*HEADER    HYDROLASE                               01-AUG-05   2AJ0              
*TITLE     SOLUTION STRUCTURE OF APOCADA                                         
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: PROBABLE CADMIUM-TRANSPORTING ATPASE;                      
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: N-TERMINAL DOMAIN;                                         
*COMPND   5 SYNONYM: CADA P-TYPE ATPASE, CADMIUM EFFLUX ATPASE;                  
*COMPND   6 EC: 3.6.3.3;                                                         
*COMPND   7 ENGINEERED: YES;                                                     
*COMPND   8 MUTATION: YES                                                        
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: LISTERIA MONOCYTOGENES;                         
*SOURCE   3 ORGANISM_COMMON: BACTERIA;                                           
*SOURCE   4 GENE: CADA;                                                          
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   7 EXPRESSION_SYSTEM_STRAIN: M15;                                       
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   9 EXPRESSION_SYSTEM_PLASMID: PQE-60 VECTOR (QIAGEN)                    
*KEYWDS    FERRODOXIN-LIKE FOLD, BETA-ALPHA-BETA-BETA-ALPHA-BETA,                
*KEYWDS   2 METAL BINDING PROTEIN                                                
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    L.BANCI, I.BERTINI, S.CIOFI-BAFFONI, X.-C.SU, R.MIRAS,                
*AUTHOR   2 N.BAL, E.MINTZ, P.CATTY, J.E.SHOKES, R.A.SCOTT                       
*REVDAT   1   02-MAY-06 2AJ0    0                                                

  3 GLU  
         HN      3 GLU  QB      3.60                
         HA      4 LYS  HN      3.10                
  4 LYS  
         HN      4 LYS  QB      3.91                
         HN      4 LYS  QG      6.00                
         HN      5 THR  HN      4.70                
         HA      5 THR  HN      2.90                
         HA     45 VAL  HN      5.20                
         HA     46 THR  HA      3.70                
         HA     46 THR  HB      5.40                
         HA     46 THR  QG2     6.10                
         HA     47 GLY  HN      3.70                
         HB2     5 THR  HN      6.00                
         HB2    46 THR  HA      5.50                
         HB2    46 THR  QG2     5.10                
         HB3     5 THR  HN      6.00                
         HB3    46 THR  HA      5.50                
         HB3    46 THR  QG2     5.10                
         QB      5 THR  HN      5.15                
         QB      6 VAL  HN      6.88                
         QB     45 VAL  HN      6.88                
         QB     46 THR  HA      5.09                
         QB     47 GLY  HN      6.88                
         QG      5 THR  HN      7.00                
         QG     46 THR  HA      6.60                
  5 THR  
         HN      5 THR  HB      3.80                
         HN      6 VAL  HN      4.70                
         HN     44 THR  QG2     6.10                
         HN     45 VAL  HN      3.30                
         HN     45 VAL  HB      6.00                
         HN     45 VAL  QG1     7.00                
         HN     45 VAL  QG2     7.00                
         HN     46 THR  HA      3.60                
         HA      6 VAL  HN      2.70                
         HB      6 VAL  HN      5.20                
         HB     45 VAL  HN      6.00                
         QG2     6 VAL  HN      4.10                
         QG2     6 VAL  HA      5.60                
         QG2     7 TYR  QE      6.60                
         QG2    45 VAL  HN      7.00                
  6 VAL  
         HN      6 VAL  HB      3.20                
         HN      6 VAL  QG1     4.80                
         HN      6 VAL  QG2     4.80                
         HN      6 VAL  QQG     4.18                
         HN      7 TYR  HN      4.90                
         HA      7 TYR  HN      2.90                
         HA     44 THR  HA      2.70                
         HA     44 THR  QG2     5.00                
         HA     45 VAL  HN      3.20                
         HB      7 TYR  HN      5.00                
         HB     44 THR  HA      4.00                
         HB     44 THR  QG2     6.30                
         QG1     7 TYR  HN      5.60                
         QG1    44 THR  HB      6.20                
         QG1    44 THR  QG2     5.80                
         QG2     7 TYR  HN      5.60                
         QG2    44 THR  HB      6.20                
         QG2    44 THR  QG2     5.80                
         QQG     7 TYR  HN      4.61                
         QQG     8 ARG  HN      8.56                
         QQG    43 ILE  HN      6.16                
         QQG    44 THR  HB      5.70                
         QQG    44 THR  QG2     5.19                
  7 TYR  
         HN      7 TYR  QE      7.00                
         HN      8 ARG  HN      5.70                
         HN     42 LYS  QB      6.88                
         HN     43 ILE  HN      3.10                
         HN     43 ILE  HB      6.00                
         HN     43 ILE  QG2     6.60                
         HN     44 THR  HA      3.70                
         HN     65 ILE  QG2     7.00                
         HA      8 ARG  HN      2.90                
         HA     65 ILE  QG2     7.00                
         HA     67 PRO  HA      6.00                
         HA     68 GLU  HN      3.00                
         HB2     8 ARG  HN      4.40                
         HB2    43 ILE  HN      6.00                
         HB2    43 ILE  QG2     5.90                
         HB2    43 ILE  QD1     7.00                
         HB2    54 VAL  QG1    10.12                
         HB2    54 VAL  QG2    10.12                
         HB2    65 ILE  QG2     5.00                
         HB2    65 ILE  QD1     7.00                
         HB2    66 ILE  HN      6.00                
         HB3     8 ARG  HN      4.40                
         HB3    43 ILE  HN      6.00                
         HB3    43 ILE  QG2     5.90                
         HB3    43 ILE  QD1     7.00                
         HB3    54 VAL  QG1    10.12                
         HB3    54 VAL  QG2    10.12                
         HB3    65 ILE  QG2     5.00                
         HB3    65 ILE  QD1     7.00                
         HB3    66 ILE  HN      6.00                
         QB      8 ARG  HN      3.92                
         QB     43 ILE  QG2     5.31                
         QB     54 VAL  QQG     8.52                
         QB     65 ILE  QG2     4.53                
         QB     66 ILE  HN      5.69                
         QB     67 PRO  HA      6.88                
         QD      8 ARG  HN      8.00                
         QD     43 ILE  HN      8.00                
         QD     43 ILE  QG2     6.60                
         QD     43 ILE  QG1     8.88                
         QD     43 ILE  QD1     8.20                
         QD     44 THR  HA      7.60                
         QD     45 VAL  HN      8.00                
         QD     45 VAL  HB      7.50                
         QD     45 VAL  QQG     8.96                
         QD     51 ILE  HB      8.00                
         QD     51 ILE  QG2     8.00                
         QD     51 ILE  HG12    7.70                
         QD     51 ILE  HG13    7.70                
         QD     51 ILE  QG1     7.40                
         QD     54 VAL  QG1     7.70                
         QD     54 VAL  QG2     7.70                
         QD     54 VAL  QQG     7.29                
         QD     65 ILE  HB      7.10                
         QD     65 ILE  QG2     7.20                
         QD     66 ILE  HN      8.00                
         QD     67 PRO  HA      5.70                
         QD     67 PRO  HB2     8.00                
         QD     67 PRO  HB3     8.00                
         QD     67 PRO  QB      7.56                
         QD     67 PRO  HG2     8.00                
         QD     67 PRO  HG3     8.00                
         QD     67 PRO  HD2     7.50                
         QD     67 PRO  HD3     7.50                
         QD     68 GLU  HN      8.00                
         QE      8 ARG  HN      8.00                
         QE     43 ILE  QG2     8.90                
         QE     43 ILE  QG1     8.88                
         QE     43 ILE  QD1     8.40                
         QE     44 THR  HA      8.00                
         QE     45 VAL  HN      8.00                
         QE     45 VAL  HB      6.10                
         QE     45 VAL  QQG     9.16                
         QE     51 ILE  HB      6.80                
         QE     51 ILE  QG2     8.10                
         QE     51 ILE  HG12    6.90                
         QE     51 ILE  HG13    6.90                
         QE     51 ILE  QG1     6.74                
         QE     54 VAL  QQG    10.56                
         QE     65 ILE  HB      7.90                
         QE     65 ILE  QG2     9.00                
         QE     67 PRO  HA      6.80                
         QE     67 PRO  HB2     8.00                
         QE     67 PRO  HB3     8.00                
         QE     67 PRO  QB      7.47                
         QE     67 PRO  HG2     8.00                
         QE     67 PRO  HG3     8.00                
         QE     67 PRO  QD      6.98                
  8 ARG  
         HN      8 ARG  HB2     4.00                
         HN      8 ARG  HB3     4.00                
         HN      8 ARG  HG2     4.70                
         HN      8 ARG  HG3     4.70                
         HN      8 ARG  QG      4.28                
         HN      8 ARG  QD      6.88                
         HN      9 VAL  HN      4.70                
         HN     65 ILE  QG2     7.00                
         HN     66 ILE  HN      3.40                
         HN     66 ILE  HB      5.70                
         HN     66 ILE  QD1     6.50                
         HN     67 PRO  HA      3.90                
         HN     68 GLU  HN      4.20                
         HN     68 GLU  HA      5.10                
         HA      9 VAL  HN      2.70                
         HA     42 LYS  HA      3.60                
         HA     43 ILE  HN      3.50                
         HB2     9 VAL  HN      5.70                
         HB2    66 ILE  HN      6.00                
         HB3     9 VAL  HN      5.70                
         HB3    66 ILE  HN      6.00                
         QB     42 LYS  HA      6.88                
         HG2     9 VAL  HN      6.00                
         HG3     9 VAL  HN      6.00                
         QG      9 VAL  HN      5.69                
  9 VAL  
         HN      9 VAL  HB      3.70                
         HN      9 VAL  QG1     4.80                
         HN      9 VAL  QG2     4.80                
         HN      9 VAL  QQG     4.33                
         HN     10 ASP  HN      4.60                
         HN     41 SER  HN      4.60                
         HN     42 LYS  HA      3.10                
         HA     10 ASP  HN      3.20                
         HA     65 ILE  HA      4.60                
         HA     65 ILE  QG2     6.50                
         HA     65 ILE  QD1     6.30                
         HA     66 ILE  HN      3.90                
         HB     10 ASP  HN      4.70                
         HB     12 LEU  QQD     8.07                
         HB     63 LEU  QQD     8.57                
         HB     65 ILE  HB      4.50                
         HB     65 ILE  QG2     7.00                
         HB     65 ILE  QG1     5.58                
         HB     65 ILE  QD1     7.00                
         QG1    10 ASP  HN      5.20                
         QG1    12 LEU  HG      6.30                
         QG1    41 SER  HB2     8.75                
         QG1    41 SER  HB3     8.75                
         QG1    42 LYS  HA      7.00                
         QG1    65 ILE  HA      7.00                
         QG1    65 ILE  QG2     6.30                
         QG1    65 ILE  QD1     5.30                
         QG2    10 ASP  HN      5.20                
         QG2    12 LEU  HG      6.30                
         QG2    41 SER  HB2     8.75                
         QG2    41 SER  HB3     8.75                
         QG2    42 LYS  HA      7.00                
         QG2    65 ILE  HA      7.00                
         QG2    65 ILE  QG2     6.30                
         QG2    65 ILE  QD1     5.30                
         QQG    10 ASP  HN      4.56                
         QQG    11 GLY  HN      8.56                
         QQG    12 LEU  HN      8.56                
         QQG    12 LEU  HG      5.90                
         QQG    12 LEU  QQD     8.93                
         QQG    21 PHE  QB      7.54                
         QQG    41 SER  QB      7.72                
         QQG    42 LYS  HN      8.56                
         QQG    42 LYS  HA      6.19                
         QQG    43 ILE  HN      8.56                
         QQG    63 LEU  QQD    11.03                
         QQG    65 ILE  HA      6.19                
         QQG    65 ILE  QG2     5.47                
         QQG    65 ILE  QG1     7.54                
         QQG    65 ILE  QD1     4.96                
 10 ASP  
         HN     10 ASP  HB2     3.70                
         HN     10 ASP  HB3     3.70                
         HN     10 ASP  QB      3.49                
         HN     11 GLY  HN      5.60                
         HN     63 LEU  HA      6.00                
         HN     63 LEU  QQD     8.57                
         HN     64 LYS  HN      3.20                
         HN     64 LYS  QB      7.00                
         HN     64 LYS  QD      6.88                
         HN     65 ILE  HA      4.10                
         HN     65 ILE  QD1     7.00                
         HN     66 ILE  QG1     6.88                
         HA     11 GLY  HN      3.00                
         HA     12 LEU  HN      5.00                
         HB2    11 GLY  HN      4.80                
         HB2    64 LYS  HN      6.00                
         HB2    64 LYS  QB      6.70                
         HB2    64 LYS  HD2     5.40                
         HB2    64 LYS  HD3     5.40                
         HB3    11 GLY  HN      4.80                
         HB3    64 LYS  HN      6.00                
         HB3    64 LYS  QB      6.70                
         HB3    64 LYS  HD2     5.40                
         HB3    64 LYS  HD3     5.40                
         QB     64 LYS  QB      6.54                
         QB     64 LYS  QD      4.98                
 11 GLY  
         HN     12 LEU  HN      3.60                
         HN     12 LEU  QB      6.88                
         HN     12 LEU  HG      6.00                
         HN     63 LEU  QQD     8.57                
         HA1    63 LEU  QD1     9.44                
         HA1    63 LEU  QD2     9.44                
         HA2    63 LEU  QD1     9.44                
         HA2    63 LEU  QD2     9.44                
         QA     63 LEU  QQD     7.38                
 12 LEU  
         HN     12 LEU  QB      3.76                
         HN     12 LEU  HG      3.90                
         HN     12 LEU  QD1     5.10                
         HN     12 LEU  QD2     5.10                
         HN     13 SER  HN      6.00                
         HN     63 LEU  QQD     7.47                
         HA     12 LEU  QD1     5.20                
         HA     12 LEU  QD2     5.20                
         HA     63 LEU  QD1     7.00                
         HA     63 LEU  QD2     7.00                
         HA     63 LEU  QQD     6.14                
         HB2    14 CYS  HN      6.00                
         HB2    63 LEU  QD1     8.75                
         HB2    63 LEU  QD2     8.75                
         HB3    14 CYS  HN      6.00                
         HB3    63 LEU  QD1     8.75                
         HB3    63 LEU  QD2     8.75                
         QB     13 SER  HN      6.88                
         QB     38 PHE  QD      8.18                
         QB     38 PHE  QE      7.68                
         QB     60 PHE  QD      8.88                
         QB     60 PHE  QE      8.88                
         QB     63 LEU  QB      7.75                
         QB     63 LEU  HG      4.48                
         QB     63 LEU  QQD     6.91                
         HG     13 SER  HN      6.00                
         HG     14 CYS  HN      6.00                
         HG     38 PHE  QD      6.90                
         HG     38 PHE  QE      7.90                
         HG     63 LEU  QB      5.68                
         HG     63 LEU  HG      4.10                
         HG     63 LEU  QD1     7.00                
         HG     63 LEU  QD2     7.00                
         HG     63 LEU  QQD     6.33                
         QD1    21 PHE  QD      9.00                
         QD1    38 PHE  QD      9.00                
         QD1    38 PHE  QE      9.00                
         QD1    63 LEU  QD1     8.84                
         QD1    63 LEU  QD2     8.84                
         QD2    21 PHE  QD      9.00                
         QD2    38 PHE  QD      9.00                
         QD2    38 PHE  QE      9.00                
         QD2    63 LEU  QD1     8.84                
         QD2    63 LEU  QD2     8.84                
         QQD    13 SER  HN      8.57                
         QQD    14 CYS  HN      8.57                
         QQD    18 ALA  HA      5.67                
         QQD    41 SER  HN      8.57                
         QQD    60 PHE  QE     10.57                
         QQD    63 LEU  HG      5.47                
         QQD    63 LEU  QQD     6.70                
 13 SER  
         HN     14 CYS  HN      4.60                
         HN     63 LEU  QQD     8.57                
 14 CYS  
         HN     17 CYS  HN      4.90                
         HN     17 CYS  HB2     4.90                
         HN     17 CYS  HB3     4.90                
         HN     17 CYS  QB      4.62                
         HN     18 ALA  QB      7.00                
 15 THR  
         HA     19 ALA  HN      5.20                
 16 ASN  
         HN     16 ASN  HA      2.70                
         HN     17 CYS  HN      5.20                
         HA     19 ALA  QB      5.80                
         HB2    17 CYS  HN      4.30                
         HB3    17 CYS  HN      4.30                
 17 CYS  
         HN     17 CYS  HB2     3.90                
         HN     17 CYS  HB3     3.90                
         HN     17 CYS  QB      3.70                
         HN     18 ALA  HN      3.90                
         HA     20 LYS  HN      4.80                
         HA     20 LYS  HB2     4.40                
         HA     20 LYS  HB3     4.40                
         HA     20 LYS  QB      4.11                
         HA     20 LYS  QG      6.78                
         HA     21 PHE  HN      5.00                
         HA     60 PHE  QE      7.00                
         HA     60 PHE  HZ      5.20                
         HB2    18 ALA  HN      4.20                
         HB2    19 ALA  HN      5.50                
         HB3    18 ALA  HN      4.20                
         HB3    19 ALA  HN      5.50                
         QB     18 ALA  HN      3.96                
         QB     19 ALA  HN      5.33                
         QB     20 LYS  HN      5.98                
         QB     21 PHE  HN      5.98                
         QB     60 PHE  QE      8.88                
         QB     60 PHE  HZ      6.88                
 18 ALA  
         HN     18 ALA  QB      3.60                
         HN     19 ALA  HN      3.80                
         HA     21 PHE  HN      4.40                
         HA     21 PHE  HB2     3.70                
         HA     21 PHE  HB3     3.70                
         HA     21 PHE  QD      7.20                
         HA     22 GLU  HN      4.80                
         HA     63 LEU  QQD     8.57                
         QB     19 ALA  HN      3.90                
         QB     22 GLU  HN      6.00                
         QB     38 PHE  QD      9.00                
         QB     38 PHE  QE      9.00                
 19 ALA  
         HN     19 ALA  QB      3.40                
         HN     20 LYS  HN      3.90                
         HN     21 PHE  HN      5.50                
         HA     22 GLU  HN      4.70                
         HA     23 ARG  HN      5.00                
         QB     20 LYS  HN      4.30                
 20 LYS  
         HN     20 LYS  HB2     3.80                
         HN     20 LYS  HB3     3.80                
         HN     20 LYS  QB      3.40                
         HN     20 LYS  HG2     5.60                
         HN     20 LYS  HG3     5.60                
         HN     20 LYS  QG      5.09                
         HN     20 LYS  HD2     6.00                
         HN     20 LYS  HD3     6.00                
         HN     20 LYS  QD      5.64                
         HN     21 PHE  HN      3.70                
         HA     23 ARG  HN      4.10                
         HA     23 ARG  HB2     4.00                
         HA     23 ARG  HB3     4.00                
         HA     23 ARG  QB      3.65                
         HB2    21 PHE  HN      4.30                
         HB3    21 PHE  HN      4.30                
         QB     60 PHE  QD      8.88                
         QB     60 PHE  QE      8.88                
         HG2    24 ASN  HD21    6.00                
         HG2    24 ASN  HD22    6.00                
         HG2    60 PHE  QD      8.00                
         HG2    60 PHE  QE      8.00                
         HG3    24 ASN  HD21    6.00                
         HG3    24 ASN  HD22    6.00                
         HG3    60 PHE  QD      8.00                
         HG3    60 PHE  QE      8.00                
         QG     21 PHE  HN      6.88                
         HE2    24 ASN  HD21    7.73                
         HE2    24 ASN  HD22    7.73                
         HE2    60 PHE  QD      8.00                
         HE3    24 ASN  HD21    7.73                
         HE3    24 ASN  HD22    7.73                
         HE3    60 PHE  QD      8.00                
         QE     24 ASN  QD2     6.81                
         QE     60 PHE  QE      8.88                
 21 PHE  
         HN     21 PHE  HB2     3.90                
         HN     21 PHE  HB3     3.90                
         HN     21 PHE  QB      3.60                
         HN     22 GLU  HN      3.40                
         HN     23 ARG  HN      4.50                
         HN     25 VAL  QQG     8.56                
         HN     36 VAL  QQG     8.56                
         HN     60 PHE  QE      8.00                
         HN     60 PHE  HZ      5.90                
         HN     63 LEU  QQD     8.57                
         HA     24 ASN  HN      4.60                
         HA     24 ASN  HB2     4.30                
         HA     24 ASN  HB3     4.30                
         HA     24 ASN  QB      3.91                
         HA     58 GLY  QA      5.58                
         HA     60 PHE  QD      8.00                
         HA     60 PHE  QE      6.30                
         HB2    22 GLU  HN      4.80                
         HB2    38 PHE  QE      7.00                
         HB2    60 PHE  QE      7.30                
         HB2    60 PHE  HZ      4.80                
         HB2    63 LEU  QD1    10.14                
         HB2    63 LEU  QD2    10.14                
         HB3    22 GLU  HN      4.80                
         HB3    38 PHE  QE      7.00                
         HB3    60 PHE  QE      7.30                
         HB3    60 PHE  HZ      4.80                
         HB3    63 LEU  QD1    10.14                
         HB3    63 LEU  QD2    10.14                
         QB     22 GLU  HN      4.33                
         QB     25 VAL  QQG     7.94                
         QB     38 PHE  QE      6.70                
         QB     58 GLY  QA      7.75                
         QB     60 PHE  QD      8.88                
         QB     60 PHE  QE      7.05                
         QB     60 PHE  HZ      4.57                
         QB     63 LEU  QQD     7.99                
         QD     22 GLU  HN      8.00                
         QD     24 ASN  QD2     8.87                
         QD     25 VAL  QG1     9.00                
         QD     25 VAL  QG2     9.00                
         QD     25 VAL  QQG     8.04                
         QD     36 VAL  HB      8.00                
         QD     43 ILE  HB      6.80                
         QD     43 ILE  QG2     7.50                
         QD     43 ILE  QD1     9.00                
         QD     54 VAL  QQG     9.06                
         QD     57 ALA  HN      8.00                
         QD     57 ALA  QB      8.20                
         QD     58 GLY  HN      7.70                
         QD     58 GLY  HA1     6.40                
         QD     58 GLY  HA2     6.40                
         QD     58 GLY  QA      6.19                
         QD     59 ALA  HN      8.00                
         QD     60 PHE  QD     10.00                
         QD     60 PHE  QE      9.10                
         QD     63 LEU  HG      8.00                
         QD     63 LEU  QD1     9.00                
         QD     63 LEU  QD2     9.00                
         QD     63 LEU  QQD     8.76                
         QD     65 ILE  QG2     9.00                
         QD     65 ILE  QD1     9.00                
         QE     25 VAL  QQG    10.56                
         QE     43 ILE  HB      8.00                
         QE     43 ILE  QG2     8.00                
         QE     43 ILE  QD1     9.00                
         QE     54 VAL  QQG     8.96                
         QE     57 ALA  QB      9.00                
         QE     63 LEU  QD1     9.00                
         QE     63 LEU  QD2     9.00                
         QE     65 ILE  QG2     9.00                
         QE     65 ILE  QG1     9.00                
         QE     65 ILE  QD1     8.90                
 22 GLU  
         HN     22 GLU  HG2     4.30                
         HN     22 GLU  HG3     4.30                
         HN     22 GLU  QG      3.64                
         HN     23 ARG  HN      3.80                
         HN     36 VAL  QG1     7.00                
         HN     36 VAL  QG2     7.00                
         HN     36 VAL  QQG     6.14                
         HA     24 ASN  HN      5.40                
         HA     25 VAL  HN      4.40                
         HA     25 VAL  HB      3.30                
         HA     25 VAL  QG1     7.00                
         HA     25 VAL  QG2     7.00                
         HA     25 VAL  QQG     6.47                
         HA     26 LYS  HN      4.50                
         HA     34 ALA  QB      6.30                
         HA     36 VAL  QQG     6.96                
         HA     43 ILE  QG1     5.48                
         HB2    23 ARG  HN      4.40                
         HB2    25 VAL  QG1     8.75                
         HB2    25 VAL  QG2     8.75                
         HB2    36 VAL  HN      6.00                
         HB3    23 ARG  HN      4.40                
         HB3    25 VAL  QG1     8.75                
         HB3    25 VAL  QG2     8.75                
         HB3    36 VAL  HN      6.00                
         QB     23 ARG  HN      3.83                
         QB     25 VAL  QQG     7.42                
         QB     36 VAL  HN      5.69                
         HG2    36 VAL  HN      6.00                
         HG3    36 VAL  HN      6.00                
         QG     25 VAL  HN      6.88                
 23 ARG  
         HN     23 ARG  HB2     4.00                
         HN     23 ARG  HB3     4.00                
         HN     23 ARG  QB      3.65                
         HN     23 ARG  QG      5.80                
         HN     23 ARG  QD      7.00                
         HN     24 ASN  HN      3.50                
         HN     25 VAL  HN      4.20                
         HA     26 LYS  HB2     3.60                
         HA     26 LYS  HB3     3.60                
         HA     26 LYS  QB      3.34                
         HA     26 LYS  HG2     4.80                
         HA     26 LYS  HG3     4.80                
         HA     26 LYS  QG      4.52                
         HA     27 GLU  HN      5.30                
         HB2    24 ASN  HN      4.90                
         HB3    24 ASN  HN      4.90                
         QB     24 ASN  HN      4.13                
         QG     24 ASN  HN      7.00                
 24 ASN  
         HN     24 ASN  HB2     4.00                
         HN     24 ASN  HB3     4.00                
         HN     24 ASN  QB      3.65                
         HN     24 ASN  HD21    5.90                
         HN     24 ASN  HD22    5.90                
         HN     24 ASN  QD2     5.59                
         HN     25 VAL  HN      4.30                
         HN     25 VAL  QQG     8.56                
         HN     26 LYS  HN      4.90                
         HN     57 ALA  QB      6.10                
         HA     24 ASN  HD21    5.60                
         HA     24 ASN  HD22    5.60                
         HA     27 GLU  HN      4.40                
         HA     27 GLU  HB2     4.60                
         HA     27 GLU  HB3     4.60                
         HA     27 GLU  QB      4.22                
         HA     27 GLU  HG2     6.00                
         HA     27 GLU  HG3     6.00                
         HA     27 GLU  QG      5.55                
         HB2    25 VAL  HN      4.50                
         HB3    25 VAL  HN      4.50                
         QB     25 VAL  HN      4.21                
         QB     57 ALA  HN      6.88                
         QB     57 ALA  HA      4.88                
         HD21   57 ALA  HN      6.00                
         HD21   57 ALA  HA      6.00                
         HD21   57 ALA  QB      7.00                
         HD21   60 PHE  QD      8.00                
         HD21   60 PHE  QE      8.00                
         HD22   57 ALA  HN      6.00                
         HD22   57 ALA  HA      6.00                
         HD22   57 ALA  QB      7.00                
         HD22   60 PHE  QD      8.00                
         HD22   60 PHE  QE      8.00                
         QD2    57 ALA  QB      6.80                
 25 VAL  
         HN     25 VAL  HB      3.30                
         HN     25 VAL  QG1     4.60                
         HN     25 VAL  QG2     4.60                
         HN     25 VAL  QQG     3.87                
         HN     26 LYS  HN      3.30                
         HN     27 GLU  HN      4.40                
         HN     57 ALA  QB      5.30                
         HA     27 GLU  HN      4.90                
         HA     28 ILE  HN      4.10                
         HA     28 ILE  HB      3.60                
         HA     28 ILE  QG2     6.50                
         HA     28 ILE  QG1     4.88                
         HA     28 ILE  QD1     3.60                
         HB     26 LYS  HN      3.90                
         QG1    26 LYS  HN      5.50                
         QG1    28 ILE  HB      7.00                
         QG1    54 VAL  QG1    11.12                
         QG1    54 VAL  QG2    11.12                
         QG2    26 LYS  HN      5.50                
         QG2    28 ILE  HB      7.00                
         QG2    54 VAL  QG1    11.12                
         QG2    54 VAL  QG2    11.12                
         QQG    26 LYS  HN      5.12                
         QQG    27 GLU  HN      8.56                
         QQG    28 ILE  HN      6.26                
         QQG    28 ILE  HB      6.57                
         QQG    28 ILE  QG2     9.56                
         QQG    28 ILE  QD1     7.96                
         QQG    34 ALA  QB      8.56                
         QQG    36 VAL  QQG     9.32                
         QQG    43 ILE  QG1     6.94                
         QQG    45 VAL  QQG     9.52                
         QQG    54 VAL  HA      6.46                
         QQG    54 VAL  HB      8.56                
         QQG    54 VAL  QQG     8.48                
         QQG    57 ALA  HN      8.56                
         QQG    57 ALA  QB      6.56                
         QQG    58 GLY  HN      8.56                
 26 LYS  
         HN     26 LYS  HG2     5.40                
         HN     26 LYS  HG3     5.40                
         HN     26 LYS  QG      4.99                
         HN     26 LYS  HD2     4.20                
         HN     26 LYS  HD3     4.20                
         HN     26 LYS  QD      4.01                
         HN     27 GLU  HN      3.30                
         HN     28 ILE  QD1     7.00                
         HA     26 LYS  HD2     4.90                
         HA     26 LYS  HD3     4.90                
         HA     26 LYS  QD      4.53                
         HB2    26 LYS  HD2     3.80                
         HB2    26 LYS  HD3     3.80                
         HB2    27 GLU  HN      4.60                
         HB3    26 LYS  HD2     3.80                
         HB3    26 LYS  HD3     3.80                
         HB3    27 GLU  HN      4.60                
         QB     26 LYS  QD      3.00                
         QB     26 LYS  QE      7.88                
         QB     27 GLU  HN      4.17                
         QB     34 ALA  HN      6.88                
         HG2    27 GLU  HN      6.00                
         HG3    27 GLU  HN      6.00                
         QD     27 GLU  HN      6.88                
         QD     34 ALA  HN      6.88                
         QE     34 ALA  HN      7.00                
 27 GLU  
         HN     27 GLU  HB2     3.90                
         HN     27 GLU  HB3     3.90                
         HN     27 GLU  QB      3.50                
         HN     27 GLU  HG2     3.90                
         HN     27 GLU  HG3     3.90                
         HN     27 GLU  QG      3.65                
         HN     28 ILE  HN      3.20                
         HN     28 ILE  QG1     6.88                
         HN     28 ILE  QD1     7.00                
         HA     27 GLU  HG2     3.70                
         HA     27 GLU  HG3     3.70                
         QB     28 ILE  HN      3.98                
         HG2    28 ILE  HN      6.00                
         HG3    28 ILE  HN      6.00                
         QG     28 ILE  HN      5.59                
 28 ILE  
         HN     28 ILE  HB      2.90                
         HN     28 ILE  HG12    4.00                
         HN     28 ILE  HG13    4.00                
         HN     28 ILE  QG1     3.61                
         HN     28 ILE  QD1     4.10                
         HN     29 GLU  HN      5.40                
         HN     31 VAL  QQG     7.56                
         HA     28 ILE  QG1     3.85                
         HA     28 ILE  QD1     4.60                
         HA     29 GLU  HN      2.80                
         HB     29 GLU  HN      4.00                
         HB     31 VAL  HN      4.40                
         HB     31 VAL  QQG     5.86                
         QG2    29 GLU  HN      4.40                
         QG2    30 GLY  HN      5.00                
         QG2    31 VAL  HN      5.00                
         QG2    50 SER  HN      7.00                
         QG2    53 GLN  HE21    5.00                
         QG2    53 GLN  HE22    5.00                
         QG2    54 VAL  HA      7.00                
         HG12   29 GLU  HN      6.00                
         HG12   54 VAL  HA      6.00                
         HG13   29 GLU  HN      6.00                
         HG13   54 VAL  HA      6.00                
         QG1    31 VAL  HN      6.78                
         QG1    31 VAL  QQG     6.04                
         QG1    54 VAL  HA      5.79                
         QD1    29 GLU  HN      6.90                
         QD1    53 GLN  QE2     7.87                
         QD1    54 VAL  HA      4.60                
 29 GLU  
         HN     29 GLU  HB2     3.30                
         HN     29 GLU  HB3     3.30                
         HN     29 GLU  HG2     4.50                
         HN     29 GLU  HG3     4.50                
         HN     30 GLY  HN      4.40                
         HN     31 VAL  QQG     8.56                
         HA     29 GLU  QG      4.00                
         HA     30 GLY  HN      3.30                
         HA     31 VAL  HN      4.00                
         HB2    30 GLY  HN      4.50                
         HB3    30 GLY  HN      4.50                
         QB     30 GLY  HN      4.26                
         HG2    30 GLY  HN      6.00                
         HG3    30 GLY  HN      6.00                
 30 GLY  
         HN     31 VAL  HN      3.30                
         HN     31 VAL  HA      5.70                
         HN     31 VAL  QQG     8.56                
 31 VAL  
         HN     31 VAL  HB      3.00                
