0.959  -5.347  12.115
  350    HD2  HIS  46           2HD      HIS  46  -0.290  -6.652   8.186
  351    HE1  HIS  46           1HE      HIS  46   1.401  -6.314  12.064
  352    H    SER  47           H        SER  47  -4.742  -4.114  11.517
  353    HA   SER  47           HA       SER  47  -7.267  -4.023  10.153
  354   1HB   SER  47          2HB       SER  47  -7.009  -3.420  12.532
  355   2HB   SER  47          3HB       SER  47  -6.082  -1.979  12.059
  356    HG   SER  47           HG       SER  47  -7.884  -1.043  11.671
  357    H    MET  48           H        MET  48  -8.029  -2.642   8.631
  358    HA   MET  48           HA       MET  48  -6.238  -1.761   6.627
  359   1HB   MET  48          2HB       MET  48  -9.135  -0.890   7.063
  360   2HB   MET  48          3HB       MET  48  -8.197  -0.764   5.562
  361   1HG   MET  48          2HG       MET  48  -7.924  -3.269   5.605
  362   2HG   MET  48          3HG       MET  48  -9.035  -3.308   6.989
  363   1HE   MET  48          1HE       MET  48 -10.554  -5.064   5.734
  364   2HE   MET  48          2HE       MET  48 -11.165  -4.825   4.082
  365   3HE   MET  48          3HE       MET  48  -9.417  -5.017   4.357
  366    H    ASP  49           H        ASP  49  -7.994  -0.005   9.145
  367    HA   ASP  49           HA       ASP  49  -7.330   2.632   8.433
  368   1HB   ASP  49          2HB       ASP  49  -8.034   3.272  10.583
  369   2HB   ASP  49          3HB       ASP  49  -9.005   1.845  10.224
  370    H    THR  50           H        THR  50  -5.715   0.447  10.564
  371    HA   THR  50           HA       THR  50  -3.540   2.011  11.377
  372    HB   THR  50           HB       THR  50  -3.819  -1.019  11.131
  373    HG1  THR  50           1HG      THR  50  -5.441   0.213  12.386
  374   1HG2  THR  50          1HG2      THR  50  -1.915   0.626  12.828
  375   2HG2  THR  50          2HG2      THR  50  -2.233  -1.113  13.022
  376   3HG2  THR  50          3HG2      THR  50  -1.494  -0.523  11.529
  377    H    LEU  51           H        LEU  51  -3.731  -0.388   8.695
  378    HA   LEU  51           HA       LEU  51  -1.076   0.043   7.696
  379   1HB   LEU  51          2HB       LEU  51  -3.616  -0.662   6.165
  380   2HB   LEU  51          3HB       LEU  51  -1.967  -0.730   5.516
  381    HG   LEU  51           HG       LEU  51  -2.928  -2.317   7.950
  382   1HD1  LEU  51          1HD1      LEU  51  -4.235  -2.989   6.045
  383   2HD1  LEU  51          2HD1      LEU  51  -2.789  -3.104   5.024
  384   3HD1  LEU  51          3HD1      LEU  51  -3.039  -4.255   6.359
  385   1HD2  LEU  51          1HD2      LEU  51  -0.516  -2.090   7.906
  386   2HD2  LEU  51          2HD2      LEU  51  -0.909  -3.728   7.390
  387   3HD2  LEU  51          3HD2      LEU  51  -0.446  -2.503   6.185
  388    H    LEU  52           H        LEU  52  -4.219   1.506   6.642
  389    HA   LEU  52           HA       LEU  52  -3.327   3.199   4.694
  390   1HB   LEU  52          2HB       LEU  52  -5.580   2.493   5.381
  391   2HB   LEU  52          3HB       LEU  52  -5.533   3.579   6.759
  392    HG   LEU  52           HG       LEU  52  -5.324   4.475   3.842
  393   1HD1  LEU  52          1HD1      LEU  52  -7.756   4.950   4.141
  394   2HD1  LEU  52          2HD1      LEU  52  -7.377   3.221   4.365
  395   3HD1  LEU  52          3HD1      LEU  52  -7.663   4.242   5.779
  396   1HD2  LEU  52          1HD2      LEU  52  -4.472   6.201   5.325
  397   2HD2  LEU  52          2HD2      LEU  52  -6.131   6.654   4.912
  398   3HD2  LEU  52          3HD2      LEU  52  -5.780   5.914   6.495
  399    H    ALA  53           H        ALA  53  -3.859   4.028   8.160
  400    HA   ALA  53           HA       ALA  53  -2.853   6.635   8.065
  401   1HB   ALA  53          1HB       ALA  53  -2.871   4.668  10.400
  402   2HB   ALA  53          2HB       ALA  53  -2.698   6.431  10.535
  403   3HB   ALA  53          3HB       ALA  53  -4.213   5.732   9.927
  404    H    THR  54           H        THR  54  -1.099   3.576   8.646
  405    HA   THR  54           HA       THR  54   1.417   4.855   9.196
  406    HB   THR  54           HB       THR  54   0.780   2.083   8.092
  407    HG1  THR  54           1HG      THR  54  -0.021   2.344  10.095
  408   1HG2  THR  54          1HG2      THR  54   3.054   2.653   7.484
  409   2HG2  THR  54          2HG2      THR  54   3.375   3.306   9.111
  410   3HG2  THR  54          3HG2      THR  54   3.096   1.571   8.874
  411    H    LEU  55           H        LEU  55   0.203   3.311   6.163
  412    HA   LEU  55           HA       LEU  55   2.534   3.946   4.718
  413   1HB   LEU  55          2HB       LEU  55   1.460   3.085   2.844
  414   2HB   LEU  55          3HB       LEU  55   1.180   2.094   4.250
  415    HG   LEU  55           HG       LEU  55  -1.110   3.360   4.375
  416   1HD1  LEU  55          1HD1      LEU  55  -1.871   3.975   2.098
  417   2HD1  LEU  55          2HD1      LEU  55  -0.478   4.956   2.611
  418   3HD1  LEU  55          3HD1      LEU  55  -0.211   3.610   1.512
  419   1HD2  LEU  55          1HD2      LEU  55  -2.071   1.618   2.884
  420   2HD2  LEU  55          2HD2      LEU  55  -0.448   1.283   2.245
  421   3HD2  LEU  55          3HD2      LEU  55  -0.824   0.944   3.953
  422    H    LYS  56           H        LYS  56  -0.471   5.675   5.056
  423    HA   LYS  56           HA       LYS  56  -0.473   7.744   3.438
  424   1HB   LYS  56          2HB       LYS  56  -1.746   7.353   5.723
  425   2HB   LYS  56          3HB       LYS  56  -0.483   8.362   6.424
  426   1HG   LYS  56          2HG       LYS  56  -1.163  10.120   4.687
  427   2HG   LYS  56          3HG       LYS  56  -2.457   8.982   4.216
  428   1HD   LYS  56          2HD       LYS  56  -3.324   9.009   6.547
  429   2HD   LYS  56          3HD       LYS  56  -2.048  10.158   7.007
  430   1HE   LYS  56          2HE       LYS  56  -2.959  11.821   5.384
  431   2HE   LYS  56          3HE       LYS  56  -4.214  10.668   4.896
  432   1HZ   LYS  56          1HZ       LYS  56  -3.919  11.828   7.591
  433   2HZ   LYS  56          2HZ       LYS  56  -5.040  12.258   6.469
  434   3HZ   LYS  56          3HZ       LYS  56  -5.084  10.757   7.133
  435    H    LYS  57           H        LYS  57   1.977   7.324   5.956
  436    HA   LYS  57           HA       LYS  57   3.101   9.891   6.108
  437   1HB   LYS  57          2HB       LYS  57   4.232   7.129   6.534
  438   2HB   LYS  57          3HB       LYS  57   5.119   8.617   6.955
  439   1HG   LYS  57          2HG       LYS  57   3.307   9.280   8.464
  440   2HG   LYS  57          3HG       LYS  57   2.332   7.904   7.924
  441   1HD   LYS  57          2HD       LYS  57   4.023   6.317   8.767
  442   2HD   LYS  57          3HD       LYS  57   4.925   7.673   9.482
  443   1HE   LYS  57          2HE       LYS  57   3.011   8.242  10.916
  444   2HE   LYS  57          3HE       LYS  57   1.973   7.078  10.081
  445   1HZ   LYS  57          1HZ       LYS  57   3.312   5.304  10.946
  446   2HZ   LYS  57          2HZ       LYS  57   4.309   6.364  11.723
  447   3HZ   LYS  57          3HZ       LYS  57   2.733   6.232  12.168
  448    H    THR  58           H        THR  58   3.396   7.562   3.421
  449    HA   THR  58           HA       THR  58   5.826   8.598   2.309
  450    HB   THR  58           HB       THR  58   4.854   7.732   0.149
  451    HG1  THR  58           1HG      THR  58   2.624   8.078   0.680
  452   1HG2  THR  58          1HG2      THR  58   4.824   5.373   0.875
  453   2HG2  THR  58          2HG2      THR  58   6.151   6.281   1.640
  454   3HG2  THR  58          3HG2      THR  58   4.682   5.902   2.565
  455    H    GLY  59           H        GLY  59   2.533   9.851   2.419
  456   1HA   GLY  59          2HA       GLY  59   1.576  11.742   1.640
  457   2HA   GLY  59          3HA       GLY  59   3.214  12.437   1.617
  458    H    LYS  60           H        LYS  60   1.335   9.994  -0.260
  459    HA   LYS  60           HA       LYS  60   1.854  11.364  -2.818
  460   1HB   LYS  60          2HB       LYS  60   2.336   8.400  -2.254
  461   2HB   LYS  60          3HB       LYS  60   2.490   9.201  -3.816
  462   1HG   LYS  60          2HG       LYS  60   4.197   9.786  -1.360
  463   2HG   LYS  60          3HG       LYS  60   4.651   8.708  -2.644
  464   1HD   LYS  60          2HD       LYS  60   4.840  10.429  -4.266
  465   2HD   LYS  60          3HD       LYS  60   3.965  11.603  -3.301
  466   1HE   LYS  60          2HE       LYS  60   6.718  10.500  -2.571
  467   2HE   LYS  60          3HE       LYS  60   6.379  12.042  -3.368
  468   1HZ   LYS  60          1HZ       LYS  60   6.563  12.581  -1.130
  469   2HZ   LYS  60          2HZ       LYS  60   4.918  12.491  -1.346
  470   3HZ   LYS  60          3HZ       LYS  60   5.702  11.285  -0.606
  471    H    THR  61           H        THR  61   0.547   9.940  -4.574
  472    HA   THR  61           HA       THR  61  -2.107  10.359  -3.901
  473    HB   THR  61           HB       THR  61  -1.504   8.777  -6.329
  474    HG1  THR  61           1HG      THR  61   0.190   9.785  -7.039
  475   1HG2  THR  61          1HG2      THR  61  -2.447  10.775  -7.445
  476   2HG2  THR  61          2HG2      THR  61  -3.473  10.276  -6.087
  477   3HG2  THR  61          3HG2      THR  61  -2.382  11.672  -5.917
  478    H    VAL  62           H        VAL  62  -1.045   8.180  -2.186
  479    HA   VAL  62           HA       VAL  62  -2.076   5.673  -3.279
  480    HB   VAL  62           HB       VAL  62  -0.107   5.464  -2.095
  481   1HG1  VAL  62          1HG1      VAL  62  -0.063   7.411  -0.613
  482   2HG1  VAL  62          2HG1      VAL  62  -1.370   6.726   0.376
  483   3HG1  VAL  62          3HG1      VAL  62   0.205   5.924   0.291
  484   1HG2  VAL  62          1HG2      VAL  62  -2.003   3.756  -1.819
  485   2HG2  VAL  62          2HG2      VAL  62  -0.662   3.670  -0.674
  486   3HG2  VAL  62          3HG2      VAL  62  -2.212   4.400  -0.190
  487    H    SER  63           H        SER  63  -4.142   6.015  -3.670
  488    HA   SER  63           HA       SER  63  -5.983   7.086  -1.616
  489   1HB   SER  63          2HB       SER  63  -6.475   6.350  -4.528
  490   2HB   SER  63          3HB       SER  63  -7.472   7.385  -3.491
  491    HG   SER  63           HG       SER  63  -4.774   7.902  -4.325
  492    H    TYR  64           H        TYR  64  -7.222   5.677  -0.435
  493    HA   TYR  64           HA       TYR  64  -6.919   2.810  -0.819
  494   1HB   TYR  64          2HB       TYR  64  -6.697   3.756   1.395
  495   2HB   TYR  64          3HB       TYR  64  -8.226   4.611   1.234
  496    HD1  TYR  64           HD1      TYR  64  -7.262   1.001   0.642
  497    HD2  TYR  64           HD2      TYR  64  -9.800   3.801   2.732
  498    HE1  TYR  64           HE1      TYR  64  -8.703  -0.847   1.378
  499    HE2  TYR  64           HE2      TYR  64 -11.158   1.914   3.585
  500    HH   TYR  64           HH       TYR  64 -10.652  -1.417   2.447
  501    H    LEU  65           H        LEU  65  -8.400   1.414  -1.779
  502    HA   LEU  65           HA       LEU  65 -11.238   1.983  -1.711
  503   1HB   LEU  65          2HB       LEU  65 -11.354   1.503  -4.242
  504   2HB   LEU  65          3HB       LEU  65 -11.210   3.128  -3.605
  505    HG   LEU  65           HG       LEU  65  -9.891   2.454  -5.644
  506   1HD1  LEU  65          1HD1      LEU  65  -8.058   3.982  -5.123
  507   2HD1  LEU  65          2HD1      LEU  65  -9.694   4.566  -4.792
  508   3HD1  LEU  65          3HD1      LEU  65  -8.675   4.048  -3.468
  509   1HD2  LEU  65          1HD2      LEU  65  -7.667   1.592  -5.455
  510   2HD2  LEU  65          2HD2      LEU  65  -8.029   1.071  -3.805
  511   3HD2  LEU  65          3HD2      LEU  65  -8.931   0.415  -5.175
  512    H    GLY  66           H        GLY  66 -10.911  -0.090  -0.359
  513   1HA   GLY  66          2HA       GLY  66 -12.209  -2.025  -1.927
  514   2HA   GLY  66          3HA       GLY  66 -10.535  -2.568  -1.811
  515    H    LEU  67           H        LEU  67 -13.334  -3.341  -0.608
  516    HA   LEU  67           HA       LEU  67 -12.195  -4.360   1.916
  517   1HB   LEU  67          2HB       LEU  67 -15.008  -3.165   1.584
  518   2HB   LEU  67          3HB       LEU  67 -14.480  -4.209   2.911
  519    HG   LEU  67           HG       LEU  67 -12.480  -2.446   2.934
  520   1HD1  LEU  67          1HD1      LEU  67 -13.440  -0.117   2.772
  521   2HD1  LEU  67          2HD1      LEU  67 -13.500  -0.939   1.206
  522   3HD1  LEU  67          3HD1      LEU  67 -14.966  -0.805   2.192
  523   1HD2  LEU  67          1HD2      LEU  67 -15.139  -2.105   4.387
  524   2HD2  LEU  67          2HD2      LEU  67 -13.779  -3.131   4.897
  525   3HD2  LEU  67          3HD2      LEU  67 -13.598  -1.369   4.885
  526    H    GLU  68           H        GLU  68 -11.792  -6.371   1.056
  527    HA   GLU  68           HA       GLU  68 -14.063  -7.929  -0.022
  528   1HB   GLU  68          2HB       GLU  68 -11.192  -7.396  -0.849
  529   2HB   GLU  68          3HB       GLU  68 -11.992  -8.882  -1.253
  530   1HG   GLU  68          2HG       GLU  68 -13.608  -7.710  -2.655
  531   2HG   GLU  68          3HG       GLU  68 -13.193  -6.148  -1.929
  Start of MODEL   25
    1   1H    MET   1           H1       MET   1  -6.516 -12.446   5.297
    2   2H    MET   1           H2       MET   1  -7.138 -13.747   6.115
    3   3H    MET   1           H3       MET   1  -7.442 -13.390   4.478
    4    HA   MET   1           HA       MET   1  -9.215 -12.711   6.331
    5   1HB   MET   1          2HB       MET   1  -6.964 -10.637   6.287
    6   2HB   MET   1          3HB       MET   1  -8.580 -10.137   6.689
    7   1HG   MET   1          2HG       MET   1  -7.374 -10.614   8.719
    8   2HG   MET   1          3HG       MET   1  -8.665 -11.805   8.520
    9   1HE   MET   1          1HE       MET   1  -7.769 -13.503  10.249
   10   2HE   MET   1          2HE       MET   1  -6.058 -13.980  10.366
   11   3HE   MET   1          3HE       MET   1  -6.531 -12.294  10.682
   12    HA   PRO   2           HA       PRO   2 -10.665 -10.759   2.430
   13   1HB   PRO   2          2HB       PRO   2 -11.705  -8.337   3.099
   14   2HB   PRO   2          3HB       PRO   2 -12.616  -9.867   3.286
   15   1HG   PRO   2          2HG       PRO   2 -11.054  -8.366   5.418
   16   2HG   PRO   2          3HG       PRO   2 -12.705  -9.043   5.553
   17   1HD   PRO   2          2HD       PRO   2 -10.626 -10.424   6.543
   18   2HD   PRO   2          3HD       PRO   2 -11.856 -11.282   5.595
   19    H    LYS   3           H        LYS   3  -9.574  -9.402   0.976
   20    HA   LYS   3           HA       LYS   3  -7.190  -8.027   2.042
   21   1HB   LYS   3          2HB       LYS   3  -6.223  -8.321  -0.001
   22   2HB   LYS   3          3HB       LYS   3  -7.375  -9.673  -0.066
   23   1HG   LYS   3          2HG       LYS   3  -8.989  -7.933  -1.061
   24   2HG   LYS   3          3HG       LYS   3  -7.531  -6.924  -1.262
   25   1HD   LYS   3          2HD       LYS   3  -6.604  -8.945  -2.641
   26   2HD   LYS   3          3HD       LYS   3  -8.298  -9.516  -2.646
   27   1HE   LYS   3          2HE       LYS   3  -8.907  -7.074  -3.374
   28   2HE   LYS   3          3HE       LYS   3  -7.173  -6.865  -3.677
   29   1HZ   LYS   3          1HZ       LYS   3  -8.362  -7.314  -5.582
   30   2HZ   LYS   3          2HZ       LYS   3  -7.363  -8.615  -5.333
   31   3HZ   LYS   3          3HZ       LYS   3  -8.988  -8.740  -5.019
   32    H    HIS   4           H        HIS   4  -6.680  -5.890   1.227
   33    HA   HIS   4           HA       HIS   4  -9.003  -4.049   0.851
   34   1HB   HIS   4          2HB       HIS   4  -6.275  -3.506   2.066
   35   2HB   HIS   4          3HB       HIS   4  -7.720  -2.496   2.192
   36    HD1  HIS   4           1HD      HIS   4  -6.144  -5.756   3.514
   37    HD2  HIS   4           2HD      HIS   4  -9.524  -3.333   4.060
   38    HE1  HIS   4           1HE      HIS   4  -7.282  -6.570   5.661
   39    H    GLU   5           H        GLU   5  -8.714  -2.517  -0.944
   40    HA   GLU   5           HA       GLU   5  -6.239  -2.919  -2.591
   41   1HB   GLU   5          2HB       GLU   5  -9.076  -2.237  -3.453
   42   2HB   GLU   5          3HB       GLU   5  -7.634  -2.174  -4.467
   43   1HG   GLU   5          2HG       GLU   5  -7.340  -4.665  -3.610
   44   2HG   GLU   5          3HG       GLU   5  -9.082  -4.556  -3.337
   45    H    PHE   6           H        PHE   6  -5.170  -1.150  -3.375
   46    HA   PHE   6           HA       PHE   6  -6.167   1.546  -2.683
   47   1HB   PHE   6          2HB       PHE   6  -3.321   0.550  -2.166
   48   2HB   PHE   6          3HB       PHE   6  -3.972   2.091  -1.669
   49    HD1  PHE   6           1HD      PHE   6  -4.046  -1.584  -1.077
   50    HD2  PHE   6           2HD      PHE   6  -5.054   2.288   0.551
   51    HE1  PHE   6           1HE      PHE   6  -4.506  -2.617   1.098
   52    HE2  PHE   6           2HE      PHE   6  -5.662   1.205   2.687
   53    HZ   PHE   6           HZ       PHE   6  -5.326  -1.229   3.005
   54    H    SER   7           H        SER   7  -5.532   3.093  -4.202
   55    HA   SER   7           HA       SER   7  -3.931   2.105  -6.518
   56   1HB   SER   7          2HB       SER   7  -5.978   3.323  -7.137
   57   2HB   SER   7          3HB       SER   7  -5.318   4.771  -6.334
   58    HG   SER   7           HG       SER   7  -3.774   3.373  -8.275
   59    H    VAL   8           H        VAL   8  -1.941   3.092  -6.960
   60    HA   VAL   8           HA       VAL   8  -0.657   4.807  -4.908
   61    HB   VAL   8           HB       VAL   8   0.253   2.065  -5.984
   62   1HG1  VAL   8          1HG1      VAL   8   2.122   2.371  -4.392
   63   2HG1  VAL   8          2HG1      VAL   8   2.092   3.742  -5.510
   64   3HG1  VAL   8          3HG1      VAL   8   1.446   3.943  -3.878
   65   1HG2  VAL   8          1HG2      VAL   8  -0.782   2.902  -3.235
   66   2HG2  VAL   8          2HG2      VAL   8  -1.436   1.630  -4.290
   67   3HG2  VAL   8          3HG2      VAL   8   0.143   1.428  -3.514
   68    H    ASP   9           H        ASP   9  -0.692   6.458  -6.707
   69    HA   ASP   9           HA       ASP   9  -0.072   5.457  -9.301
   70   1HB   ASP   9          2HB       ASP   9  -1.578   7.439  -8.783
   71   2HB   ASP   9          3HB       ASP   9  -0.098   8.403  -8.861
   72    H    MET  10           H        MET  10   1.874   4.511  -9.310
   73    HA   MET  10           HA       MET  10   4.213   5.559  -8.195
   74   1HB   MET  10          2HB       MET  10   3.775   3.366 -10.252
   75   2HB   MET  10          3HB       MET  10   5.329   3.654  -9.466
   76   1HG   MET  10          2HG       MET  10   4.689   2.666  -7.518
   77   2HG   MET  10          3HG       MET  10   3.088   3.369  -7.558
   78   1HE   MET  10          1HE       MET  10   2.410  -0.494  -7.218
   79   2HE   MET  10          2HE       MET  10   3.827   0.361  -6.544
   80   3HE   MET  10          3HE       MET  10   2.209   1.095  -6.453
   81    H    THR  11           H        THR  11   4.153   7.653  -9.055
   82    HA   THR  11           HA       THR  11   4.661   8.272 -11.826
   83    HB   THR  11           HB       THR  11   5.058  10.588 -10.466
   84    HG1  THR  11           1HG      THR  11   3.293   9.148  -8.758
   85   1HG2  THR  11          1HG2      THR  11   2.597  10.939 -10.578
   86   2HG2  THR  11          2HG2      THR  11   3.222  10.183 -12.056
   87   3HG2  THR  11          3HG2      THR  11   2.366   9.199 -10.852
   88    H    CYS  12           H        CYS  12   6.700   7.206  -9.290
   89    HA   CYS  12           HA       CYS  12   8.762   7.258 -11.356
   90   1HB   CYS  12          2HB       CYS  12   9.579   9.027  -9.878
   91   2HB   CYS  12          3HB       CYS  12   9.298   8.014  -8.438
   92    HG   CYS  12           HG       CYS  12  11.843   8.022  -8.865
   93    H    GLY  13           H        GLY  13   9.721   5.144 -11.345
   94   1HA   GLY  13          2HA       GLY  13   8.279   2.972 -10.442
   95   2HA   GLY  13          3HA       GLY  13  10.026   2.940 -10.742
   96    H    GLY  14           H        GLY  14  10.909   4.683  -8.705
   97   1HA   GLY  14          2HA       GLY  14  11.092   2.889  -6.529
   98   2HA   GLY  14          3HA       GLY  14  11.657   4.576  -6.534
   99    H    CYS  15           H        CYS  15   8.479   4.986  -7.242
  100    HA   CYS  15           HA       CYS  15   7.397   5.619  -4.698
  101   1HB   CYS  15          2HB       CYS  15   6.078   4.710  -7.228
  102   2HB   CYS  15          3HB       CYS  15   5.213   5.146  -5.737
  103    HG   CYS  15           HG       CYS  15   7.424   7.008  -7.267
  104    H    ALA  16           H        ALA  16   7.546   2.601  -6.651
  105    HA   ALA  16           HA       ALA  16   5.982   1.001  -4.895
  106   1HB   ALA  16          1HB       ALA  16   6.432   0.403  -7.273
  107   2HB   ALA  16          2HB       ALA  16   8.149   0.154  -6.881
  108   3HB   ALA  16          3HB       ALA  16   6.916  -0.902  -6.170
  109    H    GLU  17           H        GLU  17   9.556   1.438  -5.134
  110    HA   GLU  17           HA       GLU  17  10.255  -0.230  -2.954
  111   1HB   GLU  17          2HB       GLU  17  11.492   2.304  -4.117
  112   2HB   GLU  17          3HB       GLU  17  11.990   1.715  -2.548
  113   1HG   GLU  17          2HG       GLU  17  12.354  -0.590  -3.719
  114   2HG   GLU  17          3HG       GLU  17  12.365   0.374  -5.210
  115    H    ALA  18           H        ALA  18   9.233   3.211  -2.975
  116    HA   ALA  18           HA       ALA  18   9.758   3.668  -0.217
  117   1HB   ALA  18          1HB       ALA  18   7.639   5.007  -1.961
  118   2HB   ALA  18          2HB       ALA  18   8.293   5.622  -0.432
  119   3HB   ALA  18          3HB       ALA  18   9.349   5.479  -1.854
  120    H    VAL  19           H        VAL  19   6.753   2.747  -1.892
  121    HA   VAL  19           HA       VAL  19   5.153   2.492   0.442
  122    HB   VAL  19           HB       VAL  19   4.909   1.313  -2.351
  123   1HG1  VAL  19          1HG1      VAL  19   2.910   1.340  -0.055
  124   2HG1  VAL  19          2HG1      VAL  19   2.487   1.067  -1.751
  125   3HG1  VAL  19          3HG1      VAL  19   3.536  -0.097  -0.926
  126   1HG2  VAL  19          1HG2      VAL  19   3.516   3.642  -0.914
  127   2HG2  VAL  19          2HG2      VAL  19   4.814   3.844  -2.100
  128   3HG2  VAL  19          3HG2      VAL  19   3.272   3.154  -2.596
  129    H    SER  20           H        SER  20   6.960  -0.043  -1.425
  130    HA   SER  20           HA       SER  20   6.258  -2.231   0.204
  131   1HB   SER  20          2HB       SER  20   8.995  -1.715  -1.083
  132   2HB   SER  20          3HB       SER  20   8.331  -3.282  -0.585
  133    HG   SER  20           HG       SER  20   7.366  -1.558  -2.626
  134    H    ARG  21           H        ARG  21   9.036   0.009   0.576
  135    HA   ARG  21           HA       ARG  21  10.108  -1.179   2.889
  136   1HB   ARG  21          2HB       ARG  21  10.308   1.620   1.724
  137   2HB   ARG  21          3HB       ARG  21  11.292   1.050   3.088
  138   1HG   ARG  21          2HG       ARG  21  12.302  -0.694   1.777
  139   2HG   ARG  21          3HG       ARG  21  11.146  -0.535   0.484
  140   1HD   ARG  21          2HD       ARG  21  13.125   0.329  -0.340
  141   2HD   ARG  21          3HD       ARG  21  12.033   1.702  -0.111
  142    HE   ARG  21           HE       ARG  21  13.438   1.686   2.223
  143   1HH1  ARG  21          2HH2      ARG  21  14.581   1.558  -1.195
  144   2HH1  ARG  21          1HH2      ARG  21  15.944   2.551  -0.895
  145   1HH2  ARG  21          2HH1      ARG  21  15.344   2.936   2.592
  146   2HH2  ARG  21          1HH1      ARG  21  16.424   3.291   1.284
  147    H    VAL  22           H        VAL  22   7.796   1.690   2.669
  148    HA   VAL  22           HA       VAL  22   7.607   1.886   5.441
  149    HB   VAL  22           HB       VAL  22   6.833   3.489   3.517
  150   1HG1  VAL  22          1HG1      VAL  22   4.440   3.652   3.239
  151   2HG1  VAL  22          2HG1      VAL  22   4.928   2.056   2.697
  152   3HG1  VAL  22          3HG1      VAL  22   4.163   2.247   4.290
  153   1HG2  VAL  22          1HG2      VAL  22   5.425   3.154   6.165
  154   2HG2  VAL  22          2HG2      VAL  22   6.939   4.052   5.842
  155   3HG2  VAL  22          3HG2      VAL  22   5.390   4.633   5.173
  156    H    LEU  23           H        LEU  23   5.567  -0.119   3.190
  157    HA   LEU  23           HA       LEU  23   3.856  -0.991   5.262
  158   1HB   LEU  23          2HB       LEU  23   4.553  -2.067   2.520
  159   2HB   LEU  23          3HB       LEU  23   3.699  -3.096   3.646
  160    HG   LEU  23           HG       LEU  23   2.103  -2.162   2.257
  161   1HD1  LEU  23          1HD1      LEU  23   1.784  -0.658   4.893
  162   2HD1  LEU  23          2HD1      LEU  23   0.527  -1.224   3.802
  163   3HD1  LEU  23          3HD1      LEU  23   1.507  -2.404   4.694
  164   1HD2  LEU  23          1HD2      LEU  23   1.658   0.225   2.077
  165   2HD2  LEU  23          2HD2      LEU  23   3.061   0.564   3.123
  166   3HD2  LEU  23          3HD2      LEU  23   3.286  -0.225   1.538
  167    H    ASN  24           H        ASN  24   6.893  -2.564   4.014
  168    HA   ASN  24           HA       ASN  24   6.820  -4.758   5.791
  169   1HB   ASN  24          2HB       ASN  24   9.063  -3.193   4.452
  170   2HB   ASN  24          3HB       ASN  24   9.364  -4.535   5.540
  171   1HD2  ASN  24          1HD2      ASN  24   8.369  -3.700   2.328
  172   2HD2  ASN  24          2HD2      ASN  24   8.206  -5.365   1.751
  173    H    LYS  25           H        LYS  25   8.117  -1.445   6.226
  174    HA   LYS  25           HA       LYS  25   9.182  -1.808   8.826
  175   1HB   LYS  25          2HB       LYS  25   8.117   0.588   7.290
  176   2HB   LYS  25          3HB       LYS  25   8.530   0.750   8.986
  177   1HG   LYS  25          2HG       LYS  25  10.418  -0.218   6.792
  178   2HG   LYS  25          3HG       LYS  25  10.328   1.423   7.442
  179   1HD   LYS  25          2HD       LYS  25  10.751   0.220   9.791
  180   2HD   LYS  25          3HD       LYS  25  11.275  -1.136   8.788
  181   1HE   LYS  25          2HE       LYS  25  13.261   0.006   9.251
  182   2HE   LYS  25          3HE       LYS  25  12.849   0.455   7.587
  183   1HZ   LYS  25          1HZ       LYS  25  12.353   2.081  10.006
  184   2HZ   LYS  25          2HZ       LYS  25  13.541   2.345   8.904
  185   3HZ   LYS  25          3HZ       LYS  25  11.965   2.533   8.472
  186    H    LEU  26           H        LEU  26   5.837  -1.069   7.839
  187    HA   LEU  26           HA       LEU  26   4.776  -0.591  10.363
  188   1HB   LEU  26          2HB       LEU  26   3.591  -0.623   8.122
  189   2HB   LEU  26          3HB       LEU  26   3.395  -2.351   8.273
  190    HG   LEU  26           HG       LEU  26   1.486  -0.722   8.911
  191   1HD1  LEU  26          1HD1      LEU  26   0.523  -2.329  10.432
  192   2HD1  LEU  26          2HD1      LEU  26   1.377  -3.172   9.129
  193   3HD1  LEU  26          3HD1      LEU  26   2.109  -3.059  10.743
  194   1HD2  LEU  26          1HD2      LEU  26   2.802  -0.846  11.654
  195   2HD2  LEU  26          2HD2      LEU  26   2.844   0.588  10.612
  196   3HD2  LEU  26          3HD2      LEU  26   1.299  -0.042  11.199
  197    H    GLY  27           H        GLY  27   5.499  -3.749   8.842
  198   1HA   GLY  27          2HA       GLY  27   6.440  -5.054  10.935
  199   2HA   GLY  27          3HA       GLY  27   4.717  -5.080  11.359
  200    H    GLY  28           H        GLY  28   3.228  -6.438  10.223
  201   1HA   GLY  28          2HA       GLY  28   4.633  -8.765   8.923
  202   2HA   GLY  28          3HA       GLY  28   3.471  -8.874  10.252
  203    H    VAL  29           H        VAL  29   3.761  -7.289   7.074
  204    HA   VAL  29           HA       VAL  29   0.847  -7.729   6.615
  205    HB   VAL  29           HB       VAL  29   1.319  -5.445   7.105
  206   1HG1  VAL  29          1HG1      VAL  29   2.821  -4.052   5.755
  207   2HG1  VAL  29          2HG1      VAL  29   3.695  -5.240   6.726
  208   3HG1  VAL  29          3HG1      VAL  29   3.503  -5.491   4.987
  209   1HG2  VAL  29          1HG2      VAL  29   0.439  -4.394   5.142
  210   2HG2  VAL  29          2HG2      VAL  29   1.022  -5.699   4.096
  211   3HG2  VAL  29          3HG2      VAL  29  -0.269  -6.009   5.288
  212    H    LYS  30           H        LYS  30   0.455  -9.235   5.013
  213    HA   LYS  30           HA       LYS  30   2.378  -9.392   2.841
  214   1HB   LYS  30          2HB       LYS  30   0.866 -11.325   3.796
  215   2HB   LYS  30          3HB       LYS  30  -0.211 -10.778   2.503
  216   1HG   LYS  30          2HG       LYS  30   2.649 -11.777   2.320
  217   2HG   LYS  30          3HG       LYS  30   1.203 -12.482   1.583
  218   1HD   LYS  30          2HD       LYS  30   1.056 -10.455   0.045
  219   2HD   LYS  30          3HD       LYS  30   2.500  -9.804   0.816
  220   1HE   LYS  30          2HE       LYS  30   3.353 -10.584  -1.065
  221   2HE   LYS  30          3HE       LYS  30   3.826 -11.748   0.172
  222   1HZ   LYS  30          1HZ       LYS  30   1.993 -13.164  -0.638
  223   2HZ   LYS  30          2HZ       LYS  30   1.614 -12.038  -1.783
  224   3HZ   LYS  30          3HZ       LYS  30   3.053 -12.824  -1.854
  225    H    TYR  31           H        TYR  31   2.404  -7.596   1.769
  226    HA   TYR  31           HA       TYR  31   0.023  -6.379   0.463
  227   1HB   TYR  31          2HB       TYR  31   1.754  -4.759  -0.422
  228   2HB   TYR  31          3HB       TYR  31   1.497  -4.736   1.317
  229    HD1  TYR  31           HD1      TYR  31   3.221  -5.244   2.843
  230    HD2  TYR  31           HD2      TYR  31   3.822  -6.056  -1.327
  231    HE1  TYR  31           HE1      TYR  31   5.505  -6.062   3.345
  232    HE2  TYR  31           HE2      TYR  31   6.123  -6.838  -0.847
  233    HH   TYR  31           HH       TYR  31   7.407  -7.066   2.487
  234    H    ASP  32           H        ASP  32  -0.026  -6.191  -1.847
  235    HA   ASP  32           HA       ASP  32   2.106  -7.482  -3.374
  236   1HB   ASP  32          2HB       ASP  32  -0.005  -8.995  -3.341
  237   2HB   ASP  32          3HB       ASP  32  -0.787  -7.723  -4.294
  238    H    ILE  33           H        ILE  33   2.184  -6.413  -5.516
  239    HA   ILE  33           HA       ILE  33   1.494  -3.495  -5.298