         HN     31 VAL  QG1     4.40                
         HN     31 VAL  QG2     4.40                
         HN     31 VAL  QQG     4.01                
         HN     32 THR  HN      5.60                
         HA     32 THR  HN      2.80                
         HB     32 THR  HN      5.40                
         QG1    32 THR  HN      6.20                
         QG1    33 GLU  HN      5.20                
         QG1    34 ALA  HN      7.00                
         QG1    49 ALA  HN      6.90                
         QG2    32 THR  HN      6.20                
         QG2    33 GLU  HN      5.20                
         QG2    34 ALA  HN      7.00                
         QG2    49 ALA  HN      6.90                
         QQG    32 THR  HN      5.02                
         QQG    33 GLU  HN      4.11                
         QQG    34 ALA  HN      6.52                
         QQG    45 VAL  HB      8.56                
         QQG    45 VAL  QQG     8.22                
         QQG    47 GLY  HN      8.56                
         QQG    49 ALA  HN      6.62                
 32 THR  
         HN     32 THR  QG2     4.20                
         HN     33 GLU  HN      3.00                
         HN     46 THR  HB      6.00                
         HN     47 GLY  HA1     4.00                
         HN     47 GLY  HA2     4.00                
         HN     47 GLY  QA      3.65                
         HA     33 GLU  HN      3.60                
         HB     33 GLU  HN      4.30                
         QG2    33 GLU  HN      5.10                
 33 GLU  
         HN     33 GLU  HB2     4.00                
         HN     33 GLU  HB3     4.00                
         HN     33 GLU  HG2     4.00                
         HN     33 GLU  HG3     4.00                
         HN     34 ALA  HN      4.70                
         HN     34 ALA  HA      6.00                
         HN     46 THR  HN      3.20                
         HN     46 THR  HB      4.20                
         HN     46 THR  QG2     5.00                
         HN     47 GLY  HA1     3.70                
         HN     47 GLY  HA2     3.70                
         HN     47 GLY  QA      3.44                
         HA     34 ALA  HN      2.80                
         HB2    34 ALA  HN      5.00                
         HB2    46 THR  HN      6.00                
         HB3    34 ALA  HN      5.00                
         HB3    46 THR  HN      6.00                
         QB     34 ALA  HN      4.40                
         HG2    34 ALA  HN      5.90                
         HG3    34 ALA  HN      5.90                
         QG     34 ALA  HN      5.64                
 34 ALA  
         HN     35 ILE  HN      5.10                
         HN     35 ILE  QG1     6.88                
         HA     35 ILE  HN      2.90                
         HA     45 VAL  HA      3.00                
         HA     45 VAL  QG1     7.00                
         HA     45 VAL  QG2     7.00                
         HA     45 VAL  QQG     6.72                
         HA     46 THR  HN      3.50                
         QB     35 ILE  HN      4.40                
         QB     45 VAL  HA      5.30                
         QB     45 VAL  QQG     6.36                
 35 ILE  
         HN     35 ILE  HB      3.60                
         HN     35 ILE  HG12    4.30                
         HN     35 ILE  HG13    4.30                
         HN     35 ILE  QG1     4.11                
         HN     35 ILE  QD1     4.30                
         HN     36 VAL  HN      4.80                
         HN     44 THR  HN      3.20                
         HN     44 THR  HB      5.80                
         HN     44 THR  QG2     4.60                
         HN     45 VAL  HA      3.80                
         HN     45 VAL  HB      6.00                
         HA     35 ILE  QD1     4.70                
         HA     36 VAL  HN      3.00                
         HB     36 VAL  HN      4.80                
         HB     44 THR  HN      5.70                
         QG2    36 VAL  HN      6.50                
         HG12   36 VAL  HN      6.00                
         HG13   36 VAL  HN      6.00                
         QG1    44 THR  HN      6.18                
         QD1    36 VAL  HN      7.00                
         QD1    44 THR  HN      7.00                
 36 VAL  
         HN     36 VAL  HB      3.70                
         HN     37 ASN  HN      5.30                
         HN     43 ILE  QG1     6.88                
         HA     37 ASN  HN      2.90                
         HA     43 ILE  HN      6.00                
         HA     43 ILE  HA      2.70                
         HA     43 ILE  HB      4.10                
         HA     43 ILE  HG12    5.50                
         HA     43 ILE  HG13    5.50                
         HA     43 ILE  QG1     5.23                
         HA     44 THR  HN      3.70                
         HB     37 ASN  HN      5.30                
         HB     43 ILE  HA      6.00                
         HB     43 ILE  HG12    5.40                
         HB     43 ILE  HG13    5.40                
         HB     43 ILE  QG1     4.80                
         QG1    37 ASN  HN      5.40                
         QG1    43 ILE  HG12    7.00                
         QG1    43 ILE  HG13    7.00                
         QG1    54 VAL  QG1    10.32                
         QG1    54 VAL  QG2    10.32                
         QG2    37 ASN  HN      5.40                
         QG2    43 ILE  HG12    7.00                
         QG2    43 ILE  HG13    7.00                
         QG2    54 VAL  QG1    10.32                
         QG2    54 VAL  QG2    10.32                
         QQG    37 ASN  HN      5.02                
         QQG    38 PHE  HN      8.56                
         QQG    38 PHE  QD     10.56                
         QQG    38 PHE  QE      8.26                
         QQG    42 LYS  HN      8.56                
         QQG    42 LYS  HA      8.56                
         QQG    43 ILE  HA      7.66                
         QQG    43 ILE  HB      6.56                
         QQG    43 ILE  QG1     5.90                
         QQG    54 VAL  QQG     8.13                
 37 ASN  
         HN     37 ASN  HB2     4.10                
         HN     37 ASN  HB3     4.10                
         HN     37 ASN  QB      3.85                
         HN     38 PHE  HN      4.30                
         HN     42 LYS  HN      3.60                
         HN     42 LYS  QB      6.88                
         HN     42 LYS  HG2     6.00                
         HN     42 LYS  HG3     6.00                
         HN     42 LYS  QD      7.00                
         HN     43 ILE  HA      3.40                
         HN     43 ILE  HB      6.00                
         HN     43 ILE  QD1     6.80                
         HA     37 ASN  HD21    6.00                
         HA     37 ASN  HD22    6.00                
         HA     38 PHE  HN      3.60                
         HB2    38 PHE  HN      6.00                
         HB2    40 ALA  HN      6.00                
         HB2    42 LYS  HN      6.00                
         HB2    42 LYS  HG2     6.75                
         HB2    42 LYS  HG3     6.75                
         HB3    38 PHE  HN      6.00                
         HB3    40 ALA  HN      6.00                
         HB3    42 LYS  HN      6.00                
         HB3    42 LYS  HG2     6.75                
         HB3    42 LYS  HG3     6.75                
         QB     40 ALA  HN      5.79                
         QB     42 LYS  HN      5.84                
         QB     42 LYS  QB      6.15                
         QB     42 LYS  QG      5.37                
         QB     42 LYS  QD      7.88                
         HD21   42 LYS  HG2     7.65                
         HD21   42 LYS  HG3     7.65                
         HD22   42 LYS  HG2     7.65                
         HD22   42 LYS  HG3     7.65                
         QD2    42 LYS  QG      6.52                
 38 PHE  
         HN     38 PHE  QE      7.00                
         HN     39 GLY  HN      5.20                
         HA     40 ALA  HN      6.00                
         HA     41 SER  HN      5.30                
         HB2    39 GLY  HN      5.50                
         HB2    39 GLY  HA1     7.05                
         HB2    39 GLY  HA2     7.05                
         HB3    39 GLY  HN      5.50                
         HB3    39 GLY  HA1     7.05                
         HB3    39 GLY  HA2     7.05                
         QB     39 GLY  QA      5.49                
         QD     39 GLY  HN      8.00                
         QD     39 GLY  QA      8.88                
         QD     65 ILE  QG1     8.68                
         QE     39 GLY  QA      8.88                
         QE     43 ILE  QG1     8.68                
         QE     43 ILE  QD1     9.00                
         QE     54 VAL  QQG     8.36                
         QE     63 LEU  QD1     9.00                
         QE     63 LEU  QD2     9.00                
         QE     63 LEU  QQD     8.04                
         QE     65 ILE  QG2     9.00                
         QE     65 ILE  QG1     8.18                
         QE     65 ILE  QD1     8.70                
 39 GLY  
         HN     40 ALA  HN      4.20                
 40 ALA  
         HN     40 ALA  QB      3.60                
         HN     41 SER  HN      3.20                
         HN     41 SER  HA      5.20                
 41 SER  
         HN     42 LYS  QD      7.00                
         HA     42 LYS  HN      3.40                
 42 LYS  
         HN     42 LYS  QB      3.91                
         HN     42 LYS  HG2     4.30                
         HN     42 LYS  HG3     4.30                
         HN     42 LYS  QG      4.11                
         HN     42 LYS  QD      6.10                
         HN     43 ILE  HN      5.00                
         HN     43 ILE  QG2     7.00                
         HA     42 LYS  QD      6.80                
         HA     43 ILE  HN      2.90                
         HB2    43 ILE  HN      3.80                
         HB3    43 ILE  HN      3.80                
         HG2    43 ILE  HN      6.00                
         HG3    43 ILE  HN      6.00                
         QD     43 ILE  HN      7.00                
 43 ILE  
         HN     43 ILE  QG2     3.70                
         HN     43 ILE  HG12    6.00                
         HN     43 ILE  HG13    6.00                
         HN     43 ILE  QG1     5.55                
         HN     43 ILE  QD1     5.30                
         HN     44 THR  HN      4.80                
         HA     44 THR  HN      2.90                
         HB     44 THR  HN      4.40                
         QG2    44 THR  HN      7.00                
         QG2    65 ILE  QG2     8.00                
         QG2    65 ILE  QD1     7.90                
         HG12   44 THR  HN      6.00                
         HG12   65 ILE  QD1     7.00                
         HG13   44 THR  HN      6.00                
         HG13   65 ILE  QD1     7.00                
         QG1    44 THR  HN      5.74                
         QG1    45 VAL  HN      6.88                
         QG1    54 VAL  HB      5.08                
         QG1    54 VAL  QQG     9.04                
         QG1    65 ILE  QG2     7.88                
         QG1    65 ILE  QG1     7.05                
         QD1    44 THR  HN      6.50                
 44 THR  
         HN     44 THR  HB      3.50                
         HN     45 VAL  HN      5.00                
         HA     45 VAL  HN      2.80                
         HB     45 VAL  HN      5.70                
         QG2    45 VAL  HN      4.40                
 45 VAL  
         HN     45 VAL  HB      3.30                
         HN     45 VAL  QG1     4.80                
         HN     45 VAL  QG2     4.80                
         HN     45 VAL  QQG     4.13                
         HN     46 THR  HN      4.40                
         HA     46 THR  HN      2.80                
         HB     46 THR  HN      4.90                
         QG1    46 THR  HN      6.00                
         QG2    46 THR  HN      6.00                
         QQG    46 THR  HN      4.90                
         QQG    47 GLY  HN      8.56                
 46 THR  
         HN     46 THR  HB      3.30                
         HN     46 THR  QG2     4.50                
         HN     47 GLY  HN      4.70                
         HB     47 GLY  HN      4.70                
         QG2    47 GLY  HN      3.90                
 47 GLY  
         HN     48 GLU  HN      3.60                
         HN     48 GLU  QB      6.88                
         HA1    48 GLU  HN      3.60                
         HA2    48 GLU  HN      3.60                
 48 GLU  
         HN     48 GLU  HB2     3.60                
         HN     48 GLU  HB3     3.60                
         HN     48 GLU  QG      5.50                
         HA     49 ALA  HN      2.70                
         HB2    49 ALA  HN      6.00                
         HB3    49 ALA  HN      6.00                
         QG     49 ALA  HN      7.00                
 49 ALA  
         HN     49 ALA  QB      3.60                
         HN     50 SER  HN      4.70                
         HA     50 SER  HN      2.80                
         HA     53 GLN  QE2     6.87                
         QB     50 SER  HN      3.80                
         QB     53 GLN  HN      5.80                
         QB     53 GLN  QB      7.88                
         QB     53 GLN  QG      7.78                
         QB     53 GLN  QE2     7.87                
         QB     54 VAL  HN      7.00                
 50 SER  
         HN     50 SER  HB2     4.00                
         HN     50 SER  HB3     4.00                
         HN     50 SER  QB      3.61                
         HN     51 ILE  HN      4.50                
         HN     53 GLN  HN      4.70                
         HN     53 GLN  QB      4.98                
         HN     53 GLN  HG2     6.00                
         HN     53 GLN  HG3     6.00                
         HN     53 GLN  QG      5.23                
         HN     53 GLN  HE21    6.00                
         HN     53 GLN  HE22    6.00                
         HN     54 VAL  QQG     7.96                
         HA     51 ILE  HN      3.00                
         HA     52 GLN  HN      5.00                
         HB2    51 ILE  HN      4.10                
         HB2    52 GLN  HN      4.10                
         HB2    53 GLN  HN      4.90                
         HB3    51 ILE  HN      4.10                
         HB3    52 GLN  HN      4.10                
         HB3    53 GLN  HN      4.90                
         QB     51 ILE  HN      3.71                
         QB     52 GLN  HN      3.81                
         QB     53 GLN  HN      4.48                
 51 ILE  
         HN     51 ILE  HB      3.20                
         HN     51 ILE  QG2     3.90                
         HN     51 ILE  HG12    5.00                
         HN     51 ILE  HG13    5.00                
         HN     51 ILE  QG1     4.40                
         HN     51 ILE  QD1     7.00                
         HN     52 GLN  HN      3.60                
         HN     53 GLN  HN      5.40                
         HA     51 ILE  QG1     3.99                
         HA     54 VAL  HN      4.10                
         HA     54 VAL  HB      3.00                
         HA     54 VAL  QG1     7.00                
         HA     54 VAL  QG2     7.00                
         HA     54 VAL  QQG     6.38                
         HA     55 GLU  HN      3.90                
         HA     65 ILE  QG2     7.00                
         HA     65 ILE  QD1     7.00                
         HB     52 GLN  HN      4.00                
         HB     65 ILE  HB      5.90                
         HB     65 ILE  QG2     7.00                
         HB     65 ILE  QG1     6.38                
         QG2    52 GLN  HN      3.80                
         QG2    52 GLN  HE21    7.00                
         QG2    52 GLN  HE22    7.00                
         QG2    53 GLN  HN      6.40                
         QG2    54 VAL  HN      7.00                
         QG2    55 GLU  HN      5.60                
         QG2    55 GLU  HA      5.80                
         QG2    65 ILE  QG2     8.00                
         QG2    65 ILE  QD1     7.50                
         HG12   52 GLN  HN      6.00                
         HG12   65 ILE  HB      5.60                
         HG12   65 ILE  QG2     6.00                
         HG12   65 ILE  QD1     7.00                
         HG13   52 GLN  HN      6.00                
         HG13   65 ILE  HB      5.60                
         HG13   65 ILE  QG2     6.00                
         HG13   65 ILE  QD1     7.00                
         QG1    55 GLU  HN      6.88                
         QG1    65 ILE  HB      5.24                
         QG1    65 ILE  QG2     5.79                
         QG1    65 ILE  QD1     6.80                
         QD1    52 GLN  HN      7.00                
         QD1    54 VAL  HN      5.70                
         QD1    55 GLU  HN      5.50                
         QD1    65 ILE  HB      5.70                
         QD1    65 ILE  QG2     5.80                
         QD1    65 ILE  QD1     6.30                
 52 GLN  
         HN     52 GLN  HB2     3.60                
         HN     52 GLN  HB3     3.60                
         HN     52 GLN  QB      3.29                
         HN     52 GLN  HG2     4.00                
         HN     52 GLN  HG3     4.00                
         HN     53 GLN  HN      3.20                
         HN     54 VAL  HN      5.10                
         HA     52 GLN  QG      4.00                
         HA     55 GLU  HN      3.90                
         HA     55 GLU  HB2     3.40                
         HA     55 GLU  HB3     3.40                
         HA     55 GLU  QB      3.13                
         HA     56 GLN  HN      4.80                
         HB2    53 GLN  HN      4.30                
         HB3    53 GLN  HN      4.30                
         HG2    53 GLN  HN      5.20                
         HG3    53 GLN  HN      5.20                
         QG     53 GLN  HN      4.88                
 53 GLN  
         HN     53 GLN  HG2     3.80                
         HN     53 GLN  HG3     3.80                
         HN     53 GLN  QG      3.36                
         HN     54 VAL  HN      3.10                
         HN     54 VAL  QQG     7.26                
         HN     55 GLU  HN      4.80                
         HA     53 GLN  HG2     4.00                
         HA     53 GLN  HG3     4.00                
         HA     53 GLN  QG      3.70                
         HA     53 GLN  HE21    5.80                
         HA     53 GLN  HE22    5.80                
         HA     53 GLN  QE2     5.21                
         HA     55 GLU  HN      5.00                
         HA     56 GLN  HN      4.30                
         HA     56 GLN  HB2     3.70                
         HA     56 GLN  HB3     3.70                
         HA     56 GLN  QB      3.49                
         HA     57 ALA  HN      5.00                
         HB2    53 GLN  HE21    6.05                
         HB2    53 GLN  HE22    6.05                
         HB2    54 VAL  HN      4.80                
         HB3    53 GLN  HE21    6.05                
         HB3    53 GLN  HE22    6.05                
         HB3    54 VAL  HN      4.80                
         QB     54 VAL  HN      4.38                
         HG2    54 VAL  HN      6.00                
         HG3    54 VAL  HN      6.00                
         QG     54 VAL  HN      5.32                
 54 VAL  
         HN     54 VAL  HB      3.20                
         HN     54 VAL  QG1     4.90                
         HN     54 VAL  QG2     4.90                
         HN     54 VAL  QQG     4.05                
         HN     55 GLU  HN      3.20                
         HN     56 GLN  HN      5.90                
         HN     65 ILE  QD1     7.00                
         HA     57 ALA  HN      3.90                
         HA     57 ALA  QB      3.70                
         HA     58 GLY  HN      6.00                
         HB     55 GLU  HN      3.30                
         QQG    55 GLU  HN      6.96                
         QQG    57 ALA  HN      8.56                
         QQG    58 GLY  HN      8.56                
 55 GLU  
         HN     55 GLU  HB2     3.40                
         HN     55 GLU  HB3     3.40                
         HN     55 GLU  QB      3.08                
         HN     55 GLU  HG2     5.10                
         HN     55 GLU  HG3     5.10                
         HN     55 GLU  QG      4.29                
         HN     56 GLN  HN      3.30                
         HN     57 ALA  HN      4.70                
         HN     65 ILE  QG1     7.00                
         HN     65 ILE  QD1     5.70                
         HA     58 GLY  HN      4.40                
         HA     59 ALA  HN      6.00                
         HA     65 ILE  QG2     7.00                
         HA     65 ILE  QD1     7.00                
         HB2    56 GLN  HN      3.70                
         HB3    56 GLN  HN      3.70                
         QB     56 GLN  HN      3.49                
         QB     65 ILE  HN      6.88                
         QB     65 ILE  QG2     7.88                
         QB     65 ILE  QD1     7.88                
         QG     65 ILE  HN      6.88                
         QG     65 ILE  QG2     7.88                
         QG     65 ILE  QD1     7.88                
 56 GLN  
         HN     56 GLN  HB2     3.40                
         HN     56 GLN  HB3     3.40                
         HN     56 GLN  QB      3.18                
         HN     56 GLN  HG2     4.60                
         HN     56 GLN  HG3     4.60                
         HN     56 GLN  QG      4.42                
         HN     56 GLN  QE2     6.87                
         HN     57 ALA  HN      3.20                
         HN     58 GLY  HN      4.60                
         HA     58 GLY  HN      4.70                
         HA     59 ALA  HN      3.80                
         HA     59 ALA  QB      3.80                
         HB2    57 ALA  HN      4.10                
         HB3    57 ALA  HN      4.10                
         QB     57 ALA  HN      3.76                
         HG2    57 ALA  HN      6.00                
         HG3    57 ALA  HN      6.00                
 57 ALA  
         HN     57 ALA  QB      3.40                
         HN     58 GLY  HN      2.90                
         HA     60 PHE  QD      6.40                
         HA     60 PHE  QE      6.40                
         QB     58 GLY  HN      4.00                
         QB     60 PHE  QD      9.00                
         QB     60 PHE  QE      9.00                
 58 GLY  
         HN     59 ALA  HN      3.40                
         HN     59 ALA  QB      5.50                
         HN     63 LEU  HN      5.40                
         HN     63 LEU  QQD     8.57                
         HN     65 ILE  QG1     6.88                
         HN     65 ILE  QD1     7.00                
         HA1    63 LEU  HB2     6.95                
         HA1    63 LEU  HB3     6.95                
         HA1    63 LEU  QD1     8.44                
         HA1    63 LEU  QD2     8.44                
         HA2    63 LEU  HB2     6.95                
         HA2    63 LEU  HB3     6.95                
         HA2    63 LEU  QD1     8.44                
         HA2    63 LEU  QD2     8.44                
         QA     60 PHE  QD      8.28                
         QA     60 PHE  QE      7.88                
         QA     63 LEU  HN      5.98                
         QA     63 LEU  QB      5.67                
         QA     63 LEU  HG      6.28                
         QA     63 LEU  QQD     6.31                
 59 ALA  
         HN     59 ALA  QB      3.40                
         HN     60 PHE  HN      3.90                
         HN     61 GLU  HN      5.20                
         HA     61 GLU  HN      4.70                
         HA     62 HIS  HN      4.40                
         QB     60 PHE  HN      4.40                
         QB     60 PHE  QD      9.00                
         QB     60 PHE  QE      9.00                
         QB     61 GLU  HN      5.60                
         QB     62 HIS  HN      5.20                
         QB     63 LEU  HN      7.00                
 60 PHE  
         HN     60 PHE  QE      6.10                
         HN     61 GLU  HN      4.30                
         HN     63 LEU  QQD     8.57                
         QD     61 GLU  HN      8.00                
         QD     61 GLU  HA      8.00                
         QD     61 GLU  HB2     8.00                
         QD     61 GLU  HB3     8.00                
         QD     61 GLU  QB      7.56                
         QD     61 GLU  HG2     7.70                
         QD     61 GLU  HG3     7.70                
         QD     61 GLU  QG      7.35                
         QD     63 LEU  QQD    10.57                
         QE     61 GLU  HN      7.50                
         QE     61 GLU  HB2     8.00                
         QE     61 GLU  HB3     8.00                
         QE     61 GLU  QB      7.47                
         QE     61 GLU  HG2     8.00                
         QE     61 GLU  HG3     8.00                
         QE     61 GLU  QG      7.85                
         QE     63 LEU  HG      8.00                
         QE     63 LEU  QD1     9.00                
         QE     63 LEU  QD2     9.00                
         HZ     63 LEU  QQD     8.57                
 61 GLU  
         HN     61 GLU  HB2     3.90                
         HN     61 GLU  HB3     3.90                
         HN     61 GLU  QB      3.65                
         HN     61 GLU  HG2     5.30                
         HN     61 GLU  HG3     5.30                
         HN     61 GLU  QG      5.08                
         HN     62 HIS  HN      3.20                
         HN     62 HIS  HA      4.50                
         HN     63 LEU  HN      4.30                
         HN     63 LEU  HG      6.00                
         HN     63 LEU  QD1     7.00                
         HN     63 LEU  QD2     7.00                
         HA     62 HIS  HD2     4.80                
         HB2    62 HIS  HN      6.00                
         HB2    63 LEU  QD1     8.05                
         HB2    63 LEU  QD2     8.05                
         HB3    62 HIS  HN      6.00                
         HB3    63 LEU  QD1     8.05                
         HB3    63 LEU  QD2     8.05                
         QB     63 LEU  HN      6.18                
         QB     63 LEU  QQD     6.88                
 62 HIS  
         HN     62 HIS  HD2     5.50                
         HN     63 LEU  HN      3.80                
         HN     63 LEU  QB      6.08                
         HN     63 LEU  HG      6.00                
         HN     63 LEU  QQD     8.57                
         HA     62 HIS  HD2     6.00                
         HA     62 HIS  HE1     5.70                
         HA     63 LEU  HN      3.60                
         QB     63 LEU  HN      6.40                
 63 LEU  
         HN     63 LEU  QB      3.54                
         HN     63 LEU  HG      4.00                
         HN     63 LEU  QD1     4.70                
         HN     63 LEU  QD2     4.70                
         HN     63 LEU  QQD     4.33                
         HN     64 LYS  HN      5.00                
         HN     65 ILE  QD1     7.00                
         HA     63 LEU  HG      3.80                
         HA     63 LEU  QD1     6.90                
         HA     63 LEU  QD2     6.90                
         HA     64 LYS  HN      2.90                
         QB     64 LYS  HN      4.98                
         QB     65 ILE  QG1     6.15                
         HG     64 LYS  HN      6.00                
         HG     65 ILE  QG1     4.98                
         QD1    64 LYS  HN      7.00                
         QD2    64 LYS  HN      7.00                
         QQD    64 LYS  HN      6.10                
         QQD    65 ILE  QD1     9.57                
 64 LYS  
         HN     64 LYS  HG2     4.50                
         HN     64 LYS  HG3     4.50                
         HN     64 LYS  QG      4.21                
         HN     64 LYS  HD2     4.00                
         HN     64 LYS  HD3     4.00                
         HN     64 LYS  QD      3.80                
         HN     65 ILE  HN      4.70                
         HA     64 LYS  HD2     5.10                
         HA     64 LYS  HD3     5.10                
         HA     64 LYS  QD      4.68                
         HA     65 ILE  HN      2.70                
         QB     65 ILE  HN      6.00                
         HG2    65 ILE  HN      6.00                
         HG3    65 ILE  HN      6.00                
         QG     65 ILE  HN      5.74                
         HD2    65 ILE  HN      6.00                
         HD3    65 ILE  HN      6.00                
         QD     65 ILE  HN      5.64                
 65 ILE  
         HN     65 ILE  HB      3.40                
         HN     65 ILE  HG12    5.50                
         HN     65 ILE  HG13    5.50                
         HN     65 ILE  QG1     4.77                
         HN     65 ILE  QD1     7.00                
         HA     65 ILE  QD1     4.80                
         HA     66 ILE  HN      3.20                
         HB     66 ILE  HN      6.00                
         QG2    66 ILE  HN      6.70                
         QD1    66 ILE  HN      6.40                
 66 ILE  
         HN     66 ILE  HB      3.80                
         HN     66 ILE  HG12    4.90                
         HN     66 ILE  HG13    4.90                
         HN     66 ILE  QG1     4.62                
         HN     66 ILE  QD1     5.10                
         HN     67 PRO  QD      6.88                
         HN     68 GLU  HN      5.30                
 67 PRO  
         HA     68 GLU  HN      3.00                
         QG     68 GLU  HN      5.56                
 68 GLU  
         HN     68 GLU  HB2     3.60                
         HN     68 GLU  HB3     3.60                
         HN     68 GLU  QB      3.39                
         HN     68 GLU  HG2     4.40                
         HN     68 GLU  HG3     4.40                
         HN     68 GLU  QG      4.11                

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    MET   1           H1       MET   1 -16.052  -8.869  -9.786
    2   2H    MET   1           H2       MET   1 -15.868 -10.428 -10.338
    3   3H    MET   1           H3       MET   1 -14.552  -9.529  -9.957
    4    HA   MET   1           HA       MET   1 -14.597  -9.585 -12.232
    5   1HB   MET   1          2HB       MET   1 -17.411  -8.422 -12.164
    6   2HB   MET   1          3HB       MET   1 -16.409  -8.797 -13.571
    7   1HG   MET   1          2HG       MET   1 -16.473 -11.260 -12.706
    8   2HG   MET   1          3HG       MET   1 -17.835 -10.688 -11.716
    9   1HE   MET   1          1HE       MET   1 -18.528 -13.027 -13.404
   10   2HE   MET   1          2HE       MET   1 -19.822 -12.033 -12.681
   11   3HE   MET   1          3HE       MET   1 -19.912 -12.499 -14.393
   12    H    ALA   2           H        ALA   2 -13.227  -8.106 -10.673
   13    HA   ALA   2           HA       ALA   2 -13.027  -5.489 -11.742
   14   1HB   ALA   2          1HB       ALA   2 -13.646  -4.139  -9.748
   15   2HB   ALA   2          2HB       ALA   2 -15.058  -4.916 -10.462
   16   3HB   ALA   2          3HB       ALA   2 -14.339  -5.579  -8.979
   17    H    GLU   3           H        GLU   3 -12.671  -7.305  -8.656
   18    HA   GLU   3           HA       GLU   3 -10.899  -7.642  -7.285
   19   1HB   GLU   3          2HB       GLU   3 -10.059  -8.436 -10.084
   20   2HB   GLU   3          3HB       GLU   3  -9.146  -8.890  -8.642
   21   1HG   GLU   3          2HG       GLU   3 -10.715 -10.672  -9.304
   22   2HG   GLU   3          3HG       GLU   3 -11.057 -10.063  -7.684
   23    H    LYS   4           H        LYS   4 -11.075  -5.101  -7.439
   24    HA   LYS   4           HA       LYS   4  -8.344  -4.075  -7.193
   25   1HB   LYS   4          2HB       LYS   4  -8.947  -1.981  -8.284
   26   2HB   LYS   4          3HB       LYS   4  -9.196  -3.322  -9.411
   27   1HG   LYS   4          2HG       LYS   4 -11.673  -3.266  -8.725
   28   2HG   LYS   4          3HG       LYS   4 -11.307  -1.746  -7.886
   29   1HD   LYS   4          2HD       LYS   4 -10.351  -0.886 -10.086
   30   2HD   LYS   4          3HD       LYS   4 -10.959  -2.373 -10.848
   31   1HE   LYS   4          2HE       LYS   4 -13.288  -1.759 -10.050
   32   2HE   LYS   4          3HE       LYS   4 -12.633  -0.247  -9.402
   33   1HZ   LYS   4          1HZ       LYS   4 -12.625  -1.054 -12.237
   34   2HZ   LYS   4          2HZ       LYS   4 -13.607   0.071 -11.551
   35   3HZ   LYS   4          3HZ       LYS   4 -11.990   0.347 -11.649
   36    H    THR   5           H        THR   5  -8.219  -2.607  -5.359
   37    HA   THR   5           HA       THR   5 -10.703  -1.867  -4.017
   38    HB   THR   5           HB       THR   5  -8.671  -3.766  -2.699
   39    HG1  THR   5           1HG      THR   5 -11.004  -3.944  -3.990
   40   1HG2  THR   5          1HG2      THR   5  -9.497  -2.170  -0.988
   41   2HG2  THR   5          2HG2      THR   5 -11.164  -2.387  -1.564
   42   3HG2  THR   5          3HG2      THR   5 -10.308  -3.725  -0.782
   43    H    VAL   6           H        VAL   6 -10.255  -0.229  -2.455
   44    HA   VAL   6           HA       VAL   6  -7.480   0.354  -2.200
   45    HB   VAL   6           HB       VAL   6  -8.161   1.845  -3.911
   46   1HG1  VAL   6          1HG1      VAL   6 -10.006   3.410  -3.846
   47   2HG1  VAL   6          2HG1      VAL   6 -10.535   1.731  -3.855
   48   3HG1  VAL   6          3HG1      VAL   6 -10.596   2.665  -2.335
   49   1HG2  VAL   6          1HG2      VAL   6  -8.418   3.543  -1.393
   50   2HG2  VAL   6          2HG2      VAL   6  -6.862   2.976  -2.027
   51   3HG2  VAL   6          3HG2      VAL   6  -7.850   4.083  -2.992
   52    H    TYR   7           H        TYR   7  -6.798   1.098  -0.289
   53    HA   TYR   7           HA       TYR   7  -8.798   0.928   1.938
   54   1HB   TYR   7          2HB       TYR   7  -5.867   0.139   2.013
   55   2HB   TYR   7          3HB       TYR   7  -7.092  -0.076   3.257
   56    HD1  TYR   7           HD1      TYR   7  -7.917  -2.227   3.541
   57    HD2  TYR   7           HD2      TYR   7  -6.187  -1.170  -0.246
   58    HE1  TYR   7           HE1      TYR   7  -8.422  -4.497   2.679
   59    HE2  TYR   7           HE2      TYR   7  -6.644  -3.442  -1.090
   60    HH   TYR   7           HH       TYR   7  -7.751  -5.462  -0.673
   61    H    ARG   8           H        ARG   8  -8.271   2.384   3.754
   62    HA   ARG   8           HA       ARG   8  -7.110   4.913   2.695
   63   1HB   ARG   8          2HB       ARG   8  -9.318   4.250   4.385
   64   2HB   ARG   8          3HB       ARG   8  -8.111   4.985   5.452
   65   1HG   ARG   8          2HG       ARG   8  -7.953   6.917   3.855
   66   2HG   ARG   8          3HG       ARG   8  -9.257   6.192   2.898
   67   1HD   ARG   8          2HD       ARG   8  -9.449   7.110   5.819
   68   2HD   ARG   8          3HD       ARG   8 -10.053   7.966   4.419
   69    HE   ARG   8           HE       ARG   8 -11.810   6.508   4.117
   70   1HH1  ARG   8          2HH2      ARG   8  -9.790   5.295   6.743
   71   2HH1  ARG   8          1HH2      ARG   8 -11.032   4.318   7.462
   72   1HH2  ARG   8          2HH1      ARG   8 -13.488   5.249   5.057
   73   2HH2  ARG   8          1HH1      ARG   8 -13.184   4.302   6.474
   74    H    VAL   9           H        VAL   9  -5.090   5.722   3.514
   75    HA   VAL   9           HA       VAL   9  -3.862   4.185   5.749
   76    HB   VAL   9           HB       VAL   9  -2.873   3.260   3.750
   77   1HG1  VAL   9          1HG1      VAL   9  -3.210   5.045   2.109
   78   2HG1  VAL   9          2HG1      VAL   9  -2.070   6.093   2.973
   79   3HG1  VAL   9          3HG1      VAL   9  -1.506   4.599   2.199
   80   1HG2  VAL   9          1HG2      VAL   9  -1.510   3.836   5.855
   81   2HG2  VAL   9          2HG2      VAL   9  -0.664   3.446   4.360
   82   3HG2  VAL   9          3HG2      VAL   9  -0.811   5.144   4.879
   83    H    ASP  10           H        ASP  10  -2.447   5.351   7.104
   84    HA   ASP  10           HA       ASP  10  -2.277   8.264   6.574
   85   1HB   ASP  10          2HB       ASP  10  -4.367   7.752   8.011
   86   2HB   ASP  10          3HB       ASP  10  -3.279   7.032   9.136
   87    H    GLY  11           H        GLY  11  -0.636   9.228   7.806
   88   1HA   GLY  11          1HA       GLY  11   0.986   9.024   9.608
   89   2HA   GLY  11          2HA       GLY  11   1.427   7.411   9.034
   90    H    LEU  12           H        LEU  12   2.294   7.313   6.752
   91    HA   LEU  12           HA       LEU  12   4.542   9.125   6.796
   92   1HB   LEU  12          2HB       LEU  12   5.648   7.793   5.290
   93   2HB   LEU  12          3HB       LEU  12   4.679   6.680   6.228
   94    HG   LEU  12           HG       LEU  12   2.965   6.827   4.267
   95   1HD1  LEU  12          1HD1      LEU  12   5.484   8.005   2.982
   96   2HD1  LEU  12          2HD1      LEU  12   4.267   7.156   2.015
   97   3HD1  LEU  12          3HD1      LEU  12   3.845   8.640   2.828
   98   1HD2  LEU  12          1HD2      LEU  12   5.668   5.474   4.036
   99   2HD2  LEU  12          2HD2      LEU  12   4.139   4.831   4.658
  100   3HD2  LEU  12          3HD2      LEU  12   4.299   5.139   2.942
  101    H    SER  13           H        SER  13   5.280  10.535   5.167
  102    HA   SER  13           HA       SER  13   3.330  11.486   3.144
  103   1HB   SER  13          2HB       SER  13   3.836  13.843   4.149
  104   2HB   SER  13          3HB       SER  13   2.679  12.810   5.002
  105    HG   SER  13           HG       SER  13   4.167  12.293   6.508
  106    H    CYS  14           H        CYS  14   5.198  10.168   2.050
  107    HA   CYS  14           HA       CYS  14   6.788  12.266   0.790
  108   1HB   CYS  14          2HB       CYS  14   8.299  11.654   2.629
  109   2HB   CYS  14          3HB       CYS  14   8.214   9.941   2.147
  110    HG   CYS  14           HG       CYS  14  10.473  10.981   1.352
  111    H    THR  15           H        THR  15   6.614  11.942  -1.349
  112    HA   THR  15           HA       THR  15   5.492   9.856  -2.664
  113    HB   THR  15           HB       THR  15   7.772  11.586  -3.707
  114    HG1  THR  15           1HG      THR  15   5.038  12.263  -3.406
  115   1HG2  THR  15          1HG2      THR  15   5.251  10.491  -5.046
  116   2HG2  THR  15          2HG2      THR  15   6.420  11.607  -5.785
  117   3HG2  THR  15          3HG2      THR  15   6.919   9.962  -5.354
  118    H    ASN  16           H        ASN  16   8.989  10.174  -1.837
  119    HA   ASN  16           HA       ASN  16   9.866   7.994  -3.329
  120   1HB   ASN  16          2HB       ASN  16  11.230   9.821  -2.238
  121   2HB   ASN  16          3HB       ASN  16  11.073   8.945  -0.705
  122   1HD2  ASN  16          1HD2      ASN  16  13.601   9.450  -1.627
  123   2HD2  ASN  16          2HD2      ASN  16  14.309   7.987  -2.285
  124    H    CYS  17           H        CYS  17   8.504   8.198  -0.038
  125    HA   CYS  17           HA       CYS  17   9.003   5.391   0.644
  126   1HB   CYS  17          2HB       CYS  17   7.357   7.616   1.867
  127   2HB   CYS  17          3HB       CYS  17   7.193   5.928   2.390
  128    HG   CYS  17           HG       CYS  17   9.991   7.635   2.153
  129    H    ALA  18           H        ALA  18   6.273   7.322  -0.667
  130    HA   ALA  18           HA       ALA  18   4.410   5.197  -0.917
  131   1HB   ALA  18          1HB       ALA  18   3.827   7.548  -1.333
  132   2HB   ALA  18          2HB       ALA  18   4.818   7.553  -2.804
  133   3HB   ALA  18          3HB       ALA  18   3.393   6.530  -2.718
  134    H    ALA  19           H        ALA  19   7.032   6.229  -3.123
  135    HA   ALA  19           HA       ALA  19   6.605   4.296  -5.148
  136   1HB   ALA  19          1HB       ALA  19   8.841   4.819  -5.906
  137   2HB   ALA  19          2HB       ALA  19   7.997   6.305  -5.432
  138   3HB   ALA  19          3HB       ALA  19   9.236   5.605  -4.370
  139    H    LYS  20           H        LYS  20   8.702   4.188  -2.221
  140    HA   LYS  20           HA       LYS  20   9.727   1.585  -2.579
  141   1HB   LYS  20          2HB       LYS  20  10.289   3.312  -0.746
  142   2HB   LYS  20          3HB       LYS  20   8.843   2.754   0.087
  143   1HG   LYS  20          2HG       LYS  20  10.527   1.556   1.105
  144   2HG   LYS  20          3HG       LYS  20   9.856   0.376  -0.027
  145   1HD   LYS  20          2HD       LYS  20  11.703   0.860  -1.626
  146   2HD   LYS  20          3HD       LYS  20  12.307   2.134  -0.544
  147   1HE   LYS  20          2HE       LYS  20  12.665   0.405   1.245
  148   2HE   LYS  20          3HE       LYS  20  12.143  -0.852   0.110
  149   1HZ   LYS  20          1HZ       LYS  20  14.526  -0.662   0.228
  150   2HZ   LYS  20          2HZ       LYS  20  14.014  -0.270  -1.283
  151   3HZ   LYS  20          3HZ       LYS  20  14.483   0.913  -0.236
  152    H    PHE  21           H        PHE  21   6.714   2.622  -0.929
  153    HA   PHE  21           HA       PHE  21   5.711   0.089  -0.290
  154   1HB   PHE  21          2HB       PHE  21   4.641   2.817  -0.431
  155   2HB   PHE  21          3HB       PHE  21   3.450   1.618  -0.870
  156    HD1  PHE  21           HD1      PHE  21   3.080  -0.431   0.628
  157    HD2  PHE  21           HD2      PHE  21   5.131   3.150   1.883
  158    HE1  PHE  21           HE1      PHE  21   2.361  -0.831   2.977
  159    HE2  PHE  21           HE2      PHE  21   4.574   2.627   4.235
  160    HZ   PHE  21           HZ       PHE  21   2.945   0.818   4.739
  161    H    GLU  22           H        GLU  22   4.777   2.007  -3.284
  162    HA   GLU  22           HA       GLU  22   3.019   0.000  -4.155
  163   1HB   GLU  22          2HB       GLU  22   3.127   0.977  -6.386
  164   2HB   GLU  22          3HB       GLU  22   2.881   2.152  -5.108
  165   1HG   GLU  22          2HG       GLU  22   4.441   3.398  -6.090
  166   2HG   GLU  22          3HG       GLU  22   5.622   2.254  -5.456
  167    H    ARG  23           H        ARG  23   6.503   0.418  -4.810
  168    HA   ARG  23           HA       ARG  23   6.814  -1.824  -6.534
  169   1HB   ARG  23          2HB       ARG  23   8.449   0.147  -5.880
  170   2HB   ARG  23          3HB       ARG  23   9.032  -1.002  -4.659
  171   1HG   ARG  23          2HG       ARG  23   9.326  -2.682  -6.572
  172   2HG   ARG  23          3HG       ARG  23   8.833  -1.382  -7.682
  173   1HD   ARG  23          2HD       ARG  23  10.730   0.016  -6.726
  174   2HD   ARG  23          3HD       ARG  23  11.281  -1.460  -5.884
  175    HE   ARG  23           HE       ARG  23  10.892  -2.053  -8.639
  176   1HH1  ARG  23          2HH2      ARG  23  13.059  -0.226  -6.569
  177   2HH1  ARG  23          1HH2      ARG  23  14.414  -0.242  -7.659
  178   1HH2  ARG  23          2HH1      ARG  23  12.642  -2.068 -10.162
  179   2HH2  ARG  23          1HH1      ARG  23  14.155  -1.322  -9.768
  180    H    ASN  24           H        ASN  24   7.145  -1.584  -2.945
  181    HA   ASN  24           HA       ASN  24   7.726  -4.320  -2.419
  182   1HB   ASN  24          2HB       ASN  24   6.389  -2.095  -0.857
  183   2HB   ASN  24          3HB       ASN  24   6.150  -3.756  -0.333
  184   1HD2  ASN  24          1HD2      ASN  24   7.170  -2.651   1.603
  185   2HD2  ASN  24          2HD2      ASN  24   8.863  -3.028   1.766
  186    H    VAL  25           H        VAL  25   4.574  -2.714  -3.002
  187    HA   VAL  25           HA       VAL  25   3.042  -5.162  -2.719
  188    HB   VAL  25           HB       VAL  25   2.375  -2.602  -4.268
  189   1HG1  VAL  25          1HG1      VAL  25   0.668  -4.940  -3.339
  190   2HG1  VAL  25          2HG1      VAL  25   0.004  -3.372  -3.796
  191   3HG1  VAL  25          3HG1      VAL  25   0.894  -4.312  -5.001
  192   1HG2  VAL  25          1HG2      VAL  25   1.807  -3.510  -1.439
  193   2HG2  VAL  25          2HG2      VAL  25   2.757  -2.103  -1.885
  194   3HG2  VAL  25          3HG2      VAL  25   1.026  -2.102  -2.201
  195    H    LYS  26           H        LYS  26   4.291  -3.558  -5.715
  196    HA   LYS  26           HA       LYS  26   3.540  -5.535  -7.535
  197   1HB   LYS  26          2HB       LYS  26   5.790  -3.579  -7.291
  198   2HB   LYS  26          3HB       LYS  26   5.848  -4.690  -8.629
  199   1HG   LYS  26          2HG       LYS  26   3.857  -3.869  -9.599
  200   2HG   LYS  26          3HG       LYS  26   3.300  -3.128  -8.079
  201   1HD   LYS  26          2HD       LYS  26   4.985  -1.488  -8.097
  202   2HD   LYS  26          3HD       LYS  26   5.864  -2.240  -9.431
  203   1HE   LYS  26          2HE       LYS  26   4.045  -1.646 -11.002
  204   2HE   LYS  26          3HE       LYS  26   3.053  -1.051  -9.657
  205   1HZ   LYS  26          1HZ       LYS  26   4.080   0.815 -10.682
  206   2HZ   LYS  26          2HZ       LYS  26   4.806   0.591  -9.226
  207   3HZ   LYS  26          3HZ       LYS  26   5.585   0.146 -10.575
  208    H    GLU  27           H        GLU  27   6.415  -5.653  -5.366
  209    HA   GLU  27           HA       GLU  27   7.586  -8.013  -6.379
  210   1HB   GLU  27          2HB       GLU  27   7.483  -6.662  -3.700
  211   2HB   GLU  27          3HB       GLU  27   8.054  -8.324  -3.735
  212   1HG   GLU  27          2HG       GLU  27   9.220  -6.287  -5.657
  213   2HG   GLU  27          3HG       GLU  27   9.772  -6.390  -3.976
  214    H    ILE  28           H        ILE  28   4.590  -7.730  -4.473
  215    HA   ILE  28           HA       ILE  28   4.537 -10.530  -3.692
  216    HB   ILE  28           HB       ILE  28   2.246  -8.597  -3.939
  217   1HG1  ILE  28          2HG1      ILE  28   3.767  -8.943  -1.346
  218   2HG1  ILE  28          3HG1      ILE  28   4.068  -7.615  -2.463
  219   1HG2  ILE  28          1HG2      ILE  28   0.972 -10.073  -2.656
  220   2HG2  ILE  28          2HG2      ILE  28   2.066 -11.267  -3.360
  221   3HG2  ILE  28          3HG2      ILE  28   2.375 -10.668  -1.748
  222   1HD1  ILE  28          1HD1      ILE  28   2.421  -6.967  -0.732
  223   2HD1  ILE  28          2HD1      ILE  28   1.747  -6.884  -2.377
  224   3HD1  ILE  28          3HD1      ILE  28   1.318  -8.222  -1.341
  225    H    GLU  29           H        GLU  29   3.852 -12.229  -5.011
  226    HA   GLU  29           HA       GLU  29   3.153 -11.816  -7.747
  227   1HB   GLU  29          2HB       GLU  29   3.389 -14.183  -5.840
  228   2HB   GLU  29          3HB       GLU  29   2.704 -14.374  -7.436
  229   1HG   GLU  29          2HG       GLU  29   4.747 -13.417  -8.471
  230   2HG   GLU  29          3HG       GLU  29   5.489 -13.295  -6.864
  231    H    GLY  30           H        GLY  30   1.230 -11.586  -5.015
  232   1HA   GLY  30          1HA       GLY  30  -1.218 -12.803  -6.064
  233   2HA   GLY  30          2HA       GLY  30  -1.020 -11.895  -4.562
  234    H    VAL  31           H        VAL  31   0.326  -9.605  -6.298
  235    HA   VAL  31           HA       VAL  31  -2.257  -8.363  -7.031
  236    HB   VAL  31           HB       VAL  31  -1.088  -7.613  -4.959
  237   1HG1  VAL  31          1HG1      VAL  31   1.263  -7.862  -6.010
  238   2HG1  VAL  31          2HG1      VAL  31   0.958  -6.286  -6.755
  239   3HG1  VAL  31          3HG1      VAL  31   0.910  -6.496  -4.979
  240   1HG2  VAL  31          1HG2      VAL  31  -1.281  -5.609  -7.202
  241   2HG2  VAL  31          2HG2      VAL  31  -2.619  -6.161  -6.144
  242   3HG2  VAL  31          3HG2      VAL  31  -1.257  -5.226  -5.477
  243    H    THR  32           H        THR  32  -2.178  -6.922  -8.816
  244    HA   THR  32           HA       THR  32  -0.110  -7.547 -10.870
  245    HB   THR  32           HB       THR  32  -2.991  -6.627 -11.254
  246    HG1  THR  32           1HG      THR  32  -3.183  -8.816 -12.037
  247   1HG2  THR  32          1HG2      THR  32  -0.855  -7.579 -13.220
  248   2HG2  THR  32          2HG2      THR  32  -2.551  -7.234 -13.627
  249   3HG2  THR  32          3HG2      THR  32  -1.488  -5.926 -13.089
  250    H    GLU  33           H        GLU  33  -2.386  -5.001  -9.682
  251    HA   GLU  33           HA       GLU  33  -0.124  -3.035 -10.121
  252   1HB   GLU  33          2HB       GLU  33  -3.015  -2.477 -10.897
  253   2HB   GLU  33          3HB       GLU  33  -1.691  -1.315 -10.833
  254   1HG   GLU  33          2HG       GLU  33  -0.456  -2.966 -12.456
  255   2HG   GLU  33          3HG       GLU  33  -2.088  -3.586 -12.772
  256    H    ALA  34           H        ALA  34  -0.241  -1.059  -8.898
  257    HA   ALA  34           HA       ALA  34  -2.108  -0.958  -6.687
  258   1HB   ALA  34          1HB       ALA  34   0.907  -1.151  -6.184
  259   2HB   ALA  34          2HB       ALA  34  -0.337  -0.821  -4.955
  260   3HB   ALA  34          3HB       ALA  34  -0.301  -2.391  -5.787
  261    H    ILE  35           H        ILE  35  -2.369   1.196  -6.027
  262    HA   ILE  35           HA       ILE  35  -0.579   3.244  -7.290
  263    HB   ILE  35           HB       ILE  35  -3.611   3.392  -7.451
  264   1HG1  ILE  35          2HG1      ILE  35  -1.696   3.122  -9.795
  265   2HG1  ILE  35          3HG1      ILE  35  -2.513   1.725  -9.086
  266   1HG2  ILE  35          1HG2      ILE  35  -2.478   5.569  -7.127
  267   2HG2  ILE  35          2HG2      ILE  35  -1.422   5.224  -8.510
  268   3HG2  ILE  35          3HG2      ILE  35  -3.166   5.449  -8.742
  269   1HD1  ILE  35          1HD1      ILE  35  -4.713   2.697  -9.504
  270   2HD1  ILE  35          2HD1      ILE  35  -3.956   4.086 -10.319
  271   3HD1  ILE  35          3HD1      ILE  35  -3.770   2.457 -10.985
  272    H    VAL  36           H        VAL  36   0.287   4.122  -5.481
  273    HA   VAL  36           HA       VAL  36  -1.399   4.178  -3.041
  274    HB   VAL  36           HB       VAL  36   0.330   3.317  -1.842
  275   1HG1  VAL  36          1HG1      VAL  36  -0.713   1.698  -3.542
  276   2HG1  VAL  36          2HG1      VAL  36   0.757   1.874  -4.489
  277   3HG1  VAL  36          3HG1      VAL  36   0.852   1.216  -2.849
  278   1HG2  VAL  36          1HG2      VAL  36   2.651   2.916  -2.801
  279   2HG2  VAL  36          2HG2      VAL  36   2.213   4.011  -4.134
  280   3HG2  VAL  36          3HG2      VAL  36   2.260   4.599  -2.469
  281    H    ASN  37           H        ASN  37  -1.817   6.117  -2.212
  282    HA   ASN  37           HA       ASN  37  -0.314   8.404  -3.378
  283   1HB   ASN  37          2HB       ASN  37  -2.969   8.227  -1.941
  284   2HB   ASN  37          3HB       ASN  37  -2.234   9.719  -2.553
  285   1HD2  ASN  37          1HD2      ASN  37  -4.608   9.466  -3.589
  286   2HD2  ASN  37          2HD2      ASN  37  -4.570   8.748  -5.191
  287    H    PHE  38           H        PHE  38  -1.398   7.255  -0.149
  288    HA   PHE  38           HA       PHE  38  -0.749   7.826   1.958
  289   1HB   PHE  38          2HB       PHE  38   1.922   8.149   0.522
  290   2HB   PHE  38          3HB       PHE  38   1.738   8.158   2.260
  291    HD1  PHE  38           HD1      PHE  38   1.798   5.971  -0.653
  292    HD2  PHE  38           HD2      PHE  38   0.905   6.276   3.550
  293    HE1  PHE  38           HE1      PHE  38   2.066   3.497  -0.389
  294    HE2  PHE  38           HE2      PHE  38   1.374   3.855   3.811
  295    HZ   PHE  38           HZ       PHE  38   1.740   2.447   1.827
  296    H    GLY  39           H        GLY  39   1.065   9.823   3.067
  297   1HA   GLY  39          1HA       GLY  39   1.242  12.058   3.415
  298   2HA   GLY  39          2HA       GLY  39   0.345  12.412   1.936
  299    H    ALA  40           H        ALA  40  -1.986  11.650   2.065
  300    HA   ALA  40           HA       ALA  40  -3.384  11.455   4.577
  301   1HB   ALA  40          1HB       ALA  40  -3.492  14.140   3.109
  302   2HB   ALA  40          2HB       ALA  40  -4.606  13.634   4.399
  303   3HB   ALA  40          3HB       ALA  40  -2.887  13.867   4.756
  304    H    SER  41           H        SER  41  -3.549   9.647   2.806
  305    HA   SER  41           HA       SER  41  -6.016  10.018   1.273
  306   1HB   SER  41          2HB       SER  41  -3.313   9.837  -0.105
  307   2HB   SER  41          3HB       SER  41  -4.839   9.423  -0.912
  308    HG   SER  41           HG       SER  41  -4.785  11.871   0.363
  309    H    LYS  42           H        LYS  42  -4.173   7.635  -0.295
  310    HA   LYS  42           HA       LYS  42  -5.257   5.477   1.292
  311   1HB   LYS  42          2HB       LYS  42  -7.060   4.960  -0.294
  312   2HB   LYS  42          3HB       LYS  42  -7.286   6.463   0.582
  313   1HG   LYS  42          2HG       LYS  42  -6.172   7.511  -1.648
  314   2HG   LYS  42          3HG       LYS  42  -6.811   6.041  -2.356
  315   1HD   LYS  42          2HD       LYS  42  -8.331   8.174  -0.778
  316   2HD   LYS  42          3HD       LYS  42  -8.398   7.916  -2.526
  317   1HE   LYS  42          2HE       LYS  42  -9.423   5.659  -2.147
  318   2HE   LYS  42          3HE       LYS  42  -9.386   5.932  -0.398
  319   1HZ   LYS  42          1HZ       LYS  42 -10.949   7.468  -2.355
  320   2HZ   LYS  42          2HZ       LYS  42 -11.513   6.375  -1.259
  321   3HZ   LYS  42          3HZ       LYS  42 -10.874   7.798  -0.743
  322    H    ILE  43           H        ILE  43  -5.187   3.467   0.076
  323    HA   ILE  43           HA       ILE  43  -2.902   3.327  -1.833
  324    HB   ILE  43           HB       ILE  43  -2.040   2.963   0.316
  325   1HG1  ILE  43          2HG1      ILE  43  -2.282   0.110  -0.719
  326   2HG1  ILE  43          3HG1      ILE  43  -1.283   1.342  -1.518
  327   1HG2  ILE  43          1HG2      ILE  43  -3.980   2.461   1.650
  328   2HG2  ILE  43          2HG2      ILE  43  -4.229   0.919   0.794
  329   3HG2  ILE  43          3HG2      ILE  43  -2.830   1.143   1.816
  330   1HD1  ILE  43          1HD1      ILE  43  -0.914   0.141   1.207
  331   2HD1  ILE  43          2HD1      ILE  43   0.223   0.290  -0.146
  332   3HD1  ILE  43          3HD1      ILE  43  -0.215   1.720   0.793
  333    H    THR  44           H        THR  44  -3.806   2.708  -3.702
  334    HA   THR  44           HA       THR  44  -6.046   0.792  -3.733
  335    HB   THR  44           HB       THR  44  -4.648   2.241  -5.976
  336    HG1  THR  44           1HG      THR  44  -6.198   3.114  -4.211
  337   1HG2  THR  44          1HG2      THR  44  -7.192   0.571  -6.007
  338   2HG2  THR  44          2HG2      THR  44  -6.614   1.597  -7.334
  339   3HG2  THR  44          3HG2      THR  44  -5.675   0.181  -6.849
  340    H    VAL  45           H        VAL  45  -5.872  -1.241  -4.437
  341    HA   VAL  45           HA       VAL  45  -3.255  -2.417  -5.192
  342    HB   VAL  45           HB       VAL  45  -5.243  -3.257  -3.056
  343   1HG1  VAL  45          1HG1      VAL  45  -2.722  -4.746  -3.882
  344   2HG1  VAL  45          2HG1      VAL  45  -3.853  -5.223  -2.608
  345   3HG1  VAL  45          3HG1      VAL  45  -4.373  -5.268  -4.296
  346   1HG2  VAL  45          1HG2      VAL  45  -3.284  -3.138  -1.503
  347   2HG2  VAL  45          2HG2      VAL  45  -2.321  -2.446  -2.826
  348   3HG2  VAL  45          3HG2      VAL  45  -3.727  -1.571  -2.181
  349    H    THR  46           H        THR  46  -3.622  -3.919  -6.905
  350    HA   THR  46           HA       THR  46  -6.369  -4.797  -7.497
  351    HB   THR  46           HB       THR  46  -4.590  -3.127  -9.355
  352    HG1  THR  46           1HG      THR  46  -6.552  -2.769  -7.641
  353   1HG2  THR  46          1HG2      THR  46  -6.510  -3.315 -10.965
  354   2HG2  THR  46          2HG2      THR  46  -5.679  -4.860 -10.730
  355   3HG2  THR  46          3HG2      THR  46  -7.235  -4.560  -9.927
  356    H    GLY  47           H        GLY  47  -6.412  -6.757  -8.279
  357   1HA   GLY  47          1HA       GLY  47  -4.790  -7.940 -10.039
  358   2HA   GLY  47          2HA       GLY  47  -3.778  -8.087  -8.637
  359    H    GLU  48           H        GLU  48  -4.254  -9.399  -6.904
  360    HA   GLU  48           HA       GLU  48  -6.854 -10.494  -6.330
  361   1HB   GLU  48          2HB       GLU  48  -5.884 -11.965  -8.259
  362   2HB   GLU  48          3HB       GLU  48  -4.691 -12.509  -7.078
  363   1HG   GLU  48          2HG       GLU  48  -6.627 -13.278  -5.623
  364   2HG   GLU  48          3HG       GLU  48  -7.728 -12.790  -6.925
  365    H    ALA  49           H        ALA  49  -5.443  -8.823  -4.722
  366    HA   ALA  49           HA       ALA  49  -4.715 -10.579  -2.485
  367   1HB   ALA  49          1HB       ALA  49  -2.554 -10.322  -3.622
  368   2HB   ALA  49          2HB       ALA  49  -2.740  -8.554  -3.611
  369   3HB   ALA  49          3HB       ALA  49  -2.544  -9.443  -2.087
  370    H    SER  50           H        SER  50  -4.246  -9.305  -0.509
  371    HA   SER  50           HA       SER  50  -6.100  -6.983  -0.315
  372   1HB   SER  50          2HB       SER  50  -5.572  -9.275   1.635
  373   2HB   SER  50          3HB       SER  50  -6.624  -7.895   1.954
  374    HG   SER  50           HG       SER  50  -7.826  -8.578   0.042
  375    H    ILE  51           H        ILE  51  -5.725  -5.619   1.617
  376    HA   ILE  51           HA       ILE  51  -3.233  -4.486   1.637
  377    HB   ILE  51           HB       ILE  51  -5.311  -3.511   2.596
  378   1HG1  ILE  51          2HG1      ILE  51  -3.347  -2.247   2.670
  379   2HG1  ILE  51          3HG1      ILE  51  -4.364  -2.040   4.097
  380   1HG2  ILE  51          1HG2      ILE  51  -4.510  -4.912   5.176
  381   2HG2  ILE  51          2HG2      ILE  51  -5.808  -3.735   4.963
  382   3HG2  ILE  51          3HG2      ILE  51  -5.926  -5.324   4.184
  383   1HD1  ILE  51          1HD1      ILE  51  -1.680  -3.400   3.917
  384   2HD1  ILE  51          2HD1      ILE  51  -2.140  -2.065   4.929
  385   3HD1  ILE  51          3HD1      ILE  51  -2.771  -3.651   5.309
  386    H    GLN  52           H        GLN  52  -4.283  -7.062   3.905
  387    HA   GLN  52           HA       GLN  52  -2.413  -7.354   5.753
  388   1HB   GLN  52          2HB       GLN  52  -3.401  -9.492   3.851
  389   2HB   GLN  52          3HB       GLN  52  -2.513  -9.862   5.332
  390   1HG   GLN  52          2HG       GLN  52  -5.058  -8.172   5.437
  391   2HG   GLN  52          3HG       GLN  52  -5.091  -9.932   5.377
  392   1HE2  GLN  52          1HE2      GLN  52  -3.751  -7.154   7.421
  393   2HE2  GLN  52          2HE2      GLN  52  -3.758  -8.151   8.839
  394    H    GLN  53           H        GLN  53  -1.708  -8.306   2.396
  395    HA   GLN  53           HA       GLN  53   0.988  -9.250   2.964
  396   1HB   GLN  53          2HB       GLN  53  -0.261  -8.324   0.369
  397   2HB   GLN  53          3HB       GLN  53   1.265  -9.215   0.568
  398   1HG   GLN  53          2HG       GLN  53  -0.919 -10.608   1.962
  399   2HG   GLN  53          3HG       GLN  53  -1.362 -10.262   0.288
  400   1HE2  GLN  53          1HE2      GLN  53  -1.209 -12.346  -0.537
  401   2HE2  GLN  53          2HE2      GLN  53   0.294 -13.251  -0.549
  402    H    VAL  54           H        VAL  54  -0.402  -6.236   1.753
  403    HA   VAL  54           HA       VAL  54   2.018  -4.742   1.339
  404    HB   VAL  54           HB       VAL  54  -0.825  -3.668   1.730
  405   1HG1  VAL  54          1HG1      VAL  54   0.093  -1.954   0.123
  406   2HG1  VAL  54          2HG1      VAL  54   0.638  -1.890   1.803
  407   3HG1  VAL  54          3HG1      VAL  54   1.713  -2.549   0.562
  408   1HG2  VAL  54          1HG2      VAL  54  -0.872  -3.792  -0.825
  409   2HG2  VAL  54          2HG2      VAL  54   0.423  -5.003  -0.681
  410   3HG2  VAL  54          3HG2      VAL  54  -1.152  -5.286   0.063
  411    H    GLU  55           H        GLU  55  -0.196  -5.349   3.982
  412    HA   GLU  55           HA       GLU  55   0.449  -3.332   5.815
  413   1HB   GLU  55          2HB       GLU  55  -1.344  -5.326   5.714
  414   2HB   GLU  55          3HB       GLU  55  -0.213  -6.091   6.824
  415   1HG   GLU  55          2HG       GLU  55  -0.425  -4.218   8.375
  416   2HG   GLU  55          3HG       GLU  55  -1.481  -3.355   7.246
  417    H    GLN  56           H        GLN  56   1.574  -6.716   5.470
  418    HA   GLN  56           HA       GLN  56   3.647  -6.744   7.334
  419   1HB   GLN  56          2HB       GLN  56   2.686  -8.658   5.984
  420   2HB   GLN  56          3HB       GLN  56   3.753  -8.208   4.653
  421   1HG   GLN  56          2HG       GLN  56   4.764  -8.845   7.469
  422   2HG   GLN  56          3HG       GLN  56   4.483 -10.071   6.236
  423   1HE2  GLN  56          1HE2      GLN  56   6.482  -7.087   6.840
  424   2HE2  GLN  56          2HE2      GLN  56   7.799  -7.695   5.859
  425    H    ALA  57           H        ALA  57   3.944  -5.974   3.798
  426    HA   ALA  57           HA       ALA  57   6.610  -5.160   3.733
  427   1HB   ALA  57          1HB       ALA  57   4.103  -4.463   2.212
  428   2HB   ALA  57          2HB       ALA  57   5.530  -3.491   1.936
  429   3HB   ALA  57          3HB       ALA  57   5.584  -5.248   1.653
  430    H    GLY  58           H        GLY  58   3.712  -3.159   4.573
  431   1HA   GLY  58          1HA       GLY  58   5.031  -0.717   4.833
  432   2HA   GLY  58          2HA       GLY  58   3.482  -1.198   5.590
  433    H    ALA  59           H        ALA  59   5.145  -3.492   6.978
  434    HA   ALA  59           HA       ALA  59   5.690  -2.292   9.444
  435   1HB   ALA  59          1HB       ALA  59   7.131  -4.690   8.264
  436   2HB   ALA  59          2HB       ALA  59   6.957  -4.273   9.976
  437   3HB   ALA  59          3HB       ALA  59   5.525  -4.741   9.041
  438    H    PHE  60           H        PHE  60   7.628  -2.082   6.459
  439    HA   PHE  60           HA       PHE  60  10.091  -1.437   7.665
  440   1HB   PHE  60          2HB       PHE  60  10.761  -0.372   5.705
  441   2HB   PHE  60          3HB       PHE  60   9.822  -1.784   5.267
  442    HD1  PHE  60           HD1      PHE  60   9.736   1.960   5.514
  443    HD2  PHE  60           HD2      PHE  60   8.187  -1.544   3.570
  444    HE1  PHE  60           HE1      PHE  60   8.655   3.381   3.803
  445    HE2  PHE  60           HE2      PHE  60   6.996  -0.116   1.931
  446    HZ   PHE  60           HZ       PHE  60   7.297   2.335   1.984
  447    H    GLU  61           H        GLU  61   7.202   0.584   7.351
  448    HA   GLU  61           HA       GLU  61   8.525   2.701   9.039
  449   1HB   GLU  61          2HB       GLU  61   6.884   2.855   6.547
  450   2HB   GLU  61          3HB       GLU  61   6.568   4.073   7.800
  451   1HG   GLU  61          2HG       GLU  61   9.435   3.620   7.024
  452   2HG   GLU  61          3HG       GLU  61   8.363   4.493   5.909
  453    H    HIS  62           H        HIS  62   6.055   0.349   8.952
  454    HA   HIS  62           HA       HIS  62   4.622  -0.310  10.557
  455   1HB   HIS  62          2HB       HIS  62   5.253   2.083  12.299
  456   2HB   HIS  62          3HB       HIS  62   4.668   0.495  12.767
  457    HD1  HIS  62           1HD      HIS  62   7.269  -0.941  11.022
  458    HD2  HIS  62           2HD      HIS  62   7.261   2.052  13.987
  459    HE1  HIS  62           1HE      HIS  62   9.540  -1.005  12.119
  460    H    LEU  63           H        LEU  63   3.406   0.760   8.439
  461    HA   LEU  63           HA       LEU  63   1.952   3.211   9.149
  462   1HB   LEU  63          2HB       LEU  63   1.888   1.319   6.777
  463   2HB   LEU  63          3HB       LEU  63   0.715   2.624   6.935
  464    HG   LEU  63           HG       LEU  63   2.573   3.231   5.520
  465   1HD1  LEU  63          1HD1      LEU  63   1.214   4.885   6.902
  466   2HD1  LEU  63          2HD1      LEU  63   2.610   4.983   8.003
  467   3HD1  LEU  63          3HD1      LEU  63   2.774   5.440   6.306
  468   1HD2  LEU  63          1HD2      LEU  63   4.334   3.246   7.992
  469   2HD2  LEU  63          2HD2      LEU  63   4.398   2.011   6.705
  470   3HD2  LEU  63          3HD2      LEU  63   4.781   3.704   6.357
  471    H    LYS  64           H        LYS  64  -0.546   3.365   8.942
  472    HA   LYS  64           HA       LYS  64  -1.812   0.882   9.946
  473   1HB   LYS  64          2HB       LYS  64  -3.259   2.272  11.342
  474   2HB   LYS  64          3HB       LYS  64  -1.577   2.182  11.851
  475   1HG   LYS  64          2HG       LYS  64  -2.021   4.318  12.314
  476   2HG   LYS  64          3HG       LYS  64  -1.291   4.523  10.717
  477   1HD   LYS  64          2HD       LYS  64  -3.286   5.141   9.761
  478   2HD   LYS  64          3HD       LYS  64  -4.214   4.013  10.651
  479   1HE   LYS  64          2HE       LYS  64  -4.973   6.175  11.403
  480   2HE   LYS  64          3HE       LYS  64  -4.094   5.402  12.723
  481   1HZ   LYS  64          1HZ       LYS  64  -3.244   7.674  11.052
  482   2HZ   LYS  64          2HZ       LYS  64  -3.367   7.598  12.649
  483   3HZ   LYS  64          3HZ       LYS  64  -2.139   6.800  11.896
  484    H    ILE  65           H        ILE  65  -3.025   0.195   8.356
  485    HA   ILE  65           HA       ILE  65  -4.280   2.152   6.517
  486    HB   ILE  65           HB       ILE  65  -3.661  -0.702   5.820
  487   1HG1  ILE  65          2HG1      ILE  65  -1.750   1.577   5.840
  488   2HG1  ILE  65          3HG1      ILE  65  -1.518  -0.163   6.092
  489   1HG2  ILE  65          1HG2      ILE  65  -5.360   0.399   4.520
  490   2HG2  ILE  65          2HG2      ILE  65  -4.289   1.741   4.135
  491   3HG2  ILE  65          3HG2      ILE  65  -3.951   0.121   3.507
  492   1HD1  ILE  65          1HD1      ILE  65  -0.292   0.406   4.191
  493   2HD1  ILE  65          2HD1      ILE  65  -1.730  -0.389   3.537
  494   3HD1  ILE  65          3HD1      ILE  65  -1.585   1.386   3.521
  495    H    ILE  66           H        ILE  66  -6.519   1.755   6.075
  496    HA   ILE  66           HA       ILE  66  -7.832  -0.147   7.943
  497    HB   ILE  66           HB       ILE  66  -8.589   2.728   7.331
  498   1HG1  ILE  66          2HG1      ILE  66  -7.574   1.438   9.911
  499   2HG1  ILE  66          3HG1      ILE  66  -6.634   2.512   8.867
  500   1HG2  ILE  66          1HG2      ILE  66 -10.565   1.223   7.633
  501   2HG2  ILE  66          2HG2      ILE  66  -9.895   0.677   9.182
  502   3HG2  ILE  66          3HG2      ILE  66 -10.415   2.360   8.963
  503   1HD1  ILE  66          1HD1      ILE  66  -7.400   3.809  10.693
  504   2HD1  ILE  66          2HD1      ILE  66  -8.289   4.334   9.251
  505   3HD1  ILE  66          3HD1      ILE  66  -9.078   3.304  10.474
  506    HA   PRO  67           HA       PRO  67  -9.810  -1.012   3.881
  507   1HB   PRO  67          2HB       PRO  67 -11.509  -2.990   4.719
  508   2HB   PRO  67          3HB       PRO  67  -9.782  -3.290   4.408
  509   1HG   PRO  67          2HG       PRO  67 -11.124  -2.820   7.061
  510   2HG   PRO  67          3HG       PRO  67  -9.886  -4.040   6.650
  511   1HD   PRO  67          2HD       PRO  67  -9.330  -1.681   7.898
  512   2HD   PRO  67          3HD       PRO  67  -8.154  -2.439   6.781
  513    H    GLU  68           H        GLU  68 -11.076   0.738   3.446
  514    HA   GLU  68           HA       GLU  68 -13.085   1.809   5.123
  515   1HB   GLU  68          2HB       GLU  68 -14.065   2.703   2.984
  516   2HB   GLU  68          3HB       GLU  68 -12.370   3.123   3.270
  517   1HG   GLU  68          2HG       GLU  68 -11.614   1.514   1.618
  518   2HG   GLU  68          3HG       GLU  68 -13.245   0.848   1.455
  519    H    LYS  69           H        LYS  69 -15.345   1.519   5.219
  520    HA   LYS  69           HA       LYS  69 -16.619  -0.675   3.804
  521   1HB   LYS  69          2HB       LYS  69 -15.505  -1.639   5.975
  522   2HB   LYS  69          3HB       LYS  69 -16.637  -0.613   6.853
  523   1HG   LYS  69          2HG       LYS  69 -17.845  -2.570   6.800
  524   2HG   LYS  69          3HG       LYS  69 -18.462  -1.823   5.332
  525   1HD   LYS  69          2HD       LYS  69 -16.443  -3.123   4.155
  526   2HD   LYS  69          3HD       LYS  69 -16.340  -3.981   5.688
  527   1HE   LYS  69          2HE       LYS  69 -17.680  -5.383   4.351
  528   2HE   LYS  69          3HE       LYS  69 -18.830  -4.569   5.422
  529   1HZ   LYS  69          1HZ       LYS  69 -18.235  -3.837   2.621
  530   2HZ   LYS  69          2HZ       LYS  69 -19.589  -4.601   3.155
  531   3HZ   LYS  69          3HZ       LYS  69 -19.303  -3.046   3.594
  532    H    GLU  70           H        GLU  70 -18.735  -0.016   3.452
  533    HA   GLU  70           HA       GLU  70 -20.077   1.588   5.507
  534   1HB   GLU  70          2HB       GLU  70 -19.253   3.148   3.595
  535   2HB   GLU  70          3HB       GLU  70 -20.435   2.311   2.574
  536   1HG   GLU  70          2HG       GLU  70 -22.172   2.894   4.398
  537   2HG   GLU  70          3HG       GLU  70 -20.924   3.939   5.103
  538    H    ALA  71           H        ALA  71 -21.215  -0.252   6.138
  539    HA   ALA  71           HA       ALA  71 -23.558  -1.060   5.059
  540   1HB   ALA  71          1HB       ALA  71 -21.271  -2.955   4.339
  541   2HB   ALA  71          2HB       ALA  71 -22.984  -3.405   4.357
  542   3HB   ALA  71          3HB       ALA  71 -22.415  -2.220   3.182
  Start of MODEL    2
    1   1H    MET   1           H1       MET   1 -15.553 -12.402  -8.625
    2   2H    MET   1           H2       MET   1 -16.918 -13.259  -8.998
    3   3H    MET   1           H3       MET   1 -16.121 -12.397 -10.162
    4    HA   MET   1           HA       MET   1 -18.084 -11.244  -9.550
    5   1HB   MET   1          2HB       MET   1 -16.895 -11.523  -6.771
    6   2HB   MET   1          3HB       MET   1 -17.907 -10.133  -7.185
    7   1HG   MET   1          2HG       MET   1 -19.739 -11.598  -7.876
    8   2HG   MET   1          3HG       MET   1 -18.800 -13.024  -7.394
    9   1HE   MET   1          1HE       MET   1 -21.015 -13.691  -5.977
   10   2HE   MET   1          2HE       MET   1 -21.703 -12.640  -4.717
   11   3HE   MET   1          3HE       MET   1 -21.804 -12.155  -6.425
   12    H    ALA   2           H        ALA   2 -15.329 -10.029  -7.535
   13    HA   ALA   2           HA       ALA   2 -14.275  -8.451  -9.704
   14   1HB   ALA   2          1HB       ALA   2 -15.594  -7.094  -7.311
   15   2HB   ALA   2          2HB       ALA   2 -14.573  -6.296  -8.529
   16   3HB   ALA   2          3HB       ALA   2 -16.135  -6.988  -9.004
   17    H    GLU   3           H        GLU   3 -12.235  -7.565  -8.985
   18    HA   GLU   3           HA       GLU   3 -11.061  -8.723  -6.494
   19   1HB   GLU   3          2HB       GLU   3  -9.217  -9.415  -7.986
   20   2HB   GLU   3          3HB       GLU   3 -10.723 -10.240  -8.346
   21   1HG   GLU   3          2HG       GLU   3 -10.303  -7.736  -9.950
   22   2HG   GLU   3          3HG       GLU   3  -9.124  -9.011 -10.214
   23    H    LYS   4           H        LYS   4 -11.846  -6.061  -6.718
   24    HA   LYS   4           HA       LYS   4  -9.272  -4.556  -6.786
   25   1HB   LYS   4          2HB       LYS   4 -10.724  -2.584  -7.474
   26   2HB   LYS   4          3HB       LYS   4 -10.322  -3.755  -8.726
   27   1HG   LYS   4          2HG       LYS   4 -12.440  -4.637  -8.867
   28   2HG   LYS   4          3HG       LYS   4 -12.939  -4.136  -7.251
   29   1HD   LYS   4          2HD       LYS   4 -12.282  -2.097  -9.403
   30   2HD   LYS   4          3HD       LYS   4 -13.873  -2.850  -9.363
   31   1HE   LYS   4          2HE       LYS   4 -12.658  -1.396  -6.952
   32   2HE   LYS   4          3HE       LYS   4 -13.662  -0.595  -8.166
   33   1HZ   LYS   4          1HZ       LYS   4 -14.941  -1.276  -6.274
   34   2HZ   LYS   4          2HZ       LYS   4 -15.452  -2.075  -7.612
   35   3HZ   LYS   4          3HZ       LYS   4 -14.533  -2.852  -6.485
   36    H    THR   5           H        THR   5  -8.893  -3.328  -4.950
   37    HA   THR   5           HA       THR   5 -11.161  -2.434  -3.334
   38    HB   THR   5           HB       THR   5  -8.957  -4.192  -2.105
   39    HG1  THR   5           1HG      THR   5 -11.418  -4.504  -3.131
   40   1HG2  THR   5          1HG2      THR   5  -9.718  -2.463  -0.465
   41   2HG2  THR   5          2HG2      THR   5 -11.411  -2.824  -0.862
   42   3HG2  THR   5          3HG2      THR   5 -10.406  -4.039  -0.058
   43    H    VAL   6           H        VAL   6 -10.552  -0.658  -1.983
   44    HA   VAL   6           HA       VAL   6  -7.782  -0.051  -2.067
   45    HB   VAL   6           HB       VAL   6  -8.613   1.240  -3.877
   46   1HG1  VAL   6          1HG1      VAL   6 -10.874   2.301  -2.193
   47   2HG1  VAL   6          2HG1      VAL   6 -10.430   2.824  -3.841
   48   3HG1  VAL   6          3HG1      VAL   6 -10.977   1.169  -3.570
   49   1HG2  VAL   6          1HG2      VAL   6  -8.586   3.235  -1.550
   50   2HG2  VAL   6          2HG2      VAL   6  -7.130   2.600  -2.340
   51   3HG2  VAL   6          3HG2      VAL   6  -8.261   3.597  -3.256
   52    H    TYR   7           H        TYR   7  -6.963   1.087  -0.338
   53    HA   TYR   7           HA       TYR   7  -8.732   1.014   2.079
   54   1HB   TYR   7          2HB       TYR   7  -5.842   0.119   1.827
   55   2HB   TYR   7          3HB       TYR   7  -6.903  -0.020   3.231
   56    HD1  TYR   7           HD1      TYR   7  -7.891  -2.063   3.677
   57    HD2  TYR   7           HD2      TYR   7  -6.402  -1.275  -0.280
   58    HE1  TYR   7           HE1      TYR   7  -8.333  -4.402   3.052
   59    HE2  TYR   7           HE2      TYR   7  -6.739  -3.653  -0.865
   60    HH   TYR   7           HH       TYR   7  -8.316  -5.964   1.278
   61    H    ARG   8           H        ARG   8  -8.100   2.526   3.744
   62    HA   ARG   8           HA       ARG   8  -6.688   4.928   2.655
   63   1HB   ARG   8          2HB       ARG   8  -8.331   4.372   5.165
   64   2HB   ARG   8          3HB       ARG   8  -7.455   5.884   4.935
   65   1HG   ARG   8          2HG       ARG   8  -9.503   4.932   2.909
   66   2HG   ARG   8          3HG       ARG   8  -9.933   5.737   4.428
   67   1HD   ARG   8          2HD       ARG   8  -8.436   7.695   3.754
   68   2HD   ARG   8          3HD       ARG   8  -8.231   6.907   2.198
   69    HE   ARG   8           HE       ARG   8 -10.321   7.612   1.557
   70   1HH1  ARG   8          2HH2      ARG   8 -10.156   7.838   5.080
   71   2HH1  ARG   8          1HH2      ARG   8 -11.856   8.194   5.267
   72   1HH2  ARG   8          2HH1      ARG   8 -12.580   8.241   1.844
   73   2HH2  ARG   8          1HH1      ARG   8 -13.201   7.779   3.402