  240    HB   ILE  33           HB       ILE  33   4.287  -4.676  -5.409
  241   1HG1  ILE  33          2HG1      ILE  33   3.548  -2.674  -3.283
  242   2HG1  ILE  33          3HG1      ILE  33   2.929  -4.309  -3.056
  243   1HG2  ILE  33          1HG2      ILE  33   4.160  -2.650  -6.810
  244   2HG2  ILE  33          2HG2      ILE  33   3.385  -1.771  -5.473
  245   3HG2  ILE  33          3HG2      ILE  33   5.070  -2.306  -5.339
  246   1HD1  ILE  33          1HD1      ILE  33   5.839  -3.707  -3.636
  247   2HD1  ILE  33          2HD1      ILE  33   5.151  -3.927  -2.012
  248   3HD1  ILE  33          3HD1      ILE  33   5.132  -5.270  -3.179
  249    H    ASP  34           H        ASP  34   0.510  -3.152  -7.226
  250    HA   ASP  34           HA       ASP  34   1.489  -4.580  -9.647
  251   1HB   ASP  34          2HB       ASP  34  -0.855  -4.938  -9.039
  252   2HB   ASP  34          3HB       ASP  34  -1.150  -3.189  -9.147
  253    H    LEU  35           H        LEU  35   2.822  -3.452 -10.834
  254    HA   LEU  35           HA       LEU  35   3.117  -0.577 -10.728
  255   1HB   LEU  35          2HB       LEU  35   4.439  -2.835 -12.221
  256   2HB   LEU  35          3HB       LEU  35   4.714  -1.178 -12.737
  257    HG   LEU  35           HG       LEU  35   6.428  -2.219 -11.200
  258   1HD1  LEU  35          1HD1      LEU  35   6.856  -0.120  -9.970
  259   2HD1  LEU  35          2HD1      LEU  35   6.434   0.160 -11.666
  260   3HD1  LEU  35          3HD1      LEU  35   5.236   0.459 -10.398
  261   1HD2  LEU  35          1HD2      LEU  35   4.416  -1.609  -9.002
  262   2HD2  LEU  35          2HD2      LEU  35   4.888  -3.239  -9.543
  263   3HD2  LEU  35          3HD2      LEU  35   6.085  -2.161  -8.804
  264    HA   PRO  36           HA       PRO  36   1.631  -0.628 -15.237
  265   1HB   PRO  36          2HB       PRO  36  -0.211  -2.508 -16.109
  266   2HB   PRO  36          3HB       PRO  36   1.560  -2.619 -16.313
  267   1HG   PRO  36          2HG       PRO  36  -0.137  -3.872 -14.148
  268   2HG   PRO  36          3HG       PRO  36   1.151  -4.643 -15.116
  269   1HD   PRO  36          2HD       PRO  36   1.622  -3.768 -12.651
  270   2HD   PRO  36          3HD       PRO  36   2.852  -3.484 -13.913
  271    H    ASN  37           H        ASN  37  -0.793  -1.860 -12.852
  272    HA   ASN  37           HA       ASN  37  -2.822   0.062 -13.777
  273   1HB   ASN  37          2HB       ASN  37  -2.721  -1.614 -11.230
  274   2HB   ASN  37          3HB       ASN  37  -4.053  -0.600 -11.776
  275   1HD2  ASN  37          1HD2      ASN  37  -2.122  -3.459 -12.689
  276   2HD2  ASN  37          2HD2      ASN  37  -3.392  -4.218 -13.650
  277    H    LYS  38           H        LYS  38  -0.468  -0.283 -11.062
  278    HA   LYS  38           HA       LYS  38   0.607   1.212  -9.861
  279   1HB   LYS  38          2HB       LYS  38  -1.156   3.507 -10.774
  280   2HB   LYS  38          3HB       LYS  38   0.229   3.466  -9.770
  281   1HG   LYS  38          2HG       LYS  38   1.205   4.326 -11.599
  282   2HG   LYS  38          3HG       LYS  38   1.705   2.640 -11.525
  283   1HD   LYS  38          2HD       LYS  38   1.367   3.109 -13.780
  284   2HD   LYS  38          3HD       LYS  38  -0.009   2.149 -13.328
  285   1HE   LYS  38          2HE       LYS  38   0.128   5.166 -13.826
  286   2HE   LYS  38          3HE       LYS  38  -0.751   3.940 -14.760
  287   1HZ   LYS  38          1HZ       LYS  38  -2.053   3.608 -12.630
  288   2HZ   LYS  38          2HZ       LYS  38  -1.389   5.054 -12.127
  289   3HZ   LYS  38          3HZ       LYS  38  -2.325   5.029 -13.451
  290    H    LYS  39           H        LYS  39  -0.547  -0.474  -8.694
  291    HA   LYS  39           HA       LYS  39  -2.389   0.670  -6.706
  292   1HB   LYS  39          2HB       LYS  39  -2.899  -1.922  -8.250
  293   2HB   LYS  39          3HB       LYS  39  -3.762  -1.421  -6.793
  294   1HG   LYS  39          2HG       LYS  39  -4.711   0.519  -7.980
  295   2HG   LYS  39          3HG       LYS  39  -3.790   0.098  -9.427
  296   1HD   LYS  39          2HD       LYS  39  -6.044  -0.684  -9.723
  297   2HD   LYS  39          3HD       LYS  39  -4.984  -2.092  -9.544
  298   1HE   LYS  39          2HE       LYS  39  -5.710  -2.343  -7.161
  299   2HE   LYS  39          3HE       LYS  39  -6.696  -0.881  -7.302
  300   1HZ   LYS  39          1HZ       LYS  39  -8.041  -2.073  -8.932
  301   2HZ   LYS  39          2HZ       LYS  39  -7.108  -3.427  -8.733
  302   3HZ   LYS  39          3HZ       LYS  39  -7.982  -2.844  -7.491
  303    H    VAL  40           H        VAL  40  -2.529  -0.655  -4.739
  304    HA   VAL  40           HA       VAL  40  -0.648  -2.871  -4.539
  305    HB   VAL  40           HB       VAL  40  -1.081  -0.408  -2.820
  306   1HG1  VAL  40          1HG1      VAL  40  -0.386  -3.110  -1.668
  307   2HG1  VAL  40          2HG1      VAL  40  -0.153  -1.538  -0.855
  308   3HG1  VAL  40          3HG1      VAL  40  -1.783  -2.042  -1.331
  309   1HG2  VAL  40          1HG2      VAL  40   1.325  -2.160  -3.432
  310   2HG2  VAL  40          2HG2      VAL  40   0.883  -0.667  -4.298
  311   3HG2  VAL  40          3HG2      VAL  40   1.356  -0.608  -2.581
  312    H    CYS  41           H        CYS  41  -1.546  -4.542  -3.275
  313    HA   CYS  41           HA       CYS  41  -4.335  -4.184  -2.307
  314   1HB   CYS  41          2HB       CYS  41  -3.302  -6.701  -3.701
  315   2HB   CYS  41          3HB       CYS  41  -4.881  -6.471  -2.911
  316    HG   CYS  41           HG       CYS  41  -5.562  -4.407  -4.443
  317    H    ILE  42           H        ILE  42  -4.587  -5.206  -0.227
  318    HA   ILE  42           HA       ILE  42  -2.163  -6.583   0.827
  319    HB   ILE  42           HB       ILE  42  -3.594  -4.431   2.368
  320   1HG1  ILE  42          2HG1      ILE  42  -0.921  -4.242   0.882
  321   2HG1  ILE  42          3HG1      ILE  42  -2.393  -3.366   0.464
  322   1HG2  ILE  42          1HG2      ILE  42  -0.965  -5.866   2.840
  323   2HG2  ILE  42          2HG2      ILE  42  -1.730  -4.692   3.929
  324   3HG2  ILE  42          3HG2      ILE  42  -2.486  -6.250   3.667
  325   1HD1  ILE  42          1HD1      ILE  42  -2.314  -2.194   2.659
  326   2HD1  ILE  42          2HD1      ILE  42  -0.738  -2.970   2.964
  327   3HD1  ILE  42          3HD1      ILE  42  -0.932  -1.861   1.600
  328    H    GLU  43           H        GLU  43  -2.648  -8.355   1.749
  329    HA   GLU  43           HA       GLU  43  -5.368  -8.844   2.877
  330   1HB   GLU  43          2HB       GLU  43  -4.776 -10.005   0.604
  331   2HB   GLU  43          3HB       GLU  43  -3.765 -11.067   1.575
  332   1HG   GLU  43          2HG       GLU  43  -6.754 -10.563   2.066
  333   2HG   GLU  43          3HG       GLU  43  -6.100 -11.904   1.125
  334    H    SER  44           H        SER  44  -4.558  -8.370   5.044
  335    HA   SER  44           HA       SER  44  -3.011 -10.450   6.189
  336   1HB   SER  44          2HB       SER  44  -1.444  -8.260   5.224
  337   2HB   SER  44          3HB       SER  44  -1.498  -8.091   6.983
  338    HG   SER  44           HG       SER  44  -0.904 -10.401   7.051
  339    H    GLU  45           H        GLU  45  -2.503 -10.011   8.456
  340    HA   GLU  45           HA       GLU  45  -4.943  -9.434   9.815
  341   1HB   GLU  45          2HB       GLU  45  -2.237 -10.178  11.025
  342   2HB   GLU  45          3HB       GLU  45  -3.855 -10.558  11.614
  343   1HG   GLU  45          2HG       GLU  45  -3.339 -12.589  10.705
  344   2HG   GLU  45          3HG       GLU  45  -3.964 -11.864   9.226
  345    H    HIS  46           H        HIS  46  -4.167  -6.972   8.831
  346    HA   HIS  46           HA       HIS  46  -3.417  -5.438  11.282
  347   1HB   HIS  46          2HB       HIS  46  -2.203  -5.185   8.510
  348   2HB   HIS  46          3HB       HIS  46  -2.211  -3.853   9.668
  349    HD1  HIS  46           1HD      HIS  46  -0.909  -4.466  12.119
  350    HD2  HIS  46           2HD      HIS  46  -0.006  -6.585   8.607
  351    HE1  HIS  46           1HE      HIS  46   1.464  -5.354  12.396
  352    H    SER  47           H        SER  47  -4.771  -3.733  11.590
  353    HA   SER  47           HA       SER  47  -7.191  -3.574  10.107
  354   1HB   SER  47          2HB       SER  47  -6.915  -2.831  12.488
  355   2HB   SER  47          3HB       SER  47  -6.021  -1.419  11.887
  356    HG   SER  47           HG       SER  47  -8.728  -2.108  11.436
  357    H    MET  48           H        MET  48  -7.772  -2.547   8.345
  358    HA   MET  48           HA       MET  48  -6.359  -1.507   6.365
  359   1HB   MET  48          2HB       MET  48  -8.834  -1.966   6.536
  360   2HB   MET  48          3HB       MET  48  -9.024  -0.423   7.383
  361   1HG   MET  48          2HG       MET  48  -8.071   0.722   5.357
  362   2HG   MET  48          3HG       MET  48  -7.918  -0.869   4.596
  363   1HE   MET  48          1HE       MET  48 -11.954   1.230   5.452
  364   2HE   MET  48          2HE       MET  48 -11.007   0.518   6.772
  365   3HE   MET  48          3HE       MET  48 -10.365   1.915   5.867
  366    H    ASP  49           H        ASP  49  -7.686   0.529   9.075
  367    HA   ASP  49           HA       ASP  49  -6.309   2.753   7.859
  368   1HB   ASP  49          2HB       ASP  49  -8.517   3.155   8.851
  369   2HB   ASP  49          3HB       ASP  49  -7.729   3.115  10.445
  370    H    THR  50           H        THR  50  -5.289   0.419  10.147
  371    HA   THR  50           HA       THR  50  -3.226   2.103  11.360
  372    HB   THR  50           HB       THR  50  -3.304  -0.929  11.042
  373    HG1  THR  50           1HG      THR  50  -3.917  -0.626  13.344
  374   1HG2  THR  50          1HG2      THR  50  -1.709  -0.885  12.936
  375   2HG2  THR  50          2HG2      THR  50  -1.041  -0.065  11.520
  376   3HG2  THR  50          3HG2      THR  50  -1.680   0.891  12.875
  377    H    LEU  51           H        LEU  51  -3.519  -0.185   8.611
  378    HA   LEU  51           HA       LEU  51  -0.864   0.167   7.596
  379   1HB   LEU  51          2HB       LEU  51  -3.408  -0.367   6.007
  380   2HB   LEU  51          3HB       LEU  51  -1.748  -0.538   5.425
  381    HG   LEU  51           HG       LEU  51  -2.921  -2.097   7.800
  382   1HD1  LEU  51          1HD1      LEU  51  -3.105  -4.000   6.211
  383   2HD1  LEU  51          2HD1      LEU  51  -4.190  -2.659   5.814
  384   3HD1  LEU  51          3HD1      LEU  51  -2.699  -2.887   4.883
  385   1HD2  LEU  51          1HD2      LEU  51  -0.380  -2.397   6.145
  386   2HD2  LEU  51          2HD2      LEU  51  -0.491  -2.041   7.880
  387   3HD2  LEU  51          3HD2      LEU  51  -0.963  -3.631   7.274
  388    H    LEU  52           H        LEU  52  -3.953   1.826   6.627
  389    HA   LEU  52           HA       LEU  52  -2.779   3.673   4.900
  390   1HB   LEU  52          2HB       LEU  52  -5.196   3.886   6.619
  391   2HB   LEU  52          3HB       LEU  52  -4.692   5.157   5.551
  392    HG   LEU  52           HG       LEU  52  -5.154   2.343   4.557
  393   1HD1  LEU  52          1HD1      LEU  52  -7.130   4.666   4.644
  394   2HD1  LEU  52          2HD1      LEU  52  -7.401   3.098   3.855
  395   3HD1  LEU  52          3HD1      LEU  52  -7.230   3.182   5.613
  396   1HD2  LEU  52          1HD2      LEU  52  -4.983   5.105   3.229
  397   2HD2  LEU  52          2HD2      LEU  52  -3.863   3.745   2.992
  398   3HD2  LEU  52          3HD2      LEU  52  -5.514   3.651   2.387
  399    H    ALA  53           H        ALA  53  -3.524   4.246   8.404
  400    HA   ALA  53           HA       ALA  53  -2.416   6.806   8.596
  401   1HB   ALA  53          1HB       ALA  53  -2.207   6.358  11.014
  402   2HB   ALA  53          2HB       ALA  53  -3.758   5.759  10.396
  403   3HB   ALA  53          3HB       ALA  53  -2.428   4.621  10.721
  404    H    THR  54           H        THR  54  -0.701   3.705   8.761
  405    HA   THR  54           HA       THR  54   1.878   4.919   9.215
  406    HB   THR  54           HB       THR  54   1.175   2.269   7.863
  407    HG1  THR  54           1HG      THR  54   0.324   2.337   9.893
  408   1HG2  THR  54          1HG2      THR  54   3.457   2.953   7.394
  409   2HG2  THR  54          2HG2      THR  54   3.741   3.306   9.118
  410   3HG2  THR  54          3HG2      THR  54   3.447   1.641   8.576
  411    H    LEU  55           H        LEU  55   0.527   3.517   6.169
  412    HA   LEU  55           HA       LEU  55   2.772   4.376   4.680
  413   1HB   LEU  55          2HB       LEU  55   1.739   3.305   2.858
  414   2HB   LEU  55          3HB       LEU  55   1.450   2.395   4.302
  415    HG   LEU  55           HG       LEU  55  -0.791   3.589   4.431
  416   1HD1  LEU  55          1HD1      LEU  55   0.332   4.606   1.977
  417   2HD1  LEU  55          2HD1      LEU  55  -1.243   3.814   1.679
  418   3HD1  LEU  55          3HD1      LEU  55  -1.120   5.139   2.854
  419   1HD2  LEU  55          1HD2      LEU  55  -0.250   1.583   2.209
  420   2HD2  LEU  55          2HD2      LEU  55  -0.460   1.178   3.926
  421   3HD2  LEU  55          3HD2      LEU  55  -1.818   1.853   3.005
  422    H    LYS  56           H        LYS  56  -0.324   5.791   5.093
  423    HA   LYS  56           HA       LYS  56  -0.584   7.923   3.419
  424   1HB   LYS  56          2HB       LYS  56  -0.904   7.744   6.440
  425   2HB   LYS  56          3HB       LYS  56  -1.123   9.289   5.665
  426   1HG   LYS  56          2HG       LYS  56  -2.941   8.413   4.249
  427   2HG   LYS  56          3HG       LYS  56  -2.831   6.857   5.052
  428   1HD   LYS  56          2HD       LYS  56  -3.053   8.393   7.274
  429   2HD   LYS  56          3HD       LYS  56  -3.658   9.560   6.130
  430   1HE   LYS  56          2HE       LYS  56  -5.708   8.711   6.515
  431   2HE   LYS  56          3HE       LYS  56  -5.235   7.381   5.470
  432   1HZ   LYS  56          1HZ       LYS  56  -4.505   6.253   7.601
  433   2HZ   LYS  56          2HZ       LYS  56  -5.220   7.458   8.443
  434   3HZ   LYS  56          3HZ       LYS  56  -6.097   6.467   7.506
  435    H    LYS  57           H        LYS  57   1.751   7.662   6.115
  436    HA   LYS  57           HA       LYS  57   2.649  10.359   6.048
  437   1HB   LYS  57          2HB       LYS  57   3.912   7.849   7.164
  438   2HB   LYS  57          3HB       LYS  57   4.495   9.502   7.463
  439   1HG   LYS  57          2HG       LYS  57   2.282  10.075   8.439
  440   2HG   LYS  57          3HG       LYS  57   1.706   8.447   8.062
  441   1HD   LYS  57          2HD       LYS  57   2.188   8.492  10.373
  442   2HD   LYS  57          3HD       LYS  57   3.322   7.413   9.548
  443   1HE   LYS  57          2HE       LYS  57   5.096   9.142   9.652
  444   2HE   LYS  57          3HE       LYS  57   3.952  10.309  10.340
  445   1HZ   LYS  57          1HZ       LYS  57   3.775   8.896  12.272
  446   2HZ   LYS  57          2HZ       LYS  57   4.826   7.806  11.627
  447   3HZ   LYS  57          3HZ       LYS  57   5.341   9.319  12.011
  448    H    THR  58           H        THR  58   3.364   7.796   3.793
  449    HA   THR  58           HA       THR  58   5.974   8.671   2.975
  450    HB   THR  58           HB       THR  58   5.449   7.649   0.817
  451    HG1  THR  58           1HG      THR  58   2.897   7.030   1.862
  452   1HG2  THR  58          1HG2      THR  58   6.261   6.222   2.585
  453   2HG2  THR  58          2HG2      THR  58   4.623   5.986   3.212
  454   3HG2  THR  58          3HG2      THR  58   5.058   5.356   1.604
  455    H    GLY  59           H        GLY  59   2.673   9.838   2.405
  456   1HA   GLY  59          2HA       GLY  59   1.842  11.718   1.503
  457   2HA   GLY  59          3HA       GLY  59   3.474  12.410   1.493
  458    H    LYS  60           H        LYS  60   2.557   9.415  -0.244
  459    HA   LYS  60           HA       LYS  60   3.088  10.719  -2.870
  460   1HB   LYS  60          2HB       LYS  60   3.137   7.901  -1.751
  461   2HB   LYS  60          3HB       LYS  60   2.959   8.143  -3.482
  462   1HG   LYS  60          2HG       LYS  60   5.312   7.797  -2.703
  463   2HG   LYS  60          3HG       LYS  60   5.033   9.239  -3.705
  464   1HD   LYS  60          2HD       LYS  60   5.107  10.704  -1.811
  465   2HD   LYS  60          3HD       LYS  60   5.063   9.313  -0.701
  466   1HE   LYS  60          2HE       LYS  60   7.325   8.706  -1.287
  467   2HE   LYS  60          3HE       LYS  60   7.383   9.942  -2.561
  468   1HZ   LYS  60          1HZ       LYS  60   6.896  10.593   0.279
  469   2HZ   LYS  60          2HZ       LYS  60   8.411  10.605  -0.396
  470   3HZ   LYS  60          3HZ       LYS  60   7.241  11.634  -0.930
  471    H    THR  61           H        THR  61   1.724   9.465  -4.674
  472    HA   THR  61           HA       THR  61  -1.004  10.317  -4.441
  473    HB   THR  61           HB       THR  61  -0.809   9.112  -6.748
  474    HG1  THR  61           1HG      THR  61   1.320   8.619  -7.334
  475   1HG2  THR  61          1HG2      THR  61   0.929  11.549  -6.133
  476   2HG2  THR  61          2HG2      THR  61   0.381  11.062  -7.749
  477   3HG2  THR  61          3HG2      THR  61  -0.804  11.574  -6.532
  478    H    VAL  62           H        VAL  62  -0.901   8.663  -2.459
  479    HA   VAL  62           HA       VAL  62  -1.898   6.013  -3.389
  480    HB   VAL  62           HB       VAL  62   0.121   5.627  -2.296
  481   1HG1  VAL  62          1HG1      VAL  62  -0.868   7.325   0.030
  482   2HG1  VAL  62          2HG1      VAL  62   0.579   6.296   0.054
  483   3HG1  VAL  62          3HG1      VAL  62   0.500   7.668  -1.052
  484   1HG2  VAL  62          1HG2      VAL  62  -1.874   4.158  -1.735
  485   2HG2  VAL  62          2HG2      VAL  62  -0.533   4.115  -0.576
  486   3HG2  VAL  62          3HG2      VAL  62  -2.007   5.042  -0.208
  487    H    SER  63           H        SER  63  -3.886   5.297  -2.773
  488    HA   SER  63           HA       SER  63  -5.097   6.238  -0.352
  489   1HB   SER  63          2HB       SER  63  -5.710   8.161  -1.841
  490   2HB   SER  63          3HB       SER  63  -6.548   7.018  -2.917
  491    HG   SER  63           HG       SER  63  -7.945   7.988  -1.337
  492    H    TYR  64           H        TYR  64  -7.461   5.343  -0.372
  493    HA   TYR  64           HA       TYR  64  -7.142   2.411  -0.847
  494   1HB   TYR  64          2HB       TYR  64  -7.397   2.911   1.443
  495   2HB   TYR  64          3HB       TYR  64  -8.671   4.087   1.145
  496    HD1  TYR  64           HD1      TYR  64 -10.961   3.448   1.086
  497    HD2  TYR  64           HD2      TYR  64  -7.899   0.413   0.988
  498    HE1  TYR  64           HE1      TYR  64 -12.684   1.703   1.378
  499    HE2  TYR  64           HE2      TYR  64  -9.628  -1.327   1.343
  500    HH   TYR  64           HH       TYR  64 -13.096  -0.541   1.697
  501    H    LEU  65           H        LEU  65  -8.512   1.327  -2.196
  502    HA   LEU  65           HA       LEU  65 -11.229   2.280  -2.632
  503   1HB   LEU  65          2HB       LEU  65 -10.859   1.935  -5.177
  504   2HB   LEU  65          3HB       LEU  65 -10.640   3.489  -4.396
  505    HG   LEU  65           HG       LEU  65  -9.010   2.972  -6.093
  506   1HD1  LEU  65          1HD1      LEU  65  -7.432   3.291  -3.627
  507   2HD1  LEU  65          2HD1      LEU  65  -7.250   4.058  -5.203
  508   3HD1  LEU  65          3HD1      LEU  65  -8.585   4.536  -4.154
  509   1HD2  LEU  65          1HD2      LEU  65  -7.864   0.817  -4.338
  510   2HD2  LEU  65          2HD2      LEU  65  -8.718   0.595  -5.880
  511   3HD2  LEU  65          3HD2      LEU  65  -7.178   1.440  -5.855
  512    H    GLY  66           H        GLY  66 -11.334   0.188  -1.315
  513   1HA   GLY  66          2HA       GLY  66 -13.133  -1.302  -2.130
  514   2HA   GLY  66          3HA       GLY  66 -12.020  -1.901  -3.368
  515    H    LEU  67           H        LEU  67 -13.141  -3.774  -1.758
  516    HA   LEU  67           HA       LEU  67 -10.842  -4.843  -0.429
  517   1HB   LEU  67          2HB       LEU  67 -11.817  -5.264   1.706
  518   2HB   LEU  67          3HB       LEU  67 -11.943  -3.537   1.418
  519    HG   LEU  67           HG       LEU  67 -14.188  -5.604   1.180
  520   1HD1  LEU  67          1HD1      LEU  67 -13.646  -3.441   3.253
  521   2HD1  LEU  67          2HD1      LEU  67 -15.041  -4.542   3.226
  522   3HD1  LEU  67          3HD1      LEU  67 -13.411  -5.187   3.482
  523   1HD2  LEU  67          1HD2      LEU  67 -14.752  -3.794  -0.344
  524   2HD2  LEU  67          2HD2      LEU  67 -15.695  -3.579   1.127
  525   3HD2  LEU  67          3HD2      LEU  67 -14.261  -2.570   0.852
  526    H    GLU  68           H        GLU  68 -11.120  -7.164  -0.069
  527    HA   GLU  68           HA       GLU  68 -13.392  -8.502  -1.342
  528   1HB   GLU  68          2HB       GLU  68 -11.839  -7.649  -3.186
  529   2HB   GLU  68          3HB       GLU  68 -10.592  -8.708  -2.527
  530   1HG   GLU  68          2HG       GLU  68 -12.011 -10.677  -2.970
  531   2HG   GLU  68          3HG       GLU  68 -13.283  -9.618  -3.613
  Start of MODEL   26
    1   1H    MET   1           H1       MET   1  -6.509  -9.171   8.017
    2   2H    MET   1           H2       MET   1  -7.421  -9.303   9.417
    3   3H    MET   1           H3       MET   1  -7.337 -10.532   8.398
    4    HA   MET   1           HA       MET   1  -9.421  -9.256   8.170
    5   1HB   MET   1          2HB       MET   1  -7.400  -7.041   7.552
    6   2HB   MET   1          3HB       MET   1  -9.098  -6.864   7.150
    7   1HG   MET   1          2HG       MET   1  -8.954  -5.836   9.244
    8   2HG   MET   1          3HG       MET   1  -9.552  -7.447   9.636
    9   1HE   MET   1          1HE       MET   1  -8.846  -8.140  11.906
   10   2HE   MET   1          2HE       MET   1  -7.463  -7.417  12.752
   11   3HE   MET   1          3HE       MET   1  -8.773  -6.373  12.144
   12    HA   PRO   2           HA       PRO   2  -9.603 -10.422   3.858
   13   1HB   PRO   2          2HB       PRO   2 -10.973  -8.220   2.699
   14   2HB   PRO   2          3HB       PRO   2 -11.706  -9.657   3.458
   15   1HG   PRO   2          2HG       PRO   2 -11.084  -6.952   4.675
   16   2HG   PRO   2          3HG       PRO   2 -12.593  -7.908   4.829
   17   1HD   PRO   2          2HD       PRO   2 -10.860  -7.979   6.817
   18   2HD   PRO   2          3HD       PRO   2 -11.477  -9.529   6.220
   19    H    LYS   3           H        LYS   3  -9.350  -9.346   1.524
   20    HA   LYS   3           HA       LYS   3  -6.644  -8.128   1.464
   21   1HB   LYS   3          2HB       LYS   3  -6.813 -10.002   0.107
   22   2HB   LYS   3          3HB       LYS   3  -8.433  -9.637  -0.444
   23   1HG   LYS   3          2HG       LYS   3  -6.246  -7.711  -1.229
   24   2HG   LYS   3          3HG       LYS   3  -6.276  -9.321  -1.972
   25   1HD   LYS   3          2HD       LYS   3  -8.621  -9.065  -2.633
   26   2HD   LYS   3          3HD       LYS   3  -8.687  -7.454  -1.902
   27   1HE   LYS   3          2HE       LYS   3  -6.956  -6.669  -3.513
   28   2HE   LYS   3          3HE       LYS   3  -6.931  -8.284  -4.255
   29   1HZ   LYS   3          1HZ       LYS   3  -9.291  -6.540  -4.073
   30   2HZ   LYS   3          2HZ       LYS   3  -8.363  -6.696  -5.396
   31   3HZ   LYS   3          3HZ       LYS   3  -9.282  -7.988  -4.793
   32    H    HIS   4           H        HIS   4  -6.397  -5.983   0.975
   33    HA   HIS   4           HA       HIS   4  -8.863  -4.366   0.532
   34   1HB   HIS   4          2HB       HIS   4  -6.275  -3.432   1.767
   35   2HB   HIS   4          3HB       HIS   4  -7.854  -2.678   1.848
   36    HD1  HIS   4           1HD      HIS   4  -5.694  -5.343   3.429
   37    HD2  HIS   4           2HD      HIS   4  -9.616  -3.854   3.662
   38    HE1  HIS   4           1HE      HIS   4  -6.584  -6.001   5.734
   39    H    GLU   5           H        GLU   5  -8.804  -2.724  -1.051
   40    HA   GLU   5           HA       GLU   5  -6.569  -2.894  -3.046
   41   1HB   GLU   5          2HB       GLU   5  -9.513  -2.177  -3.169
   42   2HB   GLU   5          3HB       GLU   5  -8.389  -1.792  -4.460
   43   1HG   GLU   5          2HG       GLU   5  -8.401  -4.620  -3.542
   44   2HG   GLU   5          3HG       GLU   5  -9.864  -4.034  -4.356
   45    H    PHE   6           H        PHE   6  -5.525  -0.999  -3.668
   46    HA   PHE   6           HA       PHE   6  -6.607   1.589  -2.755
   47   1HB   PHE   6          2HB       PHE   6  -3.691   0.715  -2.514
   48   2HB   PHE   6          3HB       PHE   6  -4.325   2.239  -1.952
   49    HD1  PHE   6           1HD      PHE   6  -4.869   2.423   0.448
   50    HD2  PHE   6           2HD      PHE   6  -4.418  -1.466  -1.405
   51    HE1  PHE   6           1HE      PHE   6  -4.920   1.334   2.643
   52    HE2  PHE   6           2HE      PHE   6  -4.534  -2.520   0.787
   53    HZ   PHE   6           HZ       PHE   6  -4.830  -1.134   2.845
   54    H    SER   7           H        SER   7  -6.326   3.191  -4.297
   55    HA   SER   7           HA       SER   7  -4.882   2.441  -6.817
   56   1HB   SER   7          2HB       SER   7  -7.410   3.031  -6.955
   57   2HB   SER   7          3HB       SER   7  -6.877   4.703  -6.669
   58    HG   SER   7           HG       SER   7  -5.512   4.427  -8.530
   59    H    VAL   8           H        VAL   8  -3.234   3.814  -7.527
   60    HA   VAL   8           HA       VAL   8  -2.319   5.828  -5.561
   61    HB   VAL   8           HB       VAL   8  -0.777   3.456  -6.731
   62   1HG1  VAL   8          1HG1      VAL   8  -0.298   5.350  -4.403
   63   2HG1  VAL   8          2HG1      VAL   8   0.675   3.898  -4.732
   64   3HG1  VAL   8          3HG1      VAL   8   0.614   5.209  -5.912
   65   1HG2  VAL   8          1HG2      VAL   8  -1.023   2.453  -4.386
   66   2HG2  VAL   8          2HG2      VAL   8  -2.370   3.574  -4.138
   67   3HG2  VAL   8          3HG2      VAL   8  -2.440   2.350  -5.420
   68    H    ASP   9           H        ASP   9  -0.479   7.145  -6.441
   69    HA   ASP   9           HA       ASP   9   0.276   6.469  -9.220
   70   1HB   ASP   9          2HB       ASP   9  -0.590   8.743  -9.291
   71   2HB   ASP   9          3HB       ASP   9   0.496   9.234  -7.986
   72    H    MET  10           H        MET  10   1.770   5.006  -8.572
   73    HA   MET  10           HA       MET  10   4.234   6.155  -7.342
   74   1HB   MET  10          2HB       MET  10   2.937   3.417  -7.133
   75   2HB   MET  10          3HB       MET  10   4.658   3.596  -6.835
   76   1HG   MET  10          2HG       MET  10   2.683   5.410  -5.435
   77   2HG   MET  10          3HG       MET  10   2.998   3.779  -4.867
   78   1HE   MET  10          1HE       MET  10   4.662   6.327  -2.322
   79   2HE   MET  10          2HE       MET  10   3.213   6.646  -3.310
   80   3HE   MET  10          3HE       MET  10   3.425   5.066  -2.526
   81    H    THR  11           H        THR  11   3.775   6.876  -9.869
   82    HA   THR  11           HA       THR  11   5.040   4.885 -11.643
   83    HB   THR  11           HB       THR  11   4.246   7.752 -12.253
   84    HG1  THR  11           1HG      THR  11   2.463   6.866 -11.473
   85   1HG2  THR  11          1HG2      THR  11   3.824   6.784 -14.518
   86   2HG2  THR  11          2HG2      THR  11   5.530   6.677 -14.076
   87   3HG2  THR  11          3HG2      THR  11   4.505   5.236 -13.982
   88    H    CYS  12           H        CYS  12   7.002   5.196  -9.762
   89    HA   CYS  12           HA       CYS  12   9.050   6.338 -11.491
   90   1HB   CYS  12          2HB       CYS  12   8.316   8.367 -10.230
   91   2HB   CYS  12          3HB       CYS  12   8.797   7.569  -8.718
   92    HG   CYS  12           HG       CYS  12  10.591   9.325  -9.542
   93    H    GLY  13           H        GLY  13   9.156   3.894 -11.311
   94   1HA   GLY  13          2HA       GLY  13  10.272   2.003 -10.673
   95   2HA   GLY  13          3HA       GLY  13  11.620   3.135 -10.619
   96    H    GLY  14           H        GLY  14  12.205   4.048  -8.509
   97   1HA   GLY  14          2HA       GLY  14  12.316   2.095  -6.411
   98   2HA   GLY  14          3HA       GLY  14  12.850   3.787  -6.311
   99    H    CYS  15           H        CYS  15   9.945   4.439  -7.253
  100    HA   CYS  15           HA       CYS  15   8.325   4.854  -5.086
  101   1HB   CYS  15          2HB       CYS  15   6.490   4.666  -6.579
  102   2HB   CYS  15          3HB       CYS  15   7.832   5.416  -7.426
  103    HG   CYS  15           HG       CYS  15   6.081   2.984  -8.178
  104    H    ALA  16           H        ALA  16   8.905   1.679  -6.728
  105    HA   ALA  16           HA       ALA  16   7.069   0.188  -5.139
  106   1HB   ALA  16          1HB       ALA  16   8.303  -1.776  -5.991
  107   2HB   ALA  16          2HB       ALA  16   7.984  -0.610  -7.290
  108   3HB   ALA  16          3HB       ALA  16   9.607  -0.719  -6.574
  109    H    GLU  17           H        GLU  17  10.518   1.008  -4.681
  110    HA   GLU  17           HA       GLU  17  10.870  -0.575  -2.280
  111   1HB   GLU  17          2HB       GLU  17  12.406   1.777  -3.475
  112   2HB   GLU  17          3HB       GLU  17  12.636   1.250  -1.827
  113   1HG   GLU  17          2HG       GLU  17  13.074  -1.102  -2.718
  114   2HG   GLU  17          3HG       GLU  17  13.169  -0.350  -4.324
  115    H    ALA  18           H        ALA  18   9.782   2.784  -2.981
  116    HA   ALA  18           HA       ALA  18   9.714   3.645  -0.285
  117   1HB   ALA  18          1HB       ALA  18   7.761   4.493  -2.465
  118   2HB   ALA  18          2HB       ALA  18   8.159   5.363  -0.979
  119   3HB   ALA  18          3HB       ALA  18   9.397   5.150  -2.236
  120    H    VAL  19           H        VAL  19   7.029   2.233  -2.222
  121    HA   VAL  19           HA       VAL  19   5.187   2.073  -0.062
  122    HB   VAL  19           HB       VAL  19   5.366   0.334  -2.553
  123   1HG1  VAL  19          1HG1      VAL  19   2.918  -0.033  -2.103
  124   2HG1  VAL  19          2HG1      VAL  19   3.937  -0.747  -0.854
  125   3HG1  VAL  19          3HG1      VAL  19   3.112   0.798  -0.544
  126   1HG2  VAL  19          1HG2      VAL  19   3.636   1.848  -3.433
  127   2HG2  VAL  19          2HG2      VAL  19   3.699   2.813  -1.943
  128   3HG2  VAL  19          3HG2      VAL  19   5.095   2.763  -3.039
  129    H    SER  20           H        SER  20   7.422  -0.418  -1.408
  130    HA   SER  20           HA       SER  20   6.599  -2.451   0.364
  131   1HB   SER  20          2HB       SER  20   7.963  -2.786  -1.735
  132   2HB   SER  20          3HB       SER  20   9.341  -1.990  -0.956
  133    HG   SER  20           HG       SER  20   9.532  -4.237  -0.836
  134    H    ARG  21           H        ARG  21   9.309  -0.142   0.754
  135    HA   ARG  21           HA       ARG  21  10.174  -1.179   3.230
  136   1HB   ARG  21          2HB       ARG  21  10.552   1.532   1.936
  137   2HB   ARG  21          3HB       ARG  21  11.376   1.007   3.417
  138   1HG   ARG  21          2HG       ARG  21  12.413  -0.878   2.296
  139   2HG   ARG  21          3HG       ARG  21  11.453  -0.657   0.854
  140   1HD   ARG  21          2HD       ARG  21  13.579   0.087   0.319
  141   2HD   ARG  21          3HD       ARG  21  12.544   1.526   0.414
  142    HE   ARG  21           HE       ARG  21  13.619   1.408   2.915
  143   1HH1  ARG  21          2HH2      ARG  21  15.176   1.262  -0.325
  144   2HH1  ARG  21          1HH2      ARG  21  16.526   2.211   0.150
  145   1HH2  ARG  21          2HH1      ARG  21  15.492   2.603   3.537
  146   2HH2  ARG  21          1HH1      ARG  21  16.747   2.930   2.384
  147    H    VAL  22           H        VAL  22   7.829   1.630   2.579
  148    HA   VAL  22           HA       VAL  22   7.510   2.073   5.316
  149    HB   VAL  22           HB       VAL  22   6.973   3.584   3.338
  150   1HG1  VAL  22          1HG1      VAL  22   4.273   2.232   3.588
  151   2HG1  VAL  22          2HG1      VAL  22   4.659   3.629   2.570
  152   3HG1  VAL  22          3HG1      VAL  22   5.366   2.060   2.192
  153   1HG2  VAL  22          1HG2      VAL  22   5.243   4.751   4.589
  154   2HG2  VAL  22          2HG2      VAL  22   4.975   3.303   5.589
  155   3HG2  VAL  22          3HG2      VAL  22   6.552   4.151   5.649
  156    H    LEU  23           H        LEU  23   5.679  -0.234   3.130
  157    HA   LEU  23           HA       LEU  23   3.966  -0.989   5.321
  158   1HB   LEU  23          2HB       LEU  23   4.554  -2.214   2.639
  159   2HB   LEU  23          3HB       LEU  23   3.694  -3.095   3.892
  160    HG   LEU  23           HG       LEU  23   2.087  -2.245   2.517
  161   1HD1  LEU  23          1HD1      LEU  23   0.618  -1.077   4.014
  162   2HD1  LEU  23          2HD1      LEU  23   1.627  -2.128   5.024
  163   3HD1  LEU  23          3HD1      LEU  23   1.943  -0.382   4.929
  164   1HD2  LEU  23          1HD2      LEU  23   3.308  -0.465   1.489
  165   2HD2  LEU  23          2HD2      LEU  23   1.705   0.094   2.028
  166   3HD2  LEU  23          3HD2      LEU  23   3.153   0.518   2.965
  167    H    ASN  24           H        ASN  24   7.022  -2.392   4.115
  168    HA   ASN  24           HA       ASN  24   7.255  -4.527   5.947
  169   1HB   ASN  24          2HB       ASN  24   8.806  -4.483   4.199
  170   2HB   ASN  24          3HB       ASN  24   9.196  -2.782   4.453
  171   1HD2  ASN  24          1HD2      ASN  24  10.461  -2.110   6.202
  172   2HD2  ASN  24          2HD2      ASN  24  11.619  -3.230   6.937
  173    H    LYS  25           H        LYS  25   7.950  -1.035   6.380
  174    HA   LYS  25           HA       LYS  25   8.999  -1.258   9.004
  175   1HB   LYS  25          2HB       LYS  25   7.686   0.914   7.371
  176   2HB   LYS  25          3HB       LYS  25   7.719   1.146   9.100
  177   1HG   LYS  25          2HG       LYS  25  10.097   0.698   7.241
  178   2HG   LYS  25          3HG       LYS  25   9.632   2.209   8.020
  179   1HD   LYS  25          2HD       LYS  25  10.884  -0.253   9.290
  180   2HD   LYS  25          3HD       LYS  25  11.504   1.389   9.214
  181   1HE   LYS  25          2HE       LYS  25   9.714   2.176  10.751
  182   2HE   LYS  25          3HE       LYS  25   9.036   0.542  10.828
  183   1HZ   LYS  25          1HZ       LYS  25  11.037  -0.236  11.817
  184   2HZ   LYS  25          2HZ       LYS  25  11.711   1.270  11.780
  185   3HZ   LYS  25          3HZ       LYS  25  10.381   0.978  12.704
  186    H    LEU  26           H        LEU  26   5.644  -1.342   7.915
  187    HA   LEU  26           HA       LEU  26   4.487  -1.172  10.533
  188   1HB   LEU  26          2HB       LEU  26   3.487  -1.098   8.072
  189   2HB   LEU  26          3HB       LEU  26   3.262  -2.793   8.247
  190    HG   LEU  26           HG       LEU  26   1.334  -1.095   8.793
  191   1HD1  LEU  26          1HD1      LEU  26   1.873  -3.526  10.530
  192   2HD1  LEU  26          2HD1      LEU  26   0.301  -2.738  10.272
  193   3HD1  LEU  26          3HD1      LEU  26   1.125  -3.517   8.914
  194   1HD2  LEU  26          1HD2      LEU  26   2.509  -1.332  11.589
  195   2HD2  LEU  26          2HD2      LEU  26   2.622   0.138  10.589
  196   3HD2  LEU  26          3HD2      LEU  26   1.044  -0.484  11.085
  197    H    GLY  27           H        GLY  27   5.440  -3.807   8.364
  198   1HA   GLY  27          2HA       GLY  27   6.973  -5.401   9.416
  199   2HA   GLY  27          3HA       GLY  27   5.865  -5.461  10.777
  200    H    GLY  28           H        GLY  28   3.937  -6.745  10.627
  201   1HA   GLY  28          2HA       GLY  28   4.520  -9.149   9.095
  202   2HA   GLY  28          3HA       GLY  28   3.263  -8.918  10.316
  203    H    VAL  29           H        VAL  29   3.922  -7.354   7.140
  204    HA   VAL  29           HA       VAL  29   1.033  -7.742   6.460
  205    HB   VAL  29           HB       VAL  29   1.417  -5.490   7.136
  206   1HG1  VAL  29          1HG1      VAL  29   3.771  -5.183   6.966
  207   2HG1  VAL  29          2HG1      VAL  29   3.748  -5.356   5.208
  208   3HG1  VAL  29          3HG1      VAL  29   2.951  -3.975   5.980
  209   1HG2  VAL  29          1HG2      VAL  29   0.714  -4.305   5.152
  210   2HG2  VAL  29          2HG2      VAL  29   1.236  -5.634   4.110
  211   3HG2  VAL  29          3HG2      VAL  29  -0.095  -5.878   5.265
  212    H    LYS  30           H        LYS  30   0.600  -8.824   4.587
  213    HA   LYS  30           HA       LYS  30   2.725  -8.946   2.535
  214   1HB   LYS  30          2HB       LYS  30   1.172 -10.974   3.326
  215   2HB   LYS  30          3HB       LYS  30   0.126 -10.323   2.057
  216   1HG   LYS  30          2HG       LYS  30   3.070 -11.096   1.807
  217   2HG   LYS  30          3HG       LYS  30   1.717 -12.073   1.242
  218   1HD   LYS  30          2HD       LYS  30   1.231 -10.648  -0.579
  219   2HD   LYS  30          3HD       LYS  30   2.037  -9.265   0.133
  220   1HE   LYS  30          2HE       LYS  30   4.245 -10.318  -0.118
  221   2HE   LYS  30          3HE       LYS  30   3.470 -11.666  -0.990
  222   1HZ   LYS  30          1HZ       LYS  30   3.353  -8.807  -1.778
  223   2HZ   LYS  30          2HZ       LYS  30   4.253  -9.947  -2.552
  224   3HZ   LYS  30          3HZ       LYS  30   2.624 -10.006  -2.563
  225    H    TYR  31           H        TYR  31   2.768  -7.245   1.365
  226    HA   TYR  31           HA       TYR  31   0.316  -5.939   0.289
  227   1HB   TYR  31          2HB       TYR  31   1.860  -3.997  -0.099
  228   2HB   TYR  31          3HB       TYR  31   1.542  -4.350   1.595
  229    HD1  TYR  31           HD1      TYR  31   3.262  -5.296   3.052
  230    HD2  TYR  31           HD2      TYR  31   4.088  -4.606  -1.088
  231    HE1  TYR  31           HE1      TYR  31   5.694  -5.533   3.516
  232    HE2  TYR  31           HE2      TYR  31   6.511  -4.930  -0.666
  233    HH   TYR  31           HH       TYR  31   8.137  -4.846   1.047
  234    H    ASP  32           H        ASP  32   0.346  -5.522  -1.978
  235    HA   ASP  32           HA       ASP  32   2.714  -6.367  -3.508
  236   1HB   ASP  32          2HB       ASP  32  -0.082  -7.471  -3.717
  237   2HB   ASP  32          3HB       ASP  32   0.776  -7.137  -5.219
  238    H    ILE  33           H        ILE  33   2.987  -5.216  -5.358
  239    HA   ILE  33           HA       ILE  33   1.583  -2.577  -5.433
  240    HB   ILE  33           HB       ILE  33   4.508  -3.178  -6.014
  241   1HG1  ILE  33          2HG1      ILE  33   4.555  -1.491  -3.903
  242   2HG1  ILE  33          3HG1      ILE  33   3.090  -2.367  -3.479
  243   1HG2  ILE  33          1HG2      ILE  33   2.993  -0.550  -5.764
  244   2HG2  ILE  33          2HG2      ILE  33   4.735  -0.748  -6.061
  245   3HG2  ILE  33          3HG2      ILE  33   3.572  -1.268  -7.285
  246   1HD1  ILE  33          1HD1      ILE  33   5.229  -3.283  -2.512
  247   2HD1  ILE  33          2HD1      ILE  33   4.363  -4.496  -3.478
  248   3HD1  ILE  33          3HD1      ILE  33   5.783  -3.654  -4.148
  249    H    ASP  34           H        ASP  34   0.294  -2.657  -7.201
  250    HA   ASP  34           HA       ASP  34   1.079  -4.156  -9.626
  251   1HB   ASP  34          2HB       ASP  34  -1.268  -4.148  -8.849
  252   2HB   ASP  34          3HB       ASP  34  -1.306  -2.392  -9.058
  253    H    LEU  35           H        LEU  35   2.980  -3.077  -9.999
  254    HA   LEU  35           HA       LEU  35   3.241  -0.259 -10.178
  255   1HB   LEU  35          2HB       LEU  35   5.057  -1.844  -9.636
  256   2HB   LEU  35          3HB       LEU  35   5.007  -2.473 -11.286
  257    HG   LEU  35           HG       LEU  35   5.745  -0.273 -12.159
  258   1HD1  LEU  35          1HD1      LEU  35   6.608   1.437 -10.554
  259   2HD1  LEU  35          2HD1      LEU  35   4.853   1.277 -10.461
  260   3HD1  LEU  35          3HD1      LEU  35   5.881   0.530  -9.213
  261   1HD2  LEU  35          1HD2      LEU  35   8.044  -0.369 -11.278
  262   2HD2  LEU  35          2HD2      LEU  35   7.496  -1.339  -9.901
  263   3HD2  LEU  35          3HD2      LEU  35   7.407  -2.001 -11.547
  264    HA   PRO  36           HA       PRO  36   2.639  -0.694 -14.898
  265   1HB   PRO  36          2HB       PRO  36   0.629  -2.444 -15.704
  266   2HB   PRO  36          3HB       PRO  36   2.389  -2.673 -15.893
  267   1HG   PRO  36          2HG       PRO  36   0.571  -3.822 -13.817
  268   2HG   PRO  36          3HG       PRO  36   1.971  -4.584 -14.603
  269   1HD   PRO  36          2HD       PRO  36   2.040  -3.586 -12.106
  270   2HD   PRO  36          3HD       PRO  36   3.483  -3.525 -13.145
  271    H    ASN  37           H        ASN  37  -0.244  -1.663 -12.842
  272    HA   ASN  37           HA       ASN  37  -1.837   0.382 -14.201
  273   1HB   ASN  37          2HB       ASN  37  -2.586  -1.498 -11.940
  274   2HB   ASN  37          3HB       ASN  37  -3.679  -0.457 -12.819
  275   1HD2  ASN  37          1HD2      ASN  37  -1.717  -3.366 -13.026
  276   2HD2  ASN  37          2HD2      ASN  37  -2.390  -3.947 -14.555
  277    H    LYS  38           H        LYS  38  -0.102   0.203 -11.157
  278    HA   LYS  38           HA       LYS  38   0.361   1.720  -9.586
  279   1HB   LYS  38          2HB       LYS  38  -1.298   3.781 -11.100
  280   2HB   LYS  38          3HB       LYS  38  -0.411   4.026  -9.604
  281   1HG   LYS  38          2HG       LYS  38   0.771   4.898 -11.550
  282   2HG   LYS  38          3HG       LYS  38   1.712   3.742 -10.591
  283   1HD   LYS  38          2HD       LYS  38   1.331   1.992 -12.171
  284   2HD   LYS  38          3HD       LYS  38   0.189   2.985 -13.119
  285   1HE   LYS  38          2HE       LYS  38   1.975   4.383 -13.898
  286   2HE   LYS  38          3HE       LYS  38   3.109   3.723 -12.697
  287   1HZ   LYS  38          1HZ       LYS  38   1.860   2.030 -14.743
  288   2HZ   LYS  38          2HZ       LYS  38   3.351   2.751 -14.962
  289   3HZ   LYS  38          3HZ       LYS  38   3.081   1.661 -13.736
  290    H    LYS  39           H        LYS  39  -1.118  -0.222  -9.106
  291    HA   LYS  39           HA       LYS  39  -3.112   0.847  -7.172
  292   1HB   LYS  39          2HB       LYS  39  -3.315  -1.632  -8.905
  293   2HB   LYS  39          3HB       LYS  39  -3.860  -1.697  -7.231
  294   1HG   LYS  39          2HG       LYS  39  -5.327   0.286  -7.674
  295   2HG   LYS  39          3HG       LYS  39  -4.886   0.172  -9.396
  296   1HD   LYS  39          2HD       LYS  39  -5.722  -2.187  -9.418
  297   2HD   LYS  39          3HD       LYS  39  -6.070  -2.077  -7.681
  298   1HE   LYS  39          2HE       LYS  39  -7.676  -0.190  -8.171
  299   2HE   LYS  39          3HE       LYS  39  -7.464  -0.521  -9.903
  300   1HZ   LYS  39          1HZ       LYS  39  -8.267  -2.781  -9.436
  301   2HZ   LYS  39          2HZ       LYS  39  -8.416  -2.417  -7.851
  302   3HZ   LYS  39          3HZ       LYS  39  -9.384  -1.666  -8.942
  303    H    VAL  40           H        VAL  40  -2.964  -0.212  -5.074
  304    HA   VAL  40           HA       VAL  40  -0.715  -2.065  -4.684
  305    HB   VAL  40           HB       VAL  40  -1.582   0.455  -3.222
  306   1HG1  VAL  40          1HG1      VAL  40  -0.418  -0.329  -1.196
  307   2HG1  VAL  40          2HG1      VAL  40  -1.941  -1.156  -1.578
  308   3HG1  VAL  40          3HG1      VAL  40  -0.383  -1.977  -1.893
  309   1HG2  VAL  40          1HG2      VAL  40   0.364   0.468  -4.733
  310   2HG2  VAL  40          2HG2      VAL  40   0.805   0.832  -3.052
  311   3HG2  VAL  40          3HG2      VAL  40   1.143  -0.779  -3.734
  312    H    CYS  41           H        CYS  41  -1.390  -3.834  -3.464
  313    HA   CYS  41           HA       CYS  41  -4.158  -3.793  -2.422
  314   1HB   CYS  41          2HB       CYS  41  -4.588  -6.036  -3.260
  315   2HB   CYS  41          3HB       CYS  41  -4.337  -4.909  -4.608
  316    HG   CYS  41           HG       CYS  41  -2.055  -6.865  -3.223
  317    H    ILE  42           H        ILE  42  -4.318  -4.791  -0.438
  318    HA   ILE  42           HA       ILE  42  -1.839  -6.096   0.619
  319    HB   ILE  42           HB       ILE  42  -3.230  -3.860   2.095
  320   1HG1  ILE  42          2HG1      ILE  42  -0.699  -3.673   0.392
  321   2HG1  ILE  42          3HG1      ILE  42  -2.236  -2.859   0.078
  322   1HG2  ILE  42          1HG2      ILE  42  -1.241  -3.937   3.534
  323   2HG2  ILE  42          2HG2      ILE  42  -1.977  -5.526   3.457
  324   3HG2  ILE  42          3HG2      ILE  42  -0.525  -5.181   2.500
  325   1HD1  ILE  42          1HD1      ILE  42  -0.331  -2.305   2.353
  326   2HD1  ILE  42          2HD1      ILE  42  -0.797  -1.234   1.031
  327   3HD1  ILE  42          3HD1      ILE  42  -1.986  -1.650   2.279
  328    H    GLU  43           H        GLU  43  -2.155  -7.740   1.938
  329    HA   GLU  43           HA       GLU  43  -4.875  -8.262   3.072
  330   1HB   GLU  43          2HB       GLU  43  -4.504  -9.420   0.853
  331   2HB   GLU  43          3HB       GLU  43  -3.113 -10.243   1.561
  332   1HG   GLU  43          2HG       GLU  43  -4.658 -11.230   3.297
  333   2HG   GLU  43          3HG       GLU  43  -6.025 -10.485   2.449
  334    H    SER  44           H        SER  44  -4.453  -8.212   5.268
  335    HA   SER  44           HA       SER  44  -2.805 -10.246   6.299
  336   1HB   SER  44          2HB       SER  44  -0.995  -8.583   5.893
  337   2HB   SER  44          3HB       SER  44  -1.804  -7.465   7.014
  338    HG   SER  44           HG       SER  44  -0.139  -8.924   7.983
  339    H    GLU  45           H        GLU  45  -2.594  -9.853   8.772
  340    HA   GLU  45           HA       GLU  45  -5.256  -9.092   9.842
  341   1HB   GLU  45          2HB       GLU  45  -3.829 -11.384  10.296
  342   2HB   GLU  45          3HB       GLU  45  -3.265 -10.400  11.648
  343   1HG   GLU  45          2HG       GLU  45  -5.252 -11.858  12.154
  344   2HG   GLU  45          3HG       GLU  45  -5.593 -10.138  12.406
  345    H    HIS  46           H        HIS  46  -4.396  -7.024   8.959
  346    HA   HIS  46           HA       HIS  46  -3.737  -5.364  11.282
  347   1HB   HIS  46          2HB       HIS  46  -2.391  -5.087   8.548
  348   2HB   HIS  46          3HB       HIS  46  -2.319  -3.891   9.843
  349    HD1  HIS  46           1HD      HIS  46  -1.210  -5.148  12.275
  350    HD2  HIS  46           2HD      HIS  46  -0.193  -6.417   8.401
  351    HE1  HIS  46           1HE      HIS  46   1.116  -6.197  12.426
  352    H    SER  47           H        SER  47  -5.254  -3.510  11.181
  353    HA   SER  47           HA       SER  47  -7.379  -3.941   9.428
  354   1HB   SER  47          2HB       SER  47  -8.362  -2.248  10.621
  355   2HB   SER  47          3HB       SER  47  -7.336  -2.957  11.817
  356    HG   SER  47           HG       SER  47  -7.484  -0.497  11.149
  357    H    MET  48           H        MET  48  -8.337  -2.339   8.047
  358    HA   MET  48           HA       MET  48  -6.887  -1.118   5.970
  359   1HB   MET  48          2HB       MET  48  -9.466  -0.212   7.357
  360   2HB   MET  48          3HB       MET  48  -8.895   0.357   5.776
  361   1HG   MET  48          2HG       MET  48  -8.934  -1.944   4.942
  362   2HG   MET  48          3HG       MET  48  -9.615  -2.510   6.479
  363   1HE   MET  48          1HE       MET  48 -12.034  -1.877   7.343
  364   2HE   MET  48          2HE       MET  48 -11.765  -0.130   7.101
  365   3HE   MET  48          3HE       MET  48 -13.197  -0.914   6.403
  366    H    ASP  49           H        ASP  49  -7.925   0.103   9.159
  367    HA   ASP  49           HA       ASP  49  -7.143   2.786   8.795
  368   1HB   ASP  49          2HB       ASP  49  -7.029   1.591  11.562
  369   2HB   ASP  49          3HB       ASP  49  -7.710   3.117  11.018
  370    H    THR  50           H        THR  50  -5.571   0.110  10.359
  371    HA   THR  50           HA       THR  50  -3.163   1.310  11.216
  372    HB   THR  50           HB       THR  50  -3.547  -1.568  10.257
  373    HG1  THR  50           1HG      THR  50  -5.085  -1.011  11.834
  374   1HG2  THR  50          1HG2      THR  50  -1.191  -0.967  10.651
  375   2HG2  THR  50          2HG2      THR  50  -1.607  -0.336  12.260
  376   3HG2  THR  50          3HG2      THR  50  -1.783  -2.068  11.911
  377    H    LEU  51           H        LEU  51  -3.839  -0.512   8.172
  378    HA   LEU  51           HA       LEU  51  -1.237  -0.113   7.066
  379   1HB   LEU  51          2HB       LEU  51  -3.885  -0.537   5.627
  380   2HB   LEU  51          3HB       LEU  51  -2.270  -0.654   4.892
  381    HG   LEU  51           HG       LEU  51  -3.212  -2.370   7.257
  382   1HD1  LEU  51          1HD1      LEU  51  -4.666  -2.831   5.378
  383   2HD1  LEU  51          2HD1      LEU  51  -3.274  -2.989   4.290
  384   3HD1  LEU  51          3HD1      LEU  51  -3.539  -4.181   5.585
  385   1HD2  LEU  51          1HD2      LEU  51  -0.800  -2.300   7.155
  386   2HD2  LEU  51          2HD2      LEU  51  -1.339  -3.856   6.520
  387   3HD2  LEU  51          3HD2      LEU  51  -0.831  -2.571   5.399
  388    H    LEU  52           H        LEU  52  -4.306   1.626   6.392
  389    HA   LEU  52           HA       LEU  52  -3.350   3.566   4.636
  390   1HB   LEU  52          2HB       LEU  52  -5.579   3.426   6.623
  391   2HB   LEU  52          3HB       LEU  52  -5.177   5.020   6.017
  392    HG   LEU  52           HG       LEU  52  -5.680   2.692   4.155
  393   1HD1  LEU  52          1HD1      LEU  52  -7.643   2.898   5.589
  394   2HD1  LEU  52          2HD1      LEU  52  -7.726   4.646   5.268
  395   3HD1  LEU  52          3HD1      LEU  52  -8.008   3.475   3.961
  396   1HD2  LEU  52          1HD2      LEU  52  -4.575   4.719   3.179
  397   2HD2  LEU  52          2HD2      LEU  52  -6.221   4.570   2.571
  398   3HD2  LEU  52          3HD2      LEU  52  -5.865   5.737   3.848
  399    H    ALA  53           H        ALA  53  -3.680   3.966   8.204
  400    HA   ALA  53           HA       ALA  53  -2.494   6.496   8.306
  401   1HB   ALA  53          1HB       ALA  53  -2.520   4.319  10.449
  402   2HB   ALA  53          2HB       ALA  53  -2.241   6.050  10.735
  403   3HB   ALA  53          3HB       ALA  53  -3.820   5.492  10.146
  404    H    THR  54           H        THR  54  -0.936   3.298   8.448
  405    HA   THR  54           HA       THR  54   1.700   4.300   8.968
  406    HB   THR  54           HB       THR  54   0.807   1.764   7.525
  407    HG1  THR  54           1HG      THR  54   0.064   1.813   9.589
  408   1HG2  THR  54          1HG2      THR  54   3.094   1.009   8.225
  409   2HG2  THR  54          2HG2      THR  54   3.097   2.223   6.943
  410   3HG2  THR  54          3HG2      THR  54   3.494   2.686   8.620
  411    H    LEU  55           H        LEU  55   0.198   3.224   5.870
  412    HA   LEU  55           HA       LEU  55   2.502   3.861   4.367
  413   1HB   LEU  55          2HB       LEU  55   1.354   3.179   2.505
  414   2HB   LEU  55          3HB       LEU  55   1.033   2.108   3.832
  415    HG   LEU  55           HG       LEU  55  -1.188   3.406   4.089
  416   1HD1  LEU  55          1HD1      LEU  55  -0.713   5.235   2.608
  417   2HD1  LEU  55          2HD1      LEU  55  -0.184   4.120   1.354
  418   3HD1  LEU  55          3HD1      LEU  55  -1.923   4.233   1.793
  419   1HD2  LEU  55          1HD2      LEU  55  -0.958   1.051   3.317
  420   2HD2  LEU  55          2HD2      LEU  55  -2.207   1.898   2.378
  421   3HD2  LEU  55          3HD2      LEU  55  -0.597   1.632   1.674
  422    H    LYS  56           H        LYS  56  -0.362   5.676   5.014
  423    HA   LYS  56           HA       LYS  56  -0.490   7.821   3.506
  424   1HB   LYS  56          2HB       LYS  56  -1.508   7.361   5.916
  425   2HB   LYS  56          3HB       LYS  56  -0.180   8.362   6.487
  426   1HG   LYS  56          2HG       LYS  56  -1.051  10.133   4.831
  427   2HG   LYS  56          3HG       LYS  56  -2.399   9.003   4.528
  428   1HD   LYS  56          2HD       LYS  56  -2.954   9.030   6.954
  429   2HD   LYS  56          3HD       LYS  56  -1.651  10.206   7.230
  430   1HE   LYS  56          2HE       LYS  56  -2.789  11.831   5.722
  431   2HE   LYS  56          3HE       LYS  56  -4.059  10.645   5.380
  432   1HZ   LYS  56          1HZ       LYS  56  -4.695  10.735   7.690
  433   2HZ   LYS  56          2HZ       LYS  56  -3.516  11.839   8.019
  434   3HZ   LYS  56          3HZ       LYS  56  -4.755  12.230   7.015
  435    H    LYS  57           H        LYS  57   2.162   7.286   5.756
  436    HA   LYS  57           HA       LYS  57   3.344   9.829   5.879
  437   1HB   LYS  57          2HB       LYS  57   4.507   7.045   6.102
  438   2HB   LYS  57          3HB       LYS  57   5.382   8.529   6.560
  439   1HG   LYS  57          2HG       LYS  57   3.548   9.058   8.163
  440   2HG   LYS  57          3HG       LYS  57   2.743   7.538   7.710
  441   1HD   LYS  57          2HD       LYS  57   4.941   6.350   8.343
  442   2HD   LYS  57          3HD       LYS  57   5.394   7.846   9.165
  443   1HE   LYS  57          2HE       LYS  57   2.994   6.018   9.687
  444   2HE   LYS  57          3HE       LYS  57   4.377   6.278  10.758
  445   1HZ   LYS  57          1HZ       LYS  57   3.606   8.572  11.011
  446   2HZ   LYS  57          2HZ       LYS  57   2.298   8.244  10.054
  447   3HZ   LYS  57          3HZ       LYS  57   2.470   7.484  11.496
  448    H    THR  58           H        THR  58   3.381   7.575   3.123
  449    HA   THR  58           HA       THR  58   5.741   8.578   1.853
  450    HB   THR  58           HB       THR  58   4.570   7.831  -0.249
  451    HG1  THR  58           1HG      THR  58   2.401   8.238   0.487
  452   1HG2  THR  58          1HG2      THR  58   4.507   5.449   0.387
  453   2HG2  THR  58          2HG2      THR  58   5.920   6.278   1.086
  454   3HG2  THR  58          3HG2      THR  58   4.510   5.912   2.102
  455    H    GLY  59           H        GLY  59   2.533   9.963   2.300
  456   1HA   GLY  59          2HA       GLY  59   1.620  11.935   1.689
  457   2HA   GLY  59          3HA       GLY  59   3.285  12.541   1.530
  458    H    LYS  60           H        LYS  60   1.135  10.250  -0.237
  459    HA   LYS  60           HA       LYS  60   1.398  11.723  -2.769
  460   1HB   LYS  60          2HB       LYS  60   1.839   8.716  -2.405
  461   2HB   LYS  60          3HB       LYS  60   1.860   9.572  -3.946
  462   1HG   LYS  60          2HG       LYS  60   3.838   9.979  -1.657
  463   2HG   LYS  60          3HG       LYS  60   4.110   8.953  -3.031
  464   1HD   LYS  60          2HD       LYS  60   4.214  10.725  -4.583
  465   2HD   LYS  60          3HD       LYS  60   3.480  11.891  -3.490
  466   1HE   LYS  60          2HE       LYS  60   6.248  10.656  -3.094
  467   2HE   LYS  60          3HE       LYS  60   5.892  12.253  -3.766
  468   1HZ   LYS  60          1HZ       LYS  60   6.331  12.643  -1.530
  469   2HZ   LYS  60          2HZ       LYS  60   4.672  12.647  -1.589
  470   3HZ   LYS  60          3HZ       LYS  60   5.456  11.362  -0.992
  471    H    THR  61           H        THR  61  -0.283  10.713  -4.344
  472    HA   THR  61           HA       THR  61  -2.809  10.593  -3.148
  473    HB   THR  61           HB       THR  61  -2.076   9.685  -5.937
  474    HG1  THR  61           1HG      THR  61  -1.990  12.382  -5.083
  475   1HG2  THR  61          1HG2      THR  61  -4.494   9.940  -5.365
  476   2HG2  THR  61          2HG2      THR  61  -4.193  11.625  -4.882
  477   3HG2  THR  61          3HG2      THR  61  -3.981  11.131  -6.578
  478    H    VAL  62           H        VAL  62  -1.451   8.478  -1.924
  479    HA   VAL  62           HA       VAL  62  -2.255   5.945  -3.218
  480    HB   VAL  62           HB       VAL  62  -0.091   6.028  -2.233
  481   1HG1  VAL  62          1HG1      VAL  62   0.378   6.194   0.129
  482   2HG1  VAL  62          2HG1      VAL  62  -0.298   7.700  -0.477
  483   3HG1  VAL  62          3HG1      VAL  62  -1.302   6.605   0.490
  484   1HG2  VAL  62          1HG2      VAL  62  -1.914   4.246  -0.584
  485   2HG2  VAL  62          2HG2      VAL  62  -1.337   3.910  -2.222
  486   3HG2  VAL  62          3HG2      VAL  62  -0.176   4.013  -0.905
  487    H    SER  63           H        SER  63  -4.471   6.121  -3.334
  488    HA   SER  63           HA       SER  63  -6.012   6.722  -0.864
  489   1HB   SER  63          2HB       SER  63  -6.831   6.377  -3.775
  490   2HB   SER  63          3HB       SER  63  -7.895   6.899  -2.450
  491    HG   SER  63           HG       SER  63  -6.921   8.643  -3.707
  492    H    TYR  64           H        TYR  64  -7.523   5.242  -0.017
  493    HA   TYR  64           HA       TYR  64  -7.227   2.365  -0.703
  494   1HB   TYR  64          2HB       TYR  64  -7.070   2.711   1.612
  495   2HB   TYR  64          3HB       TYR  64  -8.317   3.961   1.606
  496    HD1  TYR  64           HD1      TYR  64  -7.828   0.264   1.129
  497    HD2  TYR  64           HD2      TYR  64 -10.576   3.464   2.037
  498    HE1  TYR  64           HE1      TYR  64  -9.642  -1.381   1.544
  499    HE2  TYR  64           HE2      TYR  64 -12.379   1.822   2.393
  500    HH   TYR  64           HH       TYR  64 -12.968  -0.414   2.346
  501    H    LEU  65           H        LEU  65  -8.838   1.266  -1.802
  502    HA   LEU  65           HA       LEU  65 -11.597   2.172  -1.646
  503   1HB   LEU  65          2HB       LEU  65 -11.801   2.093  -4.196
  504   2HB   LEU  65          3HB       LEU  65 -11.322   3.552  -3.371
  505    HG   LEU  65           HG       LEU  65 -10.119   3.062  -5.450
  506   1HD1  LEU  65          1HD1      LEU  65  -8.210   4.127  -4.882
  507   2HD1  LEU  65          2HD1      LEU  65  -9.306   4.559  -3.567
  508   3HD1  LEU  65          3HD1      LEU  65  -8.095   3.278  -3.343
  509   1HD2  LEU  65          1HD2      LEU  65  -8.704   0.839  -3.992
  510   2HD2  LEU  65          2HD2      LEU  65  -9.745   0.705  -5.428
  511   3HD2  LEU  65          3HD2      LEU  65  -8.204   1.536  -5.530
  512    H    GLY  66           H        GLY  66 -11.416  -0.043  -0.507
  513   1HA   GLY  66          2HA       GLY  66 -13.351  -1.485  -1.204
  514   2HA   GLY  66          3HA       GLY  66 -12.343  -2.049  -2.543
  515    H    LEU  67           H        LEU  67 -13.465  -3.698  -0.483
  516    HA   LEU  67           HA       LEU  67 -11.022  -4.933   0.510
  517   1HB   LEU  67          2HB       LEU  67 -11.800  -5.344   2.675
  518   2HB   LEU  67          3HB       LEU  67 -11.925  -3.606   2.418
  519    HG   LEU  67           HG       LEU  67 -14.235  -5.615   2.375
  520   1HD1  LEU  67          1HD1      LEU  67 -13.461  -3.486   4.409
  521   2HD1  LEU  67          2HD1      LEU  67 -14.868  -4.567   4.499
  522   3HD1  LEU  67          3HD1      LEU  67 -13.232  -5.237   4.604
  523   1HD2  LEU  67          1HD2      LEU  67 -15.675  -3.538   2.495
  524   2HD2  LEU  67          2HD2      LEU  67 -14.243  -2.577   2.082
  525   3HD2  LEU  67          3HD2      LEU  67 -14.897  -3.773   0.936
  526    H    GLU  68           H        GLU  68 -11.170  -7.215   0.521
  527    HA   GLU  68           HA       GLU  68 -13.590  -8.471  -0.627
  528   1HB   GLU  68          2HB       GLU  68 -12.037  -7.460  -2.397
  529   2HB   GLU  68          3HB       GLU  68 -10.782  -8.555  -1.798
  530   1HG   GLU  68          2HG       GLU  68 -12.109 -10.488  -2.506
  531   2HG   GLU  68          3HG       GLU  68 -13.457  -9.428  -2.958
  Start of MODEL   27
    1   1H    MET   1           H1       MET   1  -9.926 -12.796   7.229
    2   2H    MET   1           H2       MET   1 -10.103 -11.806   8.527
    3   3H    MET   1           H3       MET   1 -11.140 -11.668   7.236
    4    HA   MET   1           HA       MET   1  -9.424  -9.938   7.333
    5   1HB   MET   1          2HB       MET   1  -7.140 -10.608   6.655
    6   2HB   MET   1          3HB       MET   1  -7.626 -11.062   8.287
    7   1HG   MET   1          2HG       MET   1  -7.488 -12.967   5.914
    8   2HG   MET   1          3HG       MET   1  -6.289 -12.810   7.177
    9   1HE   MET   1          1HE       MET   1  -8.163 -16.349   7.521
   10   2HE   MET   1          2HE       MET   1  -8.059 -15.412   6.010
   11   3HE   MET   1          3HE       MET   1  -6.629 -15.573   7.060
   12    HA   PRO   2           HA       PRO   2 -10.725 -10.649   2.956
   13   1HB   PRO   2          2HB       PRO   2 -11.643  -8.168   2.429
   14   2HB   PRO   2          3HB       PRO   2 -12.647  -9.357   3.313
   15   1HG   PRO   2          2HG       PRO   2 -10.974  -7.102   4.452
   16   2HG   PRO   2          3HG       PRO   2 -12.651  -7.541   4.887
   17   1HD   PRO   2          2HD       PRO   2 -10.461  -8.316   6.331
   18   2HD   PRO   2          3HD       PRO   2 -11.913  -9.358   6.201
   19    H    LYS   3           H        LYS   3  -9.681  -9.652   1.017