   74    H    VAL   9           H        VAL   9  -4.629   5.379   3.336
   75    HA   VAL   9           HA       VAL   9  -3.538   3.957   5.719
   76    HB   VAL   9           HB       VAL   9  -2.122   3.245   4.020
   77   1HG1  VAL   9          1HG1      VAL   9  -2.228   6.044   2.789
   78   2HG1  VAL   9          2HG1      VAL   9  -1.194   4.716   2.230
   79   3HG1  VAL   9          3HG1      VAL   9  -2.939   4.564   2.107
   80   1HG2  VAL   9          1HG2      VAL   9  -1.022   4.427   5.949
   81   2HG2  VAL   9          2HG2      VAL   9  -0.047   4.294   4.514
   82   3HG2  VAL   9          3HG2      VAL   9  -0.801   5.843   4.868
   83    H    ASP  10           H        ASP  10  -2.452   5.276   7.253
   84    HA   ASP  10           HA       ASP  10  -2.268   8.127   6.650
   85   1HB   ASP  10          2HB       ASP  10  -4.519   7.331   8.086
   86   2HB   ASP  10          3HB       ASP  10  -3.351   7.628   9.382
   87    H    GLY  11           H        GLY  11  -0.640   9.126   7.865
   88   1HA   GLY  11          1HA       GLY  11   0.433   8.979  10.136
   89   2HA   GLY  11          2HA       GLY  11   1.041   7.388   9.657
   90    H    LEU  12           H        LEU  12   1.975   7.601   7.225
   91    HA   LEU  12           HA       LEU  12   4.441   8.994   7.637
   92   1HB   LEU  12          2HB       LEU  12   5.214   7.894   5.745
   93   2HB   LEU  12          3HB       LEU  12   4.111   6.798   6.505
   94    HG   LEU  12           HG       LEU  12   3.565   6.497   4.341
   95   1HD1  LEU  12          1HD1      LEU  12   1.497   7.361   3.642
   96   2HD1  LEU  12          2HD1      LEU  12   1.394   7.227   5.384
   97   3HD1  LEU  12          3HD1      LEU  12   1.633   8.805   4.632
   98   1HD2  LEU  12          1HD2      LEU  12   5.152   8.423   3.628
   99   2HD2  LEU  12          2HD2      LEU  12   3.855   8.005   2.514
  100   3HD2  LEU  12          3HD2      LEU  12   3.698   9.417   3.543
  101    H    SER  13           H        SER  13   5.455  10.332   5.753
  102    HA   SER  13           HA       SER  13   3.677  11.788   4.030
  103   1HB   SER  13          2HB       SER  13   3.232  12.978   6.213
  104   2HB   SER  13          3HB       SER  13   4.936  13.465   6.234
  105    HG   SER  13           HG       SER  13   3.477  15.001   5.257
  106    H    CYS  14           H        CYS  14   5.339  10.633   2.682
  107    HA   CYS  14           HA       CYS  14   7.218  12.570   1.779
  108   1HB   CYS  14          2HB       CYS  14   8.644  11.736   3.649
  109   2HB   CYS  14          3HB       CYS  14   8.490  10.084   3.010
  110    HG   CYS  14           HG       CYS  14  10.817  11.070   2.385
  111    H    THR  15           H        THR  15   7.265  12.309  -0.430
  112    HA   THR  15           HA       THR  15   6.061  10.318  -1.845
  113    HB   THR  15           HB       THR  15   8.523  11.850  -2.770
  114    HG1  THR  15           1HG      THR  15   5.870  12.813  -2.516
  115   1HG2  THR  15          1HG2      THR  15   7.516  10.335  -4.450
  116   2HG2  THR  15          2HG2      THR  15   5.922  11.074  -4.181
  117   3HG2  THR  15          3HG2      THR  15   7.244  12.033  -4.880
  118    H    ASN  16           H        ASN  16   9.522  10.383  -0.820
  119    HA   ASN  16           HA       ASN  16  10.429   8.165  -2.211
  120   1HB   ASN  16          2HB       ASN  16  11.906   9.641  -0.940
  121   2HB   ASN  16          3HB       ASN  16  11.167   9.108   0.582
  122   1HD2  ASN  16          1HD2      ASN  16  12.589   7.770   1.667
  123   2HD2  ASN  16          2HD2      ASN  16  13.555   6.538   0.874
  124    H    CYS  17           H        CYS  17   8.540   8.345   0.802
  125    HA   CYS  17           HA       CYS  17   8.807   5.577   1.582
  126   1HB   CYS  17          2HB       CYS  17   8.071   7.586   2.990
  127   2HB   CYS  17          3HB       CYS  17   6.500   7.451   2.180
  128    HG   CYS  17           HG       CYS  17   8.080   5.238   4.051
  129    H    ALA  18           H        ALA  18   6.387   7.516  -0.213
  130    HA   ALA  18           HA       ALA  18   4.587   5.416  -0.846
  131   1HB   ALA  18          1HB       ALA  18   3.718   6.872  -2.555
  132   2HB   ALA  18          2HB       ALA  18   4.154   7.879  -1.161
  133   3HB   ALA  18          3HB       ALA  18   5.197   7.837  -2.591
  134    H    ALA  19           H        ALA  19   7.534   6.540  -2.473
  135    HA   ALA  19           HA       ALA  19   7.273   4.869  -4.803
  136   1HB   ALA  19          1HB       ALA  19   9.813   5.991  -3.548
  137   2HB   ALA  19          2HB       ALA  19   9.632   5.352  -5.189
  138   3HB   ALA  19          3HB       ALA  19   8.767   6.826  -4.715
  139    H    LYS  20           H        LYS  20   9.103   4.469  -1.750
  140    HA   LYS  20           HA       LYS  20  10.103   1.877  -2.203
  141   1HB   LYS  20          2HB       LYS  20  10.612   3.546  -0.352
  142   2HB   LYS  20          3HB       LYS  20   9.139   3.003   0.459
  143   1HG   LYS  20          2HG       LYS  20  10.084   0.753   0.736
  144   2HG   LYS  20          3HG       LYS  20  11.432   1.148  -0.334
  145   1HD   LYS  20          2HD       LYS  20  12.334   1.317   1.853
  146   2HD   LYS  20          3HD       LYS  20  12.106   2.986   1.305
  147   1HE   LYS  20          2HE       LYS  20   9.848   2.953   2.566
  148   2HE   LYS  20          3HE       LYS  20  10.332   1.361   3.172
  149   1HZ   LYS  20          1HZ       LYS  20  11.704   3.919   3.685
  150   2HZ   LYS  20          2HZ       LYS  20  10.761   3.127   4.719
  151   3HZ   LYS  20          3HZ       LYS  20  12.176   2.450   4.297
  152    H    PHE  21           H        PHE  21   7.010   2.922  -0.750
  153    HA   PHE  21           HA       PHE  21   5.883   0.402  -0.259
  154   1HB   PHE  21          2HB       PHE  21   4.810   3.167  -0.616
  155   2HB   PHE  21          3HB       PHE  21   3.679   1.875  -0.945
  156    HD1  PHE  21           1HD      PHE  21   3.595  -0.103   0.767
  157    HD2  PHE  21           2HD      PHE  21   4.959   3.903   1.639
  158    HE1  PHE  21           1HE      PHE  21   2.986  -0.408   3.138
  159    HE2  PHE  21           2HE      PHE  21   4.467   3.549   4.023
  160    HZ   PHE  21           HZ       PHE  21   3.424   1.413   4.774
  161    H    GLU  22           H        GLU  22   5.202   2.430  -3.239
  162    HA   GLU  22           HA       GLU  22   3.550   0.428  -4.298
  163   1HB   GLU  22          2HB       GLU  22   3.696   1.497  -6.454
  164   2HB   GLU  22          3HB       GLU  22   3.478   2.651  -5.151
  165   1HG   GLU  22          2HG       GLU  22   4.974   3.822  -6.342
  166   2HG   GLU  22          3HG       GLU  22   6.100   2.912  -5.353
  167    H    ARG  23           H        ARG  23   7.051   0.903  -4.783
  168    HA   ARG  23           HA       ARG  23   7.426  -1.286  -6.538
  169   1HB   ARG  23          2HB       ARG  23   9.090   0.566  -5.766
  170   2HB   ARG  23          3HB       ARG  23   9.453  -0.513  -4.405
  171   1HG   ARG  23          2HG       ARG  23   9.858  -2.346  -6.206
  172   2HG   ARG  23          3HG       ARG  23   9.734  -1.030  -7.394
  173   1HD   ARG  23          2HD       ARG  23  11.599   0.152  -6.138
  174   2HD   ARG  23          3HD       ARG  23  11.736  -1.313  -5.126
  175    HE   ARG  23           HE       ARG  23  11.840  -1.900  -7.962
  176   1HH1  ARG  23          2HH2      ARG  23  13.807  -0.813  -5.255
  177   2HH1  ARG  23          1HH2      ARG  23  15.326  -1.320  -5.930
  178   1HH2  ARG  23          2HH1      ARG  23  13.832  -2.544  -8.928
  179   2HH2  ARG  23          1HH1      ARG  23  15.333  -2.307  -8.097
  180    H    ASN  24           H        ASN  24   7.536  -1.231  -2.908
  181    HA   ASN  24           HA       ASN  24   8.152  -3.978  -2.635
  182   1HB   ASN  24          2HB       ASN  24   7.880  -1.958  -0.841
  183   2HB   ASN  24          3HB       ASN  24   6.339  -2.771  -0.551
  184   1HD2  ASN  24          1HD2      ASN  24   8.579  -2.491   1.282
  185   2HD2  ASN  24          2HD2      ASN  24   9.188  -4.104   1.596
  186    H    VAL  25           H        VAL  25   5.016  -2.314  -2.996
  187    HA   VAL  25           HA       VAL  25   3.397  -4.688  -2.733
  188    HB   VAL  25           HB       VAL  25   2.792  -2.056  -4.155
  189   1HG1  VAL  25          1HG1      VAL  25   0.406  -2.827  -3.709
  190   2HG1  VAL  25          2HG1      VAL  25   1.275  -3.728  -4.963
  191   3HG1  VAL  25          3HG1      VAL  25   1.061  -4.432  -3.346
  192   1HG2  VAL  25          1HG2      VAL  25   2.303  -3.094  -1.343
  193   2HG2  VAL  25          2HG2      VAL  25   3.210  -1.656  -1.779
  194   3HG2  VAL  25          3HG2      VAL  25   1.467  -1.671  -2.022
  195    H    LYS  26           H        LYS  26   4.822  -3.036  -5.615
  196    HA   LYS  26           HA       LYS  26   3.780  -4.778  -7.565
  197   1HB   LYS  26          2HB       LYS  26   6.130  -2.915  -7.294
  198   2HB   LYS  26          3HB       LYS  26   5.992  -3.871  -8.745
  199   1HG   LYS  26          2HG       LYS  26   3.856  -2.963  -9.287
  200   2HG   LYS  26          3HG       LYS  26   3.643  -2.227  -7.684
  201   1HD   LYS  26          2HD       LYS  26   5.320  -0.581  -8.060
  202   2HD   LYS  26          3HD       LYS  26   5.976  -1.475  -9.430
  203   1HE   LYS  26          2HE       LYS  26   3.786  -1.034 -10.676
  204   2HE   LYS  26          3HE       LYS  26   3.257  -0.059  -9.289
  205   1HZ   LYS  26          1HZ       LYS  26   5.106   1.394  -9.671
  206   2HZ   LYS  26          2HZ       LYS  26   5.618   0.521 -10.963
  207   3HZ   LYS  26          3HZ       LYS  26   4.170   1.318 -11.003
  208    H    GLU  27           H        GLU  27   6.666  -5.183  -5.458
  209    HA   GLU  27           HA       GLU  27   7.592  -7.584  -6.684
  210   1HB   GLU  27          2HB       GLU  27   7.756  -6.628  -3.815
  211   2HB   GLU  27          3HB       GLU  27   8.590  -8.049  -4.424
  212   1HG   GLU  27          2HG       GLU  27   9.034  -5.551  -6.027
  213   2HG   GLU  27          3HG       GLU  27   9.670  -5.546  -4.378
  214    H    ILE  28           H        ILE  28   4.617  -7.104  -4.830
  215    HA   ILE  28           HA       ILE  28   4.526  -9.846  -3.841
  216    HB   ILE  28           HB       ILE  28   2.331  -7.879  -4.092
  217   1HG1  ILE  28          2HG1      ILE  28   4.106  -6.893  -2.690
  218   2HG1  ILE  28          3HG1      ILE  28   2.635  -7.197  -1.778
  219   1HG2  ILE  28          1HG2      ILE  28   1.238  -9.155  -2.255
  220   2HG2  ILE  28          2HG2      ILE  28   1.413 -10.066  -3.747
  221   3HG2  ILE  28          3HG2      ILE  28   2.520 -10.382  -2.403
  222   1HD1  ILE  28          1HD1      ILE  28   5.136  -8.946  -1.745
  223   2HD1  ILE  28          2HD1      ILE  28   4.651  -7.780  -0.502
  224   3HD1  ILE  28          3HD1      ILE  28   3.665  -9.222  -0.779
  225    H    GLU  29           H        GLU  29   4.428 -11.330  -5.306
  226    HA   GLU  29           HA       GLU  29   2.757 -11.493  -7.657
  227   1HB   GLU  29          2HB       GLU  29   4.258 -13.487  -5.883
  228   2HB   GLU  29          3HB       GLU  29   3.289 -13.940  -7.266
  229   1HG   GLU  29          2HG       GLU  29   4.692 -12.461  -8.734
  230   2HG   GLU  29          3HG       GLU  29   5.744 -12.141  -7.343
  231    H    GLY  30           H        GLY  30   0.849 -10.681  -6.829
  232   1HA   GLY  30          1HA       GLY  30  -1.110 -12.566  -5.870
  233   2HA   GLY  30          2HA       GLY  30  -0.572 -11.517  -4.543
  234    H    VAL  31           H        VAL  31  -0.078  -9.110  -6.065
  235    HA   VAL  31           HA       VAL  31  -2.814  -8.347  -6.865
  236    HB   VAL  31           HB       VAL  31  -1.770  -7.135  -5.006
  237   1HG1  VAL  31          1HG1      VAL  31   0.618  -7.258  -5.641
  238   2HG1  VAL  31          2HG1      VAL  31   0.300  -6.211  -7.046
  239   3HG1  VAL  31          3HG1      VAL  31   0.073  -5.599  -5.395
  240   1HG2  VAL  31          1HG2      VAL  31  -2.012  -5.441  -7.492
  241   2HG2  VAL  31          2HG2      VAL  31  -3.377  -6.114  -6.556
  242   3HG2  VAL  31          3HG2      VAL  31  -2.279  -4.942  -5.806
  243    H    THR  32           H        THR  32  -2.931  -7.042  -8.856
  244    HA   THR  32           HA       THR  32  -0.926  -7.842 -10.916
  245    HB   THR  32           HB       THR  32  -3.859  -7.075 -11.249
  246    HG1  THR  32           1HG      THR  32  -2.509  -9.571 -11.262
  247   1HG2  THR  32          1HG2      THR  32  -1.800  -8.146 -13.231
  248   2HG2  THR  32          2HG2      THR  32  -3.539  -7.951 -13.542
  249   3HG2  THR  32          3HG2      THR  32  -2.532  -6.528 -13.241
  250    H    GLU  33           H        GLU  33  -3.237  -5.242  -9.924
  251    HA   GLU  33           HA       GLU  33  -1.006  -3.293 -10.505
  252   1HB   GLU  33          2HB       GLU  33  -3.938  -2.834 -11.205
  253   2HB   GLU  33          3HB       GLU  33  -2.648  -1.626 -11.216
  254   1HG   GLU  33          2HG       GLU  33  -1.397  -3.194 -12.843
  255   2HG   GLU  33          3HG       GLU  33  -2.948  -4.028 -13.039
  256    H    ALA  34           H        ALA  34  -0.582  -1.925  -8.847
  257    HA   ALA  34           HA       ALA  34  -2.720  -1.518  -6.836
  258   1HB   ALA  34          1HB       ALA  34  -1.009  -1.456  -5.064
  259   2HB   ALA  34          2HB       ALA  34  -1.048  -3.053  -5.838
  260   3HB   ALA  34          3HB       ALA  34   0.246  -1.903  -6.242
  261    H    ILE  35           H        ILE  35  -3.115   0.641  -6.554
  262    HA   ILE  35           HA       ILE  35  -1.071   2.551  -7.706
  263    HB   ILE  35           HB       ILE  35  -4.078   2.914  -7.684
  264   1HG1  ILE  35          2HG1      ILE  35  -3.486   1.284  -9.391
  265   2HG1  ILE  35          3HG1      ILE  35  -3.952   2.821 -10.109
  266   1HG2  ILE  35          1HG2      ILE  35  -1.764   4.688  -8.533
  267   2HG2  ILE  35          2HG2      ILE  35  -3.424   4.923  -9.116
  268   3HG2  ILE  35          3HG2      ILE  35  -3.069   5.038  -7.391
  269   1HD1  ILE  35          1HD1      ILE  35  -1.111   1.744  -9.847
  270   2HD1  ILE  35          2HD1      ILE  35  -2.066   1.932 -11.318
  271   3HD1  ILE  35          3HD1      ILE  35  -1.514   3.370 -10.446
  272    H    VAL  36           H        VAL  36   0.074   3.123  -5.940
  273    HA   VAL  36           HA       VAL  36  -1.380   3.472  -3.415
  274    HB   VAL  36           HB       VAL  36   0.483   3.155  -2.320
  275   1HG1  VAL  36          1HG1      VAL  36   1.651   1.257  -3.145
  276   2HG1  VAL  36          2HG1      VAL  36   0.016   1.162  -3.817
  277   3HG1  VAL  36          3HG1      VAL  36   1.351   1.702  -4.839
  278   1HG2  VAL  36          1HG2      VAL  36   2.111   4.255  -4.620
  279   2HG2  VAL  36          2HG2      VAL  36   1.848   4.982  -3.029
  280   3HG2  VAL  36          3HG2      VAL  36   2.820   3.515  -3.155
  281    H    ASN  37           H        ASN  37  -1.530   5.394  -2.277
  282    HA   ASN  37           HA       ASN  37  -0.102   7.789  -3.315
  283   1HB   ASN  37          2HB       ASN  37  -3.044   7.751  -2.555
  284   2HB   ASN  37          3HB       ASN  37  -2.096   9.140  -3.100
  285   1HD2  ASN  37          1HD2      ASN  37  -3.373   5.932  -4.113
  286   2HD2  ASN  37          2HD2      ASN  37  -3.533   6.376  -5.804
  287    H    PHE  38           H        PHE  38   0.895   6.303  -1.371
  288    HA   PHE  38           HA       PHE  38   0.057   6.850   1.308
  289   1HB   PHE  38          2HB       PHE  38   2.756   6.234   0.062
  290   2HB   PHE  38          3HB       PHE  38   2.547   6.464   1.779
  291    HD1  PHE  38           1HD      PHE  38   2.009   4.114  -0.950
  292    HD2  PHE  38           2HD      PHE  38   1.645   4.836   3.234
  293    HE1  PHE  38           1HE      PHE  38   1.228   1.772  -0.621
  294    HE2  PHE  38           2HE      PHE  38   0.862   2.498   3.571
  295    HZ   PHE  38           HZ       PHE  38   0.561   1.002   1.632
  296    H    GLY  39           H        GLY  39   0.028   8.773   2.343
  297   1HA   GLY  39          1HA       GLY  39   1.940  10.567   2.806
  298   2HA   GLY  39          2HA       GLY  39   1.382  11.143   1.223
  299    H    ALA  40           H        ALA  40  -1.167  10.979   1.103
  300    HA   ALA  40           HA       ALA  40  -2.671  11.504   3.518
  301   1HB   ALA  40          1HB       ALA  40  -2.108  13.850   1.641
  302   2HB   ALA  40          2HB       ALA  40  -3.309  13.838   2.951
  303   3HB   ALA  40          3HB       ALA  40  -1.586  13.715   3.334
  304    H    SER  41           H        SER  41  -3.117   9.500   1.933
  305    HA   SER  41           HA       SER  41  -5.625  10.066   0.677
  306   1HB   SER  41          2HB       SER  41  -3.219  10.016  -1.066
  307   2HB   SER  41          3HB       SER  41  -4.588   9.072  -1.646
  308    HG   SER  41           HG       SER  41  -4.771  11.737  -0.768
  309    H    LYS  42           H        LYS  42  -3.947   7.422  -0.783
  310    HA   LYS  42           HA       LYS  42  -5.034   5.438   0.956
  311   1HB   LYS  42          2HB       LYS  42  -6.865   4.710  -0.571
  312   2HB   LYS  42          3HB       LYS  42  -7.215   6.286   0.108
  313   1HG   LYS  42          2HG       LYS  42  -5.802   6.231  -2.555
  314   2HG   LYS  42          3HG       LYS  42  -7.468   5.663  -2.518
  315   1HD   LYS  42          2HD       LYS  42  -8.307   7.724  -1.646
  316   2HD   LYS  42          3HD       LYS  42  -6.686   8.352  -1.357
  317   1HE   LYS  42          2HE       LYS  42  -6.258   8.141  -3.884
  318   2HE   LYS  42          3HE       LYS  42  -7.981   7.779  -4.062
  319   1HZ   LYS  42          1HZ       LYS  42  -7.508  10.089  -4.428
  320   2HZ   LYS  42          2HZ       LYS  42  -8.436   9.949  -3.082
  321   3HZ   LYS  42          3HZ       LYS  42  -6.821  10.265  -2.943
  322    H    ILE  43           H        ILE  43  -5.128   3.321  -0.127
  323    HA   ILE  43           HA       ILE  43  -3.126   3.105  -2.313
  324    HB   ILE  43           HB       ILE  43  -1.955   2.875  -0.257
  325   1HG1  ILE  43          2HG1      ILE  43  -1.076   1.500  -1.985
  326   2HG1  ILE  43          3HG1      ILE  43  -0.887   0.739  -0.417
  327   1HG2  ILE  43          1HG2      ILE  43  -3.669   2.302   1.314
  328   2HG2  ILE  43          2HG2      ILE  43  -3.892   0.708   0.570
  329   3HG2  ILE  43          3HG2      ILE  43  -2.361   1.126   1.365
  330   1HD1  ILE  43          1HD1      ILE  43  -1.433  -0.985  -1.917
  331   2HD1  ILE  43          2HD1      ILE  43  -2.918  -0.704  -0.984
  332   3HD1  ILE  43          3HD1      ILE  43  -2.748  -0.066  -2.631
  333    H    THR  44           H        THR  44  -4.077   2.247  -3.994
  334    HA   THR  44           HA       THR  44  -6.399   0.447  -3.671
  335    HB   THR  44           HB       THR  44  -5.131   1.771  -6.079
  336    HG1  THR  44           1HG      THR  44  -7.402   2.514  -5.999
  337   1HG2  THR  44          1HG2      THR  44  -7.578  -0.042  -5.944
  338   2HG2  THR  44          2HG2      THR  44  -7.132   0.965  -7.336
  339   3HG2  THR  44          3HG2      THR  44  -6.087  -0.360  -6.858
  340    H    VAL  45           H        VAL  45  -6.430  -1.571  -4.389
  341    HA   VAL  45           HA       VAL  45  -3.982  -2.912  -5.398
  342    HB   VAL  45           HB       VAL  45  -5.639  -3.486  -2.942
  343   1HG1  VAL  45          1HG1      VAL  45  -4.171  -5.673  -4.460
  344   2HG1  VAL  45          2HG1      VAL  45  -4.785  -5.797  -2.807
  345   3HG1  VAL  45          3HG1      VAL  45  -5.920  -5.593  -4.143
  346   1HG2  VAL  45          1HG2      VAL  45  -3.448  -3.970  -1.943
  347   2HG2  VAL  45          2HG2      VAL  45  -2.663  -3.781  -3.525
  348   3HG2  VAL  45          3HG2      VAL  45  -3.442  -2.392  -2.744
  349    H    THR  46           H        THR  46  -4.498  -4.129  -7.183
  350    HA   THR  46           HA       THR  46  -7.219  -5.215  -7.481
  351    HB   THR  46           HB       THR  46  -5.739  -3.514  -9.561
  352    HG1  THR  46           1HG      THR  46  -7.432  -3.224  -7.602
  353   1HG2  THR  46          1HG2      THR  46  -8.378  -5.067  -9.746
  354   2HG2  THR  46          2HG2      THR  46  -7.814  -3.859 -10.921
  355   3HG2  THR  46          3HG2      THR  46  -6.917  -5.373 -10.713
  356    H    GLY  47           H        GLY  47  -7.059  -7.268  -7.944
  357   1HA   GLY  47          1HA       GLY  47  -5.413  -8.322  -9.884
  358   2HA   GLY  47          2HA       GLY  47  -4.370  -8.359  -8.490
  359    H    GLU  48           H        GLU  48  -4.689  -9.798  -6.772
  360    HA   GLU  48           HA       GLU  48  -7.251 -10.833  -6.127
  361   1HB   GLU  48          2HB       GLU  48  -6.461 -12.384  -8.101
  362   2HB   GLU  48          3HB       GLU  48  -5.344 -13.063  -6.925
  363   1HG   GLU  48          2HG       GLU  48  -7.288 -13.653  -5.475
  364   2HG   GLU  48          3HG       GLU  48  -8.382 -12.849  -6.620
  365    H    ALA  49           H        ALA  49  -5.738  -9.268  -4.569
  366    HA   ALA  49           HA       ALA  49  -5.099 -11.055  -2.349
  367   1HB   ALA  49          1HB       ALA  49  -2.862 -10.081  -1.957
  368   2HB   ALA  49          2HB       ALA  49  -2.924 -10.930  -3.507
  369   3HB   ALA  49          3HB       ALA  49  -2.992  -9.152  -3.467
  370    H    SER  50           H        SER  50  -4.414  -9.620  -0.400
  371    HA   SER  50           HA       SER  50  -6.286  -7.315  -0.246
  372   1HB   SER  50          2HB       SER  50  -5.483  -9.409   1.835
  373   2HB   SER  50          3HB       SER  50  -6.523  -8.018   2.140
  374    HG   SER  50           HG       SER  50  -7.769  -8.991   0.232
  375    H    ILE  51           H        ILE  51  -5.718  -5.669   1.395
  376    HA   ILE  51           HA       ILE  51  -3.213  -4.705   1.097
  377    HB   ILE  51           HB       ILE  51  -5.285  -3.493   2.110
  378   1HG1  ILE  51          2HG1      ILE  51  -3.999  -1.946   3.345
  379   2HG1  ILE  51          3HG1      ILE  51  -2.564  -2.968   3.173
  380   1HG2  ILE  51          1HG2      ILE  51  -4.045  -4.320   4.751
  381   2HG2  ILE  51          2HG2      ILE  51  -5.501  -3.364   4.480
  382   3HG2  ILE  51          3HG2      ILE  51  -5.516  -5.092   4.092
  383   1HD1  ILE  51          1HD1      ILE  51  -2.539  -1.198   1.485
  384   2HD1  ILE  51          2HD1      ILE  51  -2.863  -2.689   0.613
  385   3HD1  ILE  51          3HD1      ILE  51  -4.196  -1.592   0.985
  386    H    GLN  52           H        GLN  52  -4.131  -7.059   3.534
  387    HA   GLN  52           HA       GLN  52  -2.252  -6.991   5.465
  388   1HB   GLN  52          2HB       GLN  52  -3.102  -9.364   3.756
  389   2HB   GLN  52          3HB       GLN  52  -2.152  -9.542   5.239
  390   1HG   GLN  52          2HG       GLN  52  -3.885  -8.674   6.616
  391   2HG   GLN  52          3HG       GLN  52  -4.812  -8.058   5.246
  392   1HE2  GLN  52          1HE2      GLN  52  -6.507  -9.344   4.538
  393   2HE2  GLN  52          2HE2      GLN  52  -6.592 -11.069   4.827
  394    H    GLN  53           H        GLN  53  -1.567  -8.092   2.142
  395    HA   GLN  53           HA       GLN  53   1.195  -8.794   2.480
  396   1HB   GLN  53          2HB       GLN  53  -0.314  -7.688   0.080
  397   2HB   GLN  53          3HB       GLN  53   1.266  -8.459   0.005
  398   1HG   GLN  53          2HG       GLN  53  -0.884 -10.096   1.338
  399   2HG   GLN  53          3HG       GLN  53  -1.168  -9.692  -0.354
  400   1HE2  GLN  53          1HE2      GLN  53  -0.968 -11.898  -1.019
  401   2HE2  GLN  53          2HE2      GLN  53   0.608 -12.660  -1.062
  402    H    VAL  54           H        VAL  54  -0.379  -5.753   1.541
  403    HA   VAL  54           HA       VAL  54   2.030  -4.240   1.017
  404    HB   VAL  54           HB       VAL  54  -0.837  -3.337   1.516
  405   1HG1  VAL  54          1HG1      VAL  54   1.590  -1.901   0.435
  406   2HG1  VAL  54          2HG1      VAL  54  -0.073  -1.368   0.102
  407   3HG1  VAL  54          3HG1      VAL  54   0.520  -1.450   1.762
  408   1HG2  VAL  54          1HG2      VAL  54   0.518  -4.301  -1.012
  409   2HG2  VAL  54          2HG2      VAL  54  -1.010  -4.824  -0.305
  410   3HG2  VAL  54          3HG2      VAL  54  -0.898  -3.228  -1.046
  411    H    GLU  55           H        GLU  55  -0.305  -4.540   3.733
  412    HA   GLU  55           HA       GLU  55   0.781  -2.508   5.322
  413   1HB   GLU  55          2HB       GLU  55  -1.479  -3.670   5.463
  414   2HB   GLU  55          3HB       GLU  55  -0.685  -4.985   6.335
  415   1HG   GLU  55          2HG       GLU  55  -0.101  -3.542   8.143
  416   2HG   GLU  55          3HG       GLU  55  -0.353  -2.085   7.174
  417    H    GLN  56           H        GLN  56   1.367  -6.044   5.134
  418    HA   GLN  56           HA       GLN  56   3.379  -6.279   7.064
  419   1HB   GLN  56          2HB       GLN  56   2.271  -8.116   5.673
  420   2HB   GLN  56          3HB       GLN  56   3.463  -7.769   4.413
  421   1HG   GLN  56          2HG       GLN  56   4.020  -8.630   7.287
  422   2HG   GLN  56          3HG       GLN  56   4.092  -9.664   5.856
  423   1HE2  GLN  56          1HE2      GLN  56   6.056  -7.978   7.969
  424   2HE2  GLN  56          2HE2      GLN  56   7.409  -7.710   6.887
  425    H    ALA  57           H        ALA  57   3.847  -5.501   3.518
  426    HA   ALA  57           HA       ALA  57   6.583  -4.834   3.609
  427   1HB   ALA  57          1HB       ALA  57   5.427  -4.877   1.527
  428   2HB   ALA  57          2HB       ALA  57   4.372  -3.532   1.993
  429   3HB   ALA  57          3HB       ALA  57   6.096  -3.251   1.798
  430    H    GLY  58           H        GLY  58   3.780  -2.691   4.305
  431   1HA   GLY  58          1HA       GLY  58   5.173  -0.349   4.880
  432   2HA   GLY  58          2HA       GLY  58   3.534  -0.787   5.451
  433    H    ALA  59           H        ALA  59   4.923  -3.212   6.881
  434    HA   ALA  59           HA       ALA  59   5.362  -2.180   9.441
  435   1HB   ALA  59          1HB       ALA  59   5.169  -4.601   8.866
  436   2HB   ALA  59          2HB       ALA  59   6.824  -4.535   8.198
  437   3HB   ALA  59          3HB       ALA  59   6.547  -4.227   9.921
  438    H    PHE  60           H        PHE  60   7.509  -2.023   6.590
  439    HA   PHE  60           HA       PHE  60   9.915  -1.460   7.895
  440   1HB   PHE  60          2HB       PHE  60  10.591  -0.220   5.918
  441   2HB   PHE  60          3HB       PHE  60   9.928  -1.812   5.591
  442    HD1  PHE  60           1HD      PHE  60   8.754   1.758   5.734
  443    HD2  PHE  60           2HD      PHE  60   8.755  -1.928   3.554
  444    HE1  PHE  60           1HE      PHE  60   7.387   2.822   3.989
  445    HE2  PHE  60           2HE      PHE  60   7.386  -0.842   1.767
  446    HZ   PHE  60           HZ       PHE  60   6.815   1.552   1.936
  447    H    GLU  61           H        GLU  61   7.177   0.772   7.408
  448    HA   GLU  61           HA       GLU  61   8.573   2.760   9.182
  449   1HB   GLU  61          2HB       GLU  61   7.061   3.188   6.620
  450   2HB   GLU  61          3HB       GLU  61   6.665   4.244   7.960
  451   1HG   GLU  61          2HG       GLU  61   8.239   5.513   7.005
  452   2HG   GLU  61          3HG       GLU  61   9.228   4.676   8.194
  453    H    HIS  62           H        HIS  62   6.084   0.512   9.055
  454    HA   HIS  62           HA       HIS  62   4.653  -0.133  10.663
  455   1HB   HIS  62          2HB       HIS  62   5.186   2.349  12.317
  456   2HB   HIS  62          3HB       HIS  62   4.575   0.786  12.836
  457    HD1  HIS  62           1HD      HIS  62   7.216  -0.693  11.189
  458    HD2  HIS  62           2HD      HIS  62   7.118   2.300  14.147
  459    HE1  HIS  62           1HE      HIS  62   9.467  -0.748  12.349
  460    H    LEU  63           H        LEU  63   3.599   0.936   8.409
  461    HA   LEU  63           HA       LEU  63   1.824   3.172   9.078
  462   1HB   LEU  63          2HB       LEU  63   2.144   1.328   6.695
  463   2HB   LEU  63          3HB       LEU  63   0.752   2.393   6.815
  464    HG   LEU  63           HG       LEU  63   2.432   3.423   5.481
  465   1HD1  LEU  63          1HD1      LEU  63   2.320   5.545   6.346
  466   2HD1  LEU  63          2HD1      LEU  63   0.924   4.759   7.084
  467   3HD1  LEU  63          3HD1      LEU  63   2.394   5.044   8.038
  468   1HD2  LEU  63          1HD2      LEU  63   4.493   2.430   6.552
  469   2HD2  LEU  63          2HD2      LEU  63   4.584   4.183   6.288
  470   3HD2  LEU  63          3HD2      LEU  63   4.269   3.555   7.909
  471    H    LYS  64           H        LYS  64  -0.587   3.001   8.688
  472    HA   LYS  64           HA       LYS  64  -1.720   0.410   9.576
  473   1HB   LYS  64          2HB       LYS  64  -3.396   1.699  10.923
  474   2HB   LYS  64          3HB       LYS  64  -1.761   1.610  11.567
  475   1HG   LYS  64          2HG       LYS  64  -2.391   3.727  12.083
  476   2HG   LYS  64          3HG       LYS  64  -1.366   3.983  10.692
  477   1HD   LYS  64          2HD       LYS  64  -3.059   4.790   9.398
  478   2HD   LYS  64          3HD       LYS  64  -4.273   3.673  10.015
  479   1HE   LYS  64          2HE       LYS  64  -3.197   6.105  11.536
  480   2HE   LYS  64          3HE       LYS  64  -4.656   6.121  10.534
  481   1HZ   LYS  64          1HZ       LYS  64  -4.308   4.391  12.881
  482   2HZ   LYS  64          2HZ       LYS  64  -5.167   5.794  12.839
  483   3HZ   LYS  64          3HZ       LYS  64  -5.651   4.510  11.936
  484    H    ILE  65           H        ILE  65  -3.066  -0.269   7.983
  485    HA   ILE  65           HA       ILE  65  -4.199   1.823   6.197
  486    HB   ILE  65           HB       ILE  65  -3.577  -0.916   5.207
  487   1HG1  ILE  65          2HG1      ILE  65  -1.569   1.277   5.616
  488   2HG1  ILE  65          3HG1      ILE  65  -1.517  -0.467   6.014
  489   1HG2  ILE  65          1HG2      ILE  65  -3.639   0.243   3.075
  490   2HG2  ILE  65          2HG2      ILE  65  -5.047   0.734   4.019
  491   3HG2  ILE  65          3HG2      ILE  65  -3.682   1.821   3.873
  492   1HD1  ILE  65          1HD1      ILE  65  -0.016  -0.031   4.200
  493   2HD1  ILE  65          2HD1      ILE  65  -1.374  -1.006   3.616
  494   3HD1  ILE  65          3HD1      ILE  65  -1.298   0.741   3.259
  495    H    ILE  66           H        ILE  66  -6.322   1.988   6.508
  496    HA   ILE  66           HA       ILE  66  -7.756  -0.273   7.731
  497    HB   ILE  66           HB       ILE  66  -8.437   2.655   7.412
  498   1HG1  ILE  66          2HG1      ILE  66  -7.850   0.999   9.914
  499   2HG1  ILE  66          3HG1      ILE  66  -6.610   1.925   9.067
  500   1HG2  ILE  66          1HG2      ILE  66 -10.530   1.320   7.359
  501   2HG2  ILE  66          2HG2      ILE  66 -10.015   0.445   8.816
  502   3HG2  ILE  66          3HG2      ILE  66 -10.391   2.176   8.883
  503   1HD1  ILE  66          1HD1      ILE  66  -7.385   3.215  10.925
  504   2HD1  ILE  66          2HD1      ILE  66  -7.879   4.013   9.419
  505   3HD1  ILE  66          3HD1      ILE  66  -9.067   3.115  10.394
  506    HA   PRO  67           HA       PRO  67  -9.915  -0.887   3.717
  507   1HB   PRO  67          2HB       PRO  67 -11.726  -2.758   4.532
  508   2HB   PRO  67          3HB       PRO  67 -10.021  -3.154   4.221
  509   1HG   PRO  67          2HG       PRO  67 -11.326  -2.612   6.882
  510   2HG   PRO  67          3HG       PRO  67 -10.195  -3.929   6.457
  511   1HD   PRO  67          2HD       PRO  67  -9.419  -1.649   7.719
  512   2HD   PRO  67          3HD       PRO  67  -8.335  -2.472   6.559
  513    H    GLU  68           H        GLU  68 -10.627   1.271   3.809
  514    HA   GLU  68           HA       GLU  68 -12.843   2.299   5.197
  515   1HB   GLU  68          2HB       GLU  68 -11.351   2.931   2.756
  516   2HB   GLU  68          3HB       GLU  68 -13.068   3.177   2.472
  517   1HG   GLU  68          2HG       GLU  68 -11.654   4.367   4.885
  518   2HG   GLU  68          3HG       GLU  68 -11.763   5.156   3.283
  519    H    LYS  69           H        LYS  69 -15.069   2.580   4.460
  520    HA   LYS  69           HA       LYS  69 -16.153   0.455   2.744
  521   1HB   LYS  69          2HB       LYS  69 -17.498  -0.670   4.411
  522   2HB   LYS  69          3HB       LYS  69 -15.791  -0.778   4.804
  523   1HG   LYS  69          2HG       LYS  69 -16.744  -0.390   6.877
  524   2HG   LYS  69          3HG       LYS  69 -16.164   1.207   6.407
  525   1HD   LYS  69          2HD       LYS  69 -18.251   2.032   6.666
  526   2HD   LYS  69          3HD       LYS  69 -18.803   0.980   5.361
  527   1HE   LYS  69          2HE       LYS  69 -19.178  -0.867   6.996
  528   2HE   LYS  69          3HE       LYS  69 -18.833   0.282   8.307
  529   1HZ   LYS  69          1HZ       LYS  69 -20.930   0.629   6.253
  530   2HZ   LYS  69          2HZ       LYS  69 -21.204   0.082   7.787
  531   3HZ   LYS  69          3HZ       LYS  69 -20.665   1.615   7.537
  532    H    GLU  70           H        GLU  70 -17.903   1.227   1.688
  533    HA   GLU  70           HA       GLU  70 -18.835   3.866   2.109
  534   1HB   GLU  70          2HB       GLU  70 -19.809   1.493   0.496
  535   2HB   GLU  70          3HB       GLU  70 -20.836   2.920   0.663
  536   1HG   GLU  70          2HG       GLU  70 -19.124   4.379  -0.232
  537   2HG   GLU  70          3HG       GLU  70 -17.953   3.050  -0.315
  538    H    ALA  71           H        ALA  71 -20.802   4.714   2.952
  539    HA   ALA  71           HA       ALA  71 -22.672   3.234   4.469
  540   1HB   ALA  71          1HB       ALA  71 -22.010   4.185   6.668
  541   2HB   ALA  71          2HB       ALA  71 -20.713   3.131   6.058
  542   3HB   ALA  71          3HB       ALA  71 -20.551   4.891   5.938
  Start of MODEL    3
    1   1H    MET   1           H1       MET   1 -12.676 -14.812 -10.633
    2   2H    MET   1           H2       MET   1 -14.308 -14.844 -10.923
    3   3H    MET   1           H3       MET   1 -13.439 -13.444 -11.129
    4    HA   MET   1           HA       MET   1 -14.633 -13.297  -9.078
    5   1HB   MET   1          2HB       MET   1 -13.456 -16.045  -8.784
    6   2HB   MET   1          3HB       MET   1 -13.492 -15.047  -7.329
    7   1HG   MET   1          2HG       MET   1 -15.849 -14.706  -7.468
    8   2HG   MET   1          3HG       MET   1 -15.960 -15.580  -9.008
    9   1HE   MET   1          1HE       MET   1 -18.007 -16.841  -7.707
   10   2HE   MET   1          2HE       MET   1 -17.750 -17.817  -6.240
   11   3HE   MET   1          3HE       MET   1 -17.607 -16.046  -6.161
   12    H    ALA   2           H        ALA   2 -13.436 -11.341  -9.205
   13    HA   ALA   2           HA       ALA   2 -11.260 -11.004  -7.484
   14   1HB   ALA   2          1HB       ALA   2  -9.568 -10.305  -9.205
   15   2HB   ALA   2          2HB       ALA   2  -9.850 -12.047  -9.238
   16   3HB   ALA   2          3HB       ALA   2 -10.589 -11.003 -10.475
   17    H    GLU   3           H        GLU   3 -10.838  -8.672  -7.365
   18    HA   GLU   3           HA       GLU   3 -12.181  -6.805  -9.126
   19   1HB   GLU   3          2HB       GLU   3 -13.472  -5.855  -7.157
   20   2HB   GLU   3          3HB       GLU   3 -14.076  -7.385  -7.797
   21   1HG   GLU   3          2HG       GLU   3 -12.152  -7.648  -5.517
   22   2HG   GLU   3          3HG       GLU   3 -13.697  -6.883  -5.155
   23    H    LYS   4           H        LYS   4 -11.827  -4.550  -8.118
   24    HA   LYS   4           HA       LYS   4  -9.054  -4.378  -7.092
   25   1HB   LYS   4          2HB       LYS   4  -9.145  -2.057  -7.607
   26   2HB   LYS   4          3HB       LYS   4  -9.755  -2.953  -8.994
   27   1HG   LYS   4          2HG       LYS   4 -11.514  -1.570  -8.988
   28   2HG   LYS   4          3HG       LYS   4 -12.101  -2.402  -7.543
   29   1HD   LYS   4          2HD       LYS   4 -10.766  -0.788  -6.134
   30   2HD   LYS   4          3HD       LYS   4 -10.259   0.034  -7.627
   31   1HE   LYS   4          2HE       LYS   4 -12.705   0.444  -8.156
   32   2HE   LYS   4          3HE       LYS   4 -13.122  -0.251  -6.581
   33   1HZ   LYS   4          1HZ       LYS   4 -11.466   2.148  -7.026
   34   2HZ   LYS   4          2HZ       LYS   4 -13.022   2.130  -6.499
   35   3HZ   LYS   4          3HZ       LYS   4 -11.831   1.509  -5.553
   36    H    THR   5           H        THR   5  -8.641  -2.908  -5.157
   37    HA   THR   5           HA       THR   5 -10.949  -2.514  -3.385
   38    HB   THR   5           HB       THR   5  -8.590  -4.307  -2.551
   39    HG1  THR   5           1HG      THR   5 -11.053  -4.578  -3.604
   40   1HG2  THR   5          1HG2      THR   5 -11.156  -3.512  -1.061
   41   2HG2  THR   5          2HG2      THR   5  -9.916  -4.641  -0.489
   42   3HG2  THR   5          3HG2      THR   5  -9.537  -2.916  -0.644
   43    H    VAL   6           H        VAL   6 -10.499  -0.866  -1.913
   44    HA   VAL   6           HA       VAL   6  -7.790   0.001  -1.921
   45    HB   VAL   6           HB       VAL   6  -8.694   1.259  -3.683
   46   1HG1  VAL   6          1HG1      VAL   6 -10.671   2.643  -3.663
   47   2HG1  VAL   6          2HG1      VAL   6 -11.039   0.928  -3.460
   48   3HG1  VAL   6          3HG1      VAL   6 -11.104   2.018  -2.047
   49   1HG2  VAL   6          1HG2      VAL   6  -7.402   2.721  -2.073
   50   2HG2  VAL   6          2HG2      VAL   6  -8.599   3.620  -3.010
   51   3HG2  VAL   6          3HG2      VAL   6  -8.942   3.186  -1.321
   52    H    TYR   7           H        TYR   7  -7.057   1.093  -0.154
   53    HA   TYR   7           HA       TYR   7  -8.833   0.954   2.256
   54   1HB   TYR   7          2HB       TYR   7  -5.910   0.148   2.046