   20    HA   LYS   3           HA       LYS   3  -7.080  -8.342   1.641
   21   1HB   LYS   3          2HB       LYS   3  -6.578  -9.865   0.162
   22   2HB   LYS   3          3HB       LYS   3  -8.152  -9.978  -0.544
   23   1HG   LYS   3          2HG       LYS   3  -6.289  -7.614  -1.018
   24   2HG   LYS   3          3HG       LYS   3  -6.180  -9.087  -1.942
   25   1HD   LYS   3          2HD       LYS   3  -8.798  -7.492  -1.828
   26   2HD   LYS   3          3HD       LYS   3  -7.504  -7.127  -2.956
   27   1HE   LYS   3          2HE       LYS   3  -9.177  -8.437  -4.045
   28   2HE   LYS   3          3HE       LYS   3  -7.681  -9.366  -3.970
   29   1HZ   LYS   3          1HZ       LYS   3  -9.846  -9.737  -1.974
   30   2HZ   LYS   3          2HZ       LYS   3  -9.886 -10.465  -3.437
   31   3HZ   LYS   3          3HZ       LYS   3  -8.658 -10.779  -2.375
   32    H    HIS   4           H        HIS   4  -6.658  -6.255   0.768
   33    HA   HIS   4           HA       HIS   4  -9.036  -4.557   0.274
   34   1HB   HIS   4          2HB       HIS   4  -7.421  -2.989   1.847
   35   2HB   HIS   4          3HB       HIS   4  -8.865  -3.858   2.353
   36    HD1  HIS   4           1HD      HIS   4  -8.342  -6.420   3.521
   37    HD2  HIS   4           2HD      HIS   4  -5.255  -3.576   3.215
   38    HE1  HIS   4           1HE      HIS   4  -6.684  -6.971   5.323
   39    H    GLU   5           H        GLU   5  -8.765  -2.922  -1.138
   40    HA   GLU   5           HA       GLU   5  -6.335  -3.064  -2.837
   41   1HB   GLU   5          2HB       GLU   5  -9.287  -2.459  -3.168
   42   2HB   GLU   5          3HB       GLU   5  -8.152  -1.846  -4.357
   43   1HG   GLU   5          2HG       GLU   5  -7.932  -4.753  -3.575
   44   2HG   GLU   5          3HG       GLU   5  -9.256  -4.218  -4.616
   45    H    PHE   6           H        PHE   6  -5.250  -1.247  -3.502
   46    HA   PHE   6           HA       PHE   6  -6.151   1.408  -2.566
   47   1HB   PHE   6          2HB       PHE   6  -3.296   0.318  -2.266
   48   2HB   PHE   6          3HB       PHE   6  -3.835   1.897  -1.764
   49    HD1  PHE   6           1HD      PHE   6  -4.262  -1.772  -1.090
   50    HD2  PHE   6           2HD      PHE   6  -4.442   2.223   0.568
   51    HE1  PHE   6           1HE      PHE   6  -4.660  -2.709   1.140
   52    HE2  PHE   6           2HE      PHE   6  -4.692   1.253   2.817
   53    HZ   PHE   6           HZ       PHE   6  -4.866  -1.196   3.123
   54    H    SER   7           H        SER   7  -5.765   2.977  -4.024
   55    HA   SER   7           HA       SER   7  -4.487   2.227  -6.618
   56   1HB   SER   7          2HB       SER   7  -6.722   3.408  -6.681
   57   2HB   SER   7          3HB       SER   7  -5.925   4.812  -5.917
   58    HG   SER   7           HG       SER   7  -5.966   4.921  -8.222
   59    H    VAL   8           H        VAL   8  -2.438   3.021  -7.017
   60    HA   VAL   8           HA       VAL   8  -1.191   4.875  -5.067
   61    HB   VAL   8           HB       VAL   8   0.131   2.455  -6.370
   62   1HG1  VAL   8          1HG1      VAL   8   1.809   2.896  -4.664
   63   2HG1  VAL   8          2HG1      VAL   8   1.423   4.473  -5.399
   64   3HG1  VAL   8          3HG1      VAL   8   0.739   4.045  -3.828
   65   1HG2  VAL   8          1HG2      VAL   8  -1.304   2.539  -3.685
   66   2HG2  VAL   8          2HG2      VAL   8  -1.542   1.409  -5.032
   67   3HG2  VAL   8          3HG2      VAL   8  -0.032   1.391  -4.103
   68    H    ASP   9           H        ASP   9  -0.987   6.723  -6.395
   69    HA   ASP   9           HA       ASP   9  -0.119   6.485  -9.135
   70   1HB   ASP   9          2HB       ASP   9  -1.314   8.456  -8.381
   71   2HB   ASP   9          3HB       ASP   9   0.011   8.770  -7.228
   72    H    MET  10           H        MET  10   1.533   4.856  -8.686
   73    HA   MET  10           HA       MET  10   4.004   5.658  -7.414
   74   1HB   MET  10          2HB       MET  10   3.302   3.378  -9.321
   75   2HB   MET  10          3HB       MET  10   4.918   3.618  -8.628
   76   1HG   MET  10          2HG       MET  10   3.924   3.619  -6.340
   77   2HG   MET  10          3HG       MET  10   2.347   3.251  -7.052
   78   1HE   MET  10          1HE       MET  10   2.528  -0.399  -7.960
   79   2HE   MET  10          2HE       MET  10   1.459   0.868  -7.343
   80   3HE   MET  10          3HE       MET  10   2.316   1.119  -8.877
   81    H    THR  11           H        THR  11   4.731   7.525  -8.151
   82    HA   THR  11           HA       THR  11   4.452   8.426 -10.823
   83    HB   THR  11           HB       THR  11   6.254   9.876  -8.955
   84    HG1  THR  11           1HG      THR  11   3.606   9.191  -8.141
   85   1HG2  THR  11          1HG2      THR  11   5.159  10.929 -10.925
   86   2HG2  THR  11          2HG2      THR  11   3.564  10.606 -10.200
   87   3HG2  THR  11          3HG2      THR  11   4.698  11.714  -9.400
   88    H    CYS  12           H        CYS  12   6.997   6.829  -9.028
   89    HA   CYS  12           HA       CYS  12   8.645   6.570 -11.445
   90   1HB   CYS  12          2HB       CYS  12   9.742   8.462 -10.327
   91   2HB   CYS  12          3HB       CYS  12   9.645   7.638  -8.752
   92    HG   CYS  12           HG       CYS  12  12.105   7.580  -9.539
   93    H    GLY  13           H        GLY  13   9.841   4.521 -11.234
   94   1HA   GLY  13          2HA       GLY  13   8.638   2.358 -10.060
   95   2HA   GLY  13          3HA       GLY  13  10.376   2.459 -10.377
   96    H    GLY  14           H        GLY  14  11.123   4.461  -8.537
   97   1HA   GLY  14          2HA       GLY  14  11.557   2.996  -6.189
   98   2HA   GLY  14          3HA       GLY  14  11.757   4.750  -6.353
   99    H    CYS  15           H        CYS  15   8.670   4.774  -7.057
  100    HA   CYS  15           HA       CYS  15   7.660   5.355  -4.433
  101   1HB   CYS  15          2HB       CYS  15   6.211   4.788  -7.006
  102   2HB   CYS  15          3HB       CYS  15   5.453   5.274  -5.470
  103    HG   CYS  15           HG       CYS  15   7.904   6.868  -6.944
  104    H    ALA  16           H        ALA  16   7.731   2.426  -6.517
  105    HA   ALA  16           HA       ALA  16   5.968   0.857  -4.875
  106   1HB   ALA  16          1HB       ALA  16   6.910  -1.063  -6.118
  107   2HB   ALA  16          2HB       ALA  16   6.501   0.258  -7.231
  108   3HB   ALA  16          3HB       ALA  16   8.194  -0.040  -6.777
  109    H    GLU  17           H        GLU  17   9.543   1.199  -5.028
  110    HA   GLU  17           HA       GLU  17  10.149  -0.477  -2.824
  111   1HB   GLU  17          2HB       GLU  17  11.506   2.072  -3.831
  112   2HB   GLU  17          3HB       GLU  17  11.979   1.235  -2.370
  113   1HG   GLU  17          2HG       GLU  17  12.106  -0.908  -3.909
  114   2HG   GLU  17          3HG       GLU  17  12.247   0.292  -5.210
  115    H    ALA  18           H        ALA  18   9.212   2.989  -2.892
  116    HA   ALA  18           HA       ALA  18   9.590   3.506  -0.151
  117   1HB   ALA  18          1HB       ALA  18   8.164   5.432  -0.436
  118   2HB   ALA  18          2HB       ALA  18   9.211   5.249  -1.857
  119   3HB   ALA  18          3HB       ALA  18   7.497   4.791  -1.943
  120    H    VAL  19           H        VAL  19   6.572   2.620  -1.854
  121    HA   VAL  19           HA       VAL  19   4.922   2.372   0.432
  122    HB   VAL  19           HB       VAL  19   4.727   1.130  -2.327
  123   1HG1  VAL  19          1HG1      VAL  19   2.285   0.896  -1.737
  124   2HG1  VAL  19          2HG1      VAL  19   3.334  -0.223  -0.856
  125   3HG1  VAL  19          3HG1      VAL  19   2.697   1.237  -0.052
  126   1HG2  VAL  19          1HG2      VAL  19   3.091   2.939  -2.677
  127   2HG2  VAL  19          2HG2      VAL  19   3.317   3.509  -1.015
  128   3HG2  VAL  19          3HG2      VAL  19   4.631   3.652  -2.192
  129    H    SER  20           H        SER  20   6.928  -0.082  -1.293
  130    HA   SER  20           HA       SER  20   6.190  -2.276   0.344
  131   1HB   SER  20          2HB       SER  20   7.464  -2.428  -1.809
  132   2HB   SER  20          3HB       SER  20   8.871  -1.692  -1.033
  133    HG   SER  20           HG       SER  20   9.046  -3.942  -1.095
  134    H    ARG  21           H        ARG  21   9.039  -0.002   0.823
  135    HA   ARG  21           HA       ARG  21   9.868  -1.499   3.073
  136   1HB   ARG  21          2HB       ARG  21  11.482   0.229   3.408
  137   2HB   ARG  21          3HB       ARG  21  11.409  -0.285   1.722
  138   1HG   ARG  21          2HG       ARG  21  10.136   1.769   1.159
  139   2HG   ARG  21          3HG       ARG  21  10.129   2.235   2.827
  140   1HD   ARG  21          2HD       ARG  21  11.822   3.482   1.658
  141   2HD   ARG  21          3HD       ARG  21  12.647   2.347   2.752
  142    HE   ARG  21           HE       ARG  21  12.401   1.084   0.215
  143   1HH1  ARG  21          2HH2      ARG  21  14.015   3.874   1.630
  144   2HH1  ARG  21          1HH2      ARG  21  15.356   3.870   0.523
  145   1HH2  ARG  21          2HH1      ARG  21  14.244   1.035  -1.318
  146   2HH2  ARG  21          1HH1      ARG  21  15.446   2.244  -1.182
  147    H    VAL  22           H        VAL  22   7.800   1.514   2.797
  148    HA   VAL  22           HA       VAL  22   7.646   1.877   5.570
  149    HB   VAL  22           HB       VAL  22   7.146   3.484   3.686
  150   1HG1  VAL  22          1HG1      VAL  22   4.405   2.182   3.813
  151   2HG1  VAL  22          2HG1      VAL  22   4.868   3.625   2.869
  152   3HG1  VAL  22          3HG1      VAL  22   5.586   2.062   2.494
  153   1HG2  VAL  22          1HG2      VAL  22   6.780   4.072   5.957
  154   2HG2  VAL  22          2HG2      VAL  22   5.425   4.676   4.958
  155   3HG2  VAL  22          3HG2      VAL  22   5.203   3.236   5.977
  156    H    LEU  23           H        LEU  23   5.470  -0.114   3.309
  157    HA   LEU  23           HA       LEU  23   3.789  -0.967   5.434
  158   1HB   LEU  23          2HB       LEU  23   4.485  -2.057   2.709
  159   2HB   LEU  23          3HB       LEU  23   3.722  -3.091   3.888
  160    HG   LEU  23           HG       LEU  23   2.006  -2.366   2.652
  161   1HD1  LEU  23          1HD1      LEU  23   1.728  -0.368   4.929
  162   2HD1  LEU  23          2HD1      LEU  23   0.479  -1.306   4.105
  163   3HD1  LEU  23          3HD1      LEU  23   1.615  -2.119   5.192
  164   1HD2  LEU  23          1HD2      LEU  23   2.940  -0.619   1.456
  165   2HD2  LEU  23          2HD2      LEU  23   1.441  -0.015   2.192
  166   3HD2  LEU  23          3HD2      LEU  23   3.021   0.444   2.895
  167    H    ASN  24           H        ASN  24   6.726  -2.554   4.132
  168    HA   ASN  24           HA       ASN  24   6.874  -4.689   5.937
  169   1HB   ASN  24          2HB       ASN  24   8.439  -4.718   4.229
  170   2HB   ASN  24          3HB       ASN  24   8.878  -3.027   4.441
  171   1HD2  ASN  24          1HD2      ASN  24  10.138  -2.381   6.246
  172   2HD2  ASN  24          2HD2      ASN  24  11.301  -3.520   6.946
  173    H    LYS  25           H        LYS  25   8.013  -1.323   6.432
  174    HA   LYS  25           HA       LYS  25   9.196  -1.672   8.942
  175   1HB   LYS  25          2HB       LYS  25   8.029   0.650   7.415
  176   2HB   LYS  25          3HB       LYS  25   8.262   0.882   9.135
  177   1HG   LYS  25          2HG       LYS  25  10.427  -0.005   7.176
  178   2HG   LYS  25          3HG       LYS  25  10.121   1.659   7.690
  179   1HD   LYS  25          2HD       LYS  25  10.459   0.790  10.138
  180   2HD   LYS  25          3HD       LYS  25  11.078  -0.685   9.398
  181   1HE   LYS  25          2HE       LYS  25  13.005   0.559   9.831
  182   2HE   LYS  25          3HE       LYS  25  12.724   0.732   8.090
  183   1HZ   LYS  25          1HZ       LYS  25  13.295   2.816   9.140
  184   2HZ   LYS  25          2HZ       LYS  25  11.761   2.904   8.556
  185   3HZ   LYS  25          3HZ       LYS  25  12.021   2.710  10.171
  186    H    LEU  26           H        LEU  26   5.763  -1.305   8.207
  187    HA   LEU  26           HA       LEU  26   4.814  -0.772  10.818
  188   1HB   LEU  26          2HB       LEU  26   3.540  -0.763   8.748
  189   2HB   LEU  26          3HB       LEU  26   3.539  -2.503   8.627
  190    HG   LEU  26           HG       LEU  26   1.485  -1.275   9.401
  191   1HD1  LEU  26          1HD1      LEU  26   0.700  -2.992  10.848
  192   2HD1  LEU  26          2HD1      LEU  26   1.652  -3.676   9.521
  193   3HD1  LEU  26          3HD1      LEU  26   2.353  -3.572  11.158
  194   1HD2  LEU  26          1HD2      LEU  26   2.825  -1.262  12.144
  195   2HD2  LEU  26          2HD2      LEU  26   2.622   0.184  11.137
  196   3HD2  LEU  26          3HD2      LEU  26   1.204  -0.693  11.733
  197    H    GLY  27           H        GLY  27   5.879  -3.790   9.282
  198   1HA   GLY  27          2HA       GLY  27   6.586  -5.037  11.685
  199   2HA   GLY  27          3HA       GLY  27   4.901  -5.507  11.358
  200    H    GLY  28           H        GLY  28   4.444  -6.520   9.296
  201   1HA   GLY  28          2HA       GLY  28   6.452  -7.441   7.463
  202   2HA   GLY  28          3HA       GLY  28   6.061  -8.716   8.641
  203    H    VAL  29           H        VAL  29   3.967  -6.164   7.311
  204    HA   VAL  29           HA       VAL  29   1.784  -7.948   6.778
  205    HB   VAL  29           HB       VAL  29   1.463  -5.588   7.318
  206   1HG1  VAL  29          1HG1      VAL  29   3.578  -4.946   5.636
  207   2HG1  VAL  29          2HG1      VAL  29   2.132  -4.437   4.739
  208   3HG1  VAL  29          3HG1      VAL  29   2.423  -3.846   6.382
  209   1HG2  VAL  29          1HG2      VAL  29  -0.223  -6.817   5.995
  210   2HG2  VAL  29          2HG2      VAL  29  -0.218  -5.078   5.644
  211   3HG2  VAL  29          3HG2      VAL  29   0.516  -6.213   4.498
  212    H    LYS  30           H        LYS  30   1.159  -8.941   4.806
  213    HA   LYS  30           HA       LYS  30   3.234  -8.970   2.690
  214   1HB   LYS  30          2HB       LYS  30   2.089 -11.061   3.813
  215   2HB   LYS  30          3HB       LYS  30   0.844 -10.769   2.600
  216   1HG   LYS  30          2HG       LYS  30   3.842 -11.203   2.163
  217   2HG   LYS  30          3HG       LYS  30   2.573 -12.381   1.867
  218   1HD   LYS  30          2HD       LYS  30   3.084  -9.819   0.253
  219   2HD   LYS  30          3HD       LYS  30   3.386 -11.480  -0.214
  220   1HE   LYS  30          2HE       LYS  30   0.723 -11.714   0.348
  221   2HE   LYS  30          3HE       LYS  30   0.777  -9.994  -0.072
  222   1HZ   LYS  30          1HZ       LYS  30   0.332 -11.143  -2.016
  223   2HZ   LYS  30          2HZ       LYS  30   1.813 -10.668  -2.211
  224   3HZ   LYS  30          3HZ       LYS  30   1.547 -12.250  -1.815
  225    H    TYR  31           H        TYR  31   2.980  -7.521   1.191
  226    HA   TYR  31           HA       TYR  31   0.297  -6.643   0.218
  227   1HB   TYR  31          2HB       TYR  31   1.656  -4.592  -0.506
  228   2HB   TYR  31          3HB       TYR  31   1.318  -4.774   1.211
  229    HD1  TYR  31           HD1      TYR  31   4.002  -5.326  -1.331
  230    HD2  TYR  31           HD2      TYR  31   3.030  -5.137   2.833
  231    HE1  TYR  31           HE1      TYR  31   6.419  -5.245  -0.778
  232    HE2  TYR  31           HE2      TYR  31   5.445  -5.079   3.407
  233    HH   TYR  31           HH       TYR  31   7.925  -4.616   0.946
  234    H    ASP  32           H        ASP  32   0.118  -6.304  -2.052
  235    HA   ASP  32           HA       ASP  32   2.217  -7.480  -3.808
  236   1HB   ASP  32          2HB       ASP  32  -0.796  -7.763  -3.753
  237   2HB   ASP  32          3HB       ASP  32   0.095  -8.047  -5.236
  238    H    ILE  33           H        ILE  33   2.669  -6.179  -5.541
  239    HA   ILE  33           HA       ILE  33   1.400  -3.472  -5.626
  240    HB   ILE  33           HB       ILE  33   4.344  -4.241  -5.693
  241   1HG1  ILE  33          2HG1      ILE  33   3.471  -2.401  -3.534
  242   2HG1  ILE  33          3HG1      ILE  33   2.919  -4.060  -3.318
  243   1HG2  ILE  33          1HG2      ILE  33   4.734  -1.772  -5.571
  244   2HG2  ILE  33          2HG2      ILE  33   3.922  -2.276  -7.057
  245   3HG2  ILE  33          3HG2      ILE  33   2.990  -1.513  -5.755
  246   1HD1  ILE  33          1HD1      ILE  33   5.160  -3.531  -2.308
  247   2HD1  ILE  33          2HD1      ILE  33   5.153  -4.925  -3.412
  248   3HD1  ILE  33          3HD1      ILE  33   5.811  -3.352  -3.943
  249    H    ASP  34           H        ASP  34   0.649  -3.107  -7.670
  250    HA   ASP  34           HA       ASP  34   2.172  -4.284  -9.969
  251   1HB   ASP  34          2HB       ASP  34  -0.163  -5.077  -9.834
  252   2HB   ASP  34          3HB       ASP  34  -0.721  -3.396  -9.974
  253    H    LEU  35           H        LEU  35   3.283  -2.898 -11.104
  254    HA   LEU  35           HA       LEU  35   3.334  -0.088 -10.446
  255   1HB   LEU  35          2HB       LEU  35   4.913  -1.920 -12.233
  256   2HB   LEU  35          3HB       LEU  35   5.006  -0.185 -12.519
  257    HG   LEU  35           HG       LEU  35   6.822  -1.128 -11.137
  258   1HD1  LEU  35          1HD1      LEU  35   6.261   1.278 -11.063
  259   2HD1  LEU  35          2HD1      LEU  35   5.180   0.988  -9.686
  260   3HD1  LEU  35          3HD1      LEU  35   6.919   0.684  -9.531
  261   1HD2  LEU  35          1HD2      LEU  35   4.741  -1.401  -8.947
  262   2HD2  LEU  35          2HD2      LEU  35   5.462  -2.765  -9.834
  263   3HD2  LEU  35          3HD2      LEU  35   6.479  -1.726  -8.818
  264    HA   PRO  36           HA       PRO  36   2.051   0.794 -14.935
  265   1HB   PRO  36          2HB       PRO  36   0.772  -1.163 -16.439
  266   2HB   PRO  36          3HB       PRO  36   2.518  -0.791 -16.498
  267   1HG   PRO  36          2HG       PRO  36   1.137  -2.950 -14.890
  268   2HG   PRO  36          3HG       PRO  36   2.599  -3.103 -15.903
  269   1HD   PRO  36          2HD       PRO  36   2.800  -2.830 -13.253
  270   2HD   PRO  36          3HD       PRO  36   3.915  -1.918 -14.315
  271    H    ASN  37           H        ASN  37  -0.017  -1.610 -13.177
  272    HA   ASN  37           HA       ASN  37  -2.429  -0.117 -13.927
  273   1HB   ASN  37          2HB       ASN  37  -2.119  -2.457 -12.018
  274   2HB   ASN  37          3HB       ASN  37  -3.619  -1.739 -12.590
  275   1HD2  ASN  37          1HD2      ASN  37  -0.759  -3.550 -13.675
  276   2HD2  ASN  37          2HD2      ASN  37  -1.535  -4.215 -15.118
  277    H    LYS  38           H        LYS  38   0.007   0.597 -11.645
  278    HA   LYS  38           HA       LYS  38   0.064   2.117 -10.001
  279   1HB   LYS  38          2HB       LYS  38  -2.529   2.996 -11.352
  280   2HB   LYS  38          3HB       LYS  38  -1.683   3.946 -10.153
  281   1HG   LYS  38          2HG       LYS  38  -0.053   3.031 -12.528
  282   2HG   LYS  38          3HG       LYS  38  -1.331   4.219 -12.824
  283   1HD   LYS  38          2HD       LYS  38  -0.474   5.657 -11.048
  284   2HD   LYS  38          3HD       LYS  38   0.856   4.509 -10.727
  285   1HE   LYS  38          2HE       LYS  38   1.664   4.939 -13.083
  286   2HE   LYS  38          3HE       LYS  38   0.344   6.110 -13.283
  287   1HZ   LYS  38          1HZ       LYS  38   2.623   6.306 -11.423
  288   2HZ   LYS  38          2HZ       LYS  38   2.293   7.283 -12.691
  289   3HZ   LYS  38          3HZ       LYS  38   1.347   7.347 -11.359
  290    H    LYS  39           H        LYS  39  -0.747  -0.347  -9.075
  291    HA   LYS  39           HA       LYS  39  -2.868   0.308  -7.075
  292   1HB   LYS  39          2HB       LYS  39  -2.879  -1.865  -9.176
  293   2HB   LYS  39          3HB       LYS  39  -3.636  -2.157  -7.600
  294   1HG   LYS  39          2HG       LYS  39  -5.207  -0.397  -7.853
  295   2HG   LYS  39          3HG       LYS  39  -4.347   0.291  -9.229
  296   1HD   LYS  39          2HD       LYS  39  -6.352  -0.912  -9.989
  297   2HD   LYS  39          3HD       LYS  39  -4.860  -1.555 -10.655
  298   1HE   LYS  39          2HE       LYS  39  -6.364  -3.376 -10.070
  299   2HE   LYS  39          3HE       LYS  39  -4.909  -3.473  -9.078
  300   1HZ   LYS  39          1HZ       LYS  39  -7.006  -3.816  -7.821
  301   2HZ   LYS  39          2HZ       LYS  39  -6.167  -2.646  -7.193
  302   3HZ   LYS  39          3HZ       LYS  39  -7.458  -2.281  -8.146
  303    H    VAL  40           H        VAL  40  -2.707  -0.755  -5.099
  304    HA   VAL  40           HA       VAL  40  -0.799  -2.962  -4.863
  305    HB   VAL  40           HB       VAL  40  -1.194  -0.399  -3.280
  306   1HG1  VAL  40          1HG1      VAL  40  -0.083  -1.418  -1.326
  307   2HG1  VAL  40          2HG1      VAL  40  -1.754  -1.922  -1.649
  308   3HG1  VAL  40          3HG1      VAL  40  -0.398  -3.025  -2.042
  309   1HG2  VAL  40          1HG2      VAL  40   0.712  -0.720  -4.864
  310   2HG2  VAL  40          2HG2      VAL  40   1.252  -0.459  -3.190
  311   3HG2  VAL  40          3HG2      VAL  40   1.248  -2.096  -3.867
  312    H    CYS  41           H        CYS  41  -1.665  -4.652  -3.830
  313    HA   CYS  41           HA       CYS  41  -4.262  -4.263  -2.433
  314   1HB   CYS  41          2HB       CYS  41  -5.087  -6.384  -3.131
  315   2HB   CYS  41          3HB       CYS  41  -4.807  -5.393  -4.567
  316    HG   CYS  41           HG       CYS  41  -2.777  -7.660  -3.269
  317    H    ILE  42           H        ILE  42  -4.380  -5.256  -0.450
  318    HA   ILE  42           HA       ILE  42  -1.967  -6.763   0.480
  319    HB   ILE  42           HB       ILE  42  -3.287  -4.486   2.015
  320   1HG1  ILE  42          2HG1      ILE  42  -0.819  -4.339   0.238
  321   2HG1  ILE  42          3HG1      ILE  42  -2.340  -3.460   0.038
  322   1HG2  ILE  42          1HG2      ILE  42  -1.244  -4.631   3.414
  323   2HG2  ILE  42          2HG2      ILE  42  -2.073  -6.166   3.373
  324   3HG2  ILE  42          3HG2      ILE  42  -0.625  -5.916   2.375
  325   1HD1  ILE  42          1HD1      ILE  42  -0.330  -3.009   2.259
  326   2HD1  ILE  42          2HD1      ILE  42  -0.744  -1.934   0.925
  327   3HD1  ILE  42          3HD1      ILE  42  -1.947  -2.264   2.176
  328    H    GLU  43           H        GLU  43  -2.427  -8.196   2.254
  329    HA   GLU  43           HA       GLU  43  -5.233  -8.231   3.217
  330   1HB   GLU  43          2HB       GLU  43  -4.706 -10.220   1.637
  331   2HB   GLU  43          3HB       GLU  43  -3.602 -10.772   2.904
  332   1HG   GLU  43          2HG       GLU  43  -5.561 -10.721   4.518
  333   2HG   GLU  43          3HG       GLU  43  -6.619 -10.282   3.164
  334    H    SER  44           H        SER  44  -5.281  -8.388   5.517
  335    HA   SER  44           HA       SER  44  -2.830  -8.861   6.975
  336   1HB   SER  44          2HB       SER  44  -2.609  -6.646   7.898
  337   2HB   SER  44          3HB       SER  44  -2.519  -6.507   6.144
  338    HG   SER  44           HG       SER  44  -4.635  -5.741   6.120
  339    H    GLU  45           H        GLU  45  -3.244  -9.199   9.171
  340    HA   GLU  45           HA       GLU  45  -6.096  -9.343   9.999
  341   1HB   GLU  45          2HB       GLU  45  -3.562 -10.428  11.303
  342   2HB   GLU  45          3HB       GLU  45  -5.225 -10.676  11.848
  343   1HG   GLU  45          2HG       GLU  45  -5.746 -11.778   9.650
  344   2HG   GLU  45          3HG       GLU  45  -4.037 -11.638   9.200
  345    H    HIS  46           H        HIS  46  -5.767  -6.815   9.726
  346    HA   HIS  46           HA       HIS  46  -5.982  -5.783  12.344
  347   1HB   HIS  46          2HB       HIS  46  -4.102  -3.911  11.744
  348   2HB   HIS  46          3HB       HIS  46  -3.849  -5.301  12.783
  349    HD1  HIS  46           1HD      HIS  46  -2.434  -7.332  11.820
  350    HD2  HIS  46           2HD      HIS  46  -2.505  -3.769   9.589
  351    HE1  HIS  46           1HE      HIS  46  -0.340  -7.350  10.313
  352    H    SER  47           H        SER  47  -6.325  -3.292  12.174
  353    HA   SER  47           HA       SER  47  -8.447  -2.947  10.293
  354   1HB   SER  47          2HB       SER  47  -8.437  -1.738  12.417
  355   2HB   SER  47          3HB       SER  47  -6.957  -0.864  11.959
  356    HG   SER  47           HG       SER  47  -8.872   0.343  11.525
  357    H    MET  48           H        MET  48  -8.532  -1.872   8.360
  358    HA   MET  48           HA       MET  48  -6.262  -1.862   6.658
  359   1HB   MET  48          2HB       MET  48  -8.833  -0.248   6.314
  360   2HB   MET  48          3HB       MET  48  -7.699  -0.753   5.047
  361   1HG   MET  48          2HG       MET  48  -8.167  -3.148   5.696
  362   2HG   MET  48          3HG       MET  48  -9.430  -2.543   6.787
  363   1HE   MET  48          1HE       MET  48 -11.167  -4.163   5.785
  364   2HE   MET  48          2HE       MET  48 -11.458  -4.315   4.038
  365   3HE   MET  48          3HE       MET  48  -9.887  -4.786   4.715
  366    H    ASP  49           H        ASP  49  -7.740   0.662   8.671
  367    HA   ASP  49           HA       ASP  49  -6.139   2.699   7.479
  368   1HB   ASP  49          2HB       ASP  49  -8.248   3.307   8.606
  369   2HB   ASP  49          3HB       ASP  49  -7.433   3.069  10.169
  370    H    THR  50           H        THR  50  -5.311   0.256   9.730
  371    HA   THR  50           HA       THR  50  -3.060   1.523  10.997
  372    HB   THR  50           HB       THR  50  -3.202  -1.354  10.013
  373    HG1  THR  50           1HG      THR  50  -4.964  -1.292  11.098
  374   1HG2  THR  50          1HG2      THR  50  -1.870  -0.089  12.449
  375   2HG2  THR  50          2HG2      THR  50  -1.837  -1.810  12.011
  376   3HG2  THR  50          3HG2      THR  50  -1.037  -0.618  10.968
  377    H    LEU  51           H        LEU  51  -3.585  -0.208   7.890
  378    HA   LEU  51           HA       LEU  51  -0.832  -0.004   7.034
  379   1HB   LEU  51          2HB       LEU  51  -3.312  -0.449   5.333
  380   2HB   LEU  51          3HB       LEU  51  -1.629  -0.757   4.893
  381    HG   LEU  51           HG       LEU  51  -3.243  -2.168   7.124
  382   1HD1  LEU  51          1HD1      LEU  51  -4.072  -2.778   4.997
  383   2HD1  LEU  51          2HD1      LEU  51  -2.444  -2.978   4.322
  384   3HD1  LEU  51          3HD1      LEU  51  -3.045  -4.120   5.537
  385   1HD2  LEU  51          1HD2      LEU  51  -0.429  -2.733   6.109
  386   2HD2  LEU  51          2HD2      LEU  51  -0.856  -2.149   7.734
  387   3HD2  LEU  51          3HD2      LEU  51  -1.356  -3.760   7.222
  388    H    LEU  52           H        LEU  52  -3.866   1.857   6.324
  389    HA   LEU  52           HA       LEU  52  -2.644   3.721   4.584
  390   1HB   LEU  52          2HB       LEU  52  -4.862   4.008   6.562
  391   2HB   LEU  52          3HB       LEU  52  -4.317   5.322   5.565
  392    HG   LEU  52           HG       LEU  52  -5.345   2.708   4.425
  393   1HD1  LEU  52          1HD1      LEU  52  -7.120   3.864   5.666
  394   2HD1  LEU  52          2HD1      LEU  52  -6.757   5.382   4.818
  395   3HD1  LEU  52          3HD1      LEU  52  -7.410   3.989   3.932
  396   1HD2  LEU  52          1HD2      LEU  52  -3.917   3.885   2.802
  397   2HD2  LEU  52          2HD2      LEU  52  -5.588   4.216   2.354
  398   3HD2  LEU  52          3HD2      LEU  52  -4.661   5.444   3.216
  399    H    ALA  53           H        ALA  53  -3.023   3.931   8.173
  400    HA   ALA  53           HA       ALA  53  -1.607   6.330   8.519
  401   1HB   ALA  53          1HB       ALA  53  -1.822   3.975  10.448
  402   2HB   ALA  53          2HB       ALA  53  -1.381   5.639  10.882
  403   3HB   ALA  53          3HB       ALA  53  -3.011   5.284  10.283
  404    H    THR  54           H        THR  54  -0.259   3.023   8.473
  405    HA   THR  54           HA       THR  54   2.466   3.778   8.694
  406    HB   THR  54           HB       THR  54   1.114   1.574   7.081
  407    HG1  THR  54           1HG      THR  54   2.321   1.656   9.632
  408   1HG2  THR  54          1HG2      THR  54   3.232   0.449   7.062
  409   2HG2  THR  54          2HG2      THR  54   3.371   1.952   6.194
  410   3HG2  THR  54          3HG2      THR  54   4.042   1.828   7.842
  411    H    LEU  55           H        LEU  55   0.587   3.280   5.592
  412    HA   LEU  55           HA       LEU  55   2.944   3.949   4.164
  413   1HB   LEU  55          2HB       LEU  55   1.779   3.144   2.281
  414   2HB   LEU  55          3HB       LEU  55   1.335   2.171   3.643
  415    HG   LEU  55           HG       LEU  55  -0.702   3.753   3.826
  416   1HD1  LEU  55          1HD1      LEU  55  -0.499   3.927   0.873
  417   2HD1  LEU  55          2HD1      LEU  55  -1.180   5.088   2.057
  418   3HD1  LEU  55          3HD1      LEU  55   0.579   4.982   1.778
  419   1HD2  LEU  55          1HD2      LEU  55  -0.818   1.329   3.279
  420   2HD2  LEU  55          2HD2      LEU  55  -1.954   2.250   2.272
  421   3HD2  LEU  55          3HD2      LEU  55  -0.407   1.688   1.595
  422    H    LYS  56           H        LYS  56  -0.078   5.596   4.665
  423    HA   LYS  56           HA       LYS  56  -0.354   7.832   3.285
  424   1HB   LYS  56          2HB       LYS  56  -0.308   7.428   6.285
  425   2HB   LYS  56          3HB       LYS  56  -0.489   9.054   5.706
  426   1HG   LYS  56          2HG       LYS  56  -2.515   8.472   4.434
  427   2HG   LYS  56          3HG       LYS  56  -2.430   6.824   5.033
  428   1HD   LYS  56          2HD       LYS  56  -2.302   8.011   7.423
  429   2HD   LYS  56          3HD       LYS  56  -2.832   9.421   6.550
  430   1HE   LYS  56          2HE       LYS  56  -4.956   8.792   6.970
  431   2HE   LYS  56          3HE       LYS  56  -4.741   7.565   5.734
  432   1HZ   LYS  56          1HZ       LYS  56  -5.575   6.493   7.664
  433   2HZ   LYS  56          2HZ       LYS  56  -4.020   6.080   7.651
  434   3HZ   LYS  56          3HZ       LYS  56  -4.557   7.234   8.680
  435    H    LYS  57           H        LYS  57   2.163   7.502   5.703
  436    HA   LYS  57           HA       LYS  57   3.308  10.015   5.825
  437   1HB   LYS  57          2HB       LYS  57   4.607   7.294   6.047
  438   2HB   LYS  57          3HB       LYS  57   5.310   8.823   6.641
  439   1HG   LYS  57          2HG       LYS  57   3.155   9.054   8.039
  440   2HG   LYS  57          3HG       LYS  57   2.815   7.371   7.584
  441   1HD   LYS  57          2HD       LYS  57   5.356   7.026   8.409
  442   2HD   LYS  57          3HD       LYS  57   4.998   8.470   9.354
  443   1HE   LYS  57          2HE       LYS  57   3.749   5.698   9.462
  444   2HE   LYS  57          3HE       LYS  57   4.520   6.610  10.767
  445   1HZ   LYS  57          1HZ       LYS  57   2.225   6.656  11.125
  446   2HZ   LYS  57          2HZ       LYS  57   2.554   8.160  10.533
  447   3HZ   LYS  57          3HZ       LYS  57   1.867   6.990   9.569
  448    H    THR  58           H        THR  58   3.689   7.669   3.160
  449    HA   THR  58           HA       THR  58   6.097   8.623   2.024
  450    HB   THR  58           HB       THR  58   5.031   7.781  -0.135
  451    HG1  THR  58           1HG      THR  58   2.811   8.182   0.718
  452   1HG2  THR  58          1HG2      THR  58   6.391   6.341   1.292
  453   2HG2  THR  58          2HG2      THR  58   4.979   5.971   2.301
  454   3HG2  THR  58          3HG2      THR  58   5.024   5.427   0.608
  455    H    GLY  59           H        GLY  59   2.888  10.089   2.134
  456   1HA   GLY  59          2HA       GLY  59   2.084  12.018   1.248
  457   2HA   GLY  59          3HA       GLY  59   3.780  12.557   1.154
  458    H    LYS  60           H        LYS  60   1.604  10.220  -0.514
  459    HA   LYS  60           HA       LYS  60   2.363  11.306  -3.169
  460   1HB   LYS  60          2HB       LYS  60   2.171   8.379  -2.313
  461   2HB   LYS  60          3HB       LYS  60   2.338   8.918  -3.980
  462   1HG   LYS  60          2HG       LYS  60   4.325   9.461  -1.719
  463   2HG   LYS  60          3HG       LYS  60   4.478   8.139  -2.850
  464   1HD   LYS  60          2HD       LYS  60   4.984   9.479  -4.678
  465   2HD   LYS  60          3HD       LYS  60   4.295  10.939  -3.993
  466   1HE   LYS  60          2HE       LYS  60   6.844   9.596  -2.984
  467   2HE   LYS  60          3HE       LYS  60   6.731  11.007  -4.041
  468   1HZ   LYS  60          1HZ       LYS  60   6.004  10.847  -1.193
  469   2HZ   LYS  60          2HZ       LYS  60   6.988  11.918  -1.943
  470   3HZ   LYS  60          3HZ       LYS  60   5.343  11.991  -2.117
  471    H    THR  61           H        THR  61   0.793  10.659  -4.852
  472    HA   THR  61           HA       THR  61  -1.940  10.887  -4.023
  473    HB   THR  61           HB       THR  61  -1.785  10.151  -6.685
  474    HG1  THR  61           1HG      THR  61   0.132  10.915  -7.501
  475   1HG2  THR  61          1HG2      THR  61  -3.026  12.086  -5.810
  476   2HG2  THR  61          2HG2      THR  61  -1.495  12.938  -5.492
  477   3HG2  THR  61          3HG2      THR  61  -1.986  12.578  -7.161
  478    H    VAL  62           H        VAL  62  -1.464   9.012  -2.552
  479    HA   VAL  62           HA       VAL  62  -2.393   6.475  -3.816
  480    HB   VAL  62           HB       VAL  62  -0.155   6.157  -3.011
  481   1HG1  VAL  62          1HG1      VAL  62  -1.103   7.125  -0.281
  482   2HG1  VAL  62          2HG1      VAL  62   0.472   6.391  -0.640
  483   3HG1  VAL  62          3HG1      VAL  62   0.046   7.949  -1.356
  484   1HG2  VAL  62          1HG2      VAL  62  -1.888   4.355  -2.623
  485   2HG2  VAL  62          2HG2      VAL  62  -0.466   4.265  -1.570
  486   3HG2  VAL  62          3HG2      VAL  62  -2.002   4.894  -0.942
  487    H    SER  63           H        SER  63  -4.116   5.350  -2.808
  488    HA   SER  63           HA       SER  63  -5.021   6.127  -0.193
  489   1HB   SER  63          2HB       SER  63  -6.062   7.976  -1.538
  490   2HB   SER  63          3HB       SER  63  -6.941   6.747  -2.476
  491    HG   SER  63           HG       SER  63  -8.159   7.569  -0.684
  492    H    TYR  64           H        TYR  64  -7.302   5.031   0.080
  493    HA   TYR  64           HA       TYR  64  -6.939   2.126  -0.572
  494   1HB   TYR  64          2HB       TYR  64  -6.817   2.420   1.771
  495   2HB   TYR  64          3HB       TYR  64  -8.087   3.646   1.761
  496    HD1  TYR  64           HD1      TYR  64 -10.315   3.077   2.217
  497    HD2  TYR  64           HD2      TYR  64  -7.533  -0.013   1.070
  498    HE1  TYR  64           HE1      TYR  64 -12.113   1.399   2.400
  499    HE2  TYR  64           HE2      TYR  64  -9.355  -1.687   1.221
  500    HH   TYR  64           HH       TYR  64 -12.690  -0.816   2.156
  501    H    LEU  65           H        LEU  65  -8.532   1.131  -1.767
  502    HA   LEU  65           HA       LEU  65 -11.269   2.109  -1.762
  503   1HB   LEU  65          2HB       LEU  65 -11.259   2.195  -4.322
  504   2HB   LEU  65          3HB       LEU  65 -10.818   3.586  -3.362
  505    HG   LEU  65           HG       LEU  65  -9.461   3.230  -5.347
  506   1HD1  LEU  65          1HD1      LEU  65  -8.727   4.498  -3.256
  507   2HD1  LEU  65          2HD1      LEU  65  -7.560   3.162  -3.105
  508   3HD1  LEU  65          3HD1      LEU  65  -7.577   4.170  -4.547
  509   1HD2  LEU  65          1HD2      LEU  65  -7.643   1.643  -5.494
  510   2HD2  LEU  65          2HD2      LEU  65  -8.198   0.843  -4.016
  511   3HD2  LEU  65          3HD2      LEU  65  -9.206   0.850  -5.486
  512    H    GLY  66           H        GLY  66 -11.300  -0.150  -0.762
  513   1HA   GLY  66          2HA       GLY  66 -13.222  -1.441  -1.714
  514   2HA   GLY  66          3HA       GLY  66 -12.142  -1.963  -3.014
  515    H    LEU  67           H        LEU  67 -13.480  -3.766  -1.276
  516    HA   LEU  67           HA       LEU  67 -11.196  -5.110  -0.094
  517   1HB   LEU  67          2HB       LEU  67 -12.164  -5.516   2.013
  518   2HB   LEU  67          3HB       LEU  67 -12.122  -3.773   1.769
  519    HG   LEU  67           HG       LEU  67 -14.587  -5.575   1.540
  520   1HD1  LEU  67          1HD1      LEU  67 -13.794  -3.541   3.658
  521   2HD1  LEU  67          2HD1      LEU  67 -15.293  -4.492   3.618
  522   3HD1  LEU  67          3HD1      LEU  67 -13.740  -5.312   3.839
  523   1HD2  LEU  67          1HD2      LEU  67 -15.845  -3.373   1.591
  524   2HD2  LEU  67          2HD2      LEU  67 -14.306  -2.548   1.271
  525   3HD2  LEU  67          3HD2      LEU  67 -14.995  -3.684   0.083
  526    H    GLU  68           H        GLU  68 -11.310  -7.284  -0.204
  527    HA   GLU  68           HA       GLU  68 -13.739  -8.773  -0.781
  528   1HB   GLU  68          2HB       GLU  68 -12.985  -7.869  -2.970
  529   2HB   GLU  68          3HB       GLU  68 -11.381  -8.505  -2.706
  530   1HG   GLU  68          2HG       GLU  68 -12.515 -10.849  -2.534
  531   2HG   GLU  68          3HG       GLU  68 -13.948 -10.058  -3.207
  Start of MODEL   28
    1   1H    MET   1           H1       MET   1 -12.391  -8.916   4.453
    2   2H    MET   1           H2       MET   1 -12.743  -7.421   5.034
    3   3H    MET   1           H3       MET   1 -11.346  -7.791   4.175
    4    HA   MET   1           HA       MET   1 -11.258  -7.394   6.676
    5   1HB   MET   1          2HB       MET   1 -11.962 -10.342   6.767
    6   2HB   MET   1          3HB       MET   1 -11.668  -9.213   8.096
    7   1HG   MET   1          2HG       MET   1 -14.027  -9.392   6.211
    8   2HG   MET   1          3HG       MET   1 -14.025  -9.486   7.971
    9   1HE   MET   1          1HE       MET   1 -16.015  -7.766   6.017
   10   2HE   MET   1          2HE       MET   1 -16.216  -7.894   7.785
   11   3HE   MET   1          3HE       MET   1 -16.188  -6.295   7.004
   12    HA   PRO   2           HA       PRO   2  -7.454 -10.041   5.695
   13   1HB   PRO   2          2HB       PRO   2  -7.345 -11.465   3.337
   14   2HB   PRO   2          3HB       PRO   2  -7.829 -12.140   4.912
   15   1HG   PRO   2          2HG       PRO   2  -9.654 -11.103   2.715
   16   2HG   PRO   2          3HG       PRO   2  -9.764 -12.656   3.592
   17   1HD   PRO   2          2HD       PRO   2 -11.276 -10.596   4.362
   18   2HD   PRO   2          3HD       PRO   2 -10.441 -11.575   5.593
   19    H    LYS   3           H        LYS   3  -9.169  -8.940   2.627
   20    HA   LYS   3           HA       LYS   3  -6.485  -7.929   1.835
   21   1HB   LYS   3          2HB       LYS   3  -7.254  -9.899   0.610
   22   2HB   LYS   3          3HB       LYS   3  -8.620  -8.967   0.001
   23   1HG   LYS   3          2HG       LYS   3  -6.983  -7.373  -1.114
   24   2HG   LYS   3          3HG       LYS   3  -5.671  -8.262  -0.339
   25   1HD   LYS   3          2HD       LYS   3  -5.550  -9.126  -2.441
   26   2HD   LYS   3          3HD       LYS   3  -6.539 -10.343  -1.641
   27   1HE   LYS   3          2HE       LYS   3  -7.461  -8.116  -3.547
   28   2HE   LYS   3          3HE       LYS   3  -7.433  -9.858  -3.858
   29   1HZ   LYS   3          1HZ       LYS   3  -9.691  -9.300  -3.264
   30   2HZ   LYS   3          2HZ       LYS   3  -9.075 -10.080  -2.026
   31   3HZ   LYS   3          3HZ       LYS   3  -9.184  -8.444  -1.970
   32    H    HIS   4           H        HIS   4  -6.209  -5.955   1.022
   33    HA   HIS   4           HA       HIS   4  -8.529  -4.112   0.786
   34   1HB   HIS   4          2HB       HIS   4  -5.885  -3.593   2.197
   35   2HB   HIS   4          3HB       HIS   4  -7.262  -2.482   2.075
   36    HD1  HIS   4           1HD      HIS   4  -5.882  -5.180   4.280
   37    HD2  HIS   4           2HD      HIS   4  -9.646  -3.622   3.243
   38    HE1  HIS   4           1HE      HIS   4  -7.490  -5.933   6.090
   39    H    GLU   5           H        GLU   5  -8.330  -2.669  -0.946
   40    HA   GLU   5           HA       GLU   5  -5.860  -2.840  -2.617
   41   1HB   GLU   5          2HB       GLU   5  -8.805  -2.647  -3.369
   42   2HB   GLU   5          3HB       GLU   5  -7.473  -2.438  -4.502
   43   1HG   GLU   5          2HG       GLU   5  -6.639  -4.739  -3.579
   44   2HG   GLU   5          3HG       GLU   5  -8.241  -4.900  -2.858
   45    H    PHE   6           H        PHE   6  -5.045  -1.005  -3.512
   46    HA   PHE   6           HA       PHE   6  -6.309   1.594  -2.878
   47   1HB   PHE   6          2HB       PHE   6  -3.374   0.918  -2.342
   48   2HB   PHE   6          3HB       PHE   6  -4.201   2.384  -1.870
   49    HD1  PHE   6           1HD      PHE   6  -3.873  -1.276  -1.217
   50    HD2  PHE   6           2HD      PHE   6  -5.181   2.518   0.401
   51    HE1  PHE   6           1HE      PHE   6  -4.335  -2.346   0.950
   52    HE2  PHE   6           2HE      PHE   6  -5.757   1.395   2.511
   53    HZ   PHE   6           HZ       PHE   6  -5.273  -1.013   2.833
   54    H    SER   7           H        SER   7  -5.867   3.136  -4.473
   55    HA   SER   7           HA       SER   7  -4.199   2.251  -6.779
   56   1HB   SER   7          2HB       SER   7  -6.343   3.286  -7.384
   57   2HB   SER   7          3HB       SER   7  -5.812   4.791  -6.590
   58    HG   SER   7           HG       SER   7  -4.210   3.519  -8.577
   59    H    VAL   8           H        VAL   8  -2.271   3.369  -7.268
   60    HA   VAL   8           HA       VAL   8  -1.132   5.169  -5.205
   61    HB   VAL   8           HB       VAL   8   0.010   2.529  -6.289
   62   1HG1  VAL   8          1HG1      VAL   8   1.857   3.022  -4.692
   63   2HG1  VAL   8          2HG1      VAL   8   1.695   4.353  -5.848
   64   3HG1  VAL   8          3HG1      VAL   8   1.053   4.533  -4.207
   65   1HG2  VAL   8          1HG2      VAL   8  -1.116   3.316  -3.563
   66   2HG2  VAL   8          2HG2      VAL   8  -1.631   1.964  -4.597
   67   3HG2  VAL   8          3HG2      VAL   8  -0.053   1.935  -3.791
   68    H    ASP   9           H        ASP   9  -0.632   6.981  -6.560
   69    HA   ASP   9           HA       ASP   9   0.193   6.405  -9.270
   70   1HB   ASP   9          2HB       ASP   9  -0.740   8.634  -8.644
   71   2HB   ASP   9          3HB       ASP   9   0.872   9.021  -7.975
   72    H    MET  10           H        MET  10   1.756   4.713  -8.921
   73    HA   MET  10           HA       MET  10   4.379   5.524  -7.991
   74   1HB   MET  10          2HB       MET  10   3.521   3.247  -9.817
   75   2HB   MET  10          3HB       MET  10   5.173   3.537  -9.248
   76   1HG   MET  10          2HG       MET  10   4.609   2.243  -7.474
   77   2HG   MET  10          3HG       MET  10   3.819   3.677  -6.859
   78   1HE   MET  10          1HE       MET  10   2.614   1.086  -9.712
   79   2HE   MET  10          2HE       MET  10   3.615   0.274  -8.473
   80   3HE   MET  10          3HE       MET  10   1.868  -0.049  -8.548
   81    H    THR  11           H        THR  11   4.550   7.572  -8.831
   82    HA   THR  11           HA       THR  11   4.699   8.147 -11.604
   83    HB   THR  11           HB       THR  11   6.173   9.762  -9.534
   84    HG1  THR  11           1HG      THR  11   3.380   9.254  -9.516
   85   1HG2  THR  11          1HG2      THR  11   4.050  10.484 -11.608
   86   2HG2  THR  11          2HG2      THR  11   4.998  11.619 -10.627
   87   3HG2  THR  11          3HG2      THR  11   5.809  10.619 -11.851
   88    H    CYS  12           H        CYS  12   7.018   6.839  -9.258
   89    HA   CYS  12           HA       CYS  12   8.967   6.509 -11.483
   90   1HB   CYS  12          2HB       CYS  12   9.801   8.305 -10.015
   91   2HB   CYS  12          3HB       CYS  12   9.562   7.273  -8.582
   92    HG   CYS  12           HG       CYS  12  12.092   7.303  -9.089
   93    H    GLY  13           H        GLY  13   9.973   4.415 -11.344
   94   1HA   GLY  13          2HA       GLY  13   8.549   2.237 -10.361
   95   2HA   GLY  13          3HA       GLY  13  10.302   2.252 -10.629
   96    H    GLY  14           H        GLY  14  11.074   4.174  -8.700
   97   1HA   GLY  14          2HA       GLY  14  11.256   2.540  -6.396
   98   2HA   GLY  14          3HA       GLY  14  11.784   4.234  -6.514
   99    H    CYS  15           H        CYS  15   8.579   4.547  -7.299
  100    HA   CYS  15           HA       CYS  15   7.622   5.237  -4.686
  101   1HB   CYS  15          2HB       CYS  15   6.150   4.533  -7.198
  102   2HB   CYS  15          3HB       CYS  15   5.392   4.994  -5.651
  103    HG   CYS  15           HG       CYS  15   5.194   7.130  -6.855
  104    H    ALA  16           H        ALA  16   7.772   2.206  -6.609
  105    HA   ALA  16           HA       ALA  16   6.119   0.622  -4.907
  106   1HB   ALA  16          1HB       ALA  16   6.795  -0.052  -7.214
  107   2HB   ALA  16          2HB       ALA  16   8.467  -0.265  -6.646
  108   3HB   ALA  16          3HB       ALA  16   7.176  -1.294  -6.003
  109    H    GLU  17           H        GLU  17   9.729   1.141  -4.927
  110    HA   GLU  17           HA       GLU  17  10.290  -0.267  -2.559
  111   1HB   GLU  17          2HB       GLU  17  11.506   2.191  -3.867
  112   2HB   GLU  17          3HB       GLU  17  12.085   1.574  -2.335
  113   1HG   GLU  17          2HG       GLU  17  11.741  -0.622  -4.285
  114   2HG   GLU  17          3HG       GLU  17  12.773   0.662  -4.904
  115    H    ALA  18           H        ALA  18   9.092   3.117  -2.949
  116    HA   ALA  18           HA       ALA  18   9.302   3.802  -0.208
  117   1HB   ALA  18          1HB       ALA  18   7.688   5.542  -0.610
  118   2HB   ALA  18          2HB       ALA  18   8.747   5.420  -2.033
  119   3HB   ALA  18          3HB       ALA  18   7.095   4.759  -2.076
  120    H    VAL  19           H        VAL  19   6.506   2.382  -1.964
  121    HA   VAL  19           HA       VAL  19   4.870   2.046   0.329
  122    HB   VAL  19           HB       VAL  19   4.910   0.416  -2.237
  123   1HG1  VAL  19          1HG1      VAL  19   2.627  -0.255  -1.580
  124   2HG1  VAL  19          2HG1      VAL  19   3.759  -0.799  -0.360
  125   3HG1  VAL  19          3HG1      VAL  19   2.775   0.650  -0.064
  126   1HG2  VAL  19          1HG2      VAL  19   3.152   2.752  -1.340
  127   2HG2  VAL  19          2HG2      VAL  19   4.424   2.852  -2.569
  128   3HG2  VAL  19          3HG2      VAL  19   3.003   1.847  -2.860
  129    H    SER  20           H        SER  20   7.046  -0.319  -1.306
  130    HA   SER  20           HA       SER  20   6.534  -2.459   0.420
  131   1HB   SER  20          2HB       SER  20   7.760  -2.721  -1.711
  132   2HB   SER  20          3HB       SER  20   9.055  -1.661  -1.147
  133    HG   SER  20           HG       SER  20   8.487  -4.109   0.159
  134    H    ARG  21           H        ARG  21   9.041   0.044   0.756
  135    HA   ARG  21           HA       ARG  21  10.147  -1.034   3.156
  136   1HB   ARG  21          2HB       ARG  21  10.248   1.760   1.969
  137   2HB   ARG  21          3HB       ARG  21  11.187   1.228   3.377
  138   1HG   ARG  21          2HG       ARG  21  12.252  -0.561   2.031
  139   2HG   ARG  21          3HG       ARG  21  11.333  -0.075   0.609
  140   1HD   ARG  21          2HD       ARG  21  12.385   2.223   0.804
  141   2HD   ARG  21          3HD       ARG  21  13.406   1.548   2.101
  142    HE   ARG  21           HE       ARG  21  13.386   0.127  -0.530
  143   1HH1  ARG  21          2HH2      ARG  21  15.074   2.514   1.457
  144   2HH1  ARG  21          1HH2      ARG  21  16.551   2.431   0.548
  145   1HH2  ARG  21          2HH1      ARG  21  15.252   0.177  -1.863
  146   2HH2  ARG  21          1HH1      ARG  21  16.676   1.001  -1.337
  147    H    VAL  22           H        VAL  22   7.680   1.700   2.717
  148    HA   VAL  22           HA       VAL  22   7.459   2.068   5.475
  149    HB   VAL  22           HB       VAL  22   6.767   3.572   3.501
  150   1HG1  VAL  22          1HG1      VAL  22   4.093   2.232   3.990
  151   2HG1  VAL  22          2HG1      VAL  22   4.434   3.577   2.883
  152   3HG1  VAL  22          3HG1      VAL  22   5.078   1.978   2.534
  153   1HG2  VAL  22          1HG2      VAL  22   5.049   3.257   5.960
  154   2HG2  VAL  22          2HG2      VAL  22   6.554   4.208   5.793
  155   3HG2  VAL  22          3HG2      VAL  22   5.077   4.691   4.909
  156    H    LEU  23           H        LEU  23   5.513  -0.104   3.291
  157    HA   LEU  23           HA       LEU  23   3.900  -1.066   5.397
  158   1HB   LEU  23          2HB       LEU  23   4.617  -2.107   2.646
  159   2HB   LEU  23          3HB       LEU  23   3.734  -3.091   3.804
  160    HG   LEU  23           HG       LEU  23   2.258  -2.009   2.192
  161   1HD1  LEU  23          1HD1      LEU  23   1.367  -2.836   4.293
  162   2HD1  LEU  23          2HD1      LEU  23   1.847  -1.346   5.140
  163   3HD1  LEU  23          3HD1      LEU  23   0.592  -1.283   3.911
  164   1HD2  LEU  23          1HD2      LEU  23   2.805   0.476   3.806
  165   2HD2  LEU  23          2HD2      LEU  23   3.427   0.195   2.160
  166   3HD2  LEU  23          3HD2      LEU  23   1.680   0.313   2.435
  167    H    ASN  24           H        ASN  24   7.033  -2.316   4.127
  168    HA   ASN  24           HA       ASN  24   7.239  -4.573   5.829
  169   1HB   ASN  24          2HB       ASN  24   8.874  -4.382   4.151
  170   2HB   ASN  24          3HB       ASN  24   9.212  -2.696   4.537
  171   1HD2  ASN  24          1HD2      ASN  24  10.368  -2.141   6.400
  172   2HD2  ASN  24          2HD2      ASN  24  11.546  -3.285   7.073
  173    H    LYS  25           H        LYS  25   8.072  -1.144   6.422
  174    HA   LYS  25           HA       LYS  25   9.111  -1.406   9.027
  175   1HB   LYS  25          2HB       LYS  25   7.821   0.797   7.422
  176   2HB   LYS  25          3HB       LYS  25   7.913   1.025   9.156
  177   1HG   LYS  25          2HG       LYS  25  10.289   0.354   7.351
  178   2HG   LYS  25          3HG       LYS  25   9.826   1.977   7.858
  179   1HD   LYS  25          2HD       LYS  25  11.035   1.770   9.722
  180   2HD   LYS  25          3HD       LYS  25   9.922   0.518  10.279
  181   1HE   LYS  25          2HE       LYS  25  11.354  -1.188   9.001
  182   2HE   LYS  25          3HE       LYS  25  12.491   0.124   8.660
  183   1HZ   LYS  25          1HZ       LYS  25  13.140  -1.157  10.570
  184   2HZ   LYS  25          2HZ       LYS  25  12.787   0.377  11.041
  185   3HZ   LYS  25          3HZ       LYS  25  11.723  -0.846  11.337
  186    H    LEU  26           H        LEU  26   5.748  -1.384   7.974
  187    HA   LEU  26           HA       LEU  26   4.539  -1.061  10.490
  188   1HB   LEU  26          2HB       LEU  26   3.585  -1.259   8.055
  189   2HB   LEU  26          3HB       LEU  26   3.471  -2.968   8.338
  190    HG   LEU  26           HG       LEU  26   1.478  -1.346   8.659
  191   1HD1  LEU  26          1HD1      LEU  26   1.938  -3.597  10.625
  192   2HD1  LEU  26          2HD1      LEU  26   0.382  -2.831  10.214
  193   3HD1  LEU  26          3HD1      LEU  26   1.276  -3.723   8.972
  194   1HD2  LEU  26          1HD2      LEU  26   1.023  -0.542  10.854
  195   2HD2  LEU  26          2HD2      LEU  26   2.459  -1.327  11.538
  196   3HD2  LEU  26          3HD2      LEU  26   2.636   0.061  10.442
  197    H    GLY  27           H        GLY  27   5.839  -3.932   8.877
  198   1HA   GLY  27          2HA       GLY  27   6.835  -5.184  11.045
  199   2HA   GLY  27          3HA       GLY  27   5.126  -5.661  11.140
  200    H    GLY  28           H        GLY  28   4.273  -7.142   9.671
  201   1HA   GLY  28          2HA       GLY  28   6.097  -8.425   7.671
  202   2HA   GLY  28          3HA       GLY  28   5.335  -9.387   8.949
  203    H    VAL  29           H        VAL  29   3.756  -6.628   7.573
  204    HA   VAL  29           HA       VAL  29   1.390  -7.946   6.728
  205    HB   VAL  29           HB       VAL  29   1.475  -5.617   7.394
  206   1HG1  VAL  29          1HG1      VAL  29   3.226  -5.082   4.960
  207   2HG1  VAL  29          2HG1      VAL  29   2.545  -3.861   6.046
  208   3HG1  VAL  29          3HG1      VAL  29   3.763  -4.982   6.633
  209   1HG2  VAL  29          1HG2      VAL  29   0.264  -4.560   5.562
  210   2HG2  VAL  29          2HG2      VAL  29   0.784  -5.824   4.439
  211   3HG2  VAL  29          3HG2      VAL  29  -0.282  -6.221   5.810
  212    H    LYS  30           H        LYS  30   0.744  -8.742   4.662
  213    HA   LYS  30           HA       LYS  30   2.923  -8.989   2.669
  214   1HB   LYS  30          2HB       LYS  30   1.297 -10.898   3.555
  215   2HB   LYS  30          3HB       LYS  30   0.256 -10.301   2.260
  216   1HG   LYS  30          2HG       LYS  30   3.174 -11.170   2.015
  217   2HG   LYS  30          3HG       LYS  30   1.794 -12.185   1.614
  218   1HD   LYS  30          2HD       LYS  30   1.308 -11.069  -0.368
  219   2HD   LYS  30          3HD       LYS  30   1.988  -9.544   0.149
  220   1HE   LYS  30          2HE       LYS  30   4.278 -10.449   0.049
  221   2HE   LYS  30          3HE       LYS  30   3.618 -11.974  -0.602
  222   1HZ   LYS  30          1HZ       LYS  30   2.623 -10.560  -2.392
  223   2HZ   LYS  30          2HZ       LYS  30   3.408  -9.284  -1.824
  224   3HZ   LYS  30          3HZ       LYS  30   4.261 -10.544  -2.447
  225    H    TYR  31           H        TYR  31   3.024  -7.480   1.169
  226    HA   TYR  31           HA       TYR  31   0.554  -6.237   0.046
  227   1HB   TYR  31          2HB       TYR  31   2.087  -4.334  -0.566
  228   2HB   TYR  31          3HB       TYR  31   1.691  -4.495   1.139
  229    HD1  TYR  31           HD1      TYR  31   4.374  -5.254  -1.358
  230    HD2  TYR  31           HD2      TYR  31   3.331  -5.079   2.782
  231    HE1  TYR  31           HE1      TYR  31   6.784  -5.286  -0.763
  232    HE2  TYR  31           HE2      TYR  31   5.742  -4.981   3.406
  233    HH   TYR  31           HH       TYR  31   7.821  -4.142   2.324
  234    H    ASP  32           H        ASP  32   0.537  -5.927  -2.210
  235    HA   ASP  32           HA       ASP  32   2.728  -7.035  -3.839
  236   1HB   ASP  32          2HB       ASP  32  -0.119  -8.026  -3.628
  237   2HB   ASP  32          3HB       ASP  32   0.630  -7.972  -5.227
  238    H    ILE  33           H        ILE  33   3.159  -5.693  -5.453
  239    HA   ILE  33           HA       ILE  33   1.551  -3.195  -5.643
  240    HB   ILE  33           HB       ILE  33   4.481  -3.632  -6.271
  241   1HG1  ILE  33          2HG1      ILE  33   4.508  -2.109  -4.032
  242   2HG1  ILE  33          3HG1      ILE  33   3.115  -3.108  -3.632
  243   1HG2  ILE  33          1HG2      ILE  33   2.918  -1.083  -5.716
  244   2HG2  ILE  33          2HG2      ILE  33   4.615  -1.233  -6.207
  245   3HG2  ILE  33          3HG2      ILE  33   3.321  -1.692  -7.325
  246   1HD1  ILE  33          1HD1      ILE  33   4.478  -5.136  -3.775
  247   2HD1  ILE  33          2HD1      ILE  33   5.816  -4.225  -4.522
  248   3HD1  ILE  33          3HD1      ILE  33   5.382  -3.930  -2.838
  249    H    ASP  34           H        ASP  34   0.550  -2.837  -7.626
  250    HA   ASP  34           HA       ASP  34   1.402  -4.503  -9.951
  251   1HB   ASP  34          2HB       ASP  34  -0.957  -4.659  -9.194
  252   2HB   ASP  34          3HB       ASP  34  -1.168  -2.946  -9.604
  253    H    LEU  35           H        LEU  35   2.942  -3.454 -11.024
  254    HA   LEU  35           HA       LEU  35   3.364  -0.647 -10.838
  255   1HB   LEU  35          2HB       LEU  35   4.637  -2.880 -12.402
  256   2HB   LEU  35          3HB       LEU  35   5.023  -1.214 -12.808
  257    HG   LEU  35           HG       LEU  35   6.648  -2.309 -11.313
  258   1HD1  LEU  35          1HD1      LEU  35   5.353   0.156 -10.076
  259   2HD1  LEU  35          2HD1      LEU  35   7.008  -0.416  -9.821
  260   3HD1  LEU  35          3HD1      LEU  35   6.507   0.144 -11.422
  261   1HD2  LEU  35          1HD2      LEU  35   6.185  -2.619  -8.942
  262   2HD2  LEU  35          2HD2      LEU  35   4.500  -2.131  -9.177
  263   3HD2  LEU  35          3HD2      LEU  35   5.100  -3.630  -9.916
  264    HA   PRO  36           HA       PRO  36   1.868  -0.238 -15.343
  265   1HB   PRO  36          2HB       PRO  36   0.119  -2.113 -16.390
  266   2HB   PRO  36          3HB       PRO  36   1.887  -2.095 -16.649
  267   1HG   PRO  36          2HG       PRO  36   0.326  -3.707 -14.631
  268   2HG   PRO  36          3HG       PRO  36   1.641  -4.265 -15.700
  269   1HD   PRO  36          2HD       PRO  36   2.091  -3.659 -13.135
  270   2HD   PRO  36          3HD       PRO  36   3.289  -3.189 -14.372
  271    H    ASN  37           H        ASN  37  -0.442  -1.995 -13.097
  272    HA   ASN  37           HA       ASN  37  -2.587  -0.219 -13.962
  273   1HB   ASN  37          2HB       ASN  37  -2.531  -2.211 -11.677
  274   2HB   ASN  37          3HB       ASN  37  -3.912  -1.259 -12.186
  275   1HD2  ASN  37          1HD2      ASN  37  -1.666  -3.785 -13.315
  276   2HD2  ASN  37          2HD2      ASN  37  -2.751  -4.414 -14.559
  277    H    LYS  38           H        LYS  38  -0.139  -0.009 -11.334
  278    HA   LYS  38           HA       LYS  38   0.321   1.701 -10.008
  279   1HB   LYS  38          2HB       LYS  38  -1.634   3.338 -11.689
  280   2HB   LYS  38          3HB       LYS  38  -0.597   3.934 -10.403
  281   1HG   LYS  38          2HG       LYS  38   1.402   2.940 -11.650
  282   2HG   LYS  38          3HG       LYS  38   0.311   2.464 -12.942
  283   1HD   LYS  38          2HD       LYS  38   1.577   4.456 -13.505
  284   2HD   LYS  38          3HD       LYS  38  -0.164   4.790 -13.497
  285   1HE   LYS  38          2HE       LYS  38  -0.046   6.193 -11.666
  286   2HE   LYS  38          3HE       LYS  38   1.258   5.255 -10.921
  287   1HZ   LYS  38          1HZ       LYS  38   2.853   6.271 -12.203
  288   2HZ   LYS  38          2HZ       LYS  38   1.733   7.065 -13.170
  289   3HZ   LYS  38          3HZ       LYS  38   1.921   7.467 -11.595
  290    H    LYS  39           H        LYS  39  -0.896  -0.260  -9.119
  291    HA   LYS  39           HA       LYS  39  -2.611   0.874  -7.049
  292   1HB   LYS  39          2HB       LYS  39  -3.124  -1.794  -8.477
  293   2HB   LYS  39          3HB       LYS  39  -3.892  -1.280  -6.968
  294   1HG   LYS  39          2HG       LYS  39  -5.029   0.564  -8.126
  295   2HG   LYS  39          3HG       LYS  39  -4.226   0.131  -9.641
  296   1HD   LYS  39          2HD       LYS  39  -6.520  -0.738  -9.580
  297   2HD   LYS  39          3HD       LYS  39  -5.339  -2.055  -9.665
  298   1HE   LYS  39          2HE       LYS  39  -5.621  -2.535  -7.255
  299   2HE   LYS  39          3HE       LYS  39  -6.671  -1.120  -7.064
  300   1HZ   LYS  39          1HZ       LYS  39  -8.294  -2.261  -8.427
  301   2HZ   LYS  39          2HZ       LYS  39  -7.261  -3.536  -8.653
  302   3HZ   LYS  39          3HZ       LYS  39  -7.832  -3.212  -7.172
  303    H    VAL  40           H        VAL  40  -2.576  -0.446  -5.061
  304    HA   VAL  40           HA       VAL  40  -0.510  -2.521  -4.875
  305    HB   VAL  40           HB       VAL  40  -1.114  -0.035  -3.223
  306   1HG1  VAL  40          1HG1      VAL  40  -0.035  -2.627  -2.128
  307   2HG1  VAL  40          2HG1      VAL  40   0.126  -1.034  -1.330
  308   3HG1  VAL  40          3HG1      VAL  40  -1.488  -1.687  -1.668
  309   1HG2  VAL  40          1HG2      VAL  40   1.509  -1.426  -3.883
  310   2HG2  VAL  40          2HG2      VAL  40   0.797  -0.128  -4.874
  311   3HG2  VAL  40          3HG2      VAL  40   1.289   0.203  -3.211
  312    H    CYS  41           H        CYS  41  -1.284  -4.261  -3.785
  313    HA   CYS  41           HA       CYS  41  -3.965  -4.091  -2.536
  314   1HB   CYS  41          2HB       CYS  41  -4.591  -6.234  -3.317
  315   2HB   CYS  41          3HB       CYS  41  -4.081  -5.335  -4.759
  316    HG   CYS  41           HG       CYS  41  -1.560  -6.321  -4.542
  317    H    ILE  42           H        ILE  42  -4.064  -5.212  -0.563
  318    HA   ILE  42           HA       ILE  42  -1.506  -6.295   0.479
  319    HB   ILE  42           HB       ILE  42  -3.197  -4.231   1.926
  320   1HG1  ILE  42          2HG1      ILE  42  -0.655  -3.804   0.289
  321   2HG1  ILE  42          3HG1      ILE  42  -2.250  -3.087   0.004
  322   1HG2  ILE  42          1HG2      ILE  42  -0.359  -5.171   2.464
  323   2HG2  ILE  42          2HG2      ILE  42  -1.353  -4.126   3.496
  324   3HG2  ILE  42          3HG2      ILE  42  -1.790  -5.816   3.299
  325   1HD1  ILE  42          1HD1      ILE  42  -2.041  -1.900   2.224
  326   2HD1  ILE  42          2HD1      ILE  42  -0.358  -2.482   2.275
  327   3HD1  ILE  42          3HD1      ILE  42  -0.880  -1.401   0.979
  328    H    GLU  43           H        GLU  43  -1.778  -7.993   1.784
  329    HA   GLU  43           HA       GLU  43  -4.539  -8.771   2.596
  330   1HB   GLU  43          2HB       GLU  43  -3.361 -10.217   0.834