   55   2HB   TYR   7          3HB       TYR   7  -6.985   0.061   3.453
   56    HD1  TYR   7           HD1      TYR   7  -7.617  -2.043   4.087
   57    HD2  TYR   7           HD2      TYR   7  -6.525  -1.364  -0.009
   58    HE1  TYR   7           HE1      TYR   7  -8.034  -4.418   3.592
   59    HE2  TYR   7           HE2      TYR   7  -6.857  -3.771  -0.480
   60    HH   TYR   7           HH       TYR   7  -8.227  -6.041   1.856
   61    H    ARG   8           H        ARG   8  -8.235   2.516   3.922
   62    HA   ARG   8           HA       ARG   8  -6.933   4.881   2.776
   63   1HB   ARG   8          2HB       ARG   8  -9.208   4.725   4.124
   64   2HB   ARG   8          3HB       ARG   8  -8.156   4.698   5.549
   65   1HG   ARG   8          2HG       ARG   8  -7.024   6.773   4.604
   66   2HG   ARG   8          3HG       ARG   8  -8.258   6.765   3.325
   67   1HD   ARG   8          2HD       ARG   8  -8.748   7.008   6.317
   68   2HD   ARG   8          3HD       ARG   8  -8.841   8.341   5.145
   69    HE   ARG   8           HE       ARG   8 -10.607   6.512   4.071
   70   1HH1  ARG   8          2HH2      ARG   8 -10.421   8.000   7.261
   71   2HH1  ARG   8          1HH2      ARG   8 -12.118   7.799   7.595
   72   1HH2  ARG   8          2HH1      ARG   8 -12.641   6.263   4.388
   73   2HH2  ARG   8          1HH1      ARG   8 -13.507   6.727   5.859
   74    H    VAL   9           H        VAL   9  -4.860   5.393   3.290
   75    HA   VAL   9           HA       VAL   9  -3.500   3.956   5.529
   76    HB   VAL   9           HB       VAL   9  -2.467   3.155   3.580
   77   1HG1  VAL   9          1HG1      VAL   9  -3.420   4.672   1.890
   78   2HG1  VAL   9          2HG1      VAL   9  -2.379   5.992   2.455
   79   3HG1  VAL   9          3HG1      VAL   9  -1.692   4.533   1.710
   80   1HG2  VAL   9          1HG2      VAL   9  -0.970   4.160   5.385
   81   2HG2  VAL   9          2HG2      VAL   9  -0.232   3.942   3.807
   82   3HG2  VAL   9          3HG2      VAL   9  -0.759   5.560   4.300
   83    H    ASP  10           H        ASP  10  -2.367   5.190   6.976
   84    HA   ASP  10           HA       ASP  10  -2.084   8.088   6.490
   85   1HB   ASP  10          2HB       ASP  10  -3.741   6.777   8.675
   86   2HB   ASP  10          3HB       ASP  10  -2.809   8.228   9.049
   87    H    GLY  11           H        GLY  11  -0.504   8.987   7.895
   88   1HA   GLY  11          1HA       GLY  11   1.110   8.618   9.708
   89   2HA   GLY  11          2HA       GLY  11   1.470   7.024   9.039
   90    H    LEU  12           H        LEU  12   2.264   7.028   6.691
   91    HA   LEU  12           HA       LEU  12   4.528   8.846   6.646
   92   1HB   LEU  12          2HB       LEU  12   5.432   7.504   4.917
   93   2HB   LEU  12          3HB       LEU  12   4.696   6.451   6.109
   94    HG   LEU  12           HG       LEU  12   2.649   6.320   4.560
   95   1HD1  LEU  12          1HD1      LEU  12   3.347   6.560   2.093
   96   2HD1  LEU  12          2HD1      LEU  12   2.907   8.035   2.937
   97   3HD1  LEU  12          3HD1      LEU  12   4.623   7.645   2.650
   98   1HD2  LEU  12          1HD2      LEU  12   5.266   5.265   3.416
   99   2HD2  LEU  12          2HD2      LEU  12   4.461   4.574   4.827
  100   3HD2  LEU  12          3HD2      LEU  12   3.635   4.566   3.261
  101    H    SER  13           H        SER  13   5.168   9.552   4.292
  102    HA   SER  13           HA       SER  13   3.090  10.550   2.582
  103   1HB   SER  13          2HB       SER  13   2.859  12.204   4.435
  104   2HB   SER  13          3HB       SER  13   4.560  12.664   4.219
  105    HG   SER  13           HG       SER  13   3.073  14.022   3.075
  106    H    CYS  14           H        CYS  14   6.468  10.907   3.677
  107    HA   CYS  14           HA       CYS  14   7.554  12.275   1.610
  108   1HB   CYS  14          2HB       CYS  14   8.753  11.810   3.643
  109   2HB   CYS  14          3HB       CYS  14   8.846  10.071   3.272
  110    HG   CYS  14           HG       CYS  14  10.326  10.164   1.286
  111    H    THR  15           H        THR  15   7.948  12.003  -0.504
  112    HA   THR  15           HA       THR  15   7.022  10.085  -2.092
  113    HB   THR  15           HB       THR  15   9.596  11.610  -2.639
  114    HG1  THR  15           1HG      THR  15   6.921  12.551  -2.688
  115   1HG2  THR  15          1HG2      THR  15   8.610  11.856  -4.898
  116   2HG2  THR  15          2HG2      THR  15   8.839  10.147  -4.485
  117   3HG2  THR  15          3HG2      THR  15   7.217  10.866  -4.413
  118    H    ASN  16           H        ASN  16  10.386  10.082  -0.796
  119    HA   ASN  16           HA       ASN  16  11.330   7.823  -2.067
  120   1HB   ASN  16          2HB       ASN  16  12.542   9.464  -0.560
  121   2HB   ASN  16          3HB       ASN  16  11.957   8.533   0.829
  122   1HD2  ASN  16          1HD2      ASN  16  14.747   9.043  -0.215
  123   2HD2  ASN  16          2HD2      ASN  16  15.416   7.444  -0.471
  124    H    CYS  17           H        CYS  17   9.368   8.029   0.922
  125    HA   CYS  17           HA       CYS  17   9.452   5.188   1.529
  126   1HB   CYS  17          2HB       CYS  17   8.467   7.629   2.797
  127   2HB   CYS  17          3HB       CYS  17   7.166   6.436   2.712
  128    HG   CYS  17           HG       CYS  17   8.326   6.227   5.089
  129    H    ALA  18           H        ALA  18   7.208   7.476  -0.053
  130    HA   ALA  18           HA       ALA  18   5.118   5.684  -0.602
  131   1HB   ALA  18          1HB       ALA  18   4.550   7.185  -2.495
  132   2HB   ALA  18          2HB       ALA  18   4.937   8.106  -1.019
  133   3HB   ALA  18          3HB       ALA  18   6.106   7.979  -2.350
  134    H    ALA  19           H        ALA  19   8.021   6.399  -2.513
  135    HA   ALA  19           HA       ALA  19   7.534   4.706  -4.737
  136   1HB   ALA  19          1HB       ALA  19   9.920   4.914  -5.184
  137   2HB   ALA  19          2HB       ALA  19   9.203   6.480  -4.760
  138   3HB   ALA  19          3HB       ALA  19  10.192   5.607  -3.572
  139    H    LYS  20           H        LYS  20   9.525   4.164  -1.779
  140    HA   LYS  20           HA       LYS  20  10.176   1.473  -2.210
  141   1HB   LYS  20          2HB       LYS  20  10.996   2.918  -0.292
  142   2HB   LYS  20          3HB       LYS  20   9.392   2.828   0.422
  143   1HG   LYS  20          2HG       LYS  20  10.458   1.213   1.654
  144   2HG   LYS  20          3HG       LYS  20   9.715   0.230   0.408
  145   1HD   LYS  20          2HD       LYS  20  11.855  -0.628   0.474
  146   2HD   LYS  20          3HD       LYS  20  11.978   0.511  -0.878
  147   1HE   LYS  20          2HE       LYS  20  12.893   2.240   0.753
  148   2HE   LYS  20          3HE       LYS  20  12.793   1.033   2.041
  149   1HZ   LYS  20          1HZ       LYS  20  14.987   1.175   1.175
  150   2HZ   LYS  20          2HZ       LYS  20  14.371  -0.307   0.816
  151   3HZ   LYS  20          3HZ       LYS  20  14.486   0.849  -0.356
  152    H    PHE  21           H        PHE  21   7.223   2.798  -0.623
  153    HA   PHE  21           HA       PHE  21   5.982   0.329  -0.170
  154   1HB   PHE  21          2HB       PHE  21   5.203   3.128  -0.114
  155   2HB   PHE  21          3HB       PHE  21   3.949   2.177  -0.873
  156    HD1  PHE  21           1HD      PHE  21   3.118   0.031   0.317
  157    HD2  PHE  21           2HD      PHE  21   5.511   3.043   2.258
  158    HE1  PHE  21           1HE      PHE  21   2.168  -0.615   2.530
  159    HE2  PHE  21           2HE      PHE  21   4.660   2.282   4.452
  160    HZ   PHE  21           HZ       PHE  21   2.755   0.673   4.549
  161    H    GLU  22           H        GLU  22   5.291   2.496  -3.043
  162    HA   GLU  22           HA       GLU  22   3.443   0.635  -4.095
  163   1HB   GLU  22          2HB       GLU  22   3.613   1.790  -6.241
  164   2HB   GLU  22          3HB       GLU  22   3.433   2.878  -4.879
  165   1HG   GLU  22          2HG       GLU  22   4.921   4.011  -6.191
  166   2HG   GLU  22          3HG       GLU  22   5.934   3.262  -4.962
  167    H    ARG  23           H        ARG  23   6.947   1.025  -4.726
  168    HA   ARG  23           HA       ARG  23   7.237  -1.077  -6.595
  169   1HB   ARG  23          2HB       ARG  23   9.038   0.591  -5.990
  170   2HB   ARG  23          3HB       ARG  23   9.121  -0.102  -4.367
  171   1HG   ARG  23          2HG       ARG  23   9.770  -2.286  -5.271
  172   2HG   ARG  23          3HG       ARG  23   9.703  -1.662  -6.927
  173   1HD   ARG  23          2HD       ARG  23  11.636  -0.331  -6.584
  174   2HD   ARG  23          3HD       ARG  23  11.464  -0.391  -4.805
  175    HE   ARG  23           HE       ARG  23  11.657  -3.061  -5.650
  176   1HH1  ARG  23          2HH2      ARG  23  13.825  -0.303  -5.659
  177   2HH1  ARG  23          1HH2      ARG  23  15.252  -1.250  -5.339
  178   1HH2  ARG  23          2HH1      ARG  23  13.231  -4.255  -5.215
  179   2HH2  ARG  23          1HH1      ARG  23  14.916  -3.725  -5.053
  180    H    ASN  24           H        ASN  24   7.549  -1.190  -2.972
  181    HA   ASN  24           HA       ASN  24   8.037  -3.941  -2.695
  182   1HB   ASN  24          2HB       ASN  24   6.645  -1.897  -0.936
  183   2HB   ASN  24          3HB       ASN  24   6.441  -3.605  -0.599
  184   1HD2  ASN  24          1HD2      ASN  24   7.425  -3.201   1.453
  185   2HD2  ASN  24          2HD2      ASN  24   9.155  -3.264   1.566
  186    H    VAL  25           H        VAL  25   4.868  -2.252  -3.045
  187    HA   VAL  25           HA       VAL  25   3.354  -4.686  -2.904
  188    HB   VAL  25           HB       VAL  25   2.528  -2.121  -4.330
  189   1HG1  VAL  25          1HG1      VAL  25   1.053  -4.603  -3.349
  190   2HG1  VAL  25          2HG1      VAL  25   0.234  -3.079  -3.714
  191   3HG1  VAL  25          3HG1      VAL  25   1.102  -3.947  -4.993
  192   1HG2  VAL  25          1HG2      VAL  25   2.335  -3.039  -1.443
  193   2HG2  VAL  25          2HG2      VAL  25   2.981  -1.514  -2.051
  194   3HG2  VAL  25          3HG2      VAL  25   1.251  -1.797  -2.132
  195    H    LYS  26           H        LYS  26   4.700  -2.891  -5.700
  196    HA   LYS  26           HA       LYS  26   3.746  -4.650  -7.726
  197   1HB   LYS  26          2HB       LYS  26   5.958  -2.616  -7.483
  198   2HB   LYS  26          3HB       LYS  26   6.064  -3.757  -8.784
  199   1HG   LYS  26          2HG       LYS  26   4.866  -2.353  -9.971
  200   2HG   LYS  26          3HG       LYS  26   3.465  -2.952  -9.075
  201   1HD   LYS  26          2HD       LYS  26   3.640  -1.075  -7.502
  202   2HD   LYS  26          3HD       LYS  26   5.150  -0.573  -8.263
  203   1HE   LYS  26          2HE       LYS  26   3.537   0.940  -9.091
  204   2HE   LYS  26          3HE       LYS  26   3.904  -0.164 -10.413
  205   1HZ   LYS  26          1HZ       LYS  26   1.829  -1.362  -9.757
  206   2HZ   LYS  26          2HZ       LYS  26   1.447  -0.105  -8.741
  207   3HZ   LYS  26          3HZ       LYS  26   1.589   0.138 -10.346
  208    H    GLU  27           H        GLU  27   6.610  -4.968  -5.582
  209    HA   GLU  27           HA       GLU  27   7.524  -7.357  -6.930
  210   1HB   GLU  27          2HB       GLU  27   8.212  -6.320  -4.156
  211   2HB   GLU  27          3HB       GLU  27   8.964  -7.685  -4.982
  212   1HG   GLU  27          2HG       GLU  27   9.637  -6.128  -6.856
  213   2HG   GLU  27          3HG       GLU  27   9.071  -4.775  -5.875
  214    H    ILE  28           H        ILE  28   4.685  -6.976  -5.028
  215    HA   ILE  28           HA       ILE  28   4.761  -9.709  -3.907
  216    HB   ILE  28           HB       ILE  28   2.530  -7.724  -4.100
  217   1HG1  ILE  28          2HG1      ILE  28   4.330  -6.844  -2.649
  218   2HG1  ILE  28          3HG1      ILE  28   2.820  -7.111  -1.798
  219   1HG2  ILE  28          1HG2      ILE  28   1.473  -9.001  -2.258
  220   2HG2  ILE  28          2HG2      ILE  28   1.493  -9.799  -3.821
  221   3HG2  ILE  28          3HG2      ILE  28   2.640 -10.313  -2.562
  222   1HD1  ILE  28          1HD1      ILE  28   4.739  -7.809  -0.451
  223   2HD1  ILE  28          2HD1      ILE  28   3.726  -9.210  -0.825
  224   3HD1  ILE  28          3HD1      ILE  28   5.251  -8.950  -1.709
  225    H    GLU  29           H        GLU  29   4.060 -11.443  -5.003
  226    HA   GLU  29           HA       GLU  29   3.165 -11.318  -7.709
  227   1HB   GLU  29          2HB       GLU  29   3.738 -13.475  -5.635
  228   2HB   GLU  29          3HB       GLU  29   2.956 -13.877  -7.146
  229   1HG   GLU  29          2HG       GLU  29   4.822 -12.924  -8.437
  230   2HG   GLU  29          3HG       GLU  29   5.650 -12.478  -6.933
  231    H    GLY  30           H        GLY  30   1.555 -11.639  -4.717
  232   1HA   GLY  30          1HA       GLY  30  -0.831 -12.961  -5.547
  233   2HA   GLY  30          2HA       GLY  30  -0.663 -11.973  -4.092
  234    H    VAL  31           H        VAL  31   0.132  -9.651  -6.194
  235    HA   VAL  31           HA       VAL  31  -2.635  -8.911  -6.849
  236    HB   VAL  31           HB       VAL  31  -1.862  -7.717  -4.930
  237   1HG1  VAL  31          1HG1      VAL  31   0.545  -7.947  -5.093
  238   2HG1  VAL  31          2HG1      VAL  31   0.591  -6.913  -6.542
  239   3HG1  VAL  31          3HG1      VAL  31   0.112  -6.242  -4.968
  240   1HG2  VAL  31          1HG2      VAL  31  -2.048  -5.427  -5.722
  241   2HG2  VAL  31          2HG2      VAL  31  -1.512  -5.920  -7.336
  242   3HG2  VAL  31          3HG2      VAL  31  -3.101  -6.454  -6.727
  243    H    THR  32           H        THR  32  -2.798  -7.525  -8.789
  244    HA   THR  32           HA       THR  32  -0.702  -8.136 -10.800
  245    HB   THR  32           HB       THR  32  -3.595  -7.257 -11.149
  246    HG1  THR  32           1HG      THR  32  -2.858  -9.515 -10.473
  247   1HG2  THR  32          1HG2      THR  32  -1.467  -7.993 -13.193
  248   2HG2  THR  32          2HG2      THR  32  -3.199  -7.781 -13.531
  249   3HG2  THR  32          3HG2      THR  32  -2.231  -6.399 -12.990
  250    H    GLU  33           H        GLU  33  -2.798  -5.457  -9.504
  251    HA   GLU  33           HA       GLU  33  -0.487  -3.620 -10.040
  252   1HB   GLU  33          2HB       GLU  33  -3.339  -3.303 -11.063
  253   2HB   GLU  33          3HB       GLU  33  -2.330  -1.912 -10.693
  254   1HG   GLU  33          2HG       GLU  33  -0.668  -3.586 -12.282
  255   2HG   GLU  33          3HG       GLU  33  -2.263  -3.626 -13.037
  256    H    ALA  34           H        ALA  34  -0.616  -1.631  -8.903
  257    HA   ALA  34           HA       ALA  34  -2.612  -1.308  -6.891
  258   1HB   ALA  34          1HB       ALA  34   0.277  -1.777  -6.002
  259   2HB   ALA  34          2HB       ALA  34  -1.034  -1.199  -4.951
  260   3HB   ALA  34          3HB       ALA  34  -1.113  -2.833  -5.646
  261    H    ILE  35           H        ILE  35  -2.742   0.847  -6.270
  262    HA   ILE  35           HA       ILE  35  -0.798   2.760  -7.514
  263    HB   ILE  35           HB       ILE  35  -3.840   2.904  -7.590
  264   1HG1  ILE  35          2HG1      ILE  35  -1.936   2.850  -9.967
  265   2HG1  ILE  35          3HG1      ILE  35  -2.666   1.378  -9.319
  266   1HG2  ILE  35          1HG2      ILE  35  -2.826   5.126  -7.187
  267   2HG2  ILE  35          2HG2      ILE  35  -1.722   4.883  -8.554
  268   3HG2  ILE  35          3HG2      ILE  35  -3.467   5.048  -8.820
  269   1HD1  ILE  35          1HD1      ILE  35  -4.926   2.275  -9.675
  270   2HD1  ILE  35          2HD1      ILE  35  -4.235   3.726 -10.435
  271   3HD1  ILE  35          3HD1      ILE  35  -3.987   2.137 -11.173
  272    H    VAL  36           H        VAL  36   0.016   3.947  -5.848
  273    HA   VAL  36           HA       VAL  36  -1.546   4.107  -3.315
  274    HB   VAL  36           HB       VAL  36   0.460   4.330  -2.192
  275   1HG1  VAL  36          1HG1      VAL  36   1.071   2.151  -2.291
  276   2HG1  VAL  36          2HG1      VAL  36  -0.117   1.995  -3.604
  277   3HG1  VAL  36          3HG1      VAL  36   1.561   2.248  -3.987
  278   1HG2  VAL  36          1HG2      VAL  36   1.805   5.799  -3.549
  279   2HG2  VAL  36          2HG2      VAL  36   2.716   4.305  -3.386
  280   3HG2  VAL  36          3HG2      VAL  36   1.847   4.636  -4.890
  281    H    ASN  37           H        ASN  37  -2.297   6.118  -2.661
  282    HA   ASN  37           HA       ASN  37  -1.319   8.539  -4.135
  283   1HB   ASN  37          2HB       ASN  37  -3.386   8.186  -1.957
  284   2HB   ASN  37          3HB       ASN  37  -2.919   9.724  -2.660
  285   1HD2  ASN  37          1HD2      ASN  37  -4.165  10.446  -4.370
  286   2HD2  ASN  37          2HD2      ASN  37  -5.184   9.406  -5.349
  287    H    PHE  38           H        PHE  38  -1.763   7.348  -0.799
  288    HA   PHE  38           HA       PHE  38  -0.920   7.994   1.187
  289   1HB   PHE  38          2HB       PHE  38   1.640   8.614  -0.353
  290   2HB   PHE  38          3HB       PHE  38   1.500   8.401   1.373
  291    HD1  PHE  38           1HD      PHE  38   2.688   6.767  -1.339
  292    HD2  PHE  38           2HD      PHE  38   0.124   6.109   2.049
  293    HE1  PHE  38           1HE      PHE  38   3.321   4.375  -1.306
  294    HE2  PHE  38           2HE      PHE  38   0.502   3.653   1.832
  295    HZ   PHE  38           HZ       PHE  38   2.047   2.785   0.161
  296    H    GLY  39           H        GLY  39   0.703  10.070   2.093
  297   1HA   GLY  39          1HA       GLY  39   0.630  12.254   2.589
  298   2HA   GLY  39          2HA       GLY  39   0.281  12.562   0.875
  299    H    ALA  40           H        ALA  40  -1.684  10.641   3.068
  300    HA   ALA  40           HA       ALA  40  -3.609  10.919   4.216
  301   1HB   ALA  40          1HB       ALA  40  -4.624  13.026   4.671
  302   2HB   ALA  40          2HB       ALA  40  -2.863  13.192   4.842
  303   3HB   ALA  40          3HB       ALA  40  -3.694  13.853   3.414
  304    H    SER  41           H        SER  41  -4.021   9.442   2.445
  305    HA   SER  41           HA       SER  41  -6.415  10.113   0.994
  306   1HB   SER  41          2HB       SER  41  -3.793   9.892  -0.486
  307   2HB   SER  41          3HB       SER  41  -5.330   9.457  -1.273
  308    HG   SER  41           HG       SER  41  -5.006  11.932   0.024
  309    H    LYS  42           H        LYS  42  -4.815   7.633  -0.717
  310    HA   LYS  42           HA       LYS  42  -5.330   5.528   1.150
  311   1HB   LYS  42          2HB       LYS  42  -7.174   4.537  -0.337
  312   2HB   LYS  42          3HB       LYS  42  -7.527   5.801   0.823
  313   1HG   LYS  42          2HG       LYS  42  -6.986   6.933  -1.840
  314   2HG   LYS  42          3HG       LYS  42  -8.239   5.707  -1.906
  315   1HD   LYS  42          2HD       LYS  42  -8.233   8.101  -0.038
  316   2HD   LYS  42          3HD       LYS  42  -9.199   7.966  -1.501
  317   1HE   LYS  42          2HE       LYS  42  -9.584   5.691   0.421
  318   2HE   LYS  42          3HE       LYS  42  -9.996   7.261   1.102
  319   1HZ   LYS  42          1HZ       LYS  42 -11.098   6.161  -1.395
  320   2HZ   LYS  42          2HZ       LYS  42 -11.737   6.002   0.100
  321   3HZ   LYS  42          3HZ       LYS  42 -11.630   7.510  -0.574
  322    H    ILE  43           H        ILE  43  -5.352   3.398  -0.040
  323    HA   ILE  43           HA       ILE  43  -3.344   3.349  -2.243
  324    HB   ILE  43           HB       ILE  43  -2.159   3.037  -0.222
  325   1HG1  ILE  43          2HG1      ILE  43  -1.381   1.608  -2.003
  326   2HG1  ILE  43          3HG1      ILE  43  -1.068   0.928  -0.416
  327   1HG2  ILE  43          1HG2      ILE  43  -2.572   1.265   1.397
  328   2HG2  ILE  43          2HG2      ILE  43  -3.859   2.461   1.377
  329   3HG2  ILE  43          3HG2      ILE  43  -4.120   0.886   0.619
  330   1HD1  ILE  43          1HD1      ILE  43  -3.098  -0.584  -0.783
  331   2HD1  ILE  43          2HD1      ILE  43  -3.062  -0.036  -2.466
  332   3HD1  ILE  43          3HD1      ILE  43  -1.671  -0.865  -1.795
  333    H    THR  44           H        THR  44  -4.133   2.299  -3.947
  334    HA   THR  44           HA       THR  44  -6.420   0.431  -3.621
  335    HB   THR  44           HB       THR  44  -5.380   1.848  -6.092
  336    HG1  THR  44           1HG      THR  44  -6.524   2.843  -4.308
  337   1HG2  THR  44          1HG2      THR  44  -7.797   0.017  -5.747
  338   2HG2  THR  44          2HG2      THR  44  -7.469   1.039  -7.162
  339   3HG2  THR  44          3HG2      THR  44  -6.382  -0.299  -6.776
  340    H    VAL  45           H        VAL  45  -6.248  -1.588  -4.210
  341    HA   VAL  45           HA       VAL  45  -3.777  -2.729  -5.395
  342    HB   VAL  45           HB       VAL  45  -5.371  -3.461  -2.957
  343   1HG1  VAL  45          1HG1      VAL  45  -5.898  -5.438  -4.259
  344   2HG1  VAL  45          2HG1      VAL  45  -4.199  -5.615  -4.754
  345   3HG1  VAL  45          3HG1      VAL  45  -4.665  -5.837  -3.060
  346   1HG2  VAL  45          1HG2      VAL  45  -3.063  -2.531  -2.874
  347   2HG2  VAL  45          2HG2      VAL  45  -3.197  -4.124  -2.107
  348   3HG2  VAL  45          3HG2      VAL  45  -2.470  -3.972  -3.721
  349    H    THR  46           H        THR  46  -4.242  -4.173  -7.066
  350    HA   THR  46           HA       THR  46  -7.042  -4.747  -7.827
  351    HB   THR  46           HB       THR  46  -5.081  -3.209  -9.597
  352    HG1  THR  46           1HG      THR  46  -6.873  -2.725  -7.763
  353   1HG2  THR  46          1HG2      THR  46  -7.934  -4.238 -10.088
  354   2HG2  THR  46          2HG2      THR  46  -7.073  -3.089 -11.133
  355   3HG2  THR  46          3HG2      THR  46  -6.478  -4.751 -10.969
  356    H    GLY  47           H        GLY  47  -6.615  -6.769  -7.327
  357   1HA   GLY  47          1HA       GLY  47  -5.204  -8.293  -9.380
  358   2HA   GLY  47          2HA       GLY  47  -4.359  -8.224  -7.842
  359    H    GLU  48           H        GLU  48  -4.836  -9.834  -6.417
  360    HA   GLU  48           HA       GLU  48  -7.586 -10.645  -5.922
  361   1HB   GLU  48          2HB       GLU  48  -6.612 -12.005  -7.960
  362   2HB   GLU  48          3HB       GLU  48  -5.672 -12.866  -6.738
  363   1HG   GLU  48          2HG       GLU  48  -7.806 -13.515  -5.619
  364   2HG   GLU  48          3HG       GLU  48  -8.719 -12.573  -6.816
  365    H    ALA  49           H        ALA  49  -6.005  -9.207  -4.265
  366    HA   ALA  49           HA       ALA  49  -5.642 -11.012  -2.024
  367   1HB   ALA  49          1HB       ALA  49  -3.432 -11.201  -3.181
  368   2HB   ALA  49          2HB       ALA  49  -3.240  -9.436  -3.051
  369   3HB   ALA  49          3HB       ALA  49  -3.326 -10.450  -1.585
  370    H    SER  50           H        SER  50  -4.580  -9.505  -0.160
  371    HA   SER  50           HA       SER  50  -6.368  -7.132  -0.037
  372   1HB   SER  50          2HB       SER  50  -5.550  -9.219   2.039
  373   2HB   SER  50          3HB       SER  50  -6.352  -7.711   2.472
  374    HG   SER  50           HG       SER  50  -7.413  -9.514   0.553
  375    H    ILE  51           H        ILE  51  -5.661  -5.519   1.686
  376    HA   ILE  51           HA       ILE  51  -3.151  -4.564   1.180
  377    HB   ILE  51           HB       ILE  51  -5.104  -3.302   2.371
  378   1HG1  ILE  51          2HG1      ILE  51  -3.615  -1.917   3.641
  379   2HG1  ILE  51          3HG1      ILE  51  -2.277  -2.977   3.212
  380   1HG2  ILE  51          1HG2      ILE  51  -5.183  -3.273   4.745
  381   2HG2  ILE  51          2HG2      ILE  51  -5.294  -4.983   4.296
  382   3HG2  ILE  51          3HG2      ILE  51  -3.756  -4.300   4.898
  383   1HD1  ILE  51          1HD1      ILE  51  -2.368  -1.076   1.662
  384   2HD1  ILE  51          2HD1      ILE  51  -2.856  -2.498   0.743
  385   3HD1  ILE  51          3HD1      ILE  51  -4.088  -1.380   1.339
  386    H    GLN  52           H        GLN  52  -4.036  -6.968   3.606
  387    HA   GLN  52           HA       GLN  52  -2.127  -6.922   5.472
  388   1HB   GLN  52          2HB       GLN  52  -2.975  -9.354   3.819
  389   2HB   GLN  52          3HB       GLN  52  -2.073  -9.466   5.335
  390   1HG   GLN  52          2HG       GLN  52  -4.852  -8.223   5.060
  391   2HG   GLN  52          3HG       GLN  52  -4.488  -9.843   5.654
  392   1HE2  GLN  52          1HE2      GLN  52  -4.996  -6.614   6.668
  393   2HE2  GLN  52          2HE2      GLN  52  -4.250  -6.763   8.239
  394    H    GLN  53           H        GLN  53  -1.446  -8.142   2.184
  395    HA   GLN  53           HA       GLN  53   1.343  -8.735   2.645
  396   1HB   GLN  53          2HB       GLN  53  -0.237  -8.078   0.136
  397   2HB   GLN  53          3HB       GLN  53   1.469  -8.579   0.140
  398   1HG   GLN  53          2HG       GLN  53   0.858 -10.678   1.327
  399   2HG   GLN  53          3HG       GLN  53  -0.853 -10.225   1.254
  400   1HE2  GLN  53          1HE2      GLN  53  -1.282  -9.306  -1.258
  401   2HE2  GLN  53          2HE2      GLN  53  -0.862 -10.543  -2.428
  402    H    VAL  54           H        VAL  54  -0.305  -5.825   1.437
  403    HA   VAL  54           HA       VAL  54   2.029  -4.265   0.813
  404    HB   VAL  54           HB       VAL  54  -0.836  -3.403   1.433
  405   1HG1  VAL  54          1HG1      VAL  54  -0.154  -1.435  -0.037
  406   2HG1  VAL  54          2HG1      VAL  54   0.355  -1.478   1.645
  407   3HG1  VAL  54          3HG1      VAL  54   1.519  -1.887   0.368
  408   1HG2  VAL  54          1HG2      VAL  54  -0.971  -4.916  -0.397
  409   2HG2  VAL  54          2HG2      VAL  54  -1.010  -3.292  -1.088
  410   3HG2  VAL  54          3HG2      VAL  54   0.484  -4.254  -1.148
  411    H    GLU  55           H        GLU  55  -0.130  -4.554   3.666
  412    HA   GLU  55           HA       GLU  55   1.113  -2.516   5.152
  413   1HB   GLU  55          2HB       GLU  55  -1.231  -3.620   5.405
  414   2HB   GLU  55          3HB       GLU  55  -0.418  -4.824   6.407
  415   1HG   GLU  55          2HG       GLU  55   0.327  -3.122   7.958
  416   2HG   GLU  55          3HG       GLU  55  -0.095  -1.824   6.831
  417    H    GLN  56           H        GLN  56   1.531  -6.077   5.053
  418    HA   GLN  56           HA       GLN  56   3.562  -6.329   6.983
  419   1HB   GLN  56          2HB       GLN  56   2.331  -8.165   5.720
  420   2HB   GLN  56          3HB       GLN  56   3.453  -7.913   4.379
  421   1HG   GLN  56          2HG       GLN  56   4.159  -8.683   7.248
  422   2HG   GLN  56          3HG       GLN  56   4.069  -9.791   5.874
  423   1HE2  GLN  56          1HE2      GLN  56   6.324  -8.406   7.773
  424   2HE2  GLN  56          2HE2      GLN  56   7.591  -8.160   6.586
  425    H    ALA  57           H        ALA  57   3.896  -5.675   3.415
  426    HA   ALA  57           HA       ALA  57   6.624  -5.071   3.360
  427   1HB   ALA  57          1HB       ALA  57   4.239  -4.461   1.723
  428   2HB   ALA  57          2HB       ALA  57   5.473  -3.208   1.637
  429   3HB   ALA  57          3HB       ALA  57   5.872  -4.904   1.249
  430    H    GLY  58           H        GLY  58   3.900  -2.889   4.257
  431   1HA   GLY  58          1HA       GLY  58   5.377  -0.560   4.822
  432   2HA   GLY  58          2HA       GLY  58   3.796  -1.036   5.486
  433    H    ALA  59           H        ALA  59   5.450  -3.554   6.614
  434    HA   ALA  59           HA       ALA  59   5.576  -2.660   9.246
  435   1HB   ALA  59          1HB       ALA  59   5.538  -5.030   8.603
  436   2HB   ALA  59          2HB       ALA  59   7.210  -4.897   7.995
  437   3HB   ALA  59          3HB       ALA  59   6.865  -4.677   9.722
  438    H    PHE  60           H        PHE  60   7.932  -2.040   6.688
  439    HA   PHE  60           HA       PHE  60  10.167  -1.495   8.358
  440   1HB   PHE  60          2HB       PHE  60  10.994  -0.072   6.570
  441   2HB   PHE  60          3HB       PHE  60  10.501  -1.669   6.036
  442    HD1  PHE  60           1HD      PHE  60   9.328   1.896   6.175
  443    HD2  PHE  60           2HD      PHE  60   9.242  -1.838   4.044
  444    HE1  PHE  60           1HE      PHE  60   8.057   2.973   4.331
  445    HE2  PHE  60           2HE      PHE  60   7.988  -0.754   2.203
  446    HZ   PHE  60           HZ       PHE  60   7.463   1.664   2.308
  447    H    GLU  61           H        GLU  61   7.255   0.422   7.771
  448    HA   GLU  61           HA       GLU  61   8.274   2.551   9.643
  449   1HB   GLU  61          2HB       GLU  61   6.767   2.665   7.050
  450   2HB   GLU  61          3HB       GLU  61   6.432   3.892   8.282
  451   1HG   GLU  61          2HG       GLU  61   9.332   3.537   7.849
  452   2HG   GLU  61          3HG       GLU  61   8.449   3.989   6.382
  453    H    HIS  62           H        HIS  62   5.848   0.141   9.156
  454    HA   HIS  62           HA       HIS  62   4.281  -0.618  10.607
  455   1HB   HIS  62          2HB       HIS  62   4.788   1.632  12.567
  456   2HB   HIS  62          3HB       HIS  62   4.157   0.021  12.862
  457    HD1  HIS  62           1HD      HIS  62   6.892  -1.287  11.199
  458    HD2  HIS  62           2HD      HIS  62   6.643   1.419  14.421
  459    HE1  HIS  62           1HE      HIS  62   9.072  -1.455  12.453
  460    H    LEU  63           H        LEU  63   3.145   0.381   8.573
  461    HA   LEU  63           HA       LEU  63   1.622   2.808   9.159
  462   1HB   LEU  63          2HB       LEU  63   1.715   0.964   6.775
  463   2HB   LEU  63          3HB       LEU  63   0.554   2.281   6.897
  464    HG   LEU  63           HG       LEU  63   2.509   2.956   5.594
  465   1HD1  LEU  63          1HD1      LEU  63   2.976   5.059   6.611
  466   2HD1  LEU  63          2HD1      LEU  63   1.260   4.673   6.770
  467   3HD1  LEU  63          3HD1      LEU  63   2.356   4.553   8.172
  468   1HD2  LEU  63          1HD2      LEU  63   4.180   2.800   8.123
  469   2HD2  LEU  63          2HD2      LEU  63   4.226   1.580   6.818
  470   3HD2  LEU  63          3HD2      LEU  63   4.690   3.260   6.513
  471    H    LYS  64           H        LYS  64  -0.895   2.653   8.493
  472    HA   LYS  64           HA       LYS  64  -2.147   0.487  10.079
  473   1HB   LYS  64          2HB       LYS  64  -3.334   2.196  11.428
  474   2HB   LYS  64          3HB       LYS  64  -1.642   1.963  11.843
  475   1HG   LYS  64          2HG       LYS  64  -2.555   4.230  10.023
  476   2HG   LYS  64          3HG       LYS  64  -2.619   4.379  11.769
  477   1HD   LYS  64          2HD       LYS  64  -0.037   3.737  10.283
  478   2HD   LYS  64          3HD       LYS  64  -0.625   5.316  10.545
  479   1HE   LYS  64          2HE       LYS  64  -0.261   5.194  12.902
  480   2HE   LYS  64          3HE       LYS  64  -0.359   3.431  12.926
  481   1HZ   LYS  64          1HZ       LYS  64   1.895   4.927  11.768
  482   2HZ   LYS  64          2HZ       LYS  64   1.881   4.181  13.231
  483   3HZ   LYS  64          3HZ       LYS  64   1.780   3.290  11.866
  484    H    ILE  65           H        ILE  65  -2.561   0.079   7.913
  485    HA   ILE  65           HA       ILE  65  -4.144   1.960   6.348
  486    HB   ILE  65           HB       ILE  65  -3.360  -0.836   5.517
  487   1HG1  ILE  65          2HG1      ILE  65  -1.711   1.688   5.435
  488   2HG1  ILE  65          3HG1      ILE  65  -1.341   0.114   6.188
  489   1HG2  ILE  65          1HG2      ILE  65  -4.105   1.750   4.054
  490   2HG2  ILE  65          2HG2      ILE  65  -3.567   0.274   3.241
  491   3HG2  ILE  65          3HG2      ILE  65  -5.042   0.263   4.198
  492   1HD1  ILE  65          1HD1      ILE  65  -1.355   0.692   3.230
  493   2HD1  ILE  65          2HD1      ILE  65   0.019   0.322   4.270
  494   3HD1  ILE  65          3HD1      ILE  65  -1.196  -0.929   3.963
  495    H    ILE  66           H        ILE  66  -6.323   2.098   6.677
  496    HA   ILE  66           HA       ILE  66  -7.662  -0.154   8.006
  497    HB   ILE  66           HB       ILE  66  -8.524   2.714   7.570
  498   1HG1  ILE  66          2HG1      ILE  66  -7.565   1.256  10.085
  499   2HG1  ILE  66          3HG1      ILE  66  -6.577   2.362   9.128
  500   1HG2  ILE  66          1HG2      ILE  66 -10.360   2.202   9.140
  501   2HG2  ILE  66          2HG2      ILE  66 -10.478   1.149   7.744
  502   3HG2  ILE  66          3HG2      ILE  66  -9.813   0.521   9.265
  503   1HD1  ILE  66          1HD1      ILE  66  -9.059   3.122  10.694
  504   2HD1  ILE  66          2HD1      ILE  66  -7.378   3.572  11.005
  505   3HD1  ILE  66          3HD1      ILE  66  -8.198   4.197   9.562
  506    HA   PRO  67           HA       PRO  67  -9.715  -1.028   4.005
  507   1HB   PRO  67          2HB       PRO  67 -11.504  -2.912   4.868
  508   2HB   PRO  67          3HB       PRO  67  -9.776  -3.271   4.649
  509   1HG   PRO  67          2HG       PRO  67 -11.197  -2.593   7.219
  510   2HG   PRO  67          3HG       PRO  67 -10.027  -3.910   6.921
  511   1HD   PRO  67          2HD       PRO  67  -9.325  -1.552   8.059
  512   2HD   PRO  67          3HD       PRO  67  -8.199  -2.399   6.957
  513    H    GLU  68           H        GLU  68 -10.666   1.029   3.744
  514    HA   GLU  68           HA       GLU  68 -12.877   2.099   4.989
  515   1HB   GLU  68          2HB       GLU  68 -12.422   1.946   1.961
  516   2HB   GLU  68          3HB       GLU  68 -13.531   3.024   2.813
  517   1HG   GLU  68          2HG       GLU  68 -11.385   3.734   4.176
  518   2HG   GLU  68          3HG       GLU  68 -10.509   3.062   2.785
  519    H    LYS  69           H        LYS  69 -12.971  -0.406   2.436
  520    HA   LYS  69           HA       LYS  69 -14.504  -2.004   1.913
  521   1HB   LYS  69          2HB       LYS  69 -14.370  -1.880   4.785
  522   2HB   LYS  69          3HB       LYS  69 -16.010  -2.256   4.383
  523   1HG   LYS  69          2HG       LYS  69 -13.568  -3.695   3.244
  524   2HG   LYS  69          3HG       LYS  69 -14.327  -4.160   4.757
  525   1HD   LYS  69          2HD       LYS  69 -15.653  -4.293   2.003
  526   2HD   LYS  69          3HD       LYS  69 -14.977  -5.624   2.926
  527   1HE   LYS  69          2HE       LYS  69 -17.268  -5.818   3.346
  528   2HE   LYS  69          3HE       LYS  69 -16.641  -5.047   4.810
  529   1HZ   LYS  69          1HZ       LYS  69 -18.617  -4.030   3.011
  530   2HZ   LYS  69          2HZ       LYS  69 -18.024  -3.298   4.369
  531   3HZ   LYS  69          3HZ       LYS  69 -17.367  -3.144   2.858
  532    H    GLU  70           H        GLU  70 -15.420  -0.692   0.409
  533    HA   GLU  70           HA       GLU  70 -17.079   0.203  -0.783
  534   1HB   GLU  70          2HB       GLU  70 -18.878   0.192   1.688
  535   2HB   GLU  70          3HB       GLU  70 -19.310   0.737   0.085
  536   1HG   GLU  70          2HG       GLU  70 -20.170  -1.381   0.100
  537   2HG   GLU  70          3HG       GLU  70 -18.673  -1.578  -0.812
  538    H    ALA  71           H        ALA  71 -18.603   2.582  -0.343
  539    HA   ALA  71           HA       ALA  71 -16.788   4.561   0.730
  540   1HB   ALA  71          1HB       ALA  71 -17.407   4.310  -2.260
  541   2HB   ALA  71          2HB       ALA  71 -16.599   5.684  -1.477
  542   3HB   ALA  71          3HB       ALA  71 -15.796   4.097  -1.532
  Start of MODEL    4
    1   1H    MET   1           H1       MET   1 -12.818  -7.609 -11.780
    2   2H    MET   1           H2       MET   1 -14.198  -6.708 -11.715
    3   3H    MET   1           H3       MET   1 -13.206  -6.815 -10.398
    4    HA   MET   1           HA       MET   1 -15.129  -8.116 -10.062
    5   1HB   MET   1          2HB       MET   1 -14.316  -9.273 -12.726
    6   2HB   MET   1          3HB       MET   1 -15.067 -10.336 -11.522
    7   1HG   MET   1          2HG       MET   1 -16.984  -8.879 -11.293
    8   2HG   MET   1          3HG       MET   1 -16.302  -7.714 -12.441
    9   1HE   MET   1          1HE       MET   1 -18.722  -7.787 -13.582
   10   2HE   MET   1          2HE       MET   1 -19.448  -9.280 -14.222
   11   3HE   MET   1          3HE       MET   1 -19.261  -9.070 -12.467
   12    H    ALA   2           H        ALA   2 -12.292  -9.955 -11.356
   13    HA   ALA   2           HA       ALA   2 -11.873 -11.816  -9.555
   14   1HB   ALA   2          1HB       ALA   2  -9.683  -9.973 -10.613
   15   2HB   ALA   2          2HB       ALA   2  -9.434 -11.588  -9.915
   16   3HB   ALA   2          3HB       ALA   2 -10.359 -11.404 -11.418
   17    H    GLU   3           H        GLU   3 -10.038  -8.763  -8.894
   18    HA   GLU   3           HA       GLU   3 -11.456  -8.343  -6.481
   19   1HB   GLU   3          2HB       GLU   3  -9.080  -9.933  -6.262
   20   2HB   GLU   3          3HB       GLU   3  -8.705  -8.357  -5.548
   21   1HG   GLU   3          2HG       GLU   3 -11.056 -10.151  -4.797
   22   2HG   GLU   3          3HG       GLU   3  -9.544  -9.996  -3.899
   23    H    LYS   4           H        LYS   4 -11.058  -6.285  -5.726
   24    HA   LYS   4           HA       LYS   4  -9.145  -4.474  -6.662
   25   1HB   LYS   4          2HB       LYS   4 -10.480  -2.896  -7.977
   26   2HB   LYS   4          3HB       LYS   4 -10.309  -4.451  -8.778
   27   1HG   LYS   4          2HG       LYS   4 -12.518  -4.345  -9.133
   28   2HG   LYS   4          3HG       LYS   4 -12.686  -4.852  -7.448
   29   1HD   LYS   4          2HD       LYS   4 -12.649  -2.338  -6.852
   30   2HD   LYS   4          3HD       LYS   4 -12.756  -2.022  -8.592
   31   1HE   LYS   4          2HE       LYS   4 -14.890  -3.336  -8.678
   32   2HE   LYS   4          3HE       LYS   4 -14.745  -3.676  -6.943
   33   1HZ   LYS   4          1HZ       LYS   4 -14.934  -1.336  -6.517
   34   2HZ   LYS   4          2HZ       LYS   4 -15.065  -0.997  -8.123
   35   3HZ   LYS   4          3HZ       LYS   4 -16.236  -1.866  -7.367