  331   2HB   GLU  43          3HB       GLU  43  -2.263 -10.716   2.134
  332   1HG   GLU  43          2HG       GLU  43  -5.311 -10.969   2.192
  333   2HG   GLU  43          3HG       GLU  43  -4.194 -12.268   1.762
  334    H    SER  44           H        SER  44  -4.689  -8.207   4.653
  335    HA   SER  44           HA       SER  44  -3.291  -9.759   6.456
  336   1HB   SER  44          2HB       SER  44  -1.544  -7.991   6.410
  337   2HB   SER  44          3HB       SER  44  -2.740  -6.791   6.941
  338    HG   SER  44           HG       SER  44  -2.990  -8.085   8.840
  339    H    GLU  45           H        GLU  45  -5.075 -10.393   7.600
  340    HA   GLU  45           HA       GLU  45  -7.332  -8.634   7.995
  341   1HB   GLU  45          2HB       GLU  45  -7.451 -11.136   7.809
  342   2HB   GLU  45          3HB       GLU  45  -6.790 -11.250   9.449
  343   1HG   GLU  45          2HG       GLU  45  -8.723 -10.104  10.361
  344   2HG   GLU  45          3HG       GLU  45  -9.276  -9.620   8.750
  345    H    HIS  46           H        HIS  46  -5.965  -6.857   8.747
  346    HA   HIS  46           HA       HIS  46  -6.436  -6.693  11.637
  347   1HB   HIS  46          2HB       HIS  46  -4.447  -5.492  12.162
  348   2HB   HIS  46          3HB       HIS  46  -3.981  -7.025  11.438
  349    HD1  HIS  46           1HD      HIS  46  -4.569  -3.437   9.922
  350    HD2  HIS  46           2HD      HIS  46  -1.732  -6.543  10.247
  351    HE1  HIS  46           1HE      HIS  46  -2.410  -2.596   8.911
  352    H    SER  47           H        SER  47  -6.319  -4.137  12.153
  353    HA   SER  47           HA       SER  47  -8.507  -3.091  10.761
  354   1HB   SER  47          2HB       SER  47  -7.766  -2.340  13.026
  355   2HB   SER  47          3HB       SER  47  -6.456  -1.423  12.242
  356    HG   SER  47           HG       SER  47  -8.361  -0.166  12.603
  357    H    MET  48           H        MET  48  -8.822  -1.741   9.122
  358    HA   MET  48           HA       MET  48  -7.018  -1.667   6.916
  359   1HB   MET  48          2HB       MET  48  -9.412   0.151   7.532
  360   2HB   MET  48          3HB       MET  48  -8.658  -0.110   5.950
  361   1HG   MET  48          2HG       MET  48  -9.349  -2.464   6.003
  362   2HG   MET  48          3HG       MET  48 -10.012  -2.267   7.625
  363   1HE   MET  48          1HE       MET  48 -10.456  -1.341   3.858
  364   2HE   MET  48          2HE       MET  48 -11.970  -0.406   3.900
  365   3HE   MET  48          3HE       MET  48 -10.484   0.289   4.581
  366    H    ASP  49           H        ASP  49  -8.004   0.843   9.292
  367    HA   ASP  49           HA       ASP  49  -6.292   2.684   7.930
  368   1HB   ASP  49          2HB       ASP  49  -8.361   3.418   9.195
  369   2HB   ASP  49          3HB       ASP  49  -7.314   3.454  10.630
  370    H    THR  50           H        THR  50  -5.461   0.263  10.186
  371    HA   THR  50           HA       THR  50  -3.058   1.531  11.170
  372    HB   THR  50           HB       THR  50  -3.621  -1.388  10.571
  373    HG1  THR  50           1HG      THR  50  -3.953   0.177  12.905
  374   1HG2  THR  50          1HG2      THR  50  -1.892  -1.818  12.294
  375   2HG2  THR  50          2HG2      THR  50  -1.229  -1.008  10.867
  376   3HG2  THR  50          3HG2      THR  50  -1.525  -0.080  12.355
  377    H    LEU  51           H        LEU  51  -3.944  -0.201   8.121
  378    HA   LEU  51           HA       LEU  51  -1.256  -0.112   7.019
  379   1HB   LEU  51          2HB       LEU  51  -3.945  -0.262   5.565
  380   2HB   LEU  51          3HB       LEU  51  -2.335  -0.474   4.847
  381    HG   LEU  51           HG       LEU  51  -3.581  -2.217   7.044
  382   1HD1  LEU  51          1HD1      LEU  51  -4.842  -2.454   4.992
  383   2HD1  LEU  51          2HD1      LEU  51  -3.354  -2.748   4.068
  384   3HD1  LEU  51          3HD1      LEU  51  -3.889  -3.915   5.299
  385   1HD2  LEU  51          1HD2      LEU  51  -1.079  -2.594   5.329
  386   2HD2  LEU  51          2HD2      LEU  51  -1.073  -2.298   7.076
  387   3HD2  LEU  51          3HD2      LEU  51  -1.747  -3.805   6.445
  388    H    LEU  52           H        LEU  52  -4.246   1.852   6.461
  389    HA   LEU  52           HA       LEU  52  -2.995   3.702   4.770
  390   1HB   LEU  52          2HB       LEU  52  -5.374   3.898   6.539
  391   2HB   LEU  52          3HB       LEU  52  -4.831   5.265   5.596
  392    HG   LEU  52           HG       LEU  52  -5.389   2.562   4.360
  393   1HD1  LEU  52          1HD1      LEU  52  -7.333   4.876   4.751
  394   2HD1  LEU  52          2HD1      LEU  52  -7.642   3.422   3.776
  395   3HD1  LEU  52          3HD1      LEU  52  -7.426   3.283   5.528
  396   1HD2  LEU  52          1HD2      LEU  52  -5.298   5.421   3.251
  397   2HD2  LEU  52          2HD2      LEU  52  -4.115   4.139   2.921
  398   3HD2  LEU  52          3HD2      LEU  52  -5.762   3.998   2.312
  399    H    ALA  53           H        ALA  53  -3.568   4.099   8.325
  400    HA   ALA  53           HA       ALA  53  -2.189   6.487   8.685
  401   1HB   ALA  53          1HB       ALA  53  -2.263   4.154  10.635
  402   2HB   ALA  53          2HB       ALA  53  -1.912   5.846  11.029
  403   3HB   ALA  53          3HB       ALA  53  -3.529   5.398  10.468
  404    H    THR  54           H        THR  54  -0.737   3.237   8.449
  405    HA   THR  54           HA       THR  54   1.940   4.213   8.899
  406    HB   THR  54           HB       THR  54   0.948   1.751   7.395
  407    HG1  THR  54           1HG      THR  54   0.291   1.685   9.473
  408   1HG2  THR  54          1HG2      THR  54   3.214   2.189   6.745
  409   2HG2  THR  54          2HG2      THR  54   3.696   2.555   8.426
  410   3HG2  THR  54          3HG2      THR  54   3.227   0.911   7.960
  411    H    LEU  55           H        LEU  55   0.295   3.289   5.791
  412    HA   LEU  55           HA       LEU  55   2.585   4.091   4.310
  413   1HB   LEU  55          2HB       LEU  55   1.414   3.268   2.455
  414   2HB   LEU  55          3HB       LEU  55   1.184   2.241   3.841
  415    HG   LEU  55           HG       LEU  55  -1.029   3.655   4.113
  416   1HD1  LEU  55          1HD1      LEU  55  -0.371   5.118   2.244
  417   2HD1  LEU  55          2HD1      LEU  55  -0.354   3.721   1.171
  418   3HD1  LEU  55          3HD1      LEU  55  -1.901   4.277   1.887
  419   1HD2  LEU  55          1HD2      LEU  55  -2.181   1.874   2.806
  420   2HD2  LEU  55          2HD2      LEU  55  -0.635   1.457   2.027
  421   3HD2  LEU  55          3HD2      LEU  55  -0.849   1.185   3.763
  422    H    LYS  56           H        LYS  56  -0.411   5.649   4.967
  423    HA   LYS  56           HA       LYS  56  -0.630   7.915   3.520
  424   1HB   LYS  56          2HB       LYS  56  -0.763   7.505   6.531
  425   2HB   LYS  56          3HB       LYS  56  -0.907   9.127   5.907
  426   1HG   LYS  56          2HG       LYS  56  -2.877   8.534   4.563
  427   2HG   LYS  56          3HG       LYS  56  -2.858   6.908   5.222
  428   1HD   LYS  56          2HD       LYS  56  -2.772   8.216   7.577
  429   2HD   LYS  56          3HD       LYS  56  -3.280   9.568   6.605
  430   1HE   LYS  56          2HE       LYS  56  -5.387   8.909   7.196
  431   2HE   LYS  56          3HE       LYS  56  -5.205   7.848   5.802
  432   1HZ   LYS  56          1HZ       LYS  56  -5.069   7.098   8.684
  433   2HZ   LYS  56          2HZ       LYS  56  -5.993   6.490   7.543
  434   3HZ   LYS  56          3HZ       LYS  56  -4.417   6.156   7.533
  435    H    LYS  57           H        LYS  57   1.826   7.357   6.044
  436    HA   LYS  57           HA       LYS  57   2.842   9.976   6.237
  437   1HB   LYS  57          2HB       LYS  57   4.188   7.316   6.735
  438   2HB   LYS  57          3HB       LYS  57   4.793   8.895   7.295
  439   1HG   LYS  57          2HG       LYS  57   2.529   9.145   8.488
  440   2HG   LYS  57          3HG       LYS  57   2.261   7.433   8.093
  441   1HD   LYS  57          2HD       LYS  57   4.729   7.189   9.153
  442   2HD   LYS  57          3HD       LYS  57   4.269   8.675   9.981
  443   1HE   LYS  57          2HE       LYS  57   3.075   5.885  10.158
  444   2HE   LYS  57          3HE       LYS  57   3.708   6.898  11.461
  445   1HZ   LYS  57          1HZ       LYS  57   1.375   6.871  11.592
  446   2HZ   LYS  57          2HZ       LYS  57   1.742   8.366  11.001
  447   3HZ   LYS  57          3HZ       LYS  57   1.171   7.171   9.998
  448    H    THR  58           H        THR  58   3.382   7.633   3.656
  449    HA   THR  58           HA       THR  58   5.895   8.605   2.701
  450    HB   THR  58           HB       THR  58   5.141   7.779   0.496
  451    HG1  THR  58           1HG      THR  58   2.716   7.056   1.760
  452   1HG2  THR  58          1HG2      THR  58   4.551   5.914   2.816
  453   2HG2  THR  58          2HG2      THR  58   4.813   5.421   1.128
  454   3HG2  THR  58          3HG2      THR  58   6.121   6.198   2.047
  455    H    GLY  59           H        GLY  59   2.580   9.829   2.449
  456   1HA   GLY  59          2HA       GLY  59   1.734  11.813   1.817
  457   2HA   GLY  59          3HA       GLY  59   3.378  12.472   1.727
  458    H    LYS  60           H        LYS  60   2.404   9.638  -0.202
  459    HA   LYS  60           HA       LYS  60   2.611  11.221  -2.721
  460   1HB   LYS  60          2HB       LYS  60   2.908   8.303  -1.933
  461   2HB   LYS  60          3HB       LYS  60   2.585   8.751  -3.603
  462   1HG   LYS  60          2HG       LYS  60   5.003   8.421  -3.047
  463   2HG   LYS  60          3HG       LYS  60   4.603   9.971  -3.825
  464   1HD   LYS  60          2HD       LYS  60   4.768  11.170  -1.761
  465   2HD   LYS  60          3HD       LYS  60   4.843   9.641  -0.846
  466   1HE   LYS  60          2HE       LYS  60   7.069   9.196  -1.660
  467   2HE   LYS  60          3HE       LYS  60   7.015  10.604  -2.741
  468   1HZ   LYS  60          1HZ       LYS  60   6.952  12.036  -0.878
  469   2HZ   LYS  60          2HZ       LYS  60   6.693  10.826   0.187
  470   3HZ   LYS  60          3HZ       LYS  60   8.167  10.969  -0.563
  471    H    THR  61           H        THR  61   1.078  10.605  -4.476
  472    HA   THR  61           HA       THR  61  -1.622  10.720  -3.734
  473    HB   THR  61           HB       THR  61  -0.450   9.861  -6.365
  474    HG1  THR  61           1HG      THR  61  -0.382  12.496  -5.330
  475   1HG2  THR  61          1HG2      THR  61  -2.905  10.189  -6.253
  476   2HG2  THR  61          2HG2      THR  61  -2.650  11.846  -5.650
  477   3HG2  THR  61          3HG2      THR  61  -2.141  11.406  -7.298
  478    H    VAL  62           H        VAL  62  -1.226   8.747  -2.289
  479    HA   VAL  62           HA       VAL  62  -2.222   6.299  -3.664
  480    HB   VAL  62           HB       VAL  62  -0.358   5.655  -2.410
  481   1HG1  VAL  62          1HG1      VAL  62  -1.451   7.224  -0.040
  482   2HG1  VAL  62          2HG1      VAL  62  -0.087   6.088   0.025
  483   3HG1  VAL  62          3HG1      VAL  62   0.044   7.543  -0.952
  484   1HG2  VAL  62          1HG2      VAL  62  -2.652   5.027  -0.517
  485   2HG2  VAL  62          2HG2      VAL  62  -2.508   4.285  -2.118
  486   3HG2  VAL  62          3HG2      VAL  62  -1.236   4.035  -0.920
  487    H    SER  63           H        SER  63  -4.230   5.441  -3.094
  488    HA   SER  63           HA       SER  63  -5.763   6.613  -0.895
  489   1HB   SER  63          2HB       SER  63  -6.611   6.956  -3.808
  490   2HB   SER  63          3HB       SER  63  -7.723   7.123  -2.437
  491    HG   SER  63           HG       SER  63  -5.374   8.565  -2.190
  492    H    TYR  64           H        TYR  64  -7.719   5.355  -0.522
  493    HA   TYR  64           HA       TYR  64  -7.235   2.488  -0.998
  494   1HB   TYR  64          2HB       TYR  64  -7.488   2.941   1.259
  495   2HB   TYR  64          3HB       TYR  64  -8.689   4.198   0.999
  496    HD1  TYR  64           HD1      TYR  64 -11.020   3.750   0.913
  497    HD2  TYR  64           HD2      TYR  64  -8.193   0.492   1.025
  498    HE1  TYR  64           HE1      TYR  64 -12.884   2.144   1.034
  499    HE2  TYR  64           HE2      TYR  64 -10.065  -1.103   1.305
  500    HH   TYR  64           HH       TYR  64 -13.487  -0.073   1.052
  501    H    LEU  65           H        LEU  65  -8.505   1.213  -2.281
  502    HA   LEU  65           HA       LEU  65 -11.321   1.783  -2.632
  503   1HB   LEU  65          2HB       LEU  65 -11.031   1.385  -5.171
  504   2HB   LEU  65          3HB       LEU  65 -10.978   2.990  -4.465
  505    HG   LEU  65           HG       LEU  65  -9.389   2.621  -6.226
  506   1HD1  LEU  65          1HD1      LEU  65  -7.709   3.929  -5.473
  507   2HD1  LEU  65          2HD1      LEU  65  -9.053   4.300  -4.388
  508   3HD1  LEU  65          3HD1      LEU  65  -7.752   3.209  -3.865
  509   1HD2  LEU  65          1HD2      LEU  65  -8.776   0.319  -5.992
  510   2HD2  LEU  65          2HD2      LEU  65  -7.359   1.356  -6.061
  511   3HD2  LEU  65          3HD2      LEU  65  -7.883   0.686  -4.499
  512    H    GLY  66           H        GLY  66 -11.188  -0.246  -1.288
  513   1HA   GLY  66          2HA       GLY  66 -12.661  -2.078  -2.339
  514   2HA   GLY  66          3HA       GLY  66 -11.156  -2.658  -3.062
  515    H    LEU  67           H        LEU  67 -13.104  -3.642  -0.743
  516    HA   LEU  67           HA       LEU  67 -11.024  -4.399   1.204
  517   1HB   LEU  67          2HB       LEU  67 -12.151  -2.682   2.362
  518   2HB   LEU  67          3HB       LEU  67 -13.661  -2.952   1.481
  519    HG   LEU  67           HG       LEU  67 -14.023  -5.044   2.689
  520   1HD1  LEU  67          1HD1      LEU  67 -11.664  -5.505   3.463
  521   2HD1  LEU  67          2HD1      LEU  67 -11.718  -4.027   4.442
  522   3HD1  LEU  67          3HD1      LEU  67 -12.775  -5.381   4.846
  523   1HD2  LEU  67          1HD2      LEU  67 -13.761  -2.523   4.371
  524   2HD2  LEU  67          2HD2      LEU  67 -15.139  -2.978   3.348
  525   3HD2  LEU  67          3HD2      LEU  67 -14.752  -3.937   4.788
  526    H    GLU  68           H        GLU  68 -11.134  -6.626   1.481
  527    HA   GLU  68           HA       GLU  68 -13.591  -8.132   0.785
  528   1HB   GLU  68          2HB       GLU  68 -12.030  -8.018  -1.203
  529   2HB   GLU  68          3HB       GLU  68 -10.757  -8.654  -0.149
  530   1HG   GLU  68          2HG       GLU  68 -12.156 -10.750   0.135
  531   2HG   GLU  68          3HG       GLU  68 -13.255 -10.106  -1.109
  Start of MODEL   29
    1   1H    MET   1           H1       MET   1  -6.064 -13.495   4.537
    2   2H    MET   1           H2       MET   1  -6.564 -14.444   5.800
    3   3H    MET   1           H3       MET   1  -7.323 -14.488   4.303
    4    HA   MET   1           HA       MET   1  -8.619 -13.265   5.923
    5   1HB   MET   1          2HB       MET   1  -6.479 -11.111   5.793
    6   2HB   MET   1          3HB       MET   1  -7.773 -11.308   6.969
    7   1HG   MET   1          2HG       MET   1  -5.160 -12.786   6.794
    8   2HG   MET   1          3HG       MET   1  -5.822 -11.862   8.137
    9   1HE   MET   1          1HE       MET   1  -4.442 -14.818   8.241
   10   2HE   MET   1          2HE       MET   1  -4.980 -13.923   9.679
   11   3HE   MET   1          3HE       MET   1  -5.500 -15.603   9.440
   12    HA   PRO   2           HA       PRO   2  -9.768 -10.958   2.162
   13   1HB   PRO   2          2HB       PRO   2 -10.953  -8.688   3.085
   14   2HB   PRO   2          3HB       PRO   2 -11.787 -10.275   3.108
   15   1HG   PRO   2          2HG       PRO   2 -10.295  -8.935   5.385
   16   2HG   PRO   2          3HG       PRO   2 -11.925  -9.675   5.435
   17   1HD   PRO   2          2HD       PRO   2  -9.775 -11.047   6.277
   18   2HD   PRO   2          3HD       PRO   2 -11.004 -11.877   5.292
   19    H    LYS   3           H        LYS   3  -9.012  -9.066   1.010
   20    HA   LYS   3           HA       LYS   3  -6.722  -7.654   2.329
   21   1HB   LYS   3          2HB       LYS   3  -5.878  -7.349  -0.076
   22   2HB   LYS   3          3HB       LYS   3  -5.703  -8.956   0.663
   23   1HG   LYS   3          2HG       LYS   3  -7.612  -9.796  -0.369
   24   2HG   LYS   3          3HG       LYS   3  -8.102  -8.162  -0.932
   25   1HD   LYS   3          2HD       LYS   3  -6.033  -8.277  -2.456
   26   2HD   LYS   3          3HD       LYS   3  -5.937  -9.994  -2.023
   27   1HE   LYS   3          2HE       LYS   3  -8.196  -8.486  -3.430
   28   2HE   LYS   3          3HE       LYS   3  -7.285  -9.863  -4.052
   29   1HZ   LYS   3          1HZ       LYS   3  -9.244  -9.942  -1.804
   30   2HZ   LYS   3          2HZ       LYS   3  -9.499 -10.431  -3.346
   31   3HZ   LYS   3          3HZ       LYS   3  -8.428 -11.239  -2.402
   32    H    HIS   4           H        HIS   4  -6.421  -5.468   1.725
   33    HA   HIS   4           HA       HIS   4  -8.952  -4.004   1.131
   34   1HB   HIS   4          2HB       HIS   4  -6.457  -3.174   2.653
   35   2HB   HIS   4          3HB       HIS   4  -7.945  -2.239   2.497
   36    HD1  HIS   4           1HD      HIS   4 -10.188  -3.980   3.465
   37    HD2  HIS   4           2HD      HIS   4  -6.264  -4.367   4.936
   38    HE1  HIS   4           1HE      HIS   4 -10.361  -5.194   5.700
   39    H    GLU   5           H        GLU   5  -8.984  -2.716  -0.732
   40    HA   GLU   5           HA       GLU   5  -6.650  -2.760  -2.441
   41   1HB   GLU   5          2HB       GLU   5  -9.618  -2.360  -2.600
   42   2HB   GLU   5          3HB       GLU   5  -8.687  -1.393  -3.725
   43   1HG   GLU   5          2HG       GLU   5  -8.042  -4.315  -3.358
   44   2HG   GLU   5          3HG       GLU   5  -9.388  -3.782  -4.361
   45    H    PHE   6           H        PHE   6  -5.624  -1.093  -3.373
   46    HA   PHE   6           HA       PHE   6  -6.254   1.691  -2.657
   47   1HB   PHE   6          2HB       PHE   6  -3.493   0.425  -2.261
   48   2HB   PHE   6          3HB       PHE   6  -3.880   2.113  -2.030
   49    HD1  PHE   6           1HD      PHE   6  -4.512  -1.330  -0.705
   50    HD2  PHE   6           2HD      PHE   6  -4.492   2.897   0.176
   51    HE1  PHE   6           1HE      PHE   6  -4.815  -1.822   1.693
   52    HE2  PHE   6           2HE      PHE   6  -4.640   2.382   2.578
   53    HZ   PHE   6           HZ       PHE   6  -4.894   0.033   3.355
   54    H    SER   7           H        SER   7  -5.878   3.070  -4.252
   55    HA   SER   7           HA       SER   7  -4.370   2.106  -6.640
   56   1HB   SER   7          2HB       SER   7  -6.721   3.967  -6.243
   57   2HB   SER   7          3HB       SER   7  -5.614   4.123  -7.553
   58    HG   SER   7           HG       SER   7  -7.356   2.672  -8.098
   59    H    VAL   8           H        VAL   8  -2.668   3.348  -7.362
   60    HA   VAL   8           HA       VAL   8  -1.583   5.291  -5.398
   61    HB   VAL   8           HB       VAL   8  -0.247   2.945  -6.849
   62   1HG1  VAL   8          1HG1      VAL   8   0.696   4.784  -4.606
   63   2HG1  VAL   8          2HG1      VAL   8   1.538   3.299  -5.115
   64   3HG1  VAL   8          3HG1      VAL   8   1.362   4.630  -6.247
   65   1HG2  VAL   8          1HG2      VAL   8  -0.180   1.888  -4.558
   66   2HG2  VAL   8          2HG2      VAL   8  -1.290   3.144  -3.992
   67   3HG2  VAL   8          3HG2      VAL   8  -1.806   1.977  -5.227
   68    H    ASP   9           H        ASP   9   0.178   6.662  -6.375
   69    HA   ASP   9           HA       ASP   9   0.438   6.325  -9.275
   70   1HB   ASP   9          2HB       ASP   9  -0.599   8.532  -8.936
   71   2HB   ASP   9          3HB       ASP   9   0.756   9.011  -7.899
   72    H    MET  10           H        MET  10   2.494   6.645  -9.994
   73    HA   MET  10           HA       MET  10   4.762   6.275  -8.166
   74   1HB   MET  10          2HB       MET  10   3.864   4.034 -10.060
   75   2HB   MET  10          3HB       MET  10   5.390   4.096  -9.171
   76   1HG   MET  10          2HG       MET  10   3.898   4.411  -7.058
   77   2HG   MET  10          3HG       MET  10   2.574   3.832  -8.054
   78   1HE   MET  10          1HE       MET  10   3.054   0.126  -8.154
   79   2HE   MET  10          2HE       MET  10   1.899   1.450  -7.925
   80   3HE   MET  10          3HE       MET  10   2.936   1.419  -9.382
   81    H    THR  11           H        THR  11   5.898   7.936  -8.981
   82    HA   THR  11           HA       THR  11   5.845   8.684 -11.770
   83    HB   THR  11           HB       THR  11   7.620  10.302 -10.738
   84    HG1  THR  11           1HG      THR  11   7.556  10.298  -8.459
   85   1HG2  THR  11          1HG2      THR  11   5.257  10.948 -11.128
   86   2HG2  THR  11          2HG2      THR  11   4.781  10.207  -9.590
   87   3HG2  THR  11          3HG2      THR  11   5.849  11.626  -9.603
   88    H    CYS  12           H        CYS  12   8.011   6.936  -9.529
   89    HA   CYS  12           HA       CYS  12   9.619   6.022 -11.864
   90   1HB   CYS  12          2HB       CYS  12  10.938   7.740 -10.607
   91   2HB   CYS  12          3HB       CYS  12  10.679   6.818  -9.107
   92    HG   CYS  12           HG       CYS  12  12.164   5.895 -11.908
   93    H    GLY  13           H        GLY  13  10.379   3.811 -11.477
   94   1HA   GLY  13          2HA       GLY  13   8.610   1.996 -10.284
   95   2HA   GLY  13          3HA       GLY  13  10.328   1.692 -10.604
   96    H    GLY  14           H        GLY  14  11.447   3.673  -8.923
   97   1HA   GLY  14          2HA       GLY  14  11.607   2.379  -6.461
   98   2HA   GLY  14          3HA       GLY  14  12.139   4.044  -6.768
   99    H    CYS  15           H        CYS  15   8.988   4.486  -7.479
  100    HA   CYS  15           HA       CYS  15   8.188   5.396  -4.895
  101   1HB   CYS  15          2HB       CYS  15   7.152   6.275  -6.893
  102   2HB   CYS  15          3HB       CYS  15   6.419   4.679  -7.216
  103    HG   CYS  15           HG       CYS  15   4.589   6.273  -6.126
  104    H    ALA  16           H        ALA  16   7.800   2.322  -6.720
  105    HA   ALA  16           HA       ALA  16   6.053   1.027  -4.852
  106   1HB   ALA  16          1HB       ALA  16   8.057  -0.247  -6.775
  107   2HB   ALA  16          2HB       ALA  16   6.666  -1.030  -6.009
  108   3HB   ALA  16          3HB       ALA  16   6.406   0.248  -7.211
  109    H    GLU  17           H        GLU  17   9.645   1.187  -5.173
  110    HA   GLU  17           HA       GLU  17  10.239  -0.448  -2.922
  111   1HB   GLU  17          2HB       GLU  17  11.701   2.083  -3.796
  112   2HB   GLU  17          3HB       GLU  17  12.201   0.938  -2.560
  113   1HG   GLU  17          2HG       GLU  17  12.458  -0.841  -4.194
  114   2HG   GLU  17          3HG       GLU  17  11.928   0.251  -5.489
  115    H    ALA  18           H        ALA  18   9.484   3.076  -3.148
  116    HA   ALA  18           HA       ALA  18   9.895   3.739  -0.453
  117   1HB   ALA  18          1HB       ALA  18   7.681   4.953  -2.142
  118   2HB   ALA  18          2HB       ALA  18   8.537   5.663  -0.779
  119   3HB   ALA  18          3HB       ALA  18   9.405   5.377  -2.303
  120    H    VAL  19           H        VAL  19   6.838   2.732  -2.021
  121    HA   VAL  19           HA       VAL  19   5.225   2.519   0.275
  122    HB   VAL  19           HB       VAL  19   5.226   0.818  -2.269
  123   1HG1  VAL  19          1HG1      VAL  19   2.899   0.270  -1.724
  124   2HG1  VAL  19          2HG1      VAL  19   3.987  -0.377  -0.501
  125   3HG1  VAL  19          3HG1      VAL  19   3.047   1.099  -0.164
  126   1HG2  VAL  19          1HG2      VAL  19   4.825   3.270  -2.638
  127   2HG2  VAL  19          2HG2      VAL  19   3.383   2.302  -2.959
  128   3HG2  VAL  19          3HG2      VAL  19   3.519   3.216  -1.443
  129    H    SER  20           H        SER  20   7.245   0.001  -1.302
  130    HA   SER  20           HA       SER  20   6.768  -2.061   0.490
  131   1HB   SER  20          2HB       SER  20   7.986  -2.185  -1.719
  132   2HB   SER  20          3HB       SER  20   9.432  -1.564  -0.911
  133    HG   SER  20           HG       SER  20   9.409  -3.383   0.437
  134    H    ARG  21           H        ARG  21   9.263   0.514   0.812
  135    HA   ARG  21           HA       ARG  21  10.559  -0.661   3.019
  136   1HB   ARG  21          2HB       ARG  21  10.386   2.345   2.673
  137   2HB   ARG  21          3HB       ARG  21  11.666   1.361   3.391
  138   1HG   ARG  21          2HG       ARG  21  11.636   0.336   0.838
  139   2HG   ARG  21          3HG       ARG  21  11.072   2.000   0.566
  140   1HD   ARG  21          2HD       ARG  21  13.161   2.814   1.753
  141   2HD   ARG  21          3HD       ARG  21  13.697   1.141   1.780
  142    HE   ARG  21           HE       ARG  21  14.089   1.131  -0.508
  143   1HH1  ARG  21          2HH2      ARG  21  12.435   4.124   0.343
  144   2HH1  ARG  21          1HH2      ARG  21  12.797   4.926  -1.157
  145   1HH2  ARG  21          2HH1      ARG  21  14.415   2.098  -2.580
  146   2HH2  ARG  21          1HH1      ARG  21  14.023   3.760  -2.823
  147    H    VAL  22           H        VAL  22   7.884   1.861   3.063
  148    HA   VAL  22           HA       VAL  22   7.761   1.892   5.870
  149    HB   VAL  22           HB       VAL  22   7.054   3.766   4.621
  150   1HG1  VAL  22          1HG1      VAL  22   4.901   3.684   3.319
  151   2HG1  VAL  22          2HG1      VAL  22   6.243   2.837   2.544
  152   3HG1  VAL  22          3HG1      VAL  22   4.977   1.928   3.398
  153   1HG2  VAL  22          1HG2      VAL  22   4.602   2.415   5.726
  154   2HG2  VAL  22          2HG2      VAL  22   5.873   3.158   6.748
  155   3HG2  VAL  22          3HG2      VAL  22   4.906   4.166   5.631
  156    H    LEU  23           H        LEU  23   5.907  -0.034   3.376
  157    HA   LEU  23           HA       LEU  23   4.231  -1.224   5.348
  158   1HB   LEU  23          2HB       LEU  23   4.971  -1.898   2.494
  159   2HB   LEU  23          3HB       LEU  23   4.196  -3.116   3.481
  160    HG   LEU  23           HG       LEU  23   2.524  -2.052   2.225
  161   1HD1  LEU  23          1HD1      LEU  23   0.930  -1.603   3.924
  162   2HD1  LEU  23          2HD1      LEU  23   2.091  -2.726   4.659
  163   3HD1  LEU  23          3HD1      LEU  23   2.138  -0.996   5.052
  164   1HD2  LEU  23          1HD2      LEU  23   3.633   0.108   1.926
  165   2HD2  LEU  23          2HD2      LEU  23   1.940   0.285   2.430
  166   3HD2  LEU  23          3HD2      LEU  23   3.248   0.532   3.612
  167    H    ASN  24           H        ASN  24   7.501  -2.202   4.215
  168    HA   ASN  24           HA       ASN  24   7.547  -4.613   5.780
  169   1HB   ASN  24          2HB       ASN  24   9.651  -2.831   4.500
  170   2HB   ASN  24          3HB       ASN  24  10.070  -4.107   5.630
  171   1HD2  ASN  24          1HD2      ASN  24   8.140  -3.626   2.663
  172   2HD2  ASN  24          2HD2      ASN  24   8.402  -5.249   2.035
  173    H    LYS  25           H        LYS  25   8.256  -1.173   6.494
  174    HA   LYS  25           HA       LYS  25   9.131  -1.634   9.198
  175   1HB   LYS  25          2HB       LYS  25   8.177   0.708   7.588
  176   2HB   LYS  25          3HB       LYS  25   7.857   0.787   9.321
  177   1HG   LYS  25          2HG       LYS  25   9.993   1.820   8.844
  178   2HG   LYS  25          3HG       LYS  25  10.183   0.391   9.867
  179   1HD   LYS  25          2HD       LYS  25  10.808  -0.927   7.781
  180   2HD   LYS  25          3HD       LYS  25  10.745   0.594   6.873
  181   1HE   LYS  25          2HE       LYS  25  12.535   1.540   8.292
  182   2HE   LYS  25          3HE       LYS  25  12.523   0.095   9.317
  183   1HZ   LYS  25          1HZ       LYS  25  13.278   0.136   6.473
  184   2HZ   LYS  25          2HZ       LYS  25  14.311   0.035   7.749
  185   3HZ   LYS  25          3HZ       LYS  25  13.262  -1.193   7.447
  186    H    LEU  26           H        LEU  26   5.857  -1.258   7.815
  187    HA   LEU  26           HA       LEU  26   4.519  -1.382  10.311
  188   1HB   LEU  26          2HB       LEU  26   3.763  -0.782   7.934
  189   2HB   LEU  26          3HB       LEU  26   3.338  -2.453   7.708
  190    HG   LEU  26           HG       LEU  26   1.491  -0.821   8.360
  191   1HD1  LEU  26          1HD1      LEU  26   1.237  -3.277   8.455
  192   2HD1  LEU  26          2HD1      LEU  26   1.795  -3.252  10.144
  193   3HD1  LEU  26          3HD1      LEU  26   0.287  -2.433   9.695
  194   1HD2  LEU  26          1HD2      LEU  26   1.110  -0.228  10.636
  195   2HD2  LEU  26          2HD2      LEU  26   2.487  -1.170  11.213
  196   3HD2  LEU  26          3HD2      LEU  26   2.757   0.307  10.263
  197    H    GLY  27           H        GLY  27   5.314  -3.929   7.951
  198   1HA   GLY  27          2HA       GLY  27   6.736  -5.564   8.791
  199   2HA   GLY  27          3HA       GLY  27   5.911  -5.465  10.335
  200    H    GLY  28           H        GLY  28   3.583  -6.537  10.312
  201   1HA   GLY  28          2HA       GLY  28   4.087  -9.262   9.304
  202   2HA   GLY  28          3HA       GLY  28   2.831  -8.728  10.428
  203    H    VAL  29           H        VAL  29   3.770  -7.977   7.037
  204    HA   VAL  29           HA       VAL  29   0.866  -7.923   6.321
  205    HB   VAL  29           HB       VAL  29   1.880  -5.728   7.004
  206   1HG1  VAL  29          1HG1      VAL  29   3.672  -6.133   4.577
  207   2HG1  VAL  29          2HG1      VAL  29   3.401  -4.590   5.396
  208   3HG1  VAL  29          3HG1      VAL  29   4.170  -5.925   6.253
  209   1HG2  VAL  29          1HG2      VAL  29   1.125  -5.713   4.074
  210   2HG2  VAL  29          2HG2      VAL  29  -0.045  -5.933   5.396
  211   3HG2  VAL  29          3HG2      VAL  29   0.889  -4.449   5.305
  212    H    LYS  30           H        LYS  30   0.282  -8.309   4.147
  213    HA   LYS  30           HA       LYS  30   2.544  -8.736   2.258
  214   1HB   LYS  30          2HB       LYS  30   1.396 -10.871   2.585
  215   2HB   LYS  30          3HB       LYS  30  -0.176 -10.101   2.333
  216   1HG   LYS  30          2HG       LYS  30   0.538 -11.353   0.379
  217   2HG   LYS  30          3HG       LYS  30   0.346  -9.652  -0.014
  218   1HD   LYS  30          2HD       LYS  30   2.560  -9.391  -0.570
  219   2HD   LYS  30          3HD       LYS  30   3.115 -10.299   0.848
  220   1HE   LYS  30          2HE       LYS  30   3.830 -11.476  -1.078