   36    H    THR   5           H        THR   5  -8.898  -3.200  -4.801
   37    HA   THR   5           HA       THR   5 -11.285  -2.122  -3.544
   38    HB   THR   5           HB       THR   5  -9.541  -4.053  -1.904
   39    HG1  THR   5           1HG      THR   5 -11.726  -4.203  -3.338
   40   1HG2  THR   5          1HG2      THR   5 -11.933  -2.299  -1.093
   41   2HG2  THR   5          2HG2      THR   5 -11.232  -3.585  -0.105
   42   3HG2  THR   5          3HG2      THR   5 -10.283  -2.139  -0.452
   43    H    VAL   6           H        VAL   6 -10.747  -0.465  -2.052
   44    HA   VAL   6           HA       VAL   6  -7.968   0.114  -1.996
   45    HB   VAL   6           HB       VAL   6  -8.714   1.375  -3.853
   46   1HG1  VAL   6          1HG1      VAL   6 -11.085   1.237  -3.694
   47   2HG1  VAL   6          2HG1      VAL   6 -11.107   2.357  -2.304
   48   3HG1  VAL   6          3HG1      VAL   6 -10.592   2.912  -3.921
   49   1HG2  VAL   6          1HG2      VAL   6  -8.929   3.432  -1.619
   50   2HG2  VAL   6          2HG2      VAL   6  -7.378   2.790  -2.199
   51   3HG2  VAL   6          3HG2      VAL   6  -8.424   3.699  -3.304
   52    H    TYR   7           H        TYR   7  -7.165   1.230  -0.302
   53    HA   TYR   7           HA       TYR   7  -8.877   1.067   2.135
   54   1HB   TYR   7          2HB       TYR   7  -5.951   0.385   1.946
   55   2HB   TYR   7          3HB       TYR   7  -7.115  -0.181   3.117
   56    HD1  TYR   7           HD1      TYR   7  -9.126  -1.734   1.910
   57    HD2  TYR   7           HD2      TYR   7  -5.257  -1.003   0.176
   58    HE1  TYR   7           HE1      TYR   7  -9.052  -4.055   1.092
   59    HE2  TYR   7           HE2      TYR   7  -5.222  -3.283  -0.710
   60    HH   TYR   7           HH       TYR   7  -6.540  -5.218  -1.136
   61    H    ARG   8           H        ARG   8  -8.282   2.607   3.826
   62    HA   ARG   8           HA       ARG   8  -6.956   5.046   2.729
   63   1HB   ARG   8          2HB       ARG   8  -8.859   4.393   4.979
   64   2HB   ARG   8          3HB       ARG   8  -7.670   5.639   5.311
   65   1HG   ARG   8          2HG       ARG   8  -8.783   6.207   2.690
   66   2HG   ARG   8          3HG       ARG   8 -10.089   5.828   3.801
   67   1HD   ARG   8          2HD       ARG   8  -9.087   7.477   5.462
   68   2HD   ARG   8          3HD       ARG   8  -7.829   7.824   4.273
   69    HE   ARG   8           HE       ARG   8  -9.197   9.267   3.258
   70   1HH1  ARG   8          2HH2      ARG   8 -11.602   6.883   4.537
   71   2HH1  ARG   8          1HH2      ARG   8 -12.710   8.087   4.962
   72   1HH2  ARG   8          2HH1      ARG   8 -11.000  10.692   3.281
   73   2HH2  ARG   8          1HH1      ARG   8 -12.522  10.164   3.924
   74    H    VAL   9           H        VAL   9  -5.045   5.920   3.601
   75    HA   VAL   9           HA       VAL   9  -3.585   4.229   5.559
   76    HB   VAL   9           HB       VAL   9  -2.707   3.350   3.608
   77   1HG1  VAL   9          1HG1      VAL   9  -2.137   4.621   1.574
   78   2HG1  VAL   9          2HG1      VAL   9  -3.824   4.724   1.958
   79   3HG1  VAL   9          3HG1      VAL   9  -2.767   6.106   2.322
   80   1HG2  VAL   9          1HG2      VAL   9  -0.964   4.354   5.142
   81   2HG2  VAL   9          2HG2      VAL   9  -0.440   4.053   3.492
   82   3HG2  VAL   9          3HG2      VAL   9  -0.847   5.705   3.986
   83    H    ASP  10           H        ASP  10  -2.361   5.317   6.957
   84    HA   ASP  10           HA       ASP  10  -1.905   8.224   6.629
   85   1HB   ASP  10          2HB       ASP  10  -3.453   6.777   8.828
   86   2HB   ASP  10          3HB       ASP  10  -2.583   8.277   9.156
   87    H    GLY  11           H        GLY  11  -0.074   8.870   7.734
   88   1HA   GLY  11          1HA       GLY  11   1.120   8.549   9.878
   89   2HA   GLY  11          2HA       GLY  11   1.458   6.887   9.392
   90    H    LEU  12           H        LEU  12   2.222   6.999   6.847
   91    HA   LEU  12           HA       LEU  12   4.869   7.955   7.000
   92   1HB   LEU  12          2HB       LEU  12   5.185   7.079   4.844
   93   2HB   LEU  12          3HB       LEU  12   4.041   6.025   5.625
   94    HG   LEU  12           HG       LEU  12   3.289   6.185   3.470
   95   1HD1  LEU  12          1HD1      LEU  12   1.108   7.111   3.490
   96   2HD1  LEU  12          2HD1      LEU  12   1.458   6.393   5.057
   97   3HD1  LEU  12          3HD1      LEU  12   1.476   8.162   4.858
   98   1HD2  LEU  12          1HD2      LEU  12   3.335   7.964   2.026
   99   2HD2  LEU  12          2HD2      LEU  12   3.169   9.187   3.289
  100   3HD2  LEU  12          3HD2      LEU  12   4.715   8.345   3.034
  101    H    SER  13           H        SER  13   5.969   9.529   5.631
  102    HA   SER  13           HA       SER  13   4.435  11.439   4.087
  103   1HB   SER  13          2HB       SER  13   4.032  12.235   6.462
  104   2HB   SER  13          3HB       SER  13   5.774  12.538   6.591
  105    HG   SER  13           HG       SER  13   4.571  14.385   5.903
  106    H    CYS  14           H        CYS  14   6.046  10.237   2.679
  107    HA   CYS  14           HA       CYS  14   8.154  12.045   2.103
  108   1HB   CYS  14          2HB       CYS  14   8.896   9.921   3.971
  109   2HB   CYS  14          3HB       CYS  14   9.716   9.642   2.428
  110    HG   CYS  14           HG       CYS  14   9.537  12.421   4.154
  111    H    THR  15           H        THR  15   8.587  11.941  -0.074
  112    HA   THR  15           HA       THR  15   7.198  10.201  -1.740
  113    HB   THR  15           HB       THR  15   9.796  11.636  -2.416
  114    HG1  THR  15           1HG      THR  15   7.168  12.692  -2.248
  115   1HG2  THR  15          1HG2      THR  15   8.852  10.277  -4.248
  116   2HG2  THR  15          2HG2      THR  15   7.264  11.043  -4.030
  117   3HG2  THR  15          3HG2      THR  15   8.649  12.004  -4.588
  118    H    ASN  16           H        ASN  16  10.626   9.993  -0.618
  119    HA   ASN  16           HA       ASN  16  11.355   7.757  -2.086
  120   1HB   ASN  16          2HB       ASN  16  12.254   8.653   0.682
  121   2HB   ASN  16          3HB       ASN  16  13.006   7.325  -0.219
  122   1HD2  ASN  16          1HD2      ASN  16  14.882   8.991   0.261
  123   2HD2  ASN  16          2HD2      ASN  16  15.177  10.106  -1.061
  124    H    CYS  17           H        CYS  17   9.883   7.904   1.172
  125    HA   CYS  17           HA       CYS  17   9.626   5.105   1.625
  126   1HB   CYS  17          2HB       CYS  17   8.096   7.536   2.627
  127   2HB   CYS  17          3HB       CYS  17   7.583   5.893   3.028
  128    HG   CYS  17           HG       CYS  17   9.664   5.089   4.185
  129    H    ALA  18           H        ALA  18   7.390   7.490   0.118
  130    HA   ALA  18           HA       ALA  18   5.303   5.774  -0.377
  131   1HB   ALA  18          1HB       ALA  18   5.211   8.228  -0.752
  132   2HB   ALA  18          2HB       ALA  18   6.196   8.039  -2.215
  133   3HB   ALA  18          3HB       ALA  18   4.594   7.319  -2.154
  134    H    ALA  19           H        ALA  19   8.072   6.482  -2.448
  135    HA   ALA  19           HA       ALA  19   7.454   4.797  -4.646
  136   1HB   ALA  19          1HB       ALA  19   9.156   6.572  -4.734
  137   2HB   ALA  19          2HB       ALA  19  10.183   5.671  -3.600
  138   3HB   ALA  19          3HB       ALA  19   9.837   5.002  -5.207
  139    H    LYS  20           H        LYS  20   9.558   4.185  -1.739
  140    HA   LYS  20           HA       LYS  20  10.116   1.515  -2.443
  141   1HB   LYS  20          2HB       LYS  20  11.321   2.621  -0.639
  142   2HB   LYS  20          3HB       LYS  20   9.859   2.645   0.376
  143   1HG   LYS  20          2HG       LYS  20   9.775   0.240   0.488
  144   2HG   LYS  20          3HG       LYS  20  10.933   0.088  -0.849
  145   1HD   LYS  20          2HD       LYS  20  12.746   0.927   0.592
  146   2HD   LYS  20          3HD       LYS  20  11.598   1.215   1.904
  147   1HE   LYS  20          2HE       LYS  20  12.901  -0.922   2.162
  148   2HE   LYS  20          3HE       LYS  20  11.144  -1.135   2.187
  149   1HZ   LYS  20          1HZ       LYS  20  12.778  -1.579  -0.227
  150   2HZ   LYS  20          2HZ       LYS  20  12.331  -2.768   0.816
  151   3HZ   LYS  20          3HZ       LYS  20  11.182  -1.950  -0.013
  152    H    PHE  21           H        PHE  21   7.344   2.829  -0.608
  153    HA   PHE  21           HA       PHE  21   6.069   0.414   0.042
  154   1HB   PHE  21          2HB       PHE  21   5.381   3.207   0.025
  155   2HB   PHE  21          3HB       PHE  21   4.067   2.355  -0.761
  156    HD1  PHE  21           1HD      PHE  21   4.521   3.832   2.084
  157    HD2  PHE  21           2HD      PHE  21   3.723  -0.149   0.613
  158    HE1  PHE  21           1HE      PHE  21   3.085   3.394   4.014
  159    HE2  PHE  21           2HE      PHE  21   2.520  -0.668   2.710
  160    HZ   PHE  21           HZ       PHE  21   2.130   1.116   4.387
  161    H    GLU  22           H        GLU  22   5.395   2.496  -2.867
  162    HA   GLU  22           HA       GLU  22   3.500   0.662  -3.880
  163   1HB   GLU  22          2HB       GLU  22   3.322   2.031  -5.760
  164   2HB   GLU  22          3HB       GLU  22   3.783   3.086  -4.430
  165   1HG   GLU  22          2HG       GLU  22   5.031   3.962  -6.105
  166   2HG   GLU  22          3HG       GLU  22   6.202   2.893  -5.350
  167    H    ARG  23           H        ARG  23   6.950   1.022  -4.549
  168    HA   ARG  23           HA       ARG  23   7.197  -0.991  -6.540
  169   1HB   ARG  23          2HB       ARG  23   8.813   0.888  -5.613
  170   2HB   ARG  23          3HB       ARG  23   9.370  -0.359  -4.491
  171   1HG   ARG  23          2HG       ARG  23   9.415  -0.270  -7.522
  172   2HG   ARG  23          3HG       ARG  23  10.798  -0.165  -6.414
  173   1HD   ARG  23          2HD       ARG  23   9.973  -2.547  -5.612
  174   2HD   ARG  23          3HD       ARG  23   9.184  -2.634  -7.191
  175    HE   ARG  23           HE       ARG  23  11.711  -3.378  -6.649
  176   1HH1  ARG  23          2HH2      ARG  23  10.253  -1.298  -9.015
  177   2HH1  ARG  23          1HH2      ARG  23  11.678  -1.004  -9.970
  178   1HH2  ARG  23          2HH1      ARG  23  13.729  -2.894  -7.725
  179   2HH2  ARG  23          1HH1      ARG  23  13.739  -1.986  -9.211
  180    H    ASN  24           H        ASN  24   7.607  -1.203  -2.944
  181    HA   ASN  24           HA       ASN  24   8.156  -3.974  -2.751
  182   1HB   ASN  24          2HB       ASN  24   6.996  -1.897  -0.905
  183   2HB   ASN  24          3HB       ASN  24   6.563  -3.556  -0.584
  184   1HD2  ASN  24          1HD2      ASN  24   7.837  -4.728   0.698
  185   2HD2  ASN  24          2HD2      ASN  24   9.489  -4.349   1.089
  186    H    VAL  25           H        VAL  25   4.972  -2.263  -2.853
  187    HA   VAL  25           HA       VAL  25   3.420  -4.671  -2.756
  188    HB   VAL  25           HB       VAL  25   2.663  -2.004  -4.022
  189   1HG1  VAL  25          1HG1      VAL  25   1.180  -3.779  -4.811
  190   2HG1  VAL  25          2HG1      VAL  25   1.046  -4.456  -3.182
  191   3HG1  VAL  25          3HG1      VAL  25   0.335  -2.874  -3.544
  192   1HG2  VAL  25          1HG2      VAL  25   2.293  -3.167  -1.233
  193   2HG2  VAL  25          2HG2      VAL  25   3.180  -1.705  -1.638
  194   3HG2  VAL  25          3HG2      VAL  25   1.432  -1.727  -1.842
  195    H    LYS  26           H        LYS  26   4.632  -2.794  -5.629
  196    HA   LYS  26           HA       LYS  26   3.583  -4.509  -7.593
  197   1HB   LYS  26          2HB       LYS  26   5.913  -2.615  -7.335
  198   2HB   LYS  26          3HB       LYS  26   5.729  -3.520  -8.812
  199   1HG   LYS  26          2HG       LYS  26   3.513  -2.637  -9.177
  200   2HG   LYS  26          3HG       LYS  26   3.474  -1.868  -7.569
  201   1HD   LYS  26          2HD       LYS  26   5.167  -0.296  -8.143
  202   2HD   LYS  26          3HD       LYS  26   5.696  -1.261  -9.501
  203   1HE   LYS  26          2HE       LYS  26   4.543   0.654 -10.396
  204   2HE   LYS  26          3HE       LYS  26   3.515  -0.758 -10.699
  205   1HZ   LYS  26          1HZ       LYS  26   3.263   1.255  -8.579
  206   2HZ   LYS  26          2HZ       LYS  26   2.255   1.107  -9.859
  207   3HZ   LYS  26          3HZ       LYS  26   2.243  -0.045  -8.680
  208    H    GLU  27           H        GLU  27   6.546  -4.904  -5.612
  209    HA   GLU  27           HA       GLU  27   7.433  -7.249  -7.039
  210   1HB   GLU  27          2HB       GLU  27   8.120  -6.119  -4.311
  211   2HB   GLU  27          3HB       GLU  27   8.892  -7.552  -4.995
  212   1HG   GLU  27          2HG       GLU  27   9.742  -6.318  -6.895
  213   2HG   GLU  27          3HG       GLU  27   8.850  -4.870  -6.430
  214    H    ILE  28           H        ILE  28   4.649  -6.953  -5.041
  215    HA   ILE  28           HA       ILE  28   4.788  -9.621  -3.873
  216    HB   ILE  28           HB       ILE  28   2.465  -7.761  -4.410
  217   1HG1  ILE  28          2HG1      ILE  28   4.056  -6.861  -2.751
  218   2HG1  ILE  28          3HG1      ILE  28   2.472  -7.210  -2.069
  219   1HG2  ILE  28          1HG2      ILE  28   1.188  -9.144  -2.781
  220   2HG2  ILE  28          2HG2      ILE  28   1.487  -9.893  -4.346
  221   3HG2  ILE  28          3HG2      ILE  28   2.450 -10.390  -2.937
  222   1HD1  ILE  28          1HD1      ILE  28   5.012  -8.863  -1.731
  223   2HD1  ILE  28          2HD1      ILE  28   4.201  -7.868  -0.513
  224   3HD1  ILE  28          3HD1      ILE  28   3.418  -9.341  -1.103
  225    H    GLU  29           H        GLU  29   3.968 -11.522  -4.686
  226    HA   GLU  29           HA       GLU  29   3.247 -11.701  -7.523
  227   1HB   GLU  29          2HB       GLU  29   4.125 -13.608  -5.309
  228   2HB   GLU  29          3HB       GLU  29   3.287 -14.179  -6.733
  229   1HG   GLU  29          2HG       GLU  29   5.029 -13.152  -8.195
  230   2HG   GLU  29          3HG       GLU  29   5.900 -12.611  -6.747
  231    H    GLY  30           H        GLY  30   1.240 -12.198  -8.116
  232   1HA   GLY  30          1HA       GLY  30  -0.777 -13.520  -7.834
  233   2HA   GLY  30          2HA       GLY  30  -0.849 -13.052  -6.130
  234    H    VAL  31           H        VAL  31  -0.308 -10.315  -6.310
  235    HA   VAL  31           HA       VAL  31  -2.820  -9.244  -7.156
  236    HB   VAL  31           HB       VAL  31  -1.359  -8.484  -5.256
  237   1HG1  VAL  31          1HG1      VAL  31   0.817  -8.443  -6.463
  238   2HG1  VAL  31          2HG1      VAL  31   0.245  -7.047  -7.405
  239   3HG1  VAL  31          3HG1      VAL  31   0.431  -6.915  -5.645
  240   1HG2  VAL  31          1HG2      VAL  31  -3.241  -7.156  -6.161
  241   2HG2  VAL  31          2HG2      VAL  31  -1.955  -6.186  -5.402
  242   3HG2  VAL  31          3HG2      VAL  31  -2.074  -6.253  -7.168
  243    H    THR  32           H        THR  32  -2.988  -7.401  -8.783
  244    HA   THR  32           HA       THR  32  -1.395  -8.042 -11.242
  245    HB   THR  32           HB       THR  32  -4.261  -7.054 -11.011
  246    HG1  THR  32           1HG      THR  32  -3.314  -9.455 -10.750
  247   1HG2  THR  32          1HG2      THR  32  -4.325  -7.455 -13.451
  248   2HG2  THR  32          2HG2      THR  32  -3.176  -6.174 -13.037
  249   3HG2  THR  32          3HG2      THR  32  -2.583  -7.798 -13.442
  250    H    GLU  33           H        GLU  33  -3.377  -5.446  -9.704
  251    HA   GLU  33           HA       GLU  33  -0.993  -3.638 -10.159
  252   1HB   GLU  33          2HB       GLU  33  -3.867  -2.866 -10.833
  253   2HB   GLU  33          3HB       GLU  33  -2.515  -1.748 -10.642
  254   1HG   GLU  33          2HG       GLU  33  -1.312  -3.301 -12.406
  255   2HG   GLU  33          3HG       GLU  33  -2.967  -3.769 -12.824
  256    H    ALA  34           H        ALA  34  -0.867  -1.748  -8.829
  257    HA   ALA  34           HA       ALA  34  -2.824  -1.462  -6.747
  258   1HB   ALA  34          1HB       ALA  34  -1.202  -1.512  -4.864
  259   2HB   ALA  34          2HB       ALA  34  -1.296  -3.102  -5.648
  260   3HB   ALA  34          3HB       ALA  34   0.079  -2.021  -5.985
  261    H    ILE  35           H        ILE  35  -2.867   0.669  -5.996
  262    HA   ILE  35           HA       ILE  35  -0.821   2.540  -7.149
  263    HB   ILE  35           HB       ILE  35  -3.810   3.094  -7.127
  264   1HG1  ILE  35          2HG1      ILE  35  -2.028   2.398  -9.506
  265   2HG1  ILE  35          3HG1      ILE  35  -3.294   1.361  -8.830
  266   1HG2  ILE  35          1HG2      ILE  35  -2.162   5.026  -6.860
  267   2HG2  ILE  35          2HG2      ILE  35  -1.503   4.596  -8.443
  268   3HG2  ILE  35          3HG2      ILE  35  -3.189   5.138  -8.283
  269   1HD1  ILE  35          1HD1      ILE  35  -4.995   3.113  -9.322
  270   2HD1  ILE  35          2HD1      ILE  35  -3.739   4.046 -10.177
  271   3HD1  ILE  35          3HD1      ILE  35  -4.196   2.439 -10.757
  272    H    VAL  36           H        VAL  36   0.200   3.100  -5.271
  273    HA   VAL  36           HA       VAL  36  -1.380   3.479  -2.815
  274    HB   VAL  36           HB       VAL  36   0.496   3.443  -1.635
  275   1HG1  VAL  36          1HG1      VAL  36   0.258   1.254  -2.843
  276   2HG1  VAL  36          2HG1      VAL  36   1.455   1.814  -4.012
  277   3HG1  VAL  36          3HG1      VAL  36   1.896   1.613  -2.303
  278   1HG2  VAL  36          1HG2      VAL  36   2.063   4.366  -4.063
  279   2HG2  VAL  36          2HG2      VAL  36   1.771   5.256  -2.557
  280   3HG2  VAL  36          3HG2      VAL  36   2.818   3.831  -2.543
  281    H    ASN  37           H        ASN  37  -2.381   5.492  -2.449
  282    HA   ASN  37           HA       ASN  37  -0.980   7.901  -3.574
  283   1HB   ASN  37          2HB       ASN  37  -3.951   7.688  -3.052
  284   2HB   ASN  37          3HB       ASN  37  -3.060   8.931  -3.924
  285   1HD2  ASN  37          1HD2      ASN  37  -4.199   5.571  -3.949
  286   2HD2  ASN  37          2HD2      ASN  37  -4.184   5.372  -5.700
  287    H    PHE  38           H        PHE  38   0.153   8.561  -1.783
  288    HA   PHE  38           HA       PHE  38  -1.136   8.344   0.903
  289   1HB   PHE  38          2HB       PHE  38   1.744   8.882   0.113
  290   2HB   PHE  38          3HB       PHE  38   1.148   8.538   1.735
  291    HD1  PHE  38           1HD      PHE  38  -0.616   6.284   1.504
  292    HD2  PHE  38           2HD      PHE  38   3.148   7.058  -0.399
  293    HE1  PHE  38           1HE      PHE  38  -0.174   3.828   1.336
  294    HE2  PHE  38           2HE      PHE  38   3.575   4.620  -0.506
  295    HZ   PHE  38           HZ       PHE  38   1.949   3.015   0.456
  296    H    GLY  39           H        GLY  39   0.372  10.268   2.262
  297   1HA   GLY  39          1HA       GLY  39   0.662  12.471   2.613
  298   2HA   GLY  39          2HA       GLY  39   0.080  12.856   0.981
  299    H    ALA  40           H        ALA  40  -2.354  12.035   0.732
  300    HA   ALA  40           HA       ALA  40  -4.068  12.178   3.080
  301   1HB   ALA  40          1HB       ALA  40  -3.601  14.596   2.838
  302   2HB   ALA  40          2HB       ALA  40  -4.057  14.528   1.124
  303   3HB   ALA  40          3HB       ALA  40  -5.277  14.243   2.385
  304    H    SER  41           H        SER  41  -4.100  10.022   1.662
  305    HA   SER  41           HA       SER  41  -6.485  10.101   0.024
  306   1HB   SER  41          2HB       SER  41  -3.789   9.863  -1.324
  307   2HB   SER  41          3HB       SER  41  -5.256   9.131  -2.022
  308    HG   SER  41           HG       SER  41  -5.302  11.810  -1.254
  309    H    LYS  42           H        LYS  42  -4.603   7.475  -1.046
  310    HA   LYS  42           HA       LYS  42  -5.440   5.604   0.853
  311   1HB   LYS  42          2HB       LYS  42  -7.427   4.676  -0.401
  312   2HB   LYS  42          3HB       LYS  42  -7.655   6.204   0.436
  313   1HG   LYS  42          2HG       LYS  42  -6.903   7.030  -2.155
  314   2HG   LYS  42          3HG       LYS  42  -7.864   5.616  -2.459
  315   1HD   LYS  42          2HD       LYS  42  -8.656   8.018  -0.777
  316   2HD   LYS  42          3HD       LYS  42  -9.180   7.688  -2.438
  317   1HE   LYS  42          2HE       LYS  42 -10.306   5.575  -1.655
  318   2HE   LYS  42          3HE       LYS  42  -9.843   5.946   0.011
  319   1HZ   LYS  42          1HZ       LYS  42 -11.666   7.528  -1.660
  320   2HZ   LYS  42          2HZ       LYS  42 -12.057   6.595  -0.360
  321   3HZ   LYS  42          3HZ       LYS  42 -11.166   7.957  -0.151
  322    H    ILE  43           H        ILE  43  -5.119   3.426   0.177
  323    HA   ILE  43           HA       ILE  43  -3.371   3.194  -2.219
  324    HB   ILE  43           HB       ILE  43  -2.084   2.865  -0.291
  325   1HG1  ILE  43          2HG1      ILE  43  -1.760   1.248  -2.209
  326   2HG1  ILE  43          3HG1      ILE  43  -1.017   0.859  -0.640
  327   1HG2  ILE  43          1HG2      ILE  43  -2.489   1.083   1.364
  328   2HG2  ILE  43          2HG2      ILE  43  -3.657   2.409   1.457
  329   3HG2  ILE  43          3HG2      ILE  43  -4.120   0.871   0.715
  330   1HD1  ILE  43          1HD1      ILE  43  -3.547  -0.445  -1.701
  331   2HD1  ILE  43          2HD1      ILE  43  -1.904  -1.092  -1.746
  332   3HD1  ILE  43          3HD1      ILE  43  -2.697  -0.822  -0.189
  333    H    THR  44           H        THR  44  -4.229   2.218  -3.889
  334    HA   THR  44           HA       THR  44  -6.554   0.406  -3.575
  335    HB   THR  44           HB       THR  44  -5.287   1.559  -6.085
  336    HG1  THR  44           1HG      THR  44  -6.764   2.584  -4.225
  337   1HG2  THR  44          1HG2      THR  44  -7.914   0.067  -5.660
  338   2HG2  THR  44          2HG2      THR  44  -7.451   0.932  -7.136
  339   3HG2  THR  44          3HG2      THR  44  -6.532  -0.489  -6.626
  340    H    VAL  45           H        VAL  45  -6.461  -1.703  -4.089
  341    HA   VAL  45           HA       VAL  45  -4.003  -2.864  -5.284
  342    HB   VAL  45           HB       VAL  45  -5.614  -3.744  -2.898
  343   1HG1  VAL  45          1HG1      VAL  45  -4.119  -5.582  -4.784
  344   2HG1  VAL  45          2HG1      VAL  45  -4.503  -6.013  -3.110
  345   3HG1  VAL  45          3HG1      VAL  45  -5.813  -5.719  -4.264
  346   1HG2  VAL  45          1HG2      VAL  45  -3.365  -4.240  -1.983
  347   2HG2  VAL  45          2HG2      VAL  45  -2.628  -3.836  -3.547
  348   3HG2  VAL  45          3HG2      VAL  45  -3.442  -2.580  -2.596
  349    H    THR  46           H        THR  46  -4.481  -4.324  -6.909
  350    HA   THR  46           HA       THR  46  -7.239  -5.148  -7.383
  351    HB   THR  46           HB       THR  46  -5.557  -3.519  -9.359
  352    HG1  THR  46           1HG      THR  46  -7.437  -3.122  -7.589
  353   1HG2  THR  46          1HG2      THR  46  -8.173  -5.029  -9.848
  354   2HG2  THR  46          2HG2      THR  46  -7.465  -3.823 -10.940
  355   3HG2  THR  46          3HG2      THR  46  -6.616  -5.348 -10.648
  356    H    GLY  47           H        GLY  47  -7.307  -7.096  -8.233
  357   1HA   GLY  47          1HA       GLY  47  -5.855  -8.397  -9.954
  358   2HA   GLY  47          2HA       GLY  47  -4.673  -8.449  -8.681
  359    H    GLU  48           H        GLU  48  -4.948  -9.461  -6.769
  360    HA   GLU  48           HA       GLU  48  -7.222 -10.865  -5.833
  361   1HB   GLU  48          2HB       GLU  48  -6.473 -12.269  -7.927
  362   2HB   GLU  48          3HB       GLU  48  -5.146 -12.805  -6.899
  363   1HG   GLU  48          2HG       GLU  48  -6.824 -13.655  -5.258
  364   2HG   GLU  48          3HG       GLU  48  -8.134 -13.011  -6.269
  365    H    ALA  49           H        ALA  49  -5.869  -9.109  -4.410
  366    HA   ALA  49           HA       ALA  49  -4.746 -10.802  -2.323
  367   1HB   ALA  49          1HB       ALA  49  -3.097  -8.539  -3.531
  368   2HB   ALA  49          2HB       ALA  49  -2.687  -9.460  -2.072
  369   3HB   ALA  49          3HB       ALA  49  -2.720 -10.276  -3.646
  370    H    SER  50           H        SER  50  -4.399  -9.576  -0.309
  371    HA   SER  50           HA       SER  50  -6.399  -7.409   0.068
  372   1HB   SER  50          2HB       SER  50  -5.288  -9.534   1.957
  373   2HB   SER  50          3HB       SER  50  -6.439  -8.276   2.403
  374    HG   SER  50           HG       SER  50  -7.799  -9.203   0.662
  375    H    ILE  51           H        ILE  51  -5.784  -5.873   1.954
  376    HA   ILE  51           HA       ILE  51  -3.364  -4.716   1.510
  377    HB   ILE  51           HB       ILE  51  -5.328  -3.635   2.804
  378   1HG1  ILE  51          2HG1      ILE  51  -3.884  -2.374   4.302
  379   2HG1  ILE  51          3HG1      ILE  51  -2.529  -3.372   3.772
  380   1HG2  ILE  51          1HG2      ILE  51  -5.493  -3.918   5.162
  381   2HG2  ILE  51          2HG2      ILE  51  -5.564  -5.552   4.480
  382   3HG2  ILE  51          3HG2      ILE  51  -4.060  -4.950   5.229
  383   1HD1  ILE  51          1HD1      ILE  51  -3.285  -2.645   1.324
  384   2HD1  ILE  51          2HD1      ILE  51  -4.253  -1.456   2.198
  385   3HD1  ILE  51          3HD1      ILE  51  -2.493  -1.454   2.331
  386    H    GLN  52           H        GLN  52  -4.004  -7.333   3.762
  387    HA   GLN  52           HA       GLN  52  -1.973  -7.625   5.457
  388   1HB   GLN  52          2HB       GLN  52  -2.854  -9.615   3.321
  389   2HB   GLN  52          3HB       GLN  52  -1.795 -10.060   4.656
  390   1HG   GLN  52          2HG       GLN  52  -4.582  -8.878   5.060
  391   2HG   GLN  52          3HG       GLN  52  -4.230 -10.605   4.984
  392   1HE2  GLN  52          1HE2      GLN  52  -4.916  -8.342   7.240
  393   2HE2  GLN  52          2HE2      GLN  52  -3.904  -8.942   8.541
  394    H    GLN  53           H        GLN  53  -1.498  -8.194   1.966
  395    HA   GLN  53           HA       GLN  53   1.302  -8.848   2.099
  396   1HB   GLN  53          2HB       GLN  53  -0.403  -7.771  -0.168
  397   2HB   GLN  53          3HB       GLN  53   1.213  -8.462  -0.343
  398   1HG   GLN  53          2HG       GLN  53  -0.554 -10.273   1.196
  399   2HG   GLN  53          3HG       GLN  53  -1.263  -9.836  -0.352
  400   1HE2  GLN  53          1HE2      GLN  53  -0.809 -11.401  -1.861
  401   2HE2  GLN  53          2HE2      GLN  53   0.726 -12.229  -1.988
  402    H    VAL  54           H        VAL  54  -0.440  -5.802   1.553
  403    HA   VAL  54           HA       VAL  54   1.921  -4.189   1.015
  404    HB   VAL  54           HB       VAL  54  -0.942  -3.304   1.637
  405   1HG1  VAL  54          1HG1      VAL  54  -0.187  -1.304   0.274
  406   2HG1  VAL  54          2HG1      VAL  54   0.441  -1.457   1.915
  407   3HG1  VAL  54          3HG1      VAL  54   1.475  -1.871   0.543
  408   1HG2  VAL  54          1HG2      VAL  54   0.343  -4.173  -0.962
  409   2HG2  VAL  54          2HG2      VAL  54  -1.160  -4.742  -0.231
  410   3HG2  VAL  54          3HG2      VAL  54  -1.078  -3.114  -0.901
  411    H    GLU  55           H        GLU  55  -0.176  -4.939   3.794
  412    HA   GLU  55           HA       GLU  55   0.741  -3.017   5.609
  413   1HB   GLU  55          2HB       GLU  55  -1.298  -4.487   5.710
  414   2HB   GLU  55          3HB       GLU  55  -0.269  -5.840   6.197
  415   1HG   GLU  55          2HG       GLU  55  -0.010  -3.295   7.768
  416   2HG   GLU  55          3HG       GLU  55  -1.544  -4.165   7.891
  417    H    GLN  56           H        GLN  56   1.753  -6.424   5.000
  418    HA   GLN  56           HA       GLN  56   3.941  -6.563   6.676
  419   1HB   GLN  56          2HB       GLN  56   2.984  -8.389   5.329
  420   2HB   GLN  56          3HB       GLN  56   3.762  -7.768   3.873
  421   1HG   GLN  56          2HG       GLN  56   5.467  -8.334   6.314
  422   2HG   GLN  56          3HG       GLN  56   4.800  -9.689   5.402
  423   1HE2  GLN  56          1HE2      GLN  56   6.836 -10.457   4.684
  424   2HE2  GLN  56          2HE2      GLN  56   7.747  -9.573   3.473
  425    H    ALA  57           H        ALA  57   3.963  -5.234   3.298
  426    HA   ALA  57           HA       ALA  57   6.673  -4.349   3.375
  427   1HB   ALA  57          1HB       ALA  57   5.327  -4.401   1.313
  428   2HB   ALA  57          2HB       ALA  57   4.339  -3.052   1.904
  429   3HB   ALA  57          3HB       ALA  57   6.061  -2.804   1.604
  430    H    GLY  58           H        GLY  58   3.656  -2.654   4.348
  431   1HA   GLY  58          1HA       GLY  58   4.642  -0.160   5.008
  432   2HA   GLY  58          2HA       GLY  58   3.197  -0.942   5.678
  433    H    ALA  59           H        ALA  59   4.751  -3.214   6.838
  434    HA   ALA  59           HA       ALA  59   5.412  -2.438   9.371
  435   1HB   ALA  59          1HB       ALA  59   6.744  -4.414   9.589
  436   2HB   ALA  59          2HB       ALA  59   5.395  -4.792   8.502
  437   3HB   ALA  59          3HB       ALA  59   7.029  -4.502   7.847
  438    H    PHE  60           H        PHE  60   7.492  -1.900   6.485
  439    HA   PHE  60           HA       PHE  60   9.859  -1.281   7.854
  440   1HB   PHE  60          2HB       PHE  60  10.678  -0.304   5.989
  441   2HB   PHE  60          3HB       PHE  60   9.525  -1.466   5.345
  442    HD1  PHE  60           1HD      PHE  60  10.879   1.493   4.503
  443    HD2  PHE  60           2HD      PHE  60   6.952  -0.003   5.421
  444    HE1  PHE  60           1HE      PHE  60   9.887   3.044   2.851
  445    HE2  PHE  60           2HE      PHE  60   5.978   1.450   3.702
  446    HZ   PHE  60           HZ       PHE  60   7.427   3.010   2.423
  447    H    GLU  61           H        GLU  61   6.965   0.703   7.575
  448    HA   GLU  61           HA       GLU  61   8.199   2.777   9.349
  449   1HB   GLU  61          2HB       GLU  61   7.072   3.009   6.654
  450   2HB   GLU  61          3HB       GLU  61   6.161   3.995   7.795
  451   1HG   GLU  61          2HG       GLU  61   9.152   4.236   7.943
  452   2HG   GLU  61          3HG       GLU  61   8.352   4.854   6.498
  453    H    HIS  62           H        HIS  62   5.902   0.364   9.208
  454    HA   HIS  62           HA       HIS  62   4.248  -0.271  10.600
  455   1HB   HIS  62          2HB       HIS  62   5.215   1.980  12.415
  456   2HB   HIS  62          3HB       HIS  62   4.100   0.693  12.858
  457    HD1  HIS  62           1HD      HIS  62   6.524  -1.227  11.020
  458    HD2  HIS  62           2HD      HIS  62   6.500   0.848  14.680
  459    HE1  HIS  62           1HE      HIS  62   8.238  -2.352  12.492
  460    H    LEU  63           H        LEU  63   3.145   0.911   8.510
  461    HA   LEU  63           HA       LEU  63   1.580   3.257   9.409
  462   1HB   LEU  63          2HB       LEU  63   1.491   1.782   6.761
  463   2HB   LEU  63          3HB       LEU  63   0.699   3.302   7.170
  464    HG   LEU  63           HG       LEU  63   2.502   4.013   6.034
  465   1HD1  LEU  63          1HD1      LEU  63   3.578   4.098   8.894
  466   2HD1  LEU  63          2HD1      LEU  63   4.042   5.166   7.593
  467   3HD1  LEU  63          3HD1      LEU  63   2.372   5.196   8.192
  468   1HD2  LEU  63          1HD2      LEU  63   3.702   1.746   6.038
  469   2HD2  LEU  63          2HD2      LEU  63   4.722   3.191   6.000
  470   3HD2  LEU  63          3HD2      LEU  63   4.513   2.288   7.506
  471    H    LYS  64           H        LYS  64  -0.739   3.401   9.014
  472    HA   LYS  64           HA       LYS  64  -2.067   1.011  10.257
  473   1HB   LYS  64          2HB       LYS  64  -3.510   2.777  11.352
  474   2HB   LYS  64          3HB       LYS  64  -1.891   2.553  11.997
  475   1HG   LYS  64          2HG       LYS  64  -2.377   4.698   9.918
  476   2HG   LYS  64          3HG       LYS  64  -2.863   4.982  11.580
  477   1HD   LYS  64          2HD       LYS  64  -0.082   3.898  11.190
  478   2HD   LYS  64          3HD       LYS  64  -0.348   5.518  10.620
  479   1HE   LYS  64          2HE       LYS  64  -1.221   4.682  13.419
  480   2HE   LYS  64          3HE       LYS  64   0.482   5.010  13.081
  481   1HZ   LYS  64          1HZ       LYS  64  -0.658   6.952  13.887
  482   2HZ   LYS  64          2HZ       LYS  64  -0.068   7.194  12.375
  483   3HZ   LYS  64          3HZ       LYS  64  -1.680   6.946  12.595
  484    H    ILE  65           H        ILE  65  -2.350   0.460   7.957
  485    HA   ILE  65           HA       ILE  65  -4.078   2.192   6.413
  486    HB   ILE  65           HB       ILE  65  -3.416  -0.643   5.645
  487   1HG1  ILE  65          2HG1      ILE  65  -1.572   1.688   5.799
  488   2HG1  ILE  65          3HG1      ILE  65  -1.332  -0.085   5.955
  489   1HG2  ILE  65          1HG2      ILE  65  -4.118   1.850   4.068
  490   2HG2  ILE  65          2HG2      ILE  65  -3.677   0.303   3.368
  491   3HG2  ILE  65          3HG2      ILE  65  -5.140   0.441   4.342
  492   1HD1  ILE  65          1HD1      ILE  65  -0.104   0.911   4.112
  493   2HD1  ILE  65          2HD1      ILE  65  -1.230  -0.335   3.592
  494   3HD1  ILE  65          3HD1      ILE  65  -1.606   1.398   3.344
  495    H    ILE  66           H        ILE  66  -6.247   2.236   6.530
  496    HA   ILE  66           HA       ILE  66  -7.697   0.127   8.019
  497    HB   ILE  66           HB       ILE  66  -8.614   2.895   7.207
  498   1HG1  ILE  66          2HG1      ILE  66  -6.764   3.245   8.679
  499   2HG1  ILE  66          3HG1      ILE  66  -8.258   3.536   9.558
  500   1HG2  ILE  66          1HG2      ILE  66 -10.469   1.371   7.613
  501   2HG2  ILE  66          2HG2      ILE  66  -9.755   0.835   9.143
  502   3HG2  ILE  66          3HG2      ILE  66 -10.334   2.504   8.962
  503   1HD1  ILE  66          1HD1      ILE  66  -8.049   1.286  10.640
  504   2HD1  ILE  66          2HD1      ILE  66  -6.506   1.044   9.784
  505   3HD1  ILE  66          3HD1      ILE  66  -6.669   2.349  10.963
  506    HA   PRO  67           HA       PRO  67  -9.144  -0.847   3.819
  507   1HB   PRO  67          2HB       PRO  67 -10.204  -3.330   4.241
  508   2HB   PRO  67          3HB       PRO  67  -8.445  -3.036   4.146
  509   1HG   PRO  67          2HG       PRO  67 -10.135  -3.230   6.646
  510   2HG   PRO  67          3HG       PRO  67  -8.600  -4.078   6.292
  511   1HD   PRO  67          2HD       PRO  67  -8.677  -1.794   7.755
  512   2HD   PRO  67          3HD       PRO  67  -7.337  -2.102   6.605
  513    H    GLU  68           H        GLU  68 -10.493   0.987   4.163
  514    HA   GLU  68           HA       GLU  68 -12.950   1.173   5.300
  515   1HB   GLU  68          2HB       GLU  68 -11.438   2.754   3.765
  516   2HB   GLU  68          3HB       GLU  68 -12.482   2.164   2.464
  517   1HG   GLU  68          2HG       GLU  68 -14.428   3.027   3.692
  518   2HG   GLU  68          3HG       GLU  68 -13.387   3.502   5.048
  519    H    LYS  69           H        LYS  69 -14.944   0.298   4.972
  520    HA   LYS  69           HA       LYS  69 -16.741  -0.655   4.041
  521   1HB   LYS  69          2HB       LYS  69 -15.743   0.631   1.951
  522   2HB   LYS  69          3HB       LYS  69 -15.475  -0.987   1.318
  523   1HG   LYS  69          2HG       LYS  69 -18.099   0.289   2.199
  524   2HG   LYS  69          3HG       LYS  69 -17.547  -0.034   0.553
  525   1HD   LYS  69          2HD       LYS  69 -17.512  -2.560   1.251
  526   2HD   LYS  69          3HD       LYS  69 -18.377  -2.043   2.699
  527   1HE   LYS  69          2HE       LYS  69 -20.060  -2.752   1.184
  528   2HE   LYS  69          3HE       LYS  69 -20.137  -0.984   1.193
  529   1HZ   LYS  69          1HZ       LYS  69 -20.236  -1.875  -1.027
  530   2HZ   LYS  69          2HZ       LYS  69 -18.842  -1.019  -0.861
  531   3HZ   LYS  69          3HZ       LYS  69 -18.806  -2.664  -0.836
  532    H    GLU  70           H        GLU  70 -16.023  -2.343   5.569
  533    HA   GLU  70           HA       GLU  70 -15.355  -4.942   4.263
  534   1HB   GLU  70          2HB       GLU  70 -13.753  -3.630   5.998
  535   2HB   GLU  70          3HB       GLU  70 -14.832  -4.376   7.186
  536   1HG   GLU  70          2HG       GLU  70 -13.284  -5.871   5.014
  537   2HG   GLU  70          3HG       GLU  70 -12.730  -5.646   6.678
  538    H    ALA  71           H        ALA  71 -17.060  -6.440   4.471
  539    HA   ALA  71           HA       ALA  71 -18.795  -6.798   6.575
  540   1HB   ALA  71          1HB       ALA  71 -19.855  -4.602   6.075
  541   2HB   ALA  71          2HB       ALA  71 -19.979  -5.054   4.355
  542   3HB   ALA  71          3HB       ALA  71 -20.921  -5.925   5.581
  Start of MODEL    5
    1   1H    MET   1           H1       MET   1 -18.742  -6.187  -8.275
    2   2H    MET   1           H2       MET   1 -18.831  -6.499  -6.663
    3   3H    MET   1           H3       MET   1 -17.414  -5.943  -7.320
    4    HA   MET   1           HA       MET   1 -17.395  -8.322  -6.822
    5   1HB   MET   1          2HB       MET   1 -18.656  -9.802  -8.335
    6   2HB   MET   1          3HB       MET   1 -19.677  -8.871  -7.240
    7   1HG   MET   1          2HG       MET   1 -19.259  -8.244 -10.194
    8   2HG   MET   1          3HG       MET   1 -20.641  -9.067  -9.503
    9   1HE   MET   1          1HE       MET   1 -21.649  -5.385 -10.827
   10   2HE   MET   1          2HE       MET   1 -20.190  -6.246 -11.369
   11   3HE   MET   1          3HE       MET   1 -21.737  -7.118 -11.220
   12    H    ALA   2           H        ALA   2 -15.329  -7.244  -7.392
   13    HA   ALA   2           HA       ALA   2 -14.182  -8.401  -9.692
   14   1HB   ALA   2          1HB       ALA   2 -14.509  -5.353  -9.705
   15   2HB   ALA   2          2HB       ALA   2 -13.438  -6.280 -10.777