  221   2HE   LYS  30          3HE       LYS  30   2.607 -12.418  -0.212
  222   1HZ   LYS  30          1HZ       LYS  30   0.993 -11.363  -1.924
  223   2HZ   LYS  30          2HZ       LYS  30   2.243 -10.912  -2.754
  224   3HZ   LYS  30          3HZ       LYS  30   2.027 -12.523  -2.511
  225    H    TYR  31           H        TYR  31   2.600  -7.196   0.792
  226    HA   TYR  31           HA       TYR  31   0.190  -5.563   0.145
  227   1HB   TYR  31          2HB       TYR  31   1.684  -3.632  -0.051
  228   2HB   TYR  31          3HB       TYR  31   1.553  -4.237   1.594
  229    HD1  TYR  31           HD1      TYR  31   3.855  -3.277  -0.982
  230    HD2  TYR  31           HD2      TYR  31   3.425  -5.794   2.474
  231    HE1  TYR  31           HE1      TYR  31   6.253  -3.875  -1.111
  232    HE2  TYR  31           HE2      TYR  31   5.833  -6.380   2.360
  233    HH   TYR  31           HH       TYR  31   7.967  -5.025  -0.155
  234    H    ASP  32           H        ASP  32  -0.327  -6.520  -1.755
  235    HA   ASP  32           HA       ASP  32   1.812  -7.351  -3.634
  236   1HB   ASP  32          2HB       ASP  32  -1.094  -8.022  -3.209
  237   2HB   ASP  32          3HB       ASP  32  -0.412  -8.209  -4.827
  238    H    ILE  33           H        ILE  33   2.451  -6.014  -5.121
  239    HA   ILE  33           HA       ILE  33   0.943  -3.520  -5.634
  240    HB   ILE  33           HB       ILE  33   3.849  -4.139  -6.224
  241   1HG1  ILE  33          2HG1      ILE  33   3.797  -2.416  -3.995
  242   2HG1  ILE  33          3HG1      ILE  33   2.632  -3.673  -3.584
  243   1HG2  ILE  33          1HG2      ILE  33   4.128  -1.708  -6.187
  244   2HG2  ILE  33          2HG2      ILE  33   2.976  -2.216  -7.431
  245   3HG2  ILE  33          3HG2      ILE  33   2.385  -1.500  -5.917
  246   1HD1  ILE  33          1HD1      ILE  33   4.371  -5.402  -4.176
  247   2HD1  ILE  33          2HD1      ILE  33   5.511  -4.078  -4.533
  248   3HD1  ILE  33          3HD1      ILE  33   4.901  -4.306  -2.893
  249    H    ASP  34           H        ASP  34   0.014  -3.271  -7.598
  250    HA   ASP  34           HA       ASP  34   1.075  -4.687 -10.000
  251   1HB   ASP  34          2HB       ASP  34  -1.380  -4.707  -9.756
  252   2HB   ASP  34          3HB       ASP  34  -1.377  -2.934  -9.678
  253    H    LEU  35           H        LEU  35   2.700  -3.600 -10.913
  254    HA   LEU  35           HA       LEU  35   3.260  -0.845 -10.229
  255   1HB   LEU  35          2HB       LEU  35   5.035  -2.554 -10.467
  256   2HB   LEU  35          3HB       LEU  35   4.710  -2.634 -12.192
  257    HG   LEU  35           HG       LEU  35   5.219  -0.097 -12.259
  258   1HD1  LEU  35          1HD1      LEU  35   5.084   0.376  -9.813
  259   2HD1  LEU  35          2HD1      LEU  35   6.425  -0.749  -9.521
  260   3HD1  LEU  35          3HD1      LEU  35   6.687   0.740 -10.441
  261   1HD2  LEU  35          1HD2      LEU  35   6.775  -1.809 -13.100
  262   2HD2  LEU  35          2HD2      LEU  35   7.654  -0.495 -12.299
  263   3HD2  LEU  35          3HD2      LEU  35   7.424  -2.043 -11.460
  264    HA   PRO  36           HA       PRO  36   2.498   0.014 -14.909
  265   1HB   PRO  36          2HB       PRO  36   0.676  -1.634 -16.251
  266   2HB   PRO  36          3HB       PRO  36   2.452  -1.742 -16.353
  267   1HG   PRO  36          2HG       PRO  36   0.599  -3.331 -14.578
  268   2HG   PRO  36          3HG       PRO  36   1.960  -3.931 -15.567
  269   1HD   PRO  36          2HD       PRO  36   2.289  -3.534 -12.962
  270   2HD   PRO  36          3HD       PRO  36   3.562  -2.982 -14.085
  271    H    ASN  37           H        ASN  37  -0.289  -1.617 -13.259
  272    HA   ASN  37           HA       ASN  37  -2.107   0.540 -14.130
  273   1HB   ASN  37          2HB       ASN  37  -2.608  -1.850 -12.321
  274   2HB   ASN  37          3HB       ASN  37  -3.816  -0.733 -12.929
  275   1HD2  ASN  37          1HD2      ASN  37  -2.141  -3.669 -13.628
  276   2HD2  ASN  37          2HD2      ASN  37  -2.611  -3.780 -15.323
  277    H    LYS  38           H        LYS  38   0.213   0.277 -11.689
  278    HA   LYS  38           HA       LYS  38   0.625   1.321  -9.811
  279   1HB   LYS  38          2HB       LYS  38  -1.256   3.512 -10.746
  280   2HB   LYS  38          3HB       LYS  38   0.148   3.617  -9.669
  281   1HG   LYS  38          2HG       LYS  38   1.512   2.738 -11.730
  282   2HG   LYS  38          3HG       LYS  38   0.069   3.153 -12.677
  283   1HD   LYS  38          2HD       LYS  38   0.198   5.479 -11.563
  284   2HD   LYS  38          3HD       LYS  38   1.756   4.942 -10.907
  285   1HE   LYS  38          2HE       LYS  38   2.491   4.526 -13.342
  286   2HE   LYS  38          3HE       LYS  38   1.003   5.366 -13.820
  287   1HZ   LYS  38          1HZ       LYS  38   1.888   7.205 -12.285
  288   2HZ   LYS  38          2HZ       LYS  38   3.321   6.438 -12.361
  289   3HZ   LYS  38          3HZ       LYS  38   2.648   7.013 -13.747
  290    H    LYS  39           H        LYS  39  -0.676  -0.573  -8.911
  291    HA   LYS  39           HA       LYS  39  -2.653   0.568  -7.013
  292   1HB   LYS  39          2HB       LYS  39  -3.130  -1.918  -8.724
  293   2HB   LYS  39          3HB       LYS  39  -4.016  -1.506  -7.266
  294   1HG   LYS  39          2HG       LYS  39  -4.495   0.795  -8.457
  295   2HG   LYS  39          3HG       LYS  39  -3.891   0.016  -9.905
  296   1HD   LYS  39          2HD       LYS  39  -6.370  -0.014  -9.712
  297   2HD   LYS  39          3HD       LYS  39  -5.657  -1.619  -9.893
  298   1HE   LYS  39          2HE       LYS  39  -7.549  -1.401  -8.176
  299   2HE   LYS  39          3HE       LYS  39  -6.095  -2.227  -7.648
  300   1HZ   LYS  39          1HZ       LYS  39  -6.727   0.605  -6.995
  301   2HZ   LYS  39          2HZ       LYS  39  -6.847  -0.776  -6.016
  302   3HZ   LYS  39          3HZ       LYS  39  -5.413  -0.245  -6.468
  303    H    VAL  40           H        VAL  40  -2.856  -0.594  -5.007
  304    HA   VAL  40           HA       VAL  40  -0.903  -2.727  -4.509
  305    HB   VAL  40           HB       VAL  40  -1.375  -0.026  -3.215
  306   1HG1  VAL  40          1HG1      VAL  40  -0.213  -0.850  -1.179
  307   2HG1  VAL  40          2HG1      VAL  40  -1.867  -1.430  -1.458
  308   3HG1  VAL  40          3HG1      VAL  40  -0.477  -2.515  -1.779
  309   1HG2  VAL  40          1HG2      VAL  40   0.537  -0.356  -4.760
  310   2HG2  VAL  40          2HG2      VAL  40   1.052   0.052  -3.116
  311   3HG2  VAL  40          3HG2      VAL  40   1.165  -1.629  -3.687
  312    H    CYS  41           H        CYS  41  -1.875  -4.337  -3.461
  313    HA   CYS  41           HA       CYS  41  -4.493  -3.834  -2.125
  314   1HB   CYS  41          2HB       CYS  41  -5.394  -5.893  -2.859
  315   2HB   CYS  41          3HB       CYS  41  -4.863  -5.025  -4.308
  316    HG   CYS  41           HG       CYS  41  -2.457  -6.305  -4.252
  317    H    ILE  42           H        ILE  42  -4.504  -4.585  -0.036
  318    HA   ILE  42           HA       ILE  42  -1.954  -5.877   0.847
  319    HB   ILE  42           HB       ILE  42  -3.427  -3.776   2.404
  320   1HG1  ILE  42          2HG1      ILE  42  -1.130  -3.415   0.422
  321   2HG1  ILE  42          3HG1      ILE  42  -2.752  -2.711   0.318
  322   1HG2  ILE  42          1HG2      ILE  42  -0.566  -4.811   2.535
  323   2HG2  ILE  42          2HG2      ILE  42  -1.294  -3.643   3.642
  324   3HG2  ILE  42          3HG2      ILE  42  -1.873  -5.305   3.629
  325   1HD1  ILE  42          1HD1      ILE  42  -1.374  -0.957   1.070
  326   2HD1  ILE  42          2HD1      ILE  42  -2.245  -1.501   2.516
  327   3HD1  ILE  42          3HD1      ILE  42  -0.552  -1.982   2.250
  328    H    GLU  43           H        GLU  43  -2.123  -7.594   2.057
  329    HA   GLU  43           HA       GLU  43  -4.722  -8.322   3.328
  330   1HB   GLU  43          2HB       GLU  43  -3.677  -9.705   1.315
  331   2HB   GLU  43          3HB       GLU  43  -2.630 -10.371   2.562
  332   1HG   GLU  43          2HG       GLU  43  -5.664 -10.345   2.939
  333   2HG   GLU  43          3HG       GLU  43  -4.889 -11.544   1.913
  334    H    SER  44           H        SER  44  -4.535  -8.315   5.586
  335    HA   SER  44           HA       SER  44  -2.363  -9.589   6.796
  336   1HB   SER  44          2HB       SER  44  -1.306  -7.322   6.556
  337   2HB   SER  44          3HB       SER  44  -2.676  -6.626   7.431
  338    HG   SER  44           HG       SER  44  -0.582  -8.294   8.365
  339    H    GLU  45           H        GLU  45  -2.703  -9.365   9.224
  340    HA   GLU  45           HA       GLU  45  -5.547  -9.268  10.072
  341   1HB   GLU  45          2HB       GLU  45  -2.973  -9.772  11.637
  342   2HB   GLU  45          3HB       GLU  45  -4.616  -9.811  12.289
  343   1HG   GLU  45          2HG       GLU  45  -5.197 -11.676  10.774
  344   2HG   GLU  45          3HG       GLU  45  -3.557 -11.660  10.095
  345    H    HIS  46           H        HIS  46  -2.723  -7.249   9.636
  346    HA   HIS  46           HA       HIS  46  -3.220  -5.265  11.654
  347   1HB   HIS  46          2HB       HIS  46  -2.038  -4.928   8.866
  348   2HB   HIS  46          3HB       HIS  46  -1.999  -3.731  10.150
  349    HD1  HIS  46           1HD      HIS  46  -0.683  -4.916  12.538
  350    HD2  HIS  46           2HD      HIS  46   0.308  -5.887   8.577
  351    HE1  HIS  46           1HE      HIS  46   1.764  -5.657  12.542
  352    H    SER  47           H        SER  47  -4.958  -3.923  11.801
  353    HA   SER  47           HA       SER  47  -7.132  -4.090  10.066
  354   1HB   SER  47          2HB       SER  47  -7.206  -3.222  12.423
  355   2HB   SER  47          3HB       SER  47  -6.503  -1.701  11.833
  356    HG   SER  47           HG       SER  47  -9.010  -2.849  11.201
  357    H    MET  48           H        MET  48  -7.939  -2.938   8.412
  358    HA   MET  48           HA       MET  48  -6.596  -1.790   6.399
  359   1HB   MET  48          2HB       MET  48  -9.039  -2.429   6.655
  360   2HB   MET  48          3HB       MET  48  -9.313  -0.881   7.464
  361   1HG   MET  48          2HG       MET  48  -8.668   0.309   5.434
  362   2HG   MET  48          3HG       MET  48  -8.100  -1.202   4.710
  363   1HE   MET  48          1HE       MET  48 -11.234   0.873   5.808
  364   2HE   MET  48          2HE       MET  48 -12.569  -0.209   5.350
  365   3HE   MET  48          3HE       MET  48 -11.515  -0.637   6.715
  366    H    ASP  49           H        ASP  49  -7.954  -0.022   9.235
  367    HA   ASP  49           HA       ASP  49  -7.090   2.527   8.260
  368   1HB   ASP  49          2HB       ASP  49  -8.943   2.376   9.847
  369   2HB   ASP  49          3HB       ASP  49  -7.826   1.799  11.104
  370    H    THR  50           H        THR  50  -5.696   0.293  10.581
  371    HA   THR  50           HA       THR  50  -3.473   1.804  11.407
  372    HB   THR  50           HB       THR  50  -3.429  -1.209  10.930
  373    HG1  THR  50           1HG      THR  50  -4.210  -1.119  13.196
  374   1HG2  THR  50          1HG2      THR  50  -2.081   0.568  13.013
  375   2HG2  THR  50          2HG2      THR  50  -1.948  -1.200  12.900
  376   3HG2  THR  50          3HG2      THR  50  -1.273  -0.182  11.620
  377    H    LEU  51           H        LEU  51  -3.842  -0.375   8.564
  378    HA   LEU  51           HA       LEU  51  -1.242   0.152   7.453
  379   1HB   LEU  51          2HB       LEU  51  -3.834  -0.456   5.974
  380   2HB   LEU  51          3HB       LEU  51  -2.211  -0.469   5.274
  381    HG   LEU  51           HG       LEU  51  -3.040  -2.236   7.639
  382   1HD1  LEU  51          1HD1      LEU  51  -3.328  -4.055   5.951
  383   2HD1  LEU  51          2HD1      LEU  51  -4.537  -2.769   5.829
  384   3HD1  LEU  51          3HD1      LEU  51  -3.204  -2.829   4.665
  385   1HD2  LEU  51          1HD2      LEU  51  -0.605  -2.003   7.338
  386   2HD2  LEU  51          2HD2      LEU  51  -1.121  -3.627   6.870
  387   3HD2  LEU  51          3HD2      LEU  51  -0.757  -2.419   5.621
  388    H    LEU  52           H        LEU  52  -4.419   1.601   6.542
  389    HA   LEU  52           HA       LEU  52  -3.690   3.542   4.825
  390   1HB   LEU  52          2HB       LEU  52  -5.913   2.894   6.377
  391   2HB   LEU  52          3HB       LEU  52  -5.632   4.556   6.839
  392    HG   LEU  52           HG       LEU  52  -5.864   3.546   3.965
  393   1HD1  LEU  52          1HD1      LEU  52  -7.836   2.926   5.188
  394   2HD1  LEU  52          2HD1      LEU  52  -7.989   4.553   5.885
  395   3HD1  LEU  52          3HD1      LEU  52  -8.230   4.309   4.140
  396   1HD2  LEU  52          1HD2      LEU  52  -6.225   6.295   5.201
  397   2HD2  LEU  52          2HD2      LEU  52  -4.795   5.778   4.270
  398   3HD2  LEU  52          3HD2      LEU  52  -6.379   5.903   3.473
  399    H    ALA  53           H        ALA  53  -3.868   4.151   8.340
  400    HA   ALA  53           HA       ALA  53  -2.795   6.747   8.431
  401   1HB   ALA  53          1HB       ALA  53  -2.675   4.519  10.508
  402   2HB   ALA  53          2HB       ALA  53  -2.454   6.254  10.821
  403   3HB   ALA  53          3HB       ALA  53  -4.030   5.642  10.276
  404    H    THR  54           H        THR  54  -1.121   3.609   8.437
  405    HA   THR  54           HA       THR  54   1.482   4.784   8.925
  406    HB   THR  54           HB       THR  54   0.746   2.086   7.714
  407    HG1  THR  54           1HG      THR  54  -0.013   2.244   9.780
  408   1HG2  THR  54          1HG2      THR  54   3.016   2.822   7.170
  409   2HG2  THR  54          2HG2      THR  54   3.348   3.128   8.892
  410   3HG2  THR  54          3HG2      THR  54   3.023   1.478   8.312
  411    H    LEU  55           H        LEU  55  -0.002   3.383   5.951
  412    HA   LEU  55           HA       LEU  55   2.179   4.186   4.336
  413   1HB   LEU  55          2HB       LEU  55   0.953   3.461   2.463
  414   2HB   LEU  55          3HB       LEU  55   1.076   2.332   3.776
  415    HG   LEU  55           HG       LEU  55  -1.323   2.920   4.377
  416   1HD1  LEU  55          1HD1      LEU  55  -0.894   4.304   1.766
  417   2HD1  LEU  55          2HD1      LEU  55  -2.528   3.729   2.228
  418   3HD1  LEU  55          3HD1      LEU  55  -1.673   4.916   3.232
  419   1HD2  LEU  55          1HD2      LEU  55  -0.629   1.616   1.720
  420   2HD2  LEU  55          2HD2      LEU  55  -0.539   0.835   3.314
  421   3HD2  LEU  55          3HD2      LEU  55  -2.111   1.328   2.666
  422    H    LYS  56           H        LYS  56  -0.773   5.842   5.034
  423    HA   LYS  56           HA       LYS  56  -0.840   7.973   3.347
  424   1HB   LYS  56          2HB       LYS  56  -1.283   7.626   6.295
  425   2HB   LYS  56          3HB       LYS  56  -1.113   9.289   5.785
  426   1HG   LYS  56          2HG       LYS  56  -2.959   9.221   4.324
  427   2HG   LYS  56          3HG       LYS  56  -3.062   7.448   4.381
  428   1HD   LYS  56          2HD       LYS  56  -3.812   7.410   6.594
  429   2HD   LYS  56          3HD       LYS  56  -3.298   9.074   6.934
  430   1HE   LYS  56          2HE       LYS  56  -5.115   9.996   5.649
  431   2HE   LYS  56          3HE       LYS  56  -5.511   8.432   4.935
  432   1HZ   LYS  56          1HZ       LYS  56  -7.038   9.002   6.689
  433   2HZ   LYS  56          2HZ       LYS  56  -6.192   7.670   7.132
  434   3HZ   LYS  56          3HZ       LYS  56  -5.827   9.130   7.789
  435    H    LYS  57           H        LYS  57   1.584   7.479   5.933
  436    HA   LYS  57           HA       LYS  57   2.680  10.120   5.786
  437   1HB   LYS  57          2HB       LYS  57   3.699   7.509   6.922
  438   2HB   LYS  57          3HB       LYS  57   4.569   9.051   7.094
  439   1HG   LYS  57          2HG       LYS  57   2.556  10.031   8.169
  440   2HG   LYS  57          3HG       LYS  57   1.721   8.476   8.012
  441   1HD   LYS  57          2HD       LYS  57   4.354   8.744   9.516
  442   2HD   LYS  57          3HD       LYS  57   2.791   9.085  10.284
  443   1HE   LYS  57          2HE       LYS  57   1.960   6.844   9.728
  444   2HE   LYS  57          3HE       LYS  57   3.493   6.426   8.940
  445   1HZ   LYS  57          1HZ       LYS  57   3.354   5.568  11.158
  446   2HZ   LYS  57          2HZ       LYS  57   4.566   6.676  11.079
  447   3HZ   LYS  57          3HZ       LYS  57   3.132   7.065  11.795
  448    H    THR  58           H        THR  58   3.001   7.589   3.468
  449    HA   THR  58           HA       THR  58   5.631   8.319   2.489
  450    HB   THR  58           HB       THR  58   4.891   7.364   0.376
  451    HG1  THR  58           1HG      THR  58   2.366   6.897   1.578
  452   1HG2  THR  58          1HG2      THR  58   4.377   5.082   1.136
  453   2HG2  THR  58          2HG2      THR  58   5.681   5.837   2.082
  454   3HG2  THR  58          3HG2      THR  58   4.051   5.705   2.769
  455    H    GLY  59           H        GLY  59   2.415   9.780   2.306
  456   1HA   GLY  59          2HA       GLY  59   1.638  11.654   1.315
  457   2HA   GLY  59          3HA       GLY  59   3.309  12.256   1.289
  458    H    LYS  60           H        LYS  60   2.103   9.310  -0.370
  459    HA   LYS  60           HA       LYS  60   2.285  10.717  -3.011
  460   1HB   LYS  60          2HB       LYS  60   2.290   7.722  -2.547
  461   2HB   LYS  60          3HB       LYS  60   2.604   8.584  -4.040
  462   1HG   LYS  60          2HG       LYS  60   4.361   8.057  -1.677
  463   2HG   LYS  60          3HG       LYS  60   4.699   7.838  -3.377
  464   1HD   LYS  60          2HD       LYS  60   4.883  10.327  -1.686
  465   2HD   LYS  60          3HD       LYS  60   6.148   9.529  -2.573
  466   1HE   LYS  60          2HE       LYS  60   5.763  10.702  -4.473
  467   2HE   LYS  60          3HE       LYS  60   4.024  10.476  -4.400
  468   1HZ   LYS  60          1HZ       LYS  60   3.974  12.229  -2.677
  469   2HZ   LYS  60          2HZ       LYS  60   5.572  12.494  -2.910
  470   3HZ   LYS  60          3HZ       LYS  60   4.513  12.773  -4.139
  471    H    THR  61           H        THR  61   0.639   9.811  -4.613
  472    HA   THR  61           HA       THR  61  -1.945  10.164  -3.611
  473    HB   THR  61           HB       THR  61  -1.215   8.950  -6.284
  474    HG1  THR  61           1HG      THR  61  -0.738  11.662  -5.655
  475   1HG2  THR  61          1HG2      THR  61  -3.014  11.292  -5.492
  476   2HG2  THR  61          2HG2      THR  61  -2.790  10.651  -7.136
  477   3HG2  THR  61          3HG2      THR  61  -3.573   9.652  -5.897
  478    H    VAL  62           H        VAL  62  -0.922   7.933  -2.190
  479    HA   VAL  62           HA       VAL  62  -2.136   5.477  -3.290
  480    HB   VAL  62           HB       VAL  62  -0.109   5.129  -2.208
  481   1HG1  VAL  62          1HG1      VAL  62  -1.124   6.526   0.299
  482   2HG1  VAL  62          2HG1      VAL  62   0.367   5.586   0.151
  483   3HG1  VAL  62          3HG1      VAL  62   0.184   7.068  -0.772
  484   1HG2  VAL  62          1HG2      VAL  62  -2.271   4.224  -0.272
  485   2HG2  VAL  62          2HG2      VAL  62  -1.925   3.470  -1.835
  486   3HG2  VAL  62          3HG2      VAL  62  -0.693   3.468  -0.566
  487    H    SER  63           H        SER  63  -4.292   5.989  -3.550
  488    HA   SER  63           HA       SER  63  -5.812   6.990  -1.187
  489   1HB   SER  63          2HB       SER  63  -6.298   7.861  -3.482
  490   2HB   SER  63          3HB       SER  63  -6.772   6.228  -3.967
  491    HG   SER  63           HG       SER  63  -7.990   7.964  -2.084
  492    H    TYR  64           H        TYR  64  -7.823   5.640  -0.677
  493    HA   TYR  64           HA       TYR  64  -7.167   2.717  -0.582
  494   1HB   TYR  64          2HB       TYR  64  -6.804   3.573   1.621
  495   2HB   TYR  64          3HB       TYR  64  -8.236   4.599   1.540
  496    HD1  TYR  64           HD1      TYR  64  -7.306   0.976   1.210
  497    HD2  TYR  64           HD2      TYR  64 -10.281   3.845   2.416
  498    HE1  TYR  64           HE1      TYR  64  -9.020  -0.757   1.103
  499    HE2  TYR  64           HE2      TYR  64 -11.995   2.070   2.392
  500    HH   TYR  64           HH       TYR  64 -11.217  -1.217   1.240
  501    H    LEU  65           H        LEU  65  -8.747   1.484  -1.579
  502    HA   LEU  65           HA       LEU  65 -11.530   2.360  -1.640
  503   1HB   LEU  65          2HB       LEU  65 -11.513   2.279  -4.197
  504   2HB   LEU  65          3HB       LEU  65 -11.095   3.739  -3.334
  505    HG   LEU  65           HG       LEU  65  -9.720   3.286  -5.293
  506   1HD1  LEU  65          1HD1      LEU  65  -9.003   4.640  -3.219
  507   2HD1  LEU  65          2HD1      LEU  65  -7.772   3.345  -3.107
  508   3HD1  LEU  65          3HD1      LEU  65  -7.908   4.336  -4.554
  509   1HD2  LEU  65          1HD2      LEU  65  -8.450   1.005  -3.791
  510   2HD2  LEU  65          2HD2      LEU  65  -9.414   0.901  -5.288
  511   3HD2  LEU  65          3HD2      LEU  65  -7.865   1.734  -5.288
  512    H    GLY  66           H        GLY  66 -11.478   0.134  -0.482
  513   1HA   GLY  66          2HA       GLY  66 -13.343  -1.313  -1.284
  514   2HA   GLY  66          3HA       GLY  66 -12.303  -1.812  -2.626
  515    H    LEU  67           H        LEU  67 -13.197  -3.883  -1.144
  516    HA   LEU  67           HA       LEU  67 -10.739  -4.889  -0.186
  517   1HB   LEU  67          2HB       LEU  67 -11.319  -5.520   2.043
  518   2HB   LEU  67          3HB       LEU  67 -11.514  -3.773   1.911
  519    HG   LEU  67           HG       LEU  67 -13.773  -5.830   1.899
  520   1HD1  LEU  67          1HD1      LEU  67 -12.829  -3.882   4.044
  521   2HD1  LEU  67          2HD1      LEU  67 -14.230  -4.967   4.156
  522   3HD1  LEU  67          3HD1      LEU  67 -12.597  -5.644   4.059
  523   1HD2  LEU  67          1HD2      LEU  67 -15.219  -3.796   2.310
  524   2HD2  LEU  67          2HD2      LEU  67 -13.831  -2.775   1.885
  525   3HD2  LEU  67          3HD2      LEU  67 -14.554  -3.873   0.682
  526    H    GLU  68           H        GLU  68 -10.727  -7.183  -0.083
  527    HA   GLU  68           HA       GLU  68 -13.132  -8.708  -0.754
  528   1HB   GLU  68          2HB       GLU  68 -12.292  -7.706  -2.904
  529   2HB   GLU  68          3HB       GLU  68 -10.735  -8.464  -2.630
  530   1HG   GLU  68          2HG       GLU  68 -12.039 -10.723  -2.546
  531   2HG   GLU  68          3HG       GLU  68 -13.413  -9.810  -3.183
  Start of MODEL   30
    1   1H    MET   1           H1       MET   1 -10.647  -7.403   4.495
    2   2H    MET   1           H2       MET   1 -11.949  -6.848   5.157
    3   3H    MET   1           H3       MET   1 -10.585  -5.835   5.001
    4    HA   MET   1           HA       MET   1  -9.865  -6.325   6.925
    5   1HB   MET   1          2HB       MET   1 -12.040  -6.663   7.715
    6   2HB   MET   1          3HB       MET   1 -12.070  -8.359   7.280
    7   1HG   MET   1          2HG       MET   1 -10.213  -8.794   8.861
    8   2HG   MET   1          3HG       MET   1 -10.022  -7.063   9.146
    9   1HE   MET   1          1HE       MET   1 -10.119  -9.117  11.459
   10   2HE   MET   1          2HE       MET   1  -9.992  -7.355  11.695
   11   3HE   MET   1          3HE       MET   1 -11.208  -8.287  12.602
   12    HA   PRO   2           HA       PRO   2  -7.920 -10.744   5.728
   13   1HB   PRO   2          2HB       PRO   2  -9.927 -10.942   3.444
   14   2HB   PRO   2          3HB       PRO   2  -8.910 -12.232   4.139
   15   1HG   PRO   2          2HG       PRO   2 -11.477 -11.971   4.946
   16   2HG   PRO   2          3HG       PRO   2 -10.196 -12.223   6.170
   17   1HD   PRO   2          2HD       PRO   2 -11.607  -9.672   5.443
   18   2HD   PRO   2          3HD       PRO   2 -11.025 -10.275   7.030
   19    H    LYS   3           H        LYS   3  -9.482  -8.733   3.124
   20    HA   LYS   3           HA       LYS   3  -6.773  -8.001   2.171
   21   1HB   LYS   3          2HB       LYS   3  -7.318  -9.880   0.854
   22   2HB   LYS   3          3HB       LYS   3  -8.994  -9.392   0.661
   23   1HG   LYS   3          2HG       LYS   3  -8.329  -7.535  -0.795
   24   2HG   LYS   3          3HG       LYS   3  -6.613  -7.949  -0.580
   25   1HD   LYS   3          2HD       LYS   3  -6.879 -10.071  -1.666
   26   2HD   LYS   3          3HD       LYS   3  -8.642  -9.952  -1.672
   27   1HE   LYS   3          2HE       LYS   3  -6.859  -7.963  -3.152
   28   2HE   LYS   3          3HE       LYS   3  -7.474  -9.449  -3.896
   29   1HZ   LYS   3          1HZ       LYS   3  -8.884  -7.471  -4.320
   30   2HZ   LYS   3          2HZ       LYS   3  -9.714  -8.686  -3.523
   31   3HZ   LYS   3          3HZ       LYS   3  -9.274  -7.411  -2.720
   32    H    HIS   4           H        HIS   4  -6.583  -6.117   1.012
   33    HA   HIS   4           HA       HIS   4  -8.904  -4.297   0.814
   34   1HB   HIS   4          2HB       HIS   4  -6.269  -3.626   2.190
   35   2HB   HIS   4          3HB       HIS   4  -7.620  -2.505   1.917
   36    HD1  HIS   4           1HD      HIS   4  -6.205  -4.543   4.600
   37    HD2  HIS   4           2HD      HIS   4 -10.053  -3.708   3.131
   38    HE1  HIS   4           1HE      HIS   4  -7.820  -5.108   6.469
   39    H    GLU   5           H        GLU   5  -8.635  -2.785  -0.928
   40    HA   GLU   5           HA       GLU   5  -6.140  -3.041  -2.556
   41   1HB   GLU   5          2HB       GLU   5  -9.036  -2.678  -3.410
   42   2HB   GLU   5          3HB       GLU   5  -7.643  -2.498  -4.472
   43   1HG   GLU   5          2HG       GLU   5  -7.004  -4.886  -3.577
   44   2HG   GLU   5          3HG       GLU   5  -8.685  -4.972  -3.042
   45    H    PHE   6           H        PHE   6  -5.280  -1.226  -3.491
   46    HA   PHE   6           HA       PHE   6  -6.397   1.410  -2.764
   47   1HB   PHE   6          2HB       PHE   6  -3.497   0.546  -2.314
   48   2HB   PHE   6          3HB       PHE   6  -4.196   2.072  -1.825
   49    HD1  PHE   6           1HD      PHE   6  -4.077  -1.585  -1.167
   50    HD2  PHE   6           2HD      PHE   6  -5.295   2.259   0.394
   51    HE1  PHE   6           1HE      PHE   6  -4.642  -2.632   0.981
   52    HE2  PHE   6           2HE      PHE   6  -5.945   1.168   2.512
   53    HZ   PHE   6           HZ       PHE   6  -5.548  -1.252   2.855
   54    H    SER   7           H        SER   7  -5.878   3.014  -4.290
   55    HA   SER   7           HA       SER   7  -4.245   2.156  -6.633
   56   1HB   SER   7          2HB       SER   7  -6.388   3.234  -7.193
   57   2HB   SER   7          3HB       SER   7  -5.816   4.715  -6.385
   58    HG   SER   7           HG       SER   7  -4.228   3.441  -8.381
   59    H    VAL   8           H        VAL   8  -2.256   3.117  -7.014
   60    HA   VAL   8           HA       VAL   8  -1.104   4.829  -4.877
   61    HB   VAL   8           HB       VAL   8   0.017   2.240  -6.067
   62   1HG1  VAL   8          1HG1      VAL   8   1.756   2.513  -4.416
   63   2HG1  VAL   8          2HG1      VAL   8   1.611   4.084  -5.233
   64   3HG1  VAL   8          3HG1      VAL   8   0.893   3.864  -3.632
   65   1HG2  VAL   8          1HG2      VAL   8  -0.260   1.387  -3.694
   66   2HG2  VAL   8          2HG2      VAL   8  -1.349   2.736  -3.387
   67   3HG2  VAL   8          3HG2      VAL   8  -1.770   1.529  -4.618
   68    H    ASP   9           H        ASP   9  -0.530   6.641  -6.098
   69    HA   ASP   9           HA       ASP   9   0.225   6.541  -8.871
   70   1HB   ASP   9          2HB       ASP   9  -0.684   8.513  -7.776
   71   2HB   ASP   9          3HB       ASP   9   0.703   8.553  -6.666
   72    H    MET  10           H        MET  10   1.718   4.660  -8.682
   73    HA   MET  10           HA       MET  10   4.394   5.189  -7.621
   74   1HB   MET  10          2HB       MET  10   3.266   2.950  -9.308
   75   2HB   MET  10          3HB       MET  10   4.986   3.083  -8.879
   76   1HG   MET  10          2HG       MET  10   4.450   3.200  -6.493
   77   2HG   MET  10          3HG       MET  10   2.722   3.096  -6.855
   78   1HE   MET  10          1HE       MET  10   2.348   0.849  -8.884
   79   2HE   MET  10          2HE       MET  10   2.163  -0.544  -7.795
   80   3HE   MET  10          3HE       MET  10   1.423   1.006  -7.375
   81    H    THR  11           H        THR  11   4.586   7.233  -8.507
   82    HA   THR  11           HA       THR  11   4.483   7.858 -11.186
   83    HB   THR  11           HB       THR  11   6.215   9.457  -9.302
   84    HG1  THR  11           1HG      THR  11   3.444   9.042  -8.915
   85   1HG2  THR  11          1HG2      THR  11   3.753  10.166 -10.962
   86   2HG2  THR  11          2HG2      THR  11   4.796  11.303 -10.086
   87   3HG2  THR  11          3HG2      THR  11   5.441  10.400 -11.475
   88    H    CYS  12           H        CYS  12   7.223   6.679  -9.232
   89    HA   CYS  12           HA       CYS  12   8.828   6.352 -11.672
   90   1HB   CYS  12          2HB       CYS  12   9.716   8.449 -10.830
   91   2HB   CYS  12          3HB       CYS  12   9.800   7.826  -9.166
   92    HG   CYS  12           HG       CYS  12  11.620   6.177  -9.440
   93    H    GLY  13           H        GLY  13  10.278   4.527 -11.334
   94   1HA   GLY  13          2HA       GLY  13   9.115   2.319 -10.257
   95   2HA   GLY  13          3HA       GLY  13  10.869   2.467 -10.456
   96    H    GLY  14           H        GLY  14  11.733   4.127  -8.570
   97   1HA   GLY  14          2HA       GLY  14  11.736   2.618  -6.233
   98   2HA   GLY  14          3HA       GLY  14  12.303   4.298  -6.350
   99    H    CYS  15           H        CYS  15   9.205   4.827  -7.176
  100    HA   CYS  15           HA       CYS  15   8.261   5.566  -4.594
  101   1HB   CYS  15          2HB       CYS  15   7.397   6.577  -6.603
  102   2HB   CYS  15          3HB       CYS  15   6.641   5.033  -7.089
  103    HG   CYS  15           HG       CYS  15   6.276   6.305  -4.087
  104    H    ALA  16           H        ALA  16   8.018   2.612  -6.599
  105    HA   ALA  16           HA       ALA  16   6.218   1.178  -4.891
  106   1HB   ALA  16          1HB       ALA  16   8.348   0.069  -6.780
  107   2HB   ALA  16          2HB       ALA  16   6.937  -0.787  -6.142
  108   3HB   ALA  16          3HB       ALA  16   6.713   0.562  -7.276
  109    H    GLU  17           H        GLU  17   9.813   1.456  -4.982
  110    HA   GLU  17           HA       GLU  17  10.296  -0.356  -2.824
  111   1HB   GLU  17          2HB       GLU  17  11.841   2.061  -3.853
  112   2HB   GLU  17          3HB       GLU  17  12.199   1.336  -2.307
  113   1HG   GLU  17          2HG       GLU  17  12.377  -0.925  -3.546
  114   2HG   GLU  17          3HG       GLU  17  12.473   0.062  -5.019
  115    H    ALA  18           H        ALA  18   9.510   3.157  -2.843
  116    HA   ALA  18           HA       ALA  18   9.821   3.542  -0.050
  117   1HB   ALA  18          1HB       ALA  18   7.797   4.955  -1.841
  118   2HB   ALA  18          2HB       ALA  18   8.429   5.516  -0.287
  119   3HB   ALA  18          3HB       ALA  18   9.515   5.392  -1.689
  120    H    VAL  19           H        VAL  19   6.906   2.669  -1.928
  121    HA   VAL  19           HA       VAL  19   5.179   2.363   0.296
  122    HB   VAL  19           HB       VAL  19   5.094   1.104  -2.467
  123   1HG1  VAL  19          1HG1      VAL  19   2.663   0.810  -1.971
  124   2HG1  VAL  19          2HG1      VAL  19   3.678  -0.245  -0.978
  125   3HG1  VAL  19          3HG1      VAL  19   2.965   1.229  -0.279
  126   1HG2  VAL  19          1HG2      VAL  19   3.589   3.471  -1.243
  127   2HG2  VAL  19          2HG2      VAL  19   4.963   3.633  -2.347
  128   3HG2  VAL  19          3HG2      VAL  19   3.471   2.887  -2.913
  129    H    SER  20           H        SER  20   7.089  -0.151  -1.473
  130    HA   SER  20           HA       SER  20   6.379  -2.365   0.090
  131   1HB   SER  20          2HB       SER  20   7.752  -2.407  -2.011
  132   2HB   SER  20          3HB       SER  20   9.102  -1.678  -1.134
  133    HG   SER  20           HG       SER  20   9.433  -3.855  -1.220
  134    H    ARG  21           H        ARG  21   9.071  -0.078   0.652
  135    HA   ARG  21           HA       ARG  21  10.020  -1.332   2.991
  136   1HB   ARG  21          2HB       ARG  21  10.422   1.441   1.832
  137   2HB   ARG  21          3HB       ARG  21  11.335   0.806   3.216
  138   1HG   ARG  21          2HG       ARG  21  12.246  -1.013   1.922
  139   2HG   ARG  21          3HG       ARG  21  11.144  -0.755   0.598
  140   1HD   ARG  21          2HD       ARG  21  13.169  -0.033  -0.188
  141   2HD   ARG  21          3HD       ARG  21  12.216   1.433   0.084
  142    HE   ARG  21           HE       ARG  21  13.581   1.249   2.410
  143   1HH1  ARG  21          2HH2      ARG  21  14.793   0.972  -0.981
  144   2HH1  ARG  21          1HH2      ARG  21  16.272   1.760  -0.628
  145   1HH2  ARG  21          2HH1      ARG  21  15.624   2.227   2.838
  146   2HH2  ARG  21          1HH1      ARG  21  16.782   2.431   1.564
  147    H    VAL  22           H        VAL  22   7.766   1.595   2.699
  148    HA   VAL  22           HA       VAL  22   7.520   1.815   5.470
  149    HB   VAL  22           HB       VAL  22   6.880   3.446   3.589
  150   1HG1  VAL  22          1HG1      VAL  22   5.163   2.021   2.489
  151   2HG1  VAL  22          2HG1      VAL  22   4.177   2.113   3.964
  152   3HG1  VAL  22          3HG1      VAL  22   4.528   3.569   3.010
  153   1HG2  VAL  22          1HG2      VAL  22   5.142   3.033   6.018
  154   2HG2  VAL  22          2HG2      VAL  22   6.678   3.941   5.917
  155   3HG2  VAL  22          3HG2      VAL  22   5.224   4.530   5.058
  156    H    LEU  23           H        LEU  23   5.495  -0.127   3.125
  157    HA   LEU  23           HA       LEU  23   3.759  -1.138   5.046
  158   1HB   LEU  23          2HB       LEU  23   4.699  -2.057   2.318
  159   2HB   LEU  23          3HB       LEU  23   3.767  -3.155   3.314
  160    HG   LEU  23           HG       LEU  23   2.390  -1.934   1.688
  161   1HD1  LEU  23          1HD1      LEU  23   0.582  -1.448   3.328
  162   2HD1  LEU  23          2HD1      LEU  23   1.372  -3.012   3.619
  163   3HD1  LEU  23          3HD1      LEU  23   1.745  -1.608   4.644
  164   1HD2  LEU  23          1HD2      LEU  23   3.420   0.301   1.932
  165   2HD2  LEU  23          2HD2      LEU  23   1.674   0.329   2.200
  166   3HD2  LEU  23          3HD2      LEU  23   2.781   0.383   3.591
  167    H    ASN  24           H        ASN  24   6.999  -2.474   4.089
  168    HA   ASN  24           HA       ASN  24   6.864  -4.712   5.854
  169   1HB   ASN  24          2HB       ASN  24   9.131  -3.043   4.690
  170   2HB   ASN  24          3HB       ASN  24   9.393  -4.250   5.937
  171   1HD2  ASN  24          1HD2      ASN  24   8.240  -3.833   2.616
  172   2HD2  ASN  24          2HD2      ASN  24   8.472  -5.507   2.150
  173    H    LYS  25           H        LYS  25   8.108  -1.384   6.331
  174    HA   LYS  25           HA       LYS  25   9.052  -1.656   8.946
  175   1HB   LYS  25          2HB       LYS  25   7.974   0.667   7.322
  176   2HB   LYS  25          3HB       LYS  25   8.336   0.918   9.021
  177   1HG   LYS  25          2HG       LYS  25  10.377  -0.286   7.112
  178   2HG   LYS  25          3HG       LYS  25  10.186   1.461   7.333
  179   1HD   LYS  25          2HD       LYS  25  10.576   1.231   9.769
  180   2HD   LYS  25          3HD       LYS  25  10.814  -0.513   9.583
  181   1HE   LYS  25          2HE       LYS  25  12.749  -0.085   8.065
  182   2HE   LYS  25          3HE       LYS  25  12.530   1.660   8.292
  183   1HZ   LYS  25          1HZ       LYS  25  13.179  -0.275  10.422
  184   2HZ   LYS  25          2HZ       LYS  25  14.226   0.785   9.732
  185   3HZ   LYS  25          3HZ       LYS  25  12.974   1.344  10.636
  186    H    LEU  26           H        LEU  26   5.743  -1.001   7.871
  187    HA   LEU  26           HA       LEU  26   4.503  -0.507  10.278
  188   1HB   LEU  26          2HB       LEU  26   3.532  -0.799   7.911
  189   2HB   LEU  26          3HB       LEU  26   3.435  -2.510   8.228
  190    HG   LEU  26           HG       LEU  26   1.429  -0.834   8.548
  191   1HD1  LEU  26          1HD1      LEU  26   0.293  -2.448   9.917
  192   2HD1  LEU  26          2HD1      LEU  26   1.288  -3.275   8.708
  193   3HD1  LEU  26          3HD1      LEU  26   1.833  -3.197  10.402
  194   1HD2  LEU  26          1HD2      LEU  26   0.937  -0.200  10.807
  195   2HD2  LEU  26          2HD2      LEU  26   2.381  -0.992  11.436
  196   3HD2  LEU  26          3HD2      LEU  26   2.529   0.464  10.438
  197    H    GLY  27           H        GLY  27   5.586  -3.679   9.044
  198   1HA   GLY  27          2HA       GLY  27   6.175  -4.768  11.490
  199   2HA   GLY  27          3HA       GLY  27   4.443  -5.113  11.312
  200    H    GLY  28           H        GLY  28   3.753  -6.598   9.729
  201   1HA   GLY  28          2HA       GLY  28   5.728  -8.175   8.185
  202   2HA   GLY  28          3HA       GLY  28   4.944  -8.980   9.562
  203    H    VAL  29           H        VAL  29   3.781  -6.579   7.231
  204    HA   VAL  29           HA       VAL  29   1.271  -8.024   6.785
  205    HB   VAL  29           HB       VAL  29   1.575  -5.513   7.144
  206   1HG1  VAL  29          1HG1      VAL  29   2.366  -5.435   4.228
  207   2HG1  VAL  29          2HG1      VAL  29   2.374  -4.116   5.415
  208   3HG1  VAL  29          3HG1      VAL  29   3.601  -5.386   5.506
  209   1HG2  VAL  29          1HG2      VAL  29  -0.525  -6.298   6.331
  210   2HG2  VAL  29          2HG2      VAL  29  -0.074  -4.879   5.367
  211   3HG2  VAL  29          3HG2      VAL  29   0.098  -6.497   4.678
  212    H    LYS  30           H        LYS  30   0.588  -8.776   4.654
  213    HA   LYS  30           HA       LYS  30   2.768  -8.968   2.640
  214   1HB   LYS  30          2HB       LYS  30   1.880 -11.131   3.164
  215   2HB   LYS  30          3HB       LYS  30   0.231 -10.593   2.793
  216   1HG   LYS  30          2HG       LYS  30   1.330 -11.896   0.981
  217   2HG   LYS  30          3HG       LYS  30   0.748 -10.319   0.448
  218   1HD   LYS  30          2HD       LYS  30   2.931  -9.447   0.134
  219   2HD   LYS  30          3HD       LYS  30   3.627 -10.511   1.371
  220   1HE   LYS  30          2HE       LYS  30   4.442 -11.172  -0.750
  221   2HE   LYS  30          3HE       LYS  30   3.415 -12.441  -0.053
  222   1HZ   LYS  30          1HZ       LYS  30   1.622 -11.187  -1.566
  223   2HZ   LYS  30          2HZ       LYS  30   2.867 -10.710  -2.384
  224   3HZ   LYS  30          3HZ       LYS  30   2.632 -12.319  -2.231
  225    H    TYR  31           H        TYR  31   2.791  -7.363   1.437
  226    HA   TYR  31           HA       TYR  31   0.387  -5.990   0.362
  227   1HB   TYR  31          2HB       TYR  31   1.881  -4.079   0.065
  228   2HB   TYR  31          3HB       TYR  31   1.828  -4.561   1.757
  229    HD1  TYR  31           HD1      TYR  31   3.812  -5.913   2.738
  230    HD2  TYR  31           HD2      TYR  31   3.918  -4.157  -1.188
  231    HE1  TYR  31           HE1      TYR  31   6.194  -6.478   2.567
  232    HE2  TYR  31           HE2      TYR  31   6.336  -4.756  -1.358
  233    HH   TYR  31           HH       TYR  31   8.175  -5.276  -0.088
  234    H    ASP  32           H        ASP  32   0.247  -5.948  -1.906
  235    HA   ASP  32           HA       ASP  32   2.411  -7.179  -3.523
  236   1HB   ASP  32          2HB       ASP  32  -0.489  -7.970  -3.174
  237   2HB   ASP  32          3HB       ASP  32   0.300  -8.220  -4.734
  238    H    ILE  33           H        ILE  33   2.665  -6.198  -5.475
  239    HA   ILE  33           HA       ILE  33   1.395  -3.493  -5.581
  240    HB   ILE  33           HB       ILE  33   4.271  -4.397  -5.938
  241   1HG1  ILE  33          2HG1      ILE  33   3.494  -2.480  -3.759
  242   2HG1  ILE  33          3HG1      ILE  33   3.115  -4.175  -3.466
  243   1HG2  ILE  33          1HG2      ILE  33   4.783  -1.956  -5.961
  244   2HG2  ILE  33          2HG2      ILE  33   3.731  -2.422  -7.302
  245   3HG2  ILE  33          3HG2      ILE  33   3.043  -1.612  -5.881
  246   1HD1  ILE  33          1HD1      ILE  33   5.408  -3.280  -2.725
  247   2HD1  ILE  33          2HD1      ILE  33   5.337  -4.858  -3.555
  248   3HD1  ILE  33          3HD1      ILE  33   5.881  -3.394  -4.421
  249    H    ASP  34           H        ASP  34   0.697  -2.781  -7.524
  250    HA   ASP  34           HA       ASP  34   1.505  -4.248 -10.001
  251   1HB   ASP  34          2HB       ASP  34  -0.861  -4.488  -9.335
  252   2HB   ASP  34          3HB       ASP  34  -1.053  -2.728  -9.431
  253    H    LEU  35           H        LEU  35   3.129  -3.098 -10.814
  254    HA   LEU  35           HA       LEU  35   3.457  -0.239 -10.598
  255   1HB   LEU  35          2HB       LEU  35   4.900  -2.516 -11.938
  256   2HB   LEU  35          3HB       LEU  35   5.194  -0.904 -12.562
  257    HG   LEU  35           HG       LEU  35   6.860  -1.699 -10.927
  258   1HD1  LEU  35          1HD1      LEU  35   6.573   0.711 -11.401
  259   2HD1  LEU  35          2HD1      LEU  35   5.415   0.840 -10.061
  260   3HD1  LEU  35          3HD1      LEU  35   7.104   0.412  -9.739
  261   1HD2  LEU  35          1HD2      LEU  35   5.269  -2.837  -9.358
  262   2HD2  LEU  35          2HD2      LEU  35   6.400  -1.726  -8.559
  263   3HD2  LEU  35          3HD2      LEU  35   4.724  -1.221  -8.837
  264    HA   PRO  36           HA       PRO  36   2.245  -0.120 -15.240
  265   1HB   PRO  36          2HB       PRO  36   0.366  -2.023 -16.090
  266   2HB   PRO  36          3HB       PRO  36   2.107  -1.990 -16.474
  267   1HG   PRO  36          2HG       PRO  36   0.691  -3.582 -14.367
  268   2HG   PRO  36          3HG       PRO  36   2.048  -4.083 -15.403
  269   1HD   PRO  36          2HD       PRO  36   2.414  -3.382 -12.843
  270   2HD   PRO  36          3HD       PRO  36   3.619  -2.921 -14.071
  271    H    ASN  37           H        ASN  37  -0.270  -1.698 -13.127
  272    HA   ASN  37           HA       ASN  37  -2.231   0.272 -14.051
  273   1HB   ASN  37          2HB       ASN  37  -2.558  -1.987 -12.062
  274   2HB   ASN  37          3HB       ASN  37  -3.834  -0.991 -12.729
  275   1HD2  ASN  37          1HD2      ASN  37  -2.191  -3.924 -13.190
  276   2HD2  ASN  37          2HD2      ASN  37  -2.651  -4.183 -14.874
  277    H    LYS  38           H        LYS  38  -0.064   0.125 -11.238
  278    HA   LYS  38           HA       LYS  38   0.278   1.714  -9.687
  279   1HB   LYS  38          2HB       LYS  38  -1.573   3.384 -11.428
  280   2HB   LYS  38          3HB       LYS  38  -0.823   3.995  -9.974
  281   1HG   LYS  38          2HG       LYS  38   1.288   4.045 -10.879
  282   2HG   LYS  38          3HG       LYS  38   1.053   2.522 -11.726
  283   1HD   LYS  38          2HD       LYS  38  -0.437   3.783 -13.392
  284   2HD   LYS  38          3HD       LYS  38   0.116   5.273 -12.610
  285   1HE   LYS  38          2HE       LYS  38   1.482   4.838 -14.577
  286   2HE   LYS  38          3HE       LYS  38   2.493   4.632 -13.137
  287   1HZ   LYS  38          1HZ       LYS  38   2.280   2.247 -13.380
  288   2HZ   LYS  38          2HZ       LYS  38   1.178   2.388 -14.561
  289   3HZ   LYS  38          3HZ       LYS  38   2.736   2.865 -14.831
  290    H    LYS  39           H        LYS  39  -0.903  -0.310  -8.958
  291    HA   LYS  39           HA       LYS  39  -2.759   0.661  -6.913
  292   1HB   LYS  39          2HB       LYS  39  -3.191  -1.872  -8.582
  293   2HB   LYS  39          3HB       LYS  39  -3.983  -1.527  -7.041
  294   1HG   LYS  39          2HG       LYS  39  -5.019   0.514  -8.039
  295   2HG   LYS  39          3HG       LYS  39  -4.277   0.107  -9.592
  296   1HD   LYS  39          2HD       LYS  39  -6.605  -0.612  -9.539
  297   2HD   LYS  39          3HD       LYS  39  -5.533  -2.018  -9.661
  298   1HE   LYS  39          2HE       LYS  39  -5.861  -2.559  -7.289
  299   2HE   LYS  39          3HE       LYS  39  -6.715  -1.034  -7.008
  300   1HZ   LYS  39          1HZ       LYS  39  -8.510  -1.892  -8.358
  301   2HZ   LYS  39          2HZ       LYS  39  -7.659  -3.277  -8.676
  302   3HZ   LYS  39          3HZ       LYS  39  -8.134  -2.954  -7.166
  303    H    VAL  40           H        VAL  40  -2.745  -0.688  -4.969
  304    HA   VAL  40           HA       VAL  40  -0.813  -2.874  -4.893
  305    HB   VAL  40           HB       VAL  40  -1.276  -0.484  -3.056
  306   1HG1  VAL  40          1HG1      VAL  40  -0.382  -3.198  -2.111
  307   2HG1  VAL  40          2HG1      VAL  40  -0.203  -1.673  -1.199
  308   3HG1  VAL  40          3HG1      VAL  40  -1.821  -2.239  -1.650
  309   1HG2  VAL  40          1HG2      VAL  40   1.226  -2.041  -3.815
  310   2HG2  VAL  40          2HG2      VAL  40   0.662  -0.564  -4.633
  311   3HG2  VAL  40          3HG2      VAL  40   1.165  -0.506  -2.928
  312    H    CYS  41           H        CYS  41  -1.675  -4.604  -3.880
  313    HA   CYS  41           HA       CYS  41  -4.307  -4.279  -2.561
  314   1HB   CYS  41          2HB       CYS  41  -5.007  -6.418  -3.142
  315   2HB   CYS  41          3HB       CYS  41  -4.526  -5.687  -4.682
  316    HG   CYS  41           HG       CYS  41  -3.920  -8.252  -4.561
  317    H    ILE  42           H        ILE  42  -4.388  -5.339  -0.538
  318    HA   ILE  42           HA       ILE  42  -1.805  -6.460   0.452
  319    HB   ILE  42           HB       ILE  42  -3.690  -4.667   2.016
  320   1HG1  ILE  42          2HG1      ILE  42  -0.933  -4.039   0.836
  321   2HG1  ILE  42          3HG1      ILE  42  -2.463  -3.330   0.319
  322   1HG2  ILE  42          1HG2      ILE  42  -0.910  -5.648   2.743
  323   2HG2  ILE  42          2HG2      ILE  42  -2.059  -4.806   3.797
  324   3HG2  ILE  42          3HG2      ILE  42  -2.399  -6.451   3.289
  325   1HD1  ILE  42          1HD1      ILE  42  -2.747  -2.305   2.570
  326   2HD1  ILE  42          2HD1      ILE  42  -1.141  -2.919   3.015
  327   3HD1  ILE  42          3HD1      ILE  42  -1.309  -1.744   1.698
  328    H    GLU  43           H        GLU  43  -2.109  -8.347   1.472
  329    HA   GLU  43           HA       GLU  43  -4.915  -9.300   1.958
  330   1HB   GLU  43          2HB       GLU  43  -3.988 -10.155  -0.189
  331   2HB   GLU  43          3HB       GLU  43  -2.669 -10.931   0.698
  332   1HG   GLU  43          2HG       GLU  43  -4.223 -12.410   1.822
  333   2HG   GLU  43          3HG       GLU  43  -5.620 -11.469   1.270
  334    H    SER  44           H        SER  44  -4.688  -8.769   4.112
  335    HA   SER  44           HA       SER  44  -3.313 -10.544   5.838
  336   1HB   SER  44          2HB       SER  44  -2.349  -7.646   5.724
  337   2HB   SER  44          3HB       SER  44  -1.992  -8.763   7.057
  338    HG   SER  44           HG       SER  44  -1.368  -9.788   4.595
  339    H    GLU  45           H        GLU  45  -4.533 -10.517   7.774
  340    HA   GLU  45           HA       GLU  45  -6.932  -9.103   8.003
  341   1HB   GLU  45          2HB       GLU  45  -5.211 -10.263  10.215
  342   2HB   GLU  45          3HB       GLU  45  -6.924  -9.840  10.330
  343   1HG   GLU  45          2HG       GLU  45  -5.780 -11.994   8.480
  344   2HG   GLU  45          3HG       GLU  45  -6.620 -12.241  10.008
  345    H    HIS  46           H        HIS  46  -3.789  -7.828   8.433
  346    HA   HIS  46           HA       HIS  46  -3.992  -6.177  10.642
  347   1HB   HIS  46          2HB       HIS  46  -2.057  -6.665   8.784
  348   2HB   HIS  46          3HB       HIS  46  -2.536  -5.044   8.283
  349    HD1  HIS  46           1HD      HIS  46  -2.716  -3.406  10.837
  350    HD2  HIS  46           2HD      HIS  46  -0.068  -6.650  10.369
  351    HE1  HIS  46           1HE      HIS  46  -0.910  -3.161  12.634
  352    H    SER  47           H        SER  47  -5.137  -4.396  11.121
  353    HA   SER  47           HA       SER  47  -7.354  -3.786   9.671
  354   1HB   SER  47          2HB       SER  47  -7.073  -3.349  12.077
  355   2HB   SER  47          3HB       SER  47  -6.035  -1.955  11.706
  356    HG   SER  47           HG       SER  47  -7.759  -0.858  11.398
  357    H    MET  48           H        MET  48  -8.017  -2.413   8.143
  358    HA   MET  48           HA       MET  48  -6.422  -1.309   6.220
  359   1HB   MET  48          2HB       MET  48  -8.936  -1.818   6.250
  360   2HB   MET  48          3HB       MET  48  -9.156  -0.277   7.094
  361   1HG   MET  48          2HG       MET  48  -7.730   0.665   5.070
  362   2HG   MET  48          3HG       MET  48  -8.224  -0.839   4.292
  363   1HE   MET  48          1HE       MET  48 -12.160  -0.366   4.325
  364   2HE   MET  48          2HE       MET  48 -10.815  -1.459   3.919
  365   3HE   MET  48          3HE       MET  48 -11.214  -1.123   5.623
  366    H    ASP  49           H        ASP  49  -7.889   0.334   9.048
  367    HA   ASP  49           HA       ASP  49  -7.201   2.976   8.427
  368   1HB   ASP  49          2HB       ASP  49  -7.756   3.508  10.651
  369   2HB   ASP  49          3HB       ASP  49  -8.804   2.151  10.241
  370    H    THR  50           H        THR  50  -5.548   0.646  10.363
  371    HA   THR  50           HA       THR  50  -3.289   2.103  11.153
  372    HB   THR  50           HB       THR  50  -3.671  -0.903  10.768
  373    HG1  THR  50           1HG      THR  50  -5.229   0.270  12.142
  374   1HG2  THR  50          1HG2      THR  50  -1.332  -0.513  11.126
  375   2HG2  THR  50          2HG2      THR  50  -1.667   0.637  12.449
  376   3HG2  THR  50          3HG2      THR  50  -2.043  -1.086  12.644
  377    H    LEU  51           H        LEU  51  -3.683  -0.196   8.410
  378    HA   LEU  51           HA       LEU  51  -1.057   0.144   7.325
  379   1HB   LEU  51          2HB       LEU  51  -3.677  -0.434   5.880
  380   2HB   LEU  51          3HB       LEU  51  -2.058  -0.585   5.172
  381    HG   LEU  51           HG       LEU  51  -2.949  -2.112   7.668
  382   1HD1  LEU  51          1HD1      LEU  51  -3.306  -4.059   6.140
  383   2HD1  LEU  51          2HD1      LEU  51  -4.466  -2.745   5.895
  384   3HD1  LEU  51          3HD1      LEU  51  -3.122  -2.958   4.759
  385   1HD2  LEU  51          1HD2      LEU  51  -0.680  -2.573   5.683
  386   2HD2  LEU  51          2HD2      LEU  51  -0.499  -1.987   7.348
  387   3HD2  LEU  51          3HD2      LEU  51  -1.085  -3.622   7.060
  388    H    LEU  52           H        LEU  52  -4.135   1.787   6.499
  389    HA   LEU  52           HA       LEU  52  -3.133   3.576   4.597
  390   1HB   LEU  52          2HB       LEU  52  -5.445   3.625   6.522
  391   2HB   LEU  52          3HB       LEU  52  -5.082   5.078   5.606
  392    HG   LEU  52           HG       LEU  52  -5.512   2.359   4.338
  393   1HD1  LEU  52          1HD1      LEU  52  -7.804   3.129   3.823
  394   2HD1  LEU  52          2HD1      LEU  52  -7.538   3.072   5.574
  395   3HD1  LEU  52          3HD1      LEU  52  -7.512   4.631   4.725
  396   1HD2  LEU  52          1HD2      LEU  52  -6.001   3.788   2.298
  397   2HD2  LEU  52          2HD2      LEU  52  -5.511   5.214   3.216
  398   3HD2  LEU  52          3HD2      LEU  52  -4.332   3.943   2.831
  399    H    ALA  53           H        ALA  53  -3.617   4.263   8.091
  400    HA   ALA  53           HA       ALA  53  -2.454   6.816   8.155
  401   1HB   ALA  53          1HB       ALA  53  -2.170   6.387  10.578
  402   2HB   ALA  53          2HB       ALA  53  -3.756   5.818  10.018
  403   3HB   ALA  53          3HB       ALA  53  -2.448   4.653  10.312
  404    H    THR  54           H        THR  54  -0.858   3.646   8.458
  405    HA   THR  54           HA       THR  54   1.758   4.729   8.879
  406    HB   THR  54           HB       THR  54   0.897   2.072   7.661
  407    HG1  THR  54           1HG      THR  54   0.149   2.284   9.703
  408   1HG2  THR  54          1HG2      THR  54   3.579   3.072   8.700
  409   2HG2  THR  54          2HG2      THR  54   3.176   1.372   8.408
  410   3HG2  THR  54          3HG2      THR  54   3.187   2.503   7.056
  411    H    LEU  55           H        LEU  55   0.347   3.389   5.834
  412    HA   LEU  55           HA       LEU  55   2.679   4.015   4.377
  413   1HB   LEU  55          2HB       LEU  55   1.574   3.056   2.550
  414   2HB   LEU  55          3HB       LEU  55   1.160   2.176   3.985
  415    HG   LEU  55           HG       LEU  55  -0.993   3.558   4.045
  416   1HD1  LEU  55          1HD1      LEU  55   0.341   4.522   1.666
  417   2HD1  LEU  55          2HD1      LEU  55  -1.270   3.866   1.268
  418   3HD1  LEU  55          3HD1      LEU  55  -1.108   5.153   2.480
  419   1HD2  LEU  55          1HD2      LEU  55  -0.845   1.143   3.521
  420   2HD2  LEU  55          2HD2      LEU  55  -2.068   1.937   2.509
  421   3HD2  LEU  55          3HD2      LEU  55  -0.472   1.535   1.829
  422    H    LYS  56           H        LYS  56  -0.318   5.707   4.740
  423    HA   LYS  56           HA       LYS  56  -0.256   7.841   3.013
  424   1HB   LYS  56          2HB       LYS  56  -0.945   7.600   5.945
  425   2HB   LYS  56          3HB       LYS  56  -0.922   9.200   5.251
  426   1HG   LYS  56          2HG       LYS  56  -2.539   8.645   3.548
  427   2HG   LYS  56          3HG       LYS  56  -2.568   6.943   4.052
  428   1HD   LYS  56          2HD       LYS  56  -3.349   7.574   6.276
  429   2HD   LYS  56          3HD       LYS  56  -3.211   9.296   5.889
  430   1HE   LYS  56          2HE       LYS  56  -4.975   9.056   4.144
  431   2HE   LYS  56          3HE       LYS  56  -5.090   7.322   4.480
  432   1HZ   LYS  56          1HZ       LYS  56  -5.739   9.477   6.385
  433   2HZ   LYS  56          2HZ       LYS  56  -6.823   8.552   5.570
  434   3HZ   LYS  56          3HZ       LYS  56  -5.847   7.864   6.699
  435    H    LYS  57           H        LYS  57   1.942   7.400   5.811
  436    HA   LYS  57           HA       LYS  57   2.921  10.090   5.785
  437   1HB   LYS  57          2HB       LYS  57   3.928   7.502   6.943
  438   2HB   LYS  57          3HB       LYS  57   4.793   9.041   7.173
  439   1HG   LYS  57          2HG       LYS  57   2.711  10.007   8.145
  440   2HG   LYS  57          3HG       LYS  57   1.910   8.440   7.956
  441   1HD   LYS  57          2HD       LYS  57   4.472   8.787   9.572
  442   2HD   LYS  57          3HD       LYS  57   2.863   9.054  10.272
  443   1HE   LYS  57          2HE       LYS  57   2.160   6.785   9.692
  444   2HE   LYS  57          3HE       LYS  57   3.729   6.436   8.941
  445   1HZ   LYS  57          1HZ       LYS  57   4.738   6.719  11.103
  446   2HZ   LYS  57          2HZ       LYS  57   3.274   7.039  11.789
  447   3HZ   LYS  57          3HZ       LYS  57   3.575   5.557  11.148
  448    H    THR  58           H        THR  58   3.501   7.628   3.441
  449    HA   THR  58           HA       THR  58   6.107   8.537   2.577
  450    HB   THR  58           HB       THR  58   5.406   7.675   0.362
  451    HG1  THR  58           1HG      THR  58   2.999   6.866   1.616
  452   1HG2  THR  58          1HG2      THR  58   5.164   5.314   1.076
  453   2HG2  THR  58          2HG2      THR  58   6.422   6.189   1.985
  454   3HG2  THR  58          3HG2      THR  58   4.849   5.872   2.741
  455    H    GLY  59           H        GLY  59   2.924   9.989   2.505
  456   1HA   GLY  59          2HA       GLY  59   2.300  12.077   1.891
  457   2HA   GLY  59          3HA       GLY  59   3.990  12.445   1.464
  458    H    LYS  60           H        LYS  60   1.820   9.883   0.254
  459    HA   LYS  60           HA       LYS  60   2.370  10.755  -2.540
  460   1HB   LYS  60          2HB       LYS  60   1.604   8.119  -1.237
  461   2HB   LYS  60          3HB       LYS  60   1.539   8.338  -2.976
  462   1HG   LYS  60          2HG       LYS  60   4.016   8.733  -1.242
  463   2HG   LYS  60          3HG       LYS  60   3.642   7.280  -2.169
  464   1HD   LYS  60          2HD       LYS  60   4.382  10.044  -3.208
  465   2HD   LYS  60          3HD       LYS  60   5.232   8.514  -3.398
  466   1HE   LYS  60          2HE       LYS  60   3.066   7.710  -4.665
  467   2HE   LYS  60          3HE       LYS  60   2.653   9.427  -4.779
  468   1HZ   LYS  60          1HZ       LYS  60   5.070   8.120  -5.815
  469   2HZ   LYS  60          2HZ       LYS  60   3.798   8.585  -6.705
  470   3HZ   LYS  60          3HZ       LYS  60   4.726   9.745  -6.010
  471    H    THR  61           H        THR  61   0.833  10.790  -4.122
  472    HA   THR  61           HA       THR  61  -2.000  10.903  -3.689
  473    HB   THR  61           HB       THR  61  -1.518  10.127  -6.267
  474    HG1  THR  61           1HG      THR  61   0.496  10.866  -6.897
  475   1HG2  THR  61          1HG2      THR  61  -1.445  12.540  -6.842
  476   2HG2  THR  61          2HG2      THR  61  -2.671  12.204  -5.604
  477   3HG2  THR  61          3HG2      THR  61  -1.115  12.933  -5.140
  478    H    VAL  62           H        VAL  62  -2.251   9.146  -2.214
  479    HA   VAL  62           HA       VAL  62  -2.509   6.541  -3.598
  480    HB   VAL  62           HB       VAL  62  -0.513   6.328  -2.259
  481   1HG1  VAL  62          1HG1      VAL  62  -0.856   8.098  -0.572
  482   2HG1  VAL  62          2HG1      VAL  62  -2.163   7.160   0.173
  483   3HG1  VAL  62          3HG1      VAL  62  -0.496   6.551   0.188
  484   1HG2  VAL  62          1HG2      VAL  62  -2.741   4.925  -0.734
  485   2HG2  VAL  62          2HG2      VAL  62  -2.211   4.454  -2.354
  486   3HG2  VAL  62          3HG2      VAL  62  -1.069   4.383  -1.008
  487    H    SER  63           H        SER  63  -4.424   5.437  -3.106
  488    HA   SER  63           HA       SER  63  -6.246   6.607  -1.076
  489   1HB   SER  63          2HB       SER  63  -8.063   6.654  -2.823
  490   2HB   SER  63          3HB       SER  63  -6.786   7.861  -3.068
  491    HG   SER  63           HG       SER  63  -7.238   6.799  -5.017
  492    H    TYR  64           H        TYR  64  -8.075   5.188  -0.664
  493    HA   TYR  64           HA       TYR  64  -7.413   2.297  -0.948
  494   1HB   TYR  64          2HB       TYR  64  -7.619   2.583   1.290
  495   2HB   TYR  64          3HB       TYR  64  -8.611   4.025   1.154
  496    HD1  TYR  64           HD1      TYR  64 -10.944   3.945   1.435
  497    HD2  TYR  64           HD2      TYR  64  -8.743   0.285   0.813
  498    HE1  TYR  64           HE1      TYR  64 -13.012   2.649   1.789
  499    HE2  TYR  64           HE2      TYR  64 -10.813  -1.009   1.233
  500    HH   TYR  64           HH       TYR  64 -13.973   0.563   1.822
  501    H    LEU  65           H        LEU  65  -8.710   1.041  -2.213
  502    HA   LEU  65           HA       LEU  65 -11.514   1.704  -2.635
  503   1HB   LEU  65          2HB       LEU  65 -11.131   1.383  -5.172
  504   2HB   LEU  65          3HB       LEU  65 -11.048   2.958  -4.404
  505    HG   LEU  65           HG       LEU  65  -9.395   2.616  -6.109
  506   1HD1  LEU  65          1HD1      LEU  65  -7.712   3.815  -5.233
  507   2HD1  LEU  65          2HD1      LEU  65  -9.059   4.169  -4.148
  508   3HD1  LEU  65          3HD1      LEU  65  -7.801   3.004  -3.674
  509   1HD2  LEU  65          1HD2      LEU  65  -8.048   0.536  -4.412
  510   2HD2  LEU  65          2HD2      LEU  65  -8.902   0.266  -5.948
  511   3HD2  LEU  65          3HD2      LEU  65  -7.438   1.244  -5.924
  512    H    GLY  66           H        GLY  66 -11.467  -0.336  -1.329
  513   1HA   GLY  66          2HA       GLY  66 -12.884  -2.219  -2.441
  514   2HA   GLY  66          3HA       GLY  66 -11.315  -2.776  -3.040
  515    H    LEU  67           H        LEU  67 -13.426  -3.577  -0.694
  516    HA   LEU  67           HA       LEU  67 -11.385  -4.161   1.356
  517   1HB   LEU  67          2HB       LEU  67 -12.457  -2.349   2.351
  518   2HB   LEU  67          3HB       LEU  67 -13.958  -2.606   1.454
  519    HG   LEU  67           HG       LEU  67 -14.504  -4.525   2.836
  520   1HD1  LEU  67          1HD1      LEU  67 -13.293  -4.968   4.931
  521   2HD1  LEU  67          2HD1      LEU  67 -12.139  -5.082   3.593
  522   3HD1  LEU  67          3HD1      LEU  67 -12.167  -3.634   4.611
  523   1HD2  LEU  67          1HD2      LEU  67 -15.132  -3.240   4.842
  524   2HD2  LEU  67          2HD2      LEU  67 -13.999  -1.953   4.377
  525   3HD2  LEU  67          3HD2      LEU  67 -15.406  -2.314   3.355
  526    H    GLU  68           H        GLU  68 -11.307  -6.365   1.549
  527    HA   GLU  68           HA       GLU  68 -13.794  -7.951   1.501
  528   1HB   GLU  68          2HB       GLU  68 -10.886  -8.302   0.663
  529   2HB   GLU  68          3HB       GLU  68 -11.914  -9.660   0.998
  530   1HG   GLU  68          2HG       GLU  68 -12.987  -9.454  -1.060
  531   2HG   GLU  68          3HG       GLU  68 -13.149  -7.703  -0.887