   16   3HB   ALA   2          3HB       ALA   2 -15.193  -6.477 -10.903
   17    H    GLU   3           H        GLU   3 -11.891  -8.226  -9.456
   18    HA   GLU   3           HA       GLU   3 -11.210  -8.163  -6.681
   19   1HB   GLU   3          2HB       GLU   3  -9.597  -8.876  -9.164
   20   2HB   GLU   3          3HB       GLU   3  -9.155  -9.219  -7.487
   21   1HG   GLU   3          2HG       GLU   3 -10.072 -11.211  -8.522
   22   2HG   GLU   3          3HG       GLU   3 -11.113 -10.669  -7.202
   23    H    LYS   4           H        LYS   4 -11.729  -5.682  -7.055
   24    HA   LYS   4           HA       LYS   4  -9.154  -4.192  -7.023
   25   1HB   LYS   4          2HB       LYS   4 -10.454  -2.179  -7.650
   26   2HB   LYS   4          3HB       LYS   4 -10.316  -3.367  -8.935
   27   1HG   LYS   4          2HG       LYS   4 -12.510  -3.637  -9.134
   28   2HG   LYS   4          3HG       LYS   4 -12.795  -3.842  -7.416
   29   1HD   LYS   4          2HD       LYS   4 -12.404  -1.129  -8.750
   30   2HD   LYS   4          3HD       LYS   4 -13.975  -1.903  -8.482
   31   1HE   LYS   4          2HE       LYS   4 -13.515  -1.983  -6.015
   32   2HE   LYS   4          3HE       LYS   4 -12.003  -1.108  -6.279
   33   1HZ   LYS   4          1HZ       LYS   4 -13.295   0.738  -7.130
   34   2HZ   LYS   4          2HZ       LYS   4 -14.703  -0.076  -6.882
   35   3HZ   LYS   4          3HZ       LYS   4 -13.773   0.356  -5.609
   36    H    THR   5           H        THR   5  -8.795  -3.108  -5.096
   37    HA   THR   5           HA       THR   5 -11.098  -2.409  -3.411
   38    HB   THR   5           HB       THR   5  -8.867  -4.219  -2.326
   39    HG1  THR   5           1HG      THR   5 -11.297  -4.493  -3.390
   40   1HG2  THR   5          1HG2      THR   5 -10.293  -4.238  -0.256
   41   2HG2  THR   5          2HG2      THR   5  -9.618  -2.630  -0.547
   42   3HG2  THR   5          3HG2      THR   5 -11.314  -2.971  -0.953
   43    H    VAL   6           H        VAL   6 -10.539  -0.745  -1.903
   44    HA   VAL   6           HA       VAL   6  -7.799  -0.013  -2.013
   45    HB   VAL   6           HB       VAL   6  -8.733   1.374  -3.683
   46   1HG1  VAL   6          1HG1      VAL   6 -11.074   1.141  -3.364
   47   2HG1  VAL   6          2HG1      VAL   6 -11.023   2.165  -1.900
   48   3HG1  VAL   6          3HG1      VAL   6 -10.629   2.839  -3.508
   49   1HG2  VAL   6          1HG2      VAL   6  -7.295   2.699  -2.084
   50   2HG2  VAL   6          2HG2      VAL   6  -8.512   3.688  -2.895
   51   3HG2  VAL   6          3HG2      VAL   6  -8.764   3.181  -1.212
   52    H    TYR   7           H        TYR   7  -6.968   1.024  -0.239
   53    HA   TYR   7           HA       TYR   7  -8.651   0.776   2.217
   54   1HB   TYR   7          2HB       TYR   7  -5.742  -0.031   1.934
   55   2HB   TYR   7          3HB       TYR   7  -6.818  -0.291   3.302
   56    HD1  TYR   7           HD1      TYR   7  -7.718  -2.416   3.608
   57    HD2  TYR   7           HD2      TYR   7  -6.238  -1.309  -0.276
   58    HE1  TYR   7           HE1      TYR   7  -8.145  -4.715   2.787
   59    HE2  TYR   7           HE2      TYR   7  -6.660  -3.599  -1.091
   60    HH   TYR   7           HH       TYR   7  -7.589  -5.675  -0.596
   61    H    ARG   8           H        ARG   8  -8.183   2.388   3.783
   62    HA   ARG   8           HA       ARG   8  -6.905   4.785   2.682
   63   1HB   ARG   8          2HB       ARG   8  -9.195   4.488   3.971
   64   2HB   ARG   8          3HB       ARG   8  -8.173   4.524   5.419
   65   1HG   ARG   8          2HG       ARG   8  -7.216   6.688   4.530
   66   2HG   ARG   8          3HG       ARG   8  -8.359   6.586   3.180
   67   1HD   ARG   8          2HD       ARG   8 -10.272   6.793   4.552
   68   2HD   ARG   8          3HD       ARG   8  -9.409   6.472   6.044
   69    HE   ARG   8           HE       ARG   8  -9.798   8.997   4.761
   70   1HH1  ARG   8          2HH2      ARG   8  -7.424   7.182   6.632
   71   2HH1  ARG   8          1HH2      ARG   8  -6.550   8.564   7.234
   72   1HH2  ARG   8          2HH1      ARG   8  -8.718  10.902   5.628
   73   2HH2  ARG   8          1HH1      ARG   8  -7.360  10.689   6.704
   74    H    VAL   9           H        VAL   9  -4.825   5.445   3.351
   75    HA   VAL   9           HA       VAL   9  -3.477   3.868   5.504
   76    HB   VAL   9           HB       VAL   9  -2.400   3.163   3.530
   77   1HG1  VAL   9          1HG1      VAL   9  -2.404   6.072   2.582
   78   2HG1  VAL   9          2HG1      VAL   9  -1.510   4.753   1.802
   79   3HG1  VAL   9          3HG1      VAL   9  -3.267   4.699   1.855
   80   1HG2  VAL   9          1HG2      VAL   9  -0.747   5.529   4.440
   81   2HG2  VAL   9          2HG2      VAL   9  -0.867   3.983   5.323
   82   3HG2  VAL   9          3HG2      VAL   9  -0.185   4.025   3.687
   83    H    ASP  10           H        ASP  10  -2.168   5.110   6.943
   84    HA   ASP  10           HA       ASP  10  -2.318   8.019   6.645
   85   1HB   ASP  10          2HB       ASP  10  -4.323   6.682   8.132
   86   2HB   ASP  10          3HB       ASP  10  -3.163   7.166   9.355
   87    H    GLY  11           H        GLY  11  -1.377   9.046   8.627
   88   1HA   GLY  11          1HA       GLY  11   0.555   9.474   9.860
   89   2HA   GLY  11          2HA       GLY  11   0.507   7.757  10.284
   90    H    LEU  12           H        LEU  12   1.252   9.648   7.287
   91    HA   LEU  12           HA       LEU  12   4.040   9.023   7.319
   92   1HB   LEU  12          2HB       LEU  12   4.041   7.801   5.127
   93   2HB   LEU  12          3HB       LEU  12   3.469   6.904   6.522
   94    HG   LEU  12           HG       LEU  12   1.090   7.281   5.780
   95   1HD1  LEU  12          1HD1      LEU  12   1.163   9.172   4.271
   96   2HD1  LEU  12          2HD1      LEU  12   2.491   8.452   3.333
   97   3HD1  LEU  12          3HD1      LEU  12   0.851   7.775   3.267
   98   1HD2  LEU  12          1HD2      LEU  12   1.689   5.235   5.382
   99   2HD2  LEU  12          2HD2      LEU  12   1.507   5.715   3.701
  100   3HD2  LEU  12          3HD2      LEU  12   3.130   5.636   4.420
  101    H    SER  13           H        SER  13   5.048  10.085   5.323
  102    HA   SER  13           HA       SER  13   3.492  11.696   3.540
  103   1HB   SER  13          2HB       SER  13   4.108  13.935   4.449
  104   2HB   SER  13          3HB       SER  13   2.998  13.091   5.524
  105    HG   SER  13           HG       SER  13   5.823  13.217   5.753
  106    H    CYS  14           H        CYS  14   5.297  10.120   2.564
  107    HA   CYS  14           HA       CYS  14   7.517  11.886   1.799
  108   1HB   CYS  14          2HB       CYS  14   8.464  10.937   3.817
  109   2HB   CYS  14          3HB       CYS  14   7.997   9.298   3.321
  110    HG   CYS  14           HG       CYS  14  10.530   9.534   3.016
  111    H    THR  15           H        THR  15   7.764  11.686  -0.353
  112    HA   THR  15           HA       THR  15   6.480   9.813  -1.925
  113    HB   THR  15           HB       THR  15   9.037  11.297  -2.650
  114    HG1  THR  15           1HG      THR  15   6.380  12.281  -2.620
  115   1HG2  THR  15          1HG2      THR  15   8.169   9.803  -4.416
  116   2HG2  THR  15          2HG2      THR  15   6.555  10.524  -4.266
  117   3HG2  THR  15          3HG2      THR  15   7.916  11.500  -4.857
  118    H    ASN  16           H        ASN  16   9.918   9.716  -0.749
  119    HA   ASN  16           HA       ASN  16  10.640   7.426  -2.175
  120   1HB   ASN  16          2HB       ASN  16  11.648   8.556   0.455
  121   2HB   ASN  16          3HB       ASN  16  12.260   7.039  -0.199
  122   1HD2  ASN  16          1HD2      ASN  16  12.690  10.445  -0.333
  123   2HD2  ASN  16          2HD2      ASN  16  13.699  10.440  -1.768
  124    H    CYS  17           H        CYS  17   9.071   7.744   1.030
  125    HA   CYS  17           HA       CYS  17   8.953   4.935   1.584
  126   1HB   CYS  17          2HB       CYS  17   7.224   7.243   2.572
  127   2HB   CYS  17          3HB       CYS  17   7.060   5.562   3.081
  128    HG   CYS  17           HG       CYS  17   8.369   6.737   4.960
  129    H    ALA  18           H        ALA  18   6.643   7.175  -0.027
  130    HA   ALA  18           HA       ALA  18   4.606   5.325  -0.617
  131   1HB   ALA  18          1HB       ALA  18   3.873   6.844  -2.276
  132   2HB   ALA  18          2HB       ALA  18   4.659   7.865  -1.050
  133   3HB   ALA  18          3HB       ALA  18   5.492   7.489  -2.562
  134    H    ALA  19           H        ALA  19   7.555   6.089  -2.422
  135    HA   ALA  19           HA       ALA  19   7.088   4.474  -4.717
  136   1HB   ALA  19          1HB       ALA  19   9.746   5.363  -3.513
  137   2HB   ALA  19          2HB       ALA  19   9.479   4.765  -5.158
  138   3HB   ALA  19          3HB       ALA  19   8.745   6.296  -4.643
  139    H    LYS  20           H        LYS  20   9.030   3.898  -1.760
  140    HA   LYS  20           HA       LYS  20   9.757   1.222  -2.252
  141   1HB   LYS  20          2HB       LYS  20  10.616   2.694  -0.422
  142   2HB   LYS  20          3HB       LYS  20   9.086   2.479   0.450
  143   1HG   LYS  20          2HG       LYS  20   9.477   0.043   0.569
  144   2HG   LYS  20          3HG       LYS  20  10.928   0.228  -0.428
  145   1HD   LYS  20          2HD       LYS  20  11.168   2.055   1.799
  146   2HD   LYS  20          3HD       LYS  20  10.610   0.541   2.473
  147   1HE   LYS  20          2HE       LYS  20  13.071   0.921   0.699
  148   2HE   LYS  20          3HE       LYS  20  13.080   0.710   2.454
  149   1HZ   LYS  20          1HZ       LYS  20  12.142  -1.482   2.147
  150   2HZ   LYS  20          2HZ       LYS  20  12.140  -1.307   0.513
  151   3HZ   LYS  20          3HZ       LYS  20  13.563  -1.341   1.334
  152    H    PHE  21           H        PHE  21   6.802   2.585  -0.744
  153    HA   PHE  21           HA       PHE  21   5.547   0.132  -0.163
  154   1HB   PHE  21          2HB       PHE  21   4.890   2.742   0.238
  155   2HB   PHE  21          3HB       PHE  21   3.812   2.392  -1.087
  156    HD1  PHE  21           1HD      PHE  21   5.009   0.820   2.125
  157    HD2  PHE  21           2HD      PHE  21   1.627   1.728  -0.380
  158    HE1  PHE  21           1HE      PHE  21   3.546   0.822   4.097
  159    HE2  PHE  21           2HE      PHE  21   0.155   1.686   1.606
  160    HZ   PHE  21           HZ       PHE  21   1.186   1.542   3.874
  161    H    GLU  22           H        GLU  22   4.937   2.191  -3.148
  162    HA   GLU  22           HA       GLU  22   3.221   0.185  -4.192
  163   1HB   GLU  22          2HB       GLU  22   3.241   1.244  -6.258
  164   2HB   GLU  22          3HB       GLU  22   3.157   2.505  -5.026
  165   1HG   GLU  22          2HG       GLU  22   5.336   3.269  -5.487
  166   2HG   GLU  22          3HG       GLU  22   5.778   1.820  -6.403
  167    H    ARG  23           H        ARG  23   6.678   0.678  -4.626
  168    HA   ARG  23           HA       ARG  23   7.082  -1.420  -6.526
  169   1HB   ARG  23          2HB       ARG  23   8.732   0.316  -5.987
  170   2HB   ARG  23          3HB       ARG  23   9.000  -0.385  -4.381
  171   1HG   ARG  23          2HG       ARG  23   9.997  -2.348  -5.275
  172   2HG   ARG  23          3HG       ARG  23   9.296  -2.084  -6.876
  173   1HD   ARG  23          2HD       ARG  23  10.773  -0.053  -7.169
  174   2HD   ARG  23          3HD       ARG  23  11.442  -0.355  -5.569
  175    HE   ARG  23           HE       ARG  23  12.781  -2.001  -6.391
  176   1HH1  ARG  23          2HH2      ARG  23  10.203  -1.450  -8.717
  177   2HH1  ARG  23          1HH2      ARG  23  10.842  -2.502  -9.944
  178   1HH2  ARG  23          2HH1      ARG  23  13.673  -3.416  -7.978
  179   2HH2  ARG  23          1HH1      ARG  23  12.890  -3.630  -9.510
  180    H    ASN  24           H        ASN  24   7.226  -1.512  -2.903
  181    HA   ASN  24           HA       ASN  24   7.692  -4.282  -2.598
  182   1HB   ASN  24          2HB       ASN  24   5.930  -2.425  -0.922
  183   2HB   ASN  24          3HB       ASN  24   6.290  -4.094  -0.538
  184   1HD2  ASN  24          1HD2      ASN  24   6.771  -2.380   1.355
  185   2HD2  ASN  24          2HD2      ASN  24   8.491  -2.284   1.631
  186    H    VAL  25           H        VAL  25   4.553  -2.524  -2.935
  187    HA   VAL  25           HA       VAL  25   2.951  -4.843  -2.939
  188    HB   VAL  25           HB       VAL  25   2.332  -2.234  -4.399
  189   1HG1  VAL  25          1HG1      VAL  25  -0.040  -2.971  -3.890
  190   2HG1  VAL  25          2HG1      VAL  25   0.796  -3.940  -5.107
  191   3HG1  VAL  25          3HG1      VAL  25   0.592  -4.551  -3.450
  192   1HG2  VAL  25          1HG2      VAL  25   0.909  -2.052  -2.121
  193   2HG2  VAL  25          2HG2      VAL  25   2.247  -3.058  -1.516
  194   3HG2  VAL  25          3HG2      VAL  25   2.550  -1.465  -2.221
  195    H    LYS  26           H        LYS  26   4.385  -3.153  -5.760
  196    HA   LYS  26           HA       LYS  26   3.464  -4.870  -7.786
  197   1HB   LYS  26          2HB       LYS  26   5.800  -3.027  -7.359
  198   2HB   LYS  26          3HB       LYS  26   5.759  -3.986  -8.815
  199   1HG   LYS  26          2HG       LYS  26   3.703  -3.003  -9.526
  200   2HG   LYS  26          3HG       LYS  26   3.419  -2.232  -7.946
  201   1HD   LYS  26          2HD       LYS  26   5.160  -0.641  -8.240
  202   2HD   LYS  26          3HD       LYS  26   5.972  -1.659  -9.421
  203   1HE   LYS  26          2HE       LYS  26   5.125   0.170 -10.665
  204   2HE   LYS  26          3HE       LYS  26   4.073  -1.196 -11.057
  205   1HZ   LYS  26          1HZ       LYS  26   3.527   1.051  -9.212
  206   2HZ   LYS  26          2HZ       LYS  26   2.795   0.764 -10.643
  207   3HZ   LYS  26          3HZ       LYS  26   2.516  -0.242  -9.370
  208    H    GLU  27           H        GLU  27   6.230  -5.339  -5.507
  209    HA   GLU  27           HA       GLU  27   7.162  -7.718  -6.836
  210   1HB   GLU  27          2HB       GLU  27   7.552  -6.735  -3.988
  211   2HB   GLU  27          3HB       GLU  27   8.342  -8.152  -4.671
  212   1HG   GLU  27          2HG       GLU  27   9.428  -6.821  -6.398
  213   2HG   GLU  27          3HG       GLU  27   8.605  -5.356  -5.855
  214    H    ILE  28           H        ILE  28   4.249  -7.273  -4.957
  215    HA   ILE  28           HA       ILE  28   4.218  -9.993  -3.904
  216    HB   ILE  28           HB       ILE  28   1.955  -8.097  -4.256
  217   1HG1  ILE  28          2HG1      ILE  28   3.458  -8.521  -1.642
  218   2HG1  ILE  28          3HG1      ILE  28   3.834  -7.205  -2.761
  219   1HG2  ILE  28          1HG2      ILE  28   1.037 -10.247  -3.890
  220   2HG2  ILE  28          2HG2      ILE  28   2.255 -10.655  -2.658
  221   3HG2  ILE  28          3HG2      ILE  28   0.960  -9.505  -2.310
  222   1HD1  ILE  28          1HD1      ILE  28   2.334  -6.328  -1.095
  223   2HD1  ILE  28          2HD1      ILE  28   1.481  -6.424  -2.657
  224   3HD1  ILE  28          3HD1      ILE  28   1.144  -7.595  -1.410
  225    H    GLU  29           H        GLU  29   4.078 -11.577  -5.275
  226    HA   GLU  29           HA       GLU  29   3.242 -11.763  -7.896
  227   1HB   GLU  29          2HB       GLU  29   3.582 -13.664  -5.556
  228   2HB   GLU  29          3HB       GLU  29   2.886 -14.268  -7.040
  229   1HG   GLU  29          2HG       GLU  29   5.501 -12.732  -7.122
  230   2HG   GLU  29          3HG       GLU  29   5.449 -14.464  -6.749
  231    H    GLY  30           H        GLY  30   1.320 -11.850  -5.079
  232   1HA   GLY  30          1HA       GLY  30  -1.107 -12.968  -6.166
  233   2HA   GLY  30          2HA       GLY  30  -0.967 -12.025  -4.678
  234    H    VAL  31           H        VAL  31   0.265  -9.660  -6.397
  235    HA   VAL  31           HA       VAL  31  -2.411  -8.575  -7.001
  236    HB   VAL  31           HB       VAL  31  -0.575  -7.631  -5.324
  237   1HG1  VAL  31          1HG1      VAL  31   0.132  -6.106  -7.865
  238   2HG1  VAL  31          2HG1      VAL  31   0.756  -5.879  -6.226
  239   3HG1  VAL  31          3HG1      VAL  31   1.183  -7.333  -7.130
  240   1HG2  VAL  31          1HG2      VAL  31  -1.590  -5.449  -5.578
  241   2HG2  VAL  31          2HG2      VAL  31  -2.237  -5.903  -7.171
  242   3HG2  VAL  31          3HG2      VAL  31  -2.804  -6.745  -5.713
  243    H    THR  32           H        THR  32  -2.547  -7.042  -8.863
  244    HA   THR  32           HA       THR  32  -0.773  -7.805 -11.128
  245    HB   THR  32           HB       THR  32  -3.648  -6.845 -11.331
  246    HG1  THR  32           1HG      THR  32  -3.992  -9.048 -11.914
  247   1HG2  THR  32          1HG2      THR  32  -3.405  -7.595 -13.672
  248   2HG2  THR  32          2HG2      THR  32  -2.269  -6.291 -13.288
  249   3HG2  THR  32          3HG2      THR  32  -1.692  -7.969 -13.375
  250    H    GLU  33           H        GLU  33  -2.853  -5.123  -9.807
  251    HA   GLU  33           HA       GLU  33  -0.472  -3.360 -10.097
  252   1HB   GLU  33          2HB       GLU  33  -3.242  -2.655 -11.197
  253   2HB   GLU  33          3HB       GLU  33  -1.893  -1.533 -10.973
  254   1HG   GLU  33          2HG       GLU  33  -0.535  -3.193 -12.463
  255   2HG   GLU  33          3HG       GLU  33  -2.123  -3.801 -12.958
  256    H    ALA  34           H        ALA  34  -0.713  -1.367  -8.819
  257    HA   ALA  34           HA       ALA  34  -2.939  -1.219  -6.962
  258   1HB   ALA  34          1HB       ALA  34  -0.064  -1.695  -6.031
  259   2HB   ALA  34          2HB       ALA  34  -1.376  -1.179  -4.958
  260   3HB   ALA  34          3HB       ALA  34  -1.457  -2.768  -5.750
  261    H    ILE  35           H        ILE  35  -3.231   0.948  -6.329
  262    HA   ILE  35           HA       ILE  35  -1.194   2.877  -7.453
  263    HB   ILE  35           HB       ILE  35  -4.141   3.467  -7.230
  264   1HG1  ILE  35          2HG1      ILE  35  -3.962   1.699  -8.895
  265   2HG1  ILE  35          3HG1      ILE  35  -4.330   3.251  -9.634
  266   1HG2  ILE  35          1HG2      ILE  35  -2.616   5.391  -7.152
  267   2HG2  ILE  35          2HG2      ILE  35  -1.850   4.879  -8.652
  268   3HG2  ILE  35          3HG2      ILE  35  -3.557   5.373  -8.652
  269   1HD1  ILE  35          1HD1      ILE  35  -1.988   3.483 -10.404
  270   2HD1  ILE  35          2HD1      ILE  35  -1.576   1.938  -9.633
  271   3HD1  ILE  35          3HD1      ILE  35  -2.723   1.982 -10.975
  272    H    VAL  36           H        VAL  36  -0.010   3.327  -5.687
  273    HA   VAL  36           HA       VAL  36  -1.216   3.703  -3.036
  274    HB   VAL  36           HB       VAL  36   1.612   4.025  -4.089
  275   1HG1  VAL  36          1HG1      VAL  36   0.531   4.016  -1.253
  276   2HG1  VAL  36          2HG1      VAL  36   2.257   3.972  -1.686
  277   3HG1  VAL  36          3HG1      VAL  36   1.297   5.391  -2.091
  278   1HG2  VAL  36          1HG2      VAL  36   2.133   1.938  -2.999
  279   2HG2  VAL  36          2HG2      VAL  36   0.498   1.755  -2.417
  280   3HG2  VAL  36          3HG2      VAL  36   0.824   1.647  -4.159
  281    H    ASN  37           H        ASN  37  -2.151   5.705  -2.510
  282    HA   ASN  37           HA       ASN  37  -0.835   8.173  -3.607
  283   1HB   ASN  37          2HB       ASN  37  -3.725   7.814  -2.757
  284   2HB   ASN  37          3HB       ASN  37  -2.938   9.305  -3.284
  285   1HD2  ASN  37          1HD2      ASN  37  -3.849   5.991  -4.362
  286   2HD2  ASN  37          2HD2      ASN  37  -4.031   6.459  -6.045
  287    H    PHE  38           H        PHE  38   0.640   8.443  -2.033
  288    HA   PHE  38           HA       PHE  38  -0.003   8.289   0.850
  289   1HB   PHE  38          2HB       PHE  38   2.445   8.587  -0.886
  290   2HB   PHE  38          3HB       PHE  38   2.557   9.247   0.715
  291    HD1  PHE  38           1HD      PHE  38   4.324   7.801   1.436
  292    HD2  PHE  38           2HD      PHE  38   0.522   6.176   0.156
  293    HE1  PHE  38           1HE      PHE  38   4.889   5.618   2.443
  294    HE2  PHE  38           2HE      PHE  38   1.115   4.032   1.161
  295    HZ   PHE  38           HZ       PHE  38   3.327   3.711   2.257
  296    H    GLY  39           H        GLY  39   1.417  10.333   1.942
  297   1HA   GLY  39          1HA       GLY  39   1.538  12.621   2.262
  298   2HA   GLY  39          2HA       GLY  39   0.575  12.914   0.806
  299    H    ALA  40           H        ALA  40  -1.711  11.863   0.996
  300    HA   ALA  40           HA       ALA  40  -2.998  11.597   3.549
  301   1HB   ALA  40          1HB       ALA  40  -2.672  14.027   3.777
  302   2HB   ALA  40          2HB       ALA  40  -3.329  14.297   2.152
  303   3HB   ALA  40          3HB       ALA  40  -4.376  13.692   3.452
  304    H    SER  41           H        SER  41  -3.486   9.706   2.034
  305    HA   SER  41           HA       SER  41  -6.022  10.103   0.733
  306   1HB   SER  41          2HB       SER  41  -3.553   9.904  -0.984
  307   2HB   SER  41          3HB       SER  41  -5.097   9.212  -1.538
  308    HG   SER  41           HG       SER  41  -4.967  11.847  -0.596
  309    H    LYS  42           H        LYS  42  -4.312   7.516  -0.734
  310    HA   LYS  42           HA       LYS  42  -5.160   5.534   1.123
  311   1HB   LYS  42          2HB       LYS  42  -7.162   4.731  -0.079
  312   2HB   LYS  42          3HB       LYS  42  -7.332   6.304   0.692
  313   1HG   LYS  42          2HG       LYS  42  -6.610   7.089  -1.853
  314   2HG   LYS  42          3HG       LYS  42  -7.448   5.588  -2.204
  315   1HD   LYS  42          2HD       LYS  42  -8.475   7.968  -0.600
  316   2HD   LYS  42          3HD       LYS  42  -8.969   7.535  -2.244
  317   1HE   LYS  42          2HE       LYS  42 -10.041   5.457  -1.426
  318   2HE   LYS  42          3HE       LYS  42  -9.445   5.745   0.209
  319   1HZ   LYS  42          1HZ       LYS  42 -11.517   7.305  -1.150
  320   2HZ   LYS  42          2HZ       LYS  42 -11.573   6.371   0.222
  321   3HZ   LYS  42          3HZ       LYS  42 -10.773   7.765   0.264
  322    H    ILE  43           H        ILE  43  -5.138   3.344   0.072
  323    HA   ILE  43           HA       ILE  43  -3.246   3.257  -2.225
  324    HB   ILE  43           HB       ILE  43  -2.012   2.883  -0.285
  325   1HG1  ILE  43          2HG1      ILE  43  -1.543   1.401  -2.189
  326   2HG1  ILE  43          3HG1      ILE  43  -0.992   0.791  -0.606
  327   1HG2  ILE  43          1HG2      ILE  43  -3.628   2.419   1.411
  328   2HG2  ILE  43          2HG2      ILE  43  -4.045   0.863   0.681
  329   3HG2  ILE  43          3HG2      ILE  43  -2.431   1.134   1.369
  330   1HD1  ILE  43          1HD1      ILE  43  -3.086  -0.692  -0.633
  331   2HD1  ILE  43          2HD1      ILE  43  -3.222  -0.245  -2.339
  332   3HD1  ILE  43          3HD1      ILE  43  -1.778  -1.069  -1.764
  333    H    THR  44           H        THR  44  -4.284   2.517  -3.917
  334    HA   THR  44           HA       THR  44  -6.531   0.614  -3.645
  335    HB   THR  44           HB       THR  44  -5.358   2.097  -5.997
  336    HG1  THR  44           1HG      THR  44  -7.539   2.828  -5.947
  337   1HG2  THR  44          1HG2      THR  44  -6.188  -0.036  -6.897
  338   2HG2  THR  44          2HG2      THR  44  -7.693   0.140  -5.964
  339   3HG2  THR  44          3HG2      THR  44  -7.313   1.250  -7.295
  340    H    VAL  45           H        VAL  45  -6.519  -1.338  -4.593
  341    HA   VAL  45           HA       VAL  45  -3.967  -2.648  -5.403
  342    HB   VAL  45           HB       VAL  45  -6.059  -3.619  -3.442
  343   1HG1  VAL  45          1HG1      VAL  45  -5.080  -5.495  -4.786
  344   2HG1  VAL  45          2HG1      VAL  45  -3.457  -4.939  -4.307
  345   3HG1  VAL  45          3HG1      VAL  45  -4.575  -5.581  -3.093
  346   1HG2  VAL  45          1HG2      VAL  45  -4.680  -2.040  -2.277
  347   2HG2  VAL  45          2HG2      VAL  45  -4.162  -3.648  -1.770
  348   3HG2  VAL  45          3HG2      VAL  45  -3.192  -2.752  -2.958
  349    H    THR  46           H        THR  46  -4.372  -3.967  -7.221
  350    HA   THR  46           HA       THR  46  -7.140  -4.751  -7.884
  351    HB   THR  46           HB       THR  46  -5.325  -3.127  -9.749
  352    HG1  THR  46           1HG      THR  46  -7.134  -2.767  -7.901
  353   1HG2  THR  46          1HG2      THR  46  -7.334  -3.186 -11.252
  354   2HG2  THR  46          2HG2      THR  46  -6.639  -4.803 -11.049
  355   3HG2  THR  46          3HG2      THR  46  -8.112  -4.352 -10.160
  356    H    GLY  47           H        GLY  47  -6.800  -6.858  -7.789
  357   1HA   GLY  47          1HA       GLY  47  -5.190  -8.084  -9.798
  358   2HA   GLY  47          2HA       GLY  47  -4.210  -7.986  -8.352
  359    H    GLU  48           H        GLU  48  -4.422  -9.480  -6.798
  360    HA   GLU  48           HA       GLU  48  -6.922 -10.649  -6.025
  361   1HB   GLU  48          2HB       GLU  48  -6.006 -12.057  -8.082
  362   2HB   GLU  48          3HB       GLU  48  -4.857 -12.699  -6.909
  363   1HG   GLU  48          2HG       GLU  48  -6.831 -13.391  -5.486
  364   2HG   GLU  48          3HG       GLU  48  -7.911 -12.764  -6.749
  365    H    ALA  49           H        ALA  49  -5.273  -8.927  -4.733
  366    HA   ALA  49           HA       ALA  49  -4.147 -10.552  -2.518
  367   1HB   ALA  49          1HB       ALA  49  -2.752  -8.208  -3.879
  368   2HB   ALA  49          2HB       ALA  49  -2.210  -8.990  -2.385
  369   3HB   ALA  49          3HB       ALA  49  -2.221  -9.904  -3.901
  370    H    SER  50           H        SER  50  -3.687  -9.024  -0.610
  371    HA   SER  50           HA       SER  50  -5.749  -6.917  -0.376
  372   1HB   SER  50          2HB       SER  50  -5.308  -9.353   1.407
  373   2HB   SER  50          3HB       SER  50  -6.117  -7.902   2.005
  374    HG   SER  50           HG       SER  50  -7.641  -8.098   0.322
  375    H    ILE  51           H        ILE  51  -5.410  -5.646   1.707
  376    HA   ILE  51           HA       ILE  51  -2.882  -4.618   1.475
  377    HB   ILE  51           HB       ILE  51  -5.064  -3.519   2.405
  378   1HG1  ILE  51          2HG1      ILE  51  -3.763  -1.920   3.692
  379   2HG1  ILE  51          3HG1      ILE  51  -2.338  -2.943   3.423
  380   1HG2  ILE  51          1HG2      ILE  51  -5.306  -3.372   4.780
  381   2HG2  ILE  51          2HG2      ILE  51  -5.278  -5.100   4.387
  382   3HG2  ILE  51          3HG2      ILE  51  -3.830  -4.304   5.067
  383   1HD1  ILE  51          1HD1      ILE  51  -2.736  -2.612   0.899
  384   2HD1  ILE  51          2HD1      ILE  51  -4.093  -1.568   1.329
  385   3HD1  ILE  51          3HD1      ILE  51  -2.436  -1.114   1.762
  386    H    GLN  52           H        GLN  52  -3.899  -7.160   3.669
  387    HA   GLN  52           HA       GLN  52  -2.093  -7.135   5.714
  388   1HB   GLN  52          2HB       GLN  52  -2.905  -9.443   3.906
  389   2HB   GLN  52          3HB       GLN  52  -1.980  -9.687   5.389
  390   1HG   GLN  52          2HG       GLN  52  -4.689  -8.271   5.387
  391   2HG   GLN  52          3HG       GLN  52  -4.505 -10.022   5.501
  392   1HE2  GLN  52          1HE2      GLN  52  -3.608  -6.943   7.195
  393   2HE2  GLN  52          2HE2      GLN  52  -3.358  -7.718   8.728
  394    H    GLN  53           H        GLN  53  -1.252  -8.411   2.455
  395    HA   GLN  53           HA       GLN  53   1.493  -8.804   2.978
  396   1HB   GLN  53          2HB       GLN  53   0.111  -8.131   0.402
  397   2HB   GLN  53          3HB       GLN  53   1.803  -8.677   0.576
  398   1HG   GLN  53          2HG       GLN  53   0.910 -10.735   0.329
  399   2HG   GLN  53          3HG       GLN  53   0.572 -10.617   2.049
  400   1HE2  GLN  53          1HE2      GLN  53  -0.703 -10.977  -1.049
  401   2HE2  GLN  53          2HE2      GLN  53  -2.413 -10.968  -0.631
  402    H    VAL  54           H        VAL  54  -0.188  -5.848   1.852
  403    HA   VAL  54           HA       VAL  54   2.201  -4.354   1.242
  404    HB   VAL  54           HB       VAL  54  -0.604  -3.260   1.807
  405   1HG1  VAL  54          1HG1      VAL  54   0.982  -1.508   1.902
  406   2HG1  VAL  54          2HG1      VAL  54   1.812  -2.065   0.446
  407   3HG1  VAL  54          3HG1      VAL  54   0.158  -1.416   0.343
  408   1HG2  VAL  54          1HG2      VAL  54  -0.828  -3.311  -0.697
  409   2HG2  VAL  54          2HG2      VAL  54   0.608  -4.358  -0.752
  410   3HG2  VAL  54          3HG2      VAL  54  -0.860  -4.901   0.066
  411    H    GLU  55           H        GLU  55   0.031  -4.646   4.034
  412    HA   GLU  55           HA       GLU  55   1.014  -2.632   5.708
  413   1HB   GLU  55          2HB       GLU  55  -1.172  -3.863   5.836
  414   2HB   GLU  55          3HB       GLU  55  -0.303  -5.298   6.383
  415   1HG   GLU  55          2HG       GLU  55   0.518  -3.095   8.041
  416   2HG   GLU  55          3HG       GLU  55  -1.245  -3.051   7.900
  417    H    GLN  56           H        GLN  56   1.661  -6.203   5.588
  418    HA   GLN  56           HA       GLN  56   3.768  -6.327   7.415
  419   1HB   GLN  56          2HB       GLN  56   2.685  -8.286   6.296
  420   2HB   GLN  56          3HB       GLN  56   3.532  -7.878   4.794
  421   1HG   GLN  56          2HG       GLN  56   5.719  -8.109   6.018
  422   2HG   GLN  56          3HG       GLN  56   4.812  -8.612   7.457
  423   1HE2  GLN  56          1HE2      GLN  56   6.731 -10.320   6.584
  424   2HE2  GLN  56          2HE2      GLN  56   6.005 -11.687   5.757
  425    H    ALA  57           H        ALA  57   3.989  -5.685   3.838
  426    HA   ALA  57           HA       ALA  57   6.759  -5.251   3.799
  427   1HB   ALA  57          1HB       ALA  57   5.022  -5.457   1.865
  428   2HB   ALA  57          2HB       ALA  57   4.876  -3.691   2.008
  429   3HB   ALA  57          3HB       ALA  57   6.450  -4.459   1.671
  430    H    GLY  58           H        GLY  58   4.094  -2.998   4.581
  431   1HA   GLY  58          1HA       GLY  58   5.528  -0.580   4.838
  432   2HA   GLY  58          2HA       GLY  58   3.963  -1.030   5.550
  433    H    ALA  59           H        ALA  59   5.759  -3.420   6.832
  434    HA   ALA  59           HA       ALA  59   6.116  -2.429   9.392
  435   1HB   ALA  59          1HB       ALA  59   6.302  -4.798   8.841
  436   2HB   ALA  59          2HB       ALA  59   7.807  -4.495   7.933
  437   3HB   ALA  59          3HB       ALA  59   7.758  -4.250   9.691
  438    H    PHE  60           H        PHE  60   8.122  -1.713   6.555
  439    HA   PHE  60           HA       PHE  60  10.436  -0.845   7.901
  440   1HB   PHE  60          2HB       PHE  60  10.970   0.458   5.986
  441   2HB   PHE  60          3HB       PHE  60  10.379  -1.129   5.521
  442    HD1  PHE  60           1HD      PHE  60   8.730  -1.262   3.801
  443    HD2  PHE  60           2HD      PHE  60   9.467   2.473   5.776
  444    HE1  PHE  60           1HE      PHE  60   7.261  -0.109   2.161
  445    HE2  PHE  60           2HE      PHE  60   7.994   3.629   4.147
  446    HZ   PHE  60           HZ       PHE  60   6.910   2.346   2.322
  447    H    GLU  61           H        GLU  61   7.323   0.877   7.566
  448    HA   GLU  61           HA       GLU  61   8.388   2.954   9.469
  449   1HB   GLU  61          2HB       GLU  61   6.652   3.352   7.017
  450   2HB   GLU  61          3HB       GLU  61   6.582   4.443   8.396
  451   1HG   GLU  61          2HG       GLU  61   9.350   4.212   7.831
  452   2HG   GLU  61          3HG       GLU  61   8.536   4.365   6.267
  453    H    HIS  62           H        HIS  62   6.136   0.439   9.105
  454    HA   HIS  62           HA       HIS  62   4.631  -0.371  10.583
  455   1HB   HIS  62          2HB       HIS  62   5.102   1.913  12.513
  456   2HB   HIS  62          3HB       HIS  62   4.573   0.273  12.844
  457    HD1  HIS  62           1HD      HIS  62   7.325  -0.900  11.108
  458    HD2  HIS  62           2HD      HIS  62   7.018   1.832  14.300
  459    HE1  HIS  62           1HE      HIS  62   9.537  -0.952  12.318
  460    H    LEU  63           H        LEU  63   3.404   0.698   8.552
  461    HA   LEU  63           HA       LEU  63   1.777   3.031   9.311
  462   1HB   LEU  63          2HB       LEU  63   1.615   1.317   6.811
  463   2HB   LEU  63          3HB       LEU  63   0.823   2.863   7.101
  464    HG   LEU  63           HG       LEU  63   2.619   3.387   5.753
  465   1HD1  LEU  63          1HD1      LEU  63   4.092   4.823   7.043
  466   2HD1  LEU  63          2HD1      LEU  63   2.436   4.942   7.686
  467   3HD1  LEU  63          3HD1      LEU  63   3.679   4.009   8.549
  468   1HD2  LEU  63          1HD2      LEU  63   4.798   2.629   5.798
  469   2HD2  LEU  63          2HD2      LEU  63   4.723   2.121   7.490
  470   3HD2  LEU  63          3HD2      LEU  63   3.877   1.182   6.254
  471    H    LYS  64           H        LYS  64  -0.676   2.917   8.803
  472    HA   LYS  64           HA       LYS  64  -1.841   0.537  10.180
  473   1HB   LYS  64          2HB       LYS  64  -3.113   1.995  11.621
  474   2HB   LYS  64          3HB       LYS  64  -1.387   2.097  11.941
  475   1HG   LYS  64          2HG       LYS  64  -2.752   4.166  10.164
  476   2HG   LYS  64          3HG       LYS  64  -2.896   4.260  11.902
  477   1HD   LYS  64          2HD       LYS  64  -0.170   4.086  10.558
  478   2HD   LYS  64          3HD       LYS  64  -1.079   5.560  10.625
  479   1HE   LYS  64          2HE       LYS  64  -1.200   5.374  13.141
  480   2HE   LYS  64          3HE       LYS  64  -0.278   3.864  13.063
  481   1HZ   LYS  64          1HZ       LYS  64   0.710   6.503  12.211
  482   2HZ   LYS  64          2HZ       LYS  64   1.100   5.732  13.606
  483   3HZ   LYS  64          3HZ       LYS  64   1.569   5.098  12.164
  484    H    ILE  65           H        ILE  65  -2.243   0.206   7.902
  485    HA   ILE  65           HA       ILE  65  -4.116   1.950   6.552
  486    HB   ILE  65           HB       ILE  65  -3.483  -0.809   5.545
  487   1HG1  ILE  65          2HG1      ILE  65  -1.498   1.452   5.633
  488   2HG1  ILE  65          3HG1      ILE  65  -1.362  -0.246   6.191
  489   1HG2  ILE  65          1HG2      ILE  65  -3.627   0.343   3.350
  490   2HG2  ILE  65          2HG2      ILE  65  -5.079   0.553   4.327
  491   3HG2  ILE  65          3HG2      ILE  65  -3.925   1.865   4.194
  492   1HD1  ILE  65          1HD1      ILE  65  -1.287   0.686   3.350
  493   2HD1  ILE  65          2HD1      ILE  65  -0.057  -0.169   4.321
  494   3HD1  ILE  65          3HD1      ILE  65  -1.511  -1.006   3.862
  495    H    ILE  66           H        ILE  66  -6.332   1.640   6.142
  496    HA   ILE  66           HA       ILE  66  -7.650  -0.623   7.580
  497    HB   ILE  66           HB       ILE  66  -8.492   2.292   7.519
  498   1HG1  ILE  66          2HG1      ILE  66  -7.266   0.592   9.744
  499   2HG1  ILE  66          3HG1      ILE  66  -6.516   1.972   8.931
  500   1HG2  ILE  66          1HG2      ILE  66 -10.255   1.641   9.077
  501   2HG2  ILE  66          2HG2      ILE  66 -10.413   0.663   7.632
  502   3HG2  ILE  66          3HG2      ILE  66  -9.679  -0.037   9.093
  503   1HD1  ILE  66          1HD1      ILE  66  -8.330   3.451   9.806
  504   2HD1  ILE  66          2HD1      ILE  66  -8.888   2.084  10.808
  505   3HD1  ILE  66          3HD1      ILE  66  -7.264   2.742  11.034
  506    HA   PRO  67           HA       PRO  67  -9.697  -1.020   3.557
  507   1HB   PRO  67          2HB       PRO  67 -11.587  -2.900   4.156
  508   2HB   PRO  67          3HB       PRO  67  -9.859  -3.288   4.024
  509   1HG   PRO  67          2HG       PRO  67 -11.417  -2.710   6.547
  510   2HG   PRO  67          3HG       PRO  67 -10.307  -4.076   6.230
  511   1HD   PRO  67          2HD       PRO  67  -9.504  -1.866   7.566
  512   2HD   PRO  67          3HD       PRO  67  -8.400  -2.670   6.413
  513    H    GLU  68           H        GLU  68 -10.462   1.236   3.633
  514    HA   GLU  68           HA       GLU  68 -12.996   1.943   4.689
  515   1HB   GLU  68          2HB       GLU  68 -11.202   3.501   4.147
  516   2HB   GLU  68          3HB       GLU  68 -11.255   3.032   2.426
  517   1HG   GLU  68          2HG       GLU  68 -13.544   3.838   2.289
  518   2HG   GLU  68          3HG       GLU  68 -13.522   4.252   4.018
  519    H    LYS  69           H        LYS  69 -14.423   0.274   4.157
  520    HA   LYS  69           HA       LYS  69 -15.154  -0.430   1.438
  521   1HB   LYS  69          2HB       LYS  69 -16.472  -0.587   4.161
  522   2HB   LYS  69          3HB       LYS  69 -17.435  -0.887   2.719
  523   1HG   LYS  69          2HG       LYS  69 -14.809  -2.318   2.779
  524   2HG   LYS  69          3HG       LYS  69 -15.961  -2.807   4.028
  525   1HD   LYS  69          2HD       LYS  69 -17.680  -3.299   2.435
  526   2HD   LYS  69          3HD       LYS  69 -16.763  -2.579   1.096
  527   1HE   LYS  69          2HE       LYS  69 -15.084  -4.333   1.185
  528   2HE   LYS  69          3HE       LYS  69 -15.780  -5.010   2.668
  529   1HZ   LYS  69          1HZ       LYS  69 -17.728  -5.610   1.447
  530   2HZ   LYS  69          2HZ       LYS  69 -17.160  -4.920   0.066
  531   3HZ   LYS  69          3HZ       LYS  69 -16.408  -6.240   0.697
  532    H    GLU  70           H        GLU  70 -17.167   0.217   0.418
  533    HA   GLU  70           HA       GLU  70 -17.724   3.133   0.654
  534   1HB   GLU  70          2HB       GLU  70 -16.334   2.333  -1.336
  535   2HB   GLU  70          3HB       GLU  70 -17.728   1.363  -1.832
  536   1HG   GLU  70          2HG       GLU  70 -19.068   3.497  -1.976
  537   2HG   GLU  70          3HG       GLU  70 -17.583   4.397  -1.613
  538    H    ALA  71           H        ALA  71 -19.863   3.534   0.963
  539    HA   ALA  71           HA       ALA  71 -22.035   3.252   1.446
  540   1HB   ALA  71          1HB       ALA  71 -23.456   1.916   0.019
  541   2HB   ALA  71          2HB       ALA  71 -22.248   2.740  -0.984
  542   3HB   ALA  71          3HB       ALA  71 -22.072   1.009  -0.613
  Start of MODEL    6
    1   1H    MET   1           H1       MET   1 -18.071 -10.059  -8.808
    2   2H    MET   1           H2       MET   1 -17.601 -11.639  -8.967
    3   3H    MET   1           H3       MET   1 -16.721 -10.600  -8.030
    4    HA   MET   1           HA       MET   1 -15.579 -10.928 -10.082
    5   1HB   MET   1          2HB       MET   1 -18.190  -9.854 -11.260
    6   2HB   MET   1          3HB       MET   1 -16.667  -9.992 -12.143
    7   1HG   MET   1          2HG       MET   1 -16.698 -12.427 -11.893
    8   2HG   MET   1          3HG       MET   1 -18.229 -12.337 -10.995
    9   1HE   MET   1          1HE       MET   1 -19.233 -14.136 -12.728
   10   2HE   MET   1          2HE       MET   1 -19.247 -13.871 -14.486
   11   3HE   MET   1          3HE       MET   1 -17.703 -14.132 -13.645
   12    H    ALA   2           H        ALA   2 -14.391  -9.373  -8.724
   13    HA   ALA   2           HA       ALA   2 -14.372  -6.676  -9.634
   14   1HB   ALA   2          1HB       ALA   2 -16.499  -6.383  -8.401
   15   2HB   ALA   2          2HB       ALA   2 -15.769  -7.102  -6.949
   16   3HB   ALA   2          3HB       ALA   2 -15.191  -5.541  -7.568
   17    H    GLU   3           H        GLU   3 -12.268  -8.113  -9.597
   18    HA   GLU   3           HA       GLU   3 -11.032  -8.501  -7.044
   19   1HB   GLU   3          2HB       GLU   3  -9.657  -8.723  -9.731
   20   2HB   GLU   3          3HB       GLU   3  -9.358  -9.601  -8.228
   21   1HG   GLU   3          2HG       GLU   3 -11.624  -9.972 -10.217
   22   2HG   GLU   3          3HG       GLU   3 -10.468 -11.148  -9.604
   23    H    LYS   4           H        LYS   4 -11.482  -6.035  -6.709
   24    HA   LYS   4           HA       LYS   4  -8.932  -4.578  -6.878
   25   1HB   LYS   4          2HB       LYS   4 -10.026  -2.537  -7.553
   26   2HB   LYS   4          3HB       LYS   4 -10.221  -3.766  -8.811
   27   1HG   LYS   4          2HG       LYS   4 -12.510  -4.282  -7.852
   28   2HG   LYS   4          3HG       LYS   4 -12.378  -2.873  -6.814
   29   1HD   LYS   4          2HD       LYS   4 -12.186  -2.766  -9.869
   30   2HD   LYS   4          3HD       LYS   4 -13.697  -2.676  -8.978
   31   1HE   LYS   4          2HE       LYS   4 -13.063  -0.447  -9.550
   32   2HE   LYS   4          3HE       LYS   4 -12.982  -0.637  -7.795
   33   1HZ   LYS   4          1HZ       LYS   4 -11.106   0.566  -8.775
   34   2HZ   LYS   4          2HZ       LYS   4 -10.624  -0.768  -7.951
   35   3HZ   LYS   4          3HZ       LYS   4 -10.645  -0.786  -9.595
   36    H    THR   5           H        THR   5  -8.568  -3.329  -4.969
   37    HA   THR   5           HA       THR   5 -10.849  -2.806  -3.221
   38    HB   THR   5           HB       THR   5  -8.494  -4.477  -2.160
   39    HG1  THR   5           1HG      THR   5 -10.970  -4.897  -3.209
   40   1HG2  THR   5          1HG2      THR   5  -9.990  -4.687  -0.171
   41   2HG2  THR   5          2HG2      THR   5  -9.593  -2.975  -0.433
   42   3HG2  THR   5          3HG2      THR   5 -11.173  -3.613  -0.921
   43    H    VAL   6           H        VAL   6 -10.486  -0.974  -2.056
   44    HA   VAL   6           HA       VAL   6  -7.761  -0.149  -1.919
   45    HB   VAL   6           HB       VAL   6  -8.525   1.186  -3.652
   46   1HG1  VAL   6          1HG1      VAL   6 -11.163   1.678  -2.313
   47   2HG1  VAL   6          2HG1      VAL   6 -10.579   2.451  -3.814
   48   3HG1  VAL   6          3HG1      VAL   6 -10.820   0.709  -3.776
   49   1HG2  VAL   6          1HG2      VAL   6  -7.527   2.650  -1.843
   50   2HG2  VAL   6          2HG2      VAL   6  -8.668   3.522  -2.878
   51   3HG2  VAL   6          3HG2      VAL   6  -9.167   2.991  -1.266
   52    H    TYR   7           H        TYR   7  -7.109   0.958  -0.128
   53    HA   TYR   7           HA       TYR   7  -8.961   0.826   2.220
   54   1HB   TYR   7          2HB       TYR   7  -6.040   0.004   2.146
   55   2HB   TYR   7          3HB       TYR   7  -7.154  -0.120   3.499
   56    HD1  TYR   7           HD1      TYR   7  -6.492  -1.463   0.043
   57    HD2  TYR   7           HD2      TYR   7  -8.016  -2.212   3.993
   58    HE1  TYR   7           HE1      TYR   7  -6.666  -3.875  -0.462
   59    HE2  TYR   7           HE2      TYR   7  -8.328  -4.592   3.425
   60    HH   TYR   7           HH       TYR   7  -8.232  -6.200   1.626
   61    H    ARG   8           H        ARG   8  -8.238   2.303   3.963
   62    HA   ARG   8           HA       ARG   8  -7.063   4.731   2.770
   63   1HB   ARG   8          2HB       ARG   8  -9.178   4.390   4.510
   64   2HB   ARG   8          3HB       ARG   8  -7.882   4.770   5.645
   65   1HG   ARG   8          2HG       ARG   8  -7.263   6.708   4.141
   66   2HG   ARG   8          3HG       ARG   8  -8.703   6.327   3.166
   67   1HD   ARG   8          2HD       ARG   8 -10.105   6.618   5.215
   68   2HD   ARG   8          3HD       ARG   8  -8.672   7.190   6.099
   69    HE   ARG   8           HE       ARG   8 -10.264   8.537   4.062
   70   1HH1  ARG   8          2HH2      ARG   8  -6.992   8.486   5.574
   71   2HH1  ARG   8          1HH2      ARG   8  -6.486   9.960   4.930
   72   1HH2  ARG   8          2HH1      ARG   8  -9.600  10.533   3.154
   73   2HH2  ARG   8          1HH1      ARG   8  -8.024  11.189   3.491
   74    H    VAL   9           H        VAL   9  -4.947   5.271   3.127
   75    HA   VAL   9           HA       VAL   9  -3.480   4.046   5.409
   76    HB   VAL   9           HB       VAL   9  -2.543   3.051   3.432
   77   1HG1  VAL   9          1HG1      VAL   9  -3.323   4.633   1.695
   78   2HG1  VAL   9          2HG1      VAL   9  -2.214   5.881   2.295
   79   3HG1  VAL   9          3HG1      VAL   9  -1.575   4.391   1.589
   80   1HG2  VAL   9          1HG2      VAL   9  -0.288   3.726   3.627
   81   2HG2  VAL   9          2HG2      VAL   9  -0.720   5.342   4.216
   82   3HG2  VAL   9          3HG2      VAL   9  -1.038   3.898   5.221
   83    H    ASP  10           H        ASP  10  -2.285   5.481   6.656
   84    HA   ASP  10           HA       ASP  10  -2.231   8.341   6.011
   85   1HB   ASP  10          2HB       ASP  10  -4.044   6.990   8.059
   86   2HB   ASP  10          3HB       ASP  10  -3.431   8.601   8.347
   87    H    GLY  11           H        GLY  11  -0.987   9.429   7.771
   88   1HA   GLY  11          1HA       GLY  11   0.166   9.295   9.878
   89   2HA   GLY  11          2HA       GLY  11   0.603   7.617   9.558
   90    H    LEU  12           H        LEU  12   1.637   7.593   7.113
   91    HA   LEU  12           HA       LEU  12   4.266   8.579   7.410
   92   1HB   LEU  12          2HB       LEU  12   4.663   7.620   5.262
   93   2HB   LEU  12          3HB       LEU  12   3.562   6.596   6.135
   94    HG   LEU  12           HG       LEU  12   2.730   6.577   4.001
   95   1HD1  LEU  12          1HD1      LEU  12   1.004   8.831   5.049
   96   2HD1  LEU  12          2HD1      LEU  12   0.632   7.688   3.759
   97   3HD1  LEU  12          3HD1      LEU  12   0.793   7.104   5.411
   98   1HD2  LEU  12          1HD2      LEU  12   4.217   8.489   3.187
   99   2HD2  LEU  12          2HD2      LEU  12   2.637   8.329   2.411
  100   3HD2  LEU  12          3HD2      LEU  12   2.877   9.585   3.598
  101    H    SER  13           H        SER  13   5.438   9.874   5.633
  102    HA   SER  13           HA       SER  13   3.930  11.665   3.962
  103   1HB   SER  13          2HB       SER  13   4.603  13.795   5.004
  104   2HB   SER  13          3HB       SER  13   3.533  12.889   6.074
  105    HG   SER  13           HG       SER  13   6.366  12.948   6.182
  106    H    CYS  14           H        CYS  14   5.686  10.115   2.764
  107    HA   CYS  14           HA       CYS  14   7.676  12.054   1.965
  108   1HB   CYS  14          2HB       CYS  14   8.828  10.974   3.950
  109   2HB   CYS  14          3HB       CYS  14   8.800   9.441   3.055
  110    HG   CYS  14           HG       CYS  14   9.975  10.397   0.921
  111    H    THR  15           H        THR  15   8.108  11.898  -0.178
  112    HA   THR  15           HA       THR  15   6.870  10.150  -1.886
  113    HB   THR  15           HB       THR  15   9.526  11.529  -2.442
  114    HG1  THR  15           1HG      THR  15   6.969  12.736  -2.338
  115   1HG2  THR  15          1HG2      THR  15   8.531  10.256  -4.323
  116   2HG2  THR  15          2HG2      THR  15   7.006  11.147  -4.130
  117   3HG2  THR  15          3HG2      THR  15   8.483  12.003  -4.622
  118    H    ASN  16           H        ASN  16  10.343   9.979  -0.853
  119    HA   ASN  16           HA       ASN  16  11.096   7.718  -2.206
  120   1HB   ASN  16          2HB       ASN  16  11.862   8.350   0.679
  121   2HB   ASN  16          3HB       ASN  16  12.748   7.308  -0.441
  122   1HD2  ASN  16          1HD2      ASN  16  12.629  10.451   0.806
  123   2HD2  ASN  16          2HD2      ASN  16  13.472  11.260  -0.500
  124    H    CYS  17           H        CYS  17   9.372   7.864   0.926
  125    HA   CYS  17           HA       CYS  17   9.259   5.018   1.295
  126   1HB   CYS  17          2HB       CYS  17   7.669   7.288   2.547
  127   2HB   CYS  17          3HB       CYS  17   7.557   5.572   2.978
  128    HG   CYS  17           HG       CYS  17   9.050   6.745   4.776
  129    H    ALA  18           H        ALA  18   7.058   7.425  -0.210
  130    HA   ALA  18           HA       ALA  18   4.923   5.662  -0.878
  131   1HB   ALA  18          1HB       ALA  18   5.111   8.226  -1.307
  132   2HB   ALA  18          2HB       ALA  18   5.955   7.780  -2.799
  133   3HB   ALA  18          3HB       ALA  18   4.315   7.219  -2.544
  134    H    ALA  19           H        ALA  19   7.980   6.271  -2.530
  135    HA   ALA  19           HA       ALA  19   7.487   4.560  -4.785
  136   1HB   ALA  19          1HB       ALA  19   9.264   6.269  -4.746
  137   2HB   ALA  19          2HB       ALA  19  10.187   5.286  -3.591
  138   3HB   ALA  19          3HB       ALA  19   9.854   4.662  -5.212
  139    H    LYS  20           H        LYS  20   9.268   4.046  -1.729
  140    HA   LYS  20           HA       LYS  20   9.889   1.336  -2.048
  141   1HB   LYS  20          2HB       LYS  20  10.626   3.033  -0.312
  142   2HB   LYS  20          3HB       LYS  20   9.154   2.670   0.588
  143   1HG   LYS  20          2HG       LYS  20   9.878   0.362   0.930
  144   2HG   LYS  20          3HG       LYS  20  11.198   0.565  -0.241
  145   1HD   LYS  20          2HD       LYS  20  12.160   2.382   1.198
  146   2HD   LYS  20          3HD       LYS  20  10.920   2.039   2.417
  147   1HE   LYS  20          2HE       LYS  20  11.802  -0.218   2.752
  148   2HE   LYS  20          3HE       LYS  20  12.915  -0.034   1.384
  149   1HZ   LYS  20          1HZ       LYS  20  13.029   1.530   3.877
  150   2HZ   LYS  20          2HZ       LYS  20  14.039   0.301   3.457
  151   3HZ   LYS  20          3HZ       LYS  20  14.044   1.696   2.591
  152    H    PHE  21           H        PHE  21   6.882   2.809  -0.766
  153    HA   PHE  21           HA       PHE  21   5.649   0.325  -0.097
  154   1HB   PHE  21          2HB       PHE  21   5.033   2.895   0.452
  155   2HB   PHE  21          3HB       PHE  21   3.911   2.642  -0.858
  156    HD1  PHE  21           1HD      PHE  21   5.082   1.438   2.450
  157    HD2  PHE  21           2HD      PHE  21   1.871   1.260  -0.414
  158    HE1  PHE  21           1HE      PHE  21   3.485   1.038   4.265
  159    HE2  PHE  21           2HE      PHE  21   0.263   0.891   1.443
  160    HZ   PHE  21           HZ       PHE  21   1.092   0.865   3.796
  161    H    GLU  22           H        GLU  22   5.049   2.479  -2.991
  162    HA   GLU  22           HA       GLU  22   3.206   0.643  -4.134
  163   1HB   GLU  22          2HB       GLU  22   3.401   1.900  -6.185
  164   2HB   GLU  22          3HB       GLU  22   3.329   2.979  -4.789
  165   1HG   GLU  22          2HG       GLU  22   4.920   4.023  -6.065
  166   2HG   GLU  22          3HG       GLU  22   5.908   3.067  -4.967
  167    H    ARG  23           H        ARG  23   6.717   0.958  -4.573
  168    HA   ARG  23           HA       ARG  23   7.019  -1.174  -6.403
  169   1HB   ARG  23          2HB       ARG  23   8.838   0.412  -5.790
  170   2HB   ARG  23          3HB       ARG  23   8.917  -0.291  -4.156
  171   1HG   ARG  23          2HG       ARG  23   9.445  -2.527  -5.156
  172   2HG   ARG  23          3HG       ARG  23   9.333  -1.805  -6.765
  173   1HD   ARG  23          2HD       ARG  23  11.300  -0.289  -6.029
  174   2HD   ARG  23          3HD       ARG  23  11.340  -1.246  -4.547
  175    HE   ARG  23           HE       ARG  23  11.831  -3.243  -5.736
  176   1HH1  ARG  23          2HH2      ARG  23  11.090  -0.739  -8.013
  177   2HH1  ARG  23          1HH2      ARG  23  11.807  -1.528  -9.383
  178   1HH2  ARG  23          2HH1      ARG  23  12.885  -4.281  -7.374
  179   2HH2  ARG  23          1HH1      ARG  23  12.947  -3.631  -8.997
  180    H    ASN  24           H        ASN  24   7.210  -1.284  -2.756
  181    HA   ASN  24           HA       ASN  24   7.601  -4.060  -2.506
  182   1HB   ASN  24          2HB       ASN  24   6.080  -2.059  -0.776
  183   2HB   ASN  24          3HB       ASN  24   6.126  -3.777  -0.403
  184   1HD2  ASN  24          1HD2      ASN  24   7.005  -2.434   1.572
  185   2HD2  ASN  24          2HD2      ASN  24   8.741  -2.589   1.707
  186    H    VAL  25           H        VAL  25   4.540  -2.250  -2.874
  187    HA   VAL  25           HA       VAL  25   2.837  -4.547  -2.770
  188    HB   VAL  25           HB       VAL  25   2.379  -1.885  -4.188
  189   1HG1  VAL  25          1HG1      VAL  25   0.448  -4.068  -3.266
  190   2HG1  VAL  25          2HG1      VAL  25  -0.029  -2.470  -3.818
  191   3HG1  VAL  25          3HG1      VAL  25   0.772  -3.597  -4.943
  192   1HG2  VAL  25          1HG2      VAL  25   2.813  -1.774  -1.625
  193   2HG2  VAL  25          2HG2      VAL  25   1.249  -1.164  -2.181
  194   3HG2  VAL  25          3HG2      VAL  25   1.394  -2.779  -1.471
  195    H    LYS  26           H        LYS  26   4.334  -2.850  -5.573
  196    HA   LYS  26           HA       LYS  26   3.383  -4.607  -7.591
  197   1HB   LYS  26          2HB       LYS  26   5.648  -2.662  -7.256
  198   2HB   LYS  26          3HB       LYS  26   5.669  -3.699  -8.670
  199   1HG   LYS  26          2HG       LYS  26   3.705  -2.843  -9.514
  200   2HG   LYS  26          3HG       LYS  26   3.110  -2.272  -7.938
  201   1HD   LYS  26          2HD       LYS  26   4.481  -0.397  -7.909
  202   2HD   LYS  26          3HD       LYS  26   5.564  -1.002  -9.161
  203   1HE   LYS  26          2HE       LYS  26   4.118  -0.485 -10.905
  204   2HE   LYS  26          3HE       LYS  26   2.654  -0.651  -9.920
  205   1HZ   LYS  26          1HZ       LYS  26   3.335   1.683 -10.569
  206   2HZ   LYS  26          2HZ       LYS  26   2.970   1.411  -8.981
  207   3HZ   LYS  26          3HZ       LYS  26   4.504   1.552  -9.391
  208    H    GLU  27           H        GLU  27   6.185  -4.984  -5.397
  209    HA   GLU  27           HA       GLU  27   7.066  -7.426  -6.681
  210   1HB   GLU  27          2HB       GLU  27   7.789  -6.133  -4.032
  211   2HB   GLU  27          3HB       GLU  27   8.477  -7.652  -4.608
  212   1HG   GLU  27          2HG       GLU  27   9.304  -6.566  -6.655
  213   2HG   GLU  27          3HG       GLU  27   8.626  -5.013  -6.137
  214    H    ILE  28           H        ILE  28   4.222  -6.925  -4.838
  215    HA   ILE  28           HA       ILE  28   4.194  -9.476  -3.472
  216    HB   ILE  28           HB       ILE  28   1.969  -7.663  -4.428
  217   1HG1  ILE  28          2HG1      ILE  28   2.900  -8.320  -1.601
  218   2HG1  ILE  28          3HG1      ILE  28   3.487  -6.932  -2.520
  219   1HG2  ILE  28          1HG2      ILE  28   0.977  -9.817  -4.471
  220   2HG2  ILE  28          2HG2      ILE  28   1.720 -10.267  -2.924
  221   3HG2  ILE  28          3HG2      ILE  28   0.438  -9.047  -2.997
  222   1HD1  ILE  28          1HD1      ILE  28   0.608  -7.383  -1.647
  223   2HD1  ILE  28          2HD1      ILE  28   1.740  -6.139  -1.106
  224   3HD1  ILE  28          3HD1      ILE  28   1.126  -6.134  -2.777
  225    H    GLU  29           H        GLU  29   3.397 -11.432  -4.171
  226    HA   GLU  29           HA       GLU  29   3.342 -11.910  -7.082
  227   1HB   GLU  29          2HB       GLU  29   4.732 -13.278  -5.383
  228   2HB   GLU  29          3HB       GLU  29   3.190 -13.966  -4.845
  229   1HG   GLU  29          2HG       GLU  29   2.775 -14.737  -7.186
  230   2HG   GLU  29          3HG       GLU  29   4.337 -14.045  -7.676
  231    H    GLY  30           H        GLY  30   1.391 -12.129  -8.063
  232   1HA   GLY  30          1HA       GLY  30  -0.774 -13.202  -8.176
  233   2HA   GLY  30          2HA       GLY  30  -1.069 -12.823  -6.479
  234    H    VAL  31           H        VAL  31  -0.125 -10.033  -6.590
  235    HA   VAL  31           HA       VAL  31  -2.541  -8.841  -7.485
  236    HB   VAL  31           HB       VAL  31  -1.049  -8.099  -5.597
  237   1HG1  VAL  31          1HG1      VAL  31   0.549  -6.756  -7.822
  238   2HG1  VAL  31          2HG1      VAL  31   0.739  -6.525  -6.078
  239   3HG1  VAL  31          3HG1      VAL  31   1.114  -8.102  -6.806
  240   1HG2  VAL  31          1HG2      VAL  31  -1.722  -5.874  -7.538
  241   2HG2  VAL  31          2HG2      VAL  31  -2.914  -6.762  -6.550
  242   3HG2  VAL  31          3HG2      VAL  31  -1.631  -5.807  -5.771
  243    H    THR  32           H        THR  32  -2.642  -7.013  -9.105
  244    HA   THR  32           HA       THR  32  -0.959  -7.560 -11.524
  245    HB   THR  32           HB       THR  32  -3.913  -6.847 -11.345
  246    HG1  THR  32           1HG      THR  32  -2.898  -9.120 -11.110
  247   1HG2  THR  32          1HG2      THR  32  -2.083  -7.153 -13.761
  248   2HG2  THR  32          2HG2      THR  32  -3.857  -7.093 -13.827
  249   3HG2  THR  32          3HG2      THR  32  -2.949  -5.683 -13.262
  250    H    GLU  33           H        GLU  33  -3.170  -5.121 -10.033
  251    HA   GLU  33           HA       GLU  33  -1.043  -3.049 -10.695
  252   1HB   GLU  33          2HB       GLU  33  -4.041  -2.830 -11.136
  253   2HB   GLU  33          3HB       GLU  33  -2.966  -1.443 -10.996
  254   1HG   GLU  33          2HG       GLU  33  -1.725  -3.185 -12.895
  255   2HG   GLU  33          3HG       GLU  33  -3.447  -3.135 -13.296
  256    H    ALA  34           H        ALA  34  -0.816  -1.283  -9.267
  257    HA   ALA  34           HA       ALA  34  -2.683  -1.126  -7.049
  258   1HB   ALA  34          1HB       ALA  34   0.295  -1.608  -6.571
  259   2HB   ALA  34          2HB       ALA  34  -0.878  -1.092  -5.336
  260   3HB   ALA  34          3HB       ALA  34  -1.048  -2.687  -6.114
  261    H    ILE  35           H        ILE  35  -2.899   0.994  -6.287
  262    HA   ILE  35           HA       ILE  35  -1.037   3.017  -7.486
  263    HB   ILE  35           HB       ILE  35  -4.051   3.287  -7.409
  264   1HG1  ILE  35          2HG1      ILE  35  -2.517   3.051 -10.006
  265   2HG1  ILE  35          3HG1      ILE  35  -3.007   1.566  -9.203
  266   1HG2  ILE  35          1HG2      ILE  35  -3.606   5.293  -8.772
  267   2HG2  ILE  35          2HG2      ILE  35  -2.669   5.379  -7.274
  268   3HG2  ILE  35          3HG2      ILE  35  -1.870   4.932  -8.779
  269   1HD1  ILE  35          1HD1      ILE  35  -4.950   3.760  -9.951
  270   2HD1  ILE  35          2HD1      ILE  35  -4.677   2.234 -10.817
  271   3HD1  ILE  35          3HD1      ILE  35  -5.330   2.207  -9.170
  272    H    VAL  36           H        VAL  36   0.026   3.212  -5.557
  273    HA   VAL  36           HA       VAL  36  -1.402   3.561  -3.042
  274    HB   VAL  36           HB       VAL  36   1.567   3.914  -3.517
  275   1HG1  VAL  36          1HG1      VAL  36   1.743   3.440  -1.192
  276   2HG1  VAL  36          2HG1      VAL  36   0.455   4.632  -1.350
  277   3HG1  VAL  36          3HG1      VAL  36   0.044   2.933  -1.076
  278   1HG2  VAL  36          1HG2      VAL  36   1.723   1.500  -2.773
  279   2HG2  VAL  36          2HG2      VAL  36   0.028   1.309  -3.225
  280   3HG2  VAL  36          3HG2      VAL  36   1.201   1.764  -4.451
  281    H    ASN  37           H        ASN  37  -2.415   5.570  -2.762
  282    HA   ASN  37           HA       ASN  37  -1.069   8.019  -3.842
  283   1HB   ASN  37          2HB       ASN  37  -3.809   7.625  -2.586
  284   2HB   ASN  37          3HB       ASN  37  -3.075   9.172  -2.991
  285   1HD2  ASN  37          1HD2      ASN  37  -3.066   6.097  -4.937
  286   2HD2  ASN  37          2HD2      ASN  37  -3.716   6.933  -6.344
  287    H    PHE  38           H        PHE  38   0.684   7.194  -2.390
  288    HA   PHE  38           HA       PHE  38   0.318   7.284   0.473
  289   1HB   PHE  38          2HB       PHE  38   2.279   6.296  -1.251
  290   2HB   PHE  38          3HB       PHE  38   3.036   7.740  -0.603
  291    HD1  PHE  38           1HD      PHE  38   0.830   5.039   0.892
  292    HD2  PHE  38           2HD      PHE  38   4.607   7.132   1.056
  293    HE1  PHE  38           1HE      PHE  38   1.647   3.474   2.602
  294    HE2  PHE  38           2HE      PHE  38   5.402   5.520   2.756
  295    HZ   PHE  38           HZ       PHE  38   3.958   3.667   3.490
  296    H    GLY  39           H        GLY  39   0.508   8.986   1.849
  297   1HA   GLY  39          1HA       GLY  39   1.948  11.200   1.994
  298   2HA   GLY  39          2HA       GLY  39   0.801  11.716   0.741
  299    H    ALA  40           H        ALA  40  -1.533  11.031   1.246
  300    HA   ALA  40           HA       ALA  40  -2.520  10.704   3.896
  301   1HB   ALA  40          1HB       ALA  40  -3.497  13.002   4.191
  302   2HB   ALA  40          2HB       ALA  40  -1.738  12.994   4.343
  303   3HB   ALA  40          3HB       ALA  40  -2.491  13.577   2.844
  304    H    SER  41           H        SER  41  -3.426   9.157   2.199
  305    HA   SER  41           HA       SER  41  -5.992  10.085   1.198
  306   1HB   SER  41          2HB       SER  41  -3.708   9.701  -0.724
  307   2HB   SER  41          3HB       SER  41  -5.379   9.375  -1.214
  308    HG   SER  41           HG       SER  41  -4.747  11.795   0.065
  309    H    LYS  42           H        LYS  42  -4.420   7.509  -0.522
  310    HA   LYS  42           HA       LYS  42  -5.543   5.430   1.133
  311   1HB   LYS  42          2HB       LYS  42  -7.255   4.675  -0.480
  312   2HB   LYS  42          3HB       LYS  42  -7.623   6.212   0.267
  313   1HG   LYS  42          2HG       LYS  42  -8.275   6.270  -2.007
  314   2HG   LYS  42          3HG       LYS  42  -6.964   7.423  -1.788
  315   1HD   LYS  42          2HD       LYS  42  -5.402   5.997  -2.947
  316   2HD   LYS  42          3HD       LYS  42  -6.481   4.597  -2.830
  317   1HE   LYS  42          2HE       LYS  42  -8.071   5.735  -4.382
  318   2HE   LYS  42          3HE       LYS  42  -6.972   7.126  -4.472
  319   1HZ   LYS  42          1HZ       LYS  42  -6.372   4.370  -5.360
  320   2HZ   LYS  42          2HZ       LYS  42  -6.659   5.670  -6.327
  321   3HZ   LYS  42          3HZ       LYS  42  -5.307   5.625  -5.391
  322    H    ILE  43           H        ILE  43  -5.447   3.285  -0.003
  323    HA   ILE  43           HA       ILE  43  -3.305   3.182  -2.068
  324    HB   ILE  43           HB       ILE  43  -2.228   2.767  -0.027
  325   1HG1  ILE  43          2HG1      ILE  43  -1.582   1.321  -1.897
  326   2HG1  ILE  43          3HG1      ILE  43  -1.214   0.670  -0.307
  327   1HG2  ILE  43          1HG2      ILE  43  -3.978   2.297   1.521
  328   2HG2  ILE  43          2HG2      ILE  43  -4.385   0.778   0.715
  329   3HG2  ILE  43          3HG2      ILE  43  -2.828   0.962   1.540
  330   1HD1  ILE  43          1HD1      ILE  43  -3.363  -0.758  -0.573
  331   2HD1  ILE  43          2HD1      ILE  43  -3.260  -0.316  -2.283
  332   3HD1  ILE  43          3HD1      ILE  43  -1.921  -1.162  -1.514
  333    H    THR  44           H        THR  44  -4.085   2.308  -3.852
  334    HA   THR  44           HA       THR  44  -6.395   0.436  -3.692
  335    HB   THR  44           HB       THR  44  -5.169   1.793  -6.120
  336    HG1  THR  44           1HG      THR  44  -6.857   2.520  -4.147
  337   1HG2  THR  44          1HG2      THR  44  -6.505  -0.164  -6.733
  338   2HG2  THR  44          2HG2      THR  44  -7.844   0.391  -5.712
  339   3HG2  THR  44          3HG2      THR  44  -7.368   1.324  -7.148
  340    H    VAL  45           H        VAL  45  -6.168  -1.655  -4.161
  341    HA   VAL  45           HA       VAL  45  -3.758  -2.646  -5.571
  342    HB   VAL  45           HB       VAL  45  -5.052  -3.542  -3.000
  343   1HG1  VAL  45          1HG1      VAL  45  -5.555  -5.510  -4.309
  344   2HG1  VAL  45          2HG1      VAL  45  -3.932  -5.491  -5.035
  345   3HG1  VAL  45          3HG1      VAL  45  -4.130  -5.841  -3.311
  346   1HG2  VAL  45          1HG2      VAL  45  -2.788  -2.437  -3.209
  347   2HG2  VAL  45          2HG2      VAL  45  -2.748  -4.027  -2.418
  348   3HG2  VAL  45          3HG2      VAL  45  -2.229  -3.854  -4.108
  349    H    THR  46           H        THR  46  -4.244  -4.106  -7.192
  350    HA   THR  46           HA       THR  46  -6.970  -5.085  -7.556
  351    HB   THR  46           HB       THR  46  -5.503  -3.287  -9.546
  352    HG1  THR  46           1HG      THR  46  -7.264  -3.059  -7.665
  353   1HG2  THR  46          1HG2      THR  46  -8.105  -4.850  -9.952
  354   2HG2  THR  46          2HG2      THR  46  -7.443  -3.627 -11.053
  355   3HG2  THR  46          3HG2      THR  46  -6.581  -5.156 -10.816
  356    H    GLY  47           H        GLY  47  -6.963  -7.014  -8.431
  357   1HA   GLY  47          1HA       GLY  47  -5.380  -8.257 -10.158
  358   2HA   GLY  47          2HA       GLY  47  -4.238  -8.182  -8.857
  359    H    GLU  48           H        GLU  48  -4.504  -9.199  -6.884
  360    HA   GLU  48           HA       GLU  48  -6.707 -10.780  -6.083
  361   1HB   GLU  48          2HB       GLU  48  -5.732 -12.129  -8.139
  362   2HB   GLU  48          3HB       GLU  48  -4.416 -12.538  -7.051
  363   1HG   GLU  48          2HG       GLU  48  -6.128 -13.503  -5.466
  364   2HG   GLU  48          3HG       GLU  48  -7.398 -13.052  -6.619
  365    H    ALA  49           H        ALA  49  -5.424  -8.946  -4.569
  366    HA   ALA  49           HA       ALA  49  -4.347 -10.646  -2.461
  367   1HB   ALA  49          1HB       ALA  49  -2.693  -8.307  -3.519
  368   2HB   ALA  49          2HB       ALA  49  -2.328  -9.287  -2.081
  369   3HB   ALA  49          3HB       ALA  49  -2.274 -10.028  -3.692
  370    H    SER  50           H        SER  50  -4.217  -9.497  -0.408
  371    HA   SER  50           HA       SER  50  -6.124  -7.218  -0.183
  372   1HB   SER  50          2HB       SER  50  -5.435  -9.523   1.694
  373   2HB   SER  50          3HB       SER  50  -6.351  -8.110   2.214
  374    HG   SER  50           HG       SER  50  -8.030  -8.683   0.959
  375    H    ILE  51           H        ILE  51  -5.670  -5.796   1.735
  376    HA   ILE  51           HA       ILE  51  -3.160  -4.762   1.531
  377    HB   ILE  51           HB       ILE  51  -5.339  -3.691   2.555
  378   1HG1  ILE  51          2HG1      ILE  51  -4.012  -2.075   3.788
  379   2HG1  ILE  51          3HG1      ILE  51  -2.587  -3.062   3.423
  380   1HG2  ILE  51          1HG2      ILE  51  -5.437  -5.285   4.534
  381   2HG2  ILE  51          2HG2      ILE  51  -3.978  -4.462   5.153
  382   3HG2  ILE  51          3HG2      ILE  51  -5.483  -3.559   4.928
  383   1HD1  ILE  51          1HD1      ILE  51  -2.665  -1.397   1.680
  384   2HD1  ILE  51          2HD1      ILE  51  -3.391  -2.788   0.889
  385   3HD1  ILE  51          3HD1      ILE  51  -4.421  -1.526   1.550
  386    H    GLN  52           H        GLN  52  -4.081  -7.319   3.720
  387    HA   GLN  52           HA       GLN  52  -2.270  -7.425   5.723
  388   1HB   GLN  52          2HB       GLN  52  -2.919  -9.578   3.661
  389   2HB   GLN  52          3HB       GLN  52  -2.040  -9.926   5.150
  390   1HG   GLN  52          2HG       GLN  52  -4.798  -8.622   5.238
  391   2HG   GLN  52          3HG       GLN  52  -4.577 -10.363   5.078
  392   1HE2  GLN  52          1HE2      GLN  52  -3.921  -7.582   7.291
  393   2HE2  GLN  52          2HE2      GLN  52  -3.700  -8.608   8.682
  394    H    GLN  53           H        GLN  53  -1.409  -8.298   2.356
  395    HA   GLN  53           HA       GLN  53   1.376  -8.808   2.933
  396   1HB   GLN  53          2HB       GLN  53  -0.025  -8.140   0.346
  397   2HB   GLN  53          3HB       GLN  53   1.691  -8.572   0.520
  398   1HG   GLN  53          2HG       GLN  53   0.612 -10.624   1.943
  399   2HG   GLN  53          3HG       GLN  53  -0.786 -10.242   0.929
  400   1HE2  GLN  53          1HE2      GLN  53  -0.690 -12.146  -0.243
  401   2HE2  GLN  53          2HE2      GLN  53   0.626 -12.538  -1.349
  402    H    VAL  54           H        VAL  54  -0.381  -5.945   1.768
  403    HA   VAL  54           HA       VAL  54   1.880  -4.315   1.146
  404    HB   VAL  54           HB       VAL  54  -0.955  -3.458   1.904
  405   1HG1  VAL  54          1HG1      VAL  54   1.352  -2.009   0.610
  406   2HG1  VAL  54          2HG1      VAL  54  -0.344  -1.492   0.440
  407   3HG1  VAL  54          3HG1      VAL  54   0.402  -1.587   2.038
  408   1HG2  VAL  54          1HG2      VAL  54   0.184  -4.384  -0.743
  409   2HG2  VAL  54          2HG2      VAL  54  -1.235  -4.986   0.109
  410   3HG2  VAL  54          3HG2      VAL  54  -1.270  -3.373  -0.605
  411    H    GLU  55           H        GLU  55  -0.191  -4.690   4.011
  412    HA   GLU  55           HA       GLU  55   0.847  -2.713   5.700
  413   1HB   GLU  55          2HB       GLU  55  -1.307  -4.158   5.894
  414   2HB   GLU  55          3HB       GLU  55  -0.261  -5.423   6.528
  415   1HG   GLU  55          2HG       GLU  55   0.528  -3.322   8.098
  416   2HG   GLU  55          3HG       GLU  55  -1.147  -2.863   7.760
  417    H    GLN  56           H        GLN  56   1.557  -6.252   5.419
  418    HA   GLN  56           HA       GLN  56   3.597  -6.403   7.305
  419   1HB   GLN  56          2HB       GLN  56   2.496  -8.318   6.163
  420   2HB   GLN  56          3HB       GLN  56   3.430  -7.975   4.693
  421   1HG   GLN  56          2HG       GLN  56   5.530  -8.392   5.895
  422   2HG   GLN  56          3HG       GLN  56   4.646  -8.544   7.426
  423   1HE2  GLN  56          1HE2      GLN  56   5.524 -10.690   7.747
  424   2HE2  GLN  56          2HE2      GLN  56   4.895 -12.036   6.812
  425    H    ALA  57           H        ALA  57   3.884  -5.551   3.805
  426    HA   ALA  57           HA       ALA  57   6.669  -4.969   3.840
  427   1HB   ALA  57          1HB       ALA  57   6.194  -4.583   1.705
  428   2HB   ALA  57          2HB       ALA  57   4.465  -4.725   2.012
  429   3HB   ALA  57          3HB       ALA  57   5.228  -3.140   2.112
  430    H    GLY  58           H        GLY  58   3.844  -2.844   4.405
  431   1HA   GLY  58          1HA       GLY  58   5.104  -0.414   4.831
  432   2HA   GLY  58          2HA       GLY  58   3.502  -0.912   5.446
  433    H    ALA  59           H        ALA  59   4.893  -3.131   7.030
  434    HA   ALA  59           HA       ALA  59   5.550  -2.146   9.495
  435   1HB   ALA  59          1HB       ALA  59   7.167  -4.249   8.007
  436   2HB   ALA  59          2HB       ALA  59   7.060  -4.037   9.763
  437   3HB   ALA  59          3HB       ALA  59   5.624  -4.543   8.853
  438    H    PHE  60           H        PHE  60   7.628  -1.861   6.549
  439    HA   PHE  60           HA       PHE  60   9.946  -1.008   7.869
  440   1HB   PHE  60          2HB       PHE  60  10.768  -0.181   5.874
  441   2HB   PHE  60          3HB       PHE  60   9.805  -1.593   5.476
  442    HD1  PHE  60           1HD      PHE  60   8.253  -1.409   3.671
  443    HD2  PHE  60           2HD      PHE  60   9.838   2.165   5.464
  444    HE1  PHE  60           1HE      PHE  60   7.073  -0.040   1.978
  445    HE2  PHE  60           2HE      PHE  60   8.752   3.517   3.702
  446    HZ   PHE  60           HZ       PHE  60   7.265   2.440   2.035
  447    H    GLU  61           H        GLU  61   7.025   0.886   7.301
  448    HA   GLU  61           HA       GLU  61   8.235   3.168   8.840
  449   1HB   GLU  61          2HB       GLU  61   6.612   3.127   6.316
  450   2HB   GLU  61          3HB       GLU  61   6.328   4.443   7.464
  451   1HG   GLU  61          2HG       GLU  61   9.192   3.908   6.766
  452   2HG   GLU  61          3HG       GLU  61   8.131   4.604   5.521
  453    H    HIS  62           H        HIS  62   6.102   0.640   9.050
  454    HA   HIS  62           HA       HIS  62   4.488   0.088  10.541
  455   1HB   HIS  62          2HB       HIS  62   5.362   2.595  12.047
  456   2HB   HIS  62          3HB       HIS  62   4.232   1.384  12.641
  457    HD1  HIS  62           1HD      HIS  62   6.816  -0.641  11.073
  458    HD2  HIS  62           2HD      HIS  62   6.399   1.615  14.599
  459    HE1  HIS  62           1HE      HIS  62   8.428  -1.633  12.761
  460    H    LEU  63           H        LEU  63   3.506   0.993   8.271
  461    HA   LEU  63           HA       LEU  63   1.793   3.301   8.614
  462   1HB   LEU  63          2HB       LEU  63   2.046   1.106   6.538
  463   2HB   LEU  63          3HB       LEU  63   0.622   2.146   6.525
  464    HG   LEU  63           HG       LEU  63   2.270   2.968   5.027
  465   1HD1  LEU  63          1HD1      LEU  63   1.924   5.164   5.486
  466   2HD1  LEU  63          2HD1      LEU  63   0.692   4.454   6.526
  467   3HD1  LEU  63          3HD1      LEU  63   2.210   5.022   7.234
  468   1HD2  LEU  63          1HD2      LEU  63   4.072   3.511   7.421
  469   2HD2  LEU  63          2HD2      LEU  63   4.347   2.254   6.194
  470   3HD2  LEU  63          3HD2      LEU  63   4.376   3.975   5.746
  471    H    LYS  64           H        LYS  64  -0.614   3.283   8.451
  472    HA   LYS  64           HA       LYS  64  -1.758   1.110  10.160
  473   1HB   LYS  64          2HB       LYS  64  -2.955   2.950  11.398
  474   2HB   LYS  64          3HB       LYS  64  -1.260   2.627  11.746
  475   1HG   LYS  64          2HG       LYS  64  -1.048   4.847  11.739
  476   2HG   LYS  64          3HG       LYS  64  -0.831   4.639  10.032
  477   1HD   LYS  64          2HD       LYS  64  -2.385   6.207   9.886
  478   2HD   LYS  64          3HD       LYS  64  -3.548   4.933  10.015
  479   1HE   LYS  64          2HE       LYS  64  -2.522   6.624  12.345
  480   2HE   LYS  64          3HE       LYS  64  -4.084   6.805  11.535
  481   1HZ   LYS  64          1HZ       LYS  64  -3.215   4.404  12.997
  482   2HZ   LYS  64          2HZ       LYS  64  -4.272   5.533  13.561
  483   3HZ   LYS  64          3HZ       LYS  64  -4.671   4.605  12.259
  484    H    ILE  65           H        ILE  65  -2.289   0.460   7.935
  485    HA   ILE  65           HA       ILE  65  -4.179   2.120   6.556
  486    HB   ILE  65           HB       ILE  65  -3.780  -0.732   5.719
  487   1HG1  ILE  65          2HG1      ILE  65  -1.621   1.359   5.673
  488   2HG1  ILE  65          3HG1      ILE  65  -1.609  -0.359   6.184
  489   1HG2  ILE  65          1HG2      ILE  65  -4.068   1.846   4.184
  490   2HG2  ILE  65          2HG2      ILE  65  -4.024   0.226   3.489
  491   3HG2  ILE  65          3HG2      ILE  65  -5.354   0.702   4.538
  492   1HD1  ILE  65          1HD1      ILE  65  -1.455   0.743   3.408
  493   2HD1  ILE  65          2HD1      ILE  65  -0.457  -0.483   4.247
  494   3HD1  ILE  65          3HD1      ILE  65  -2.064  -0.895   3.733
  495    H    ILE  66           H        ILE  66  -6.441   1.807   6.313
  496    HA   ILE  66           HA       ILE  66  -7.686  -0.268   8.063
  497    HB   ILE  66           HB       ILE  66  -8.470   2.642   7.731
  498   1HG1  ILE  66          2HG1      ILE  66  -7.435   1.118  10.175
  499   2HG1  ILE  66          3HG1      ILE  66  -6.467   2.224   9.195
  500   1HG2  ILE  66          1HG2      ILE  66 -10.463   1.135   7.975
  501   2HG2  ILE  66          2HG2      ILE  66  -9.751   0.478   9.465
  502   3HG2  ILE  66          3HG2      ILE  66 -10.247   2.178   9.368
  503   1HD1  ILE  66          1HD1      ILE  66  -7.149   3.408  11.130
  504   2HD1  ILE  66          2HD1      ILE  66  -8.013   4.085   9.736
  505   3HD1  ILE  66          3HD1      ILE  66  -8.853   3.012  10.886
  506    HA   PRO  67           HA       PRO  67  -9.950  -1.005   4.178
  507   1HB   PRO  67          2HB       PRO  67 -11.708  -2.900   5.037
  508   2HB   PRO  67          3HB       PRO  67  -9.978  -3.245   4.799
  509   1HG   PRO  67          2HG       PRO  67 -11.371  -2.606   7.397
  510   2HG   PRO  67          3HG       PRO  67 -10.205  -3.918   7.067
  511   1HD   PRO  67          2HD       PRO  67  -9.480  -1.562   8.216
  512   2HD   PRO  67          3HD       PRO  67  -8.379  -2.424   7.101
  513    H    GLU  68           H        GLU  68 -11.019   0.889   3.780
  514    HA   GLU  68           HA       GLU  68 -12.962   2.128   5.389
  515   1HB   GLU  68          2HB       GLU  68 -12.658   2.205   2.344
  516   2HB   GLU  68          3HB       GLU  68 -13.550   3.368   3.343
  517   1HG   GLU  68          2HG       GLU  68 -11.431   3.863   4.587
  518   2HG   GLU  68          3HG       GLU  68 -10.549   2.821   3.452
  519    H    LYS  69           H        LYS  69 -13.303  -0.332   2.848
  520    HA   LYS  69           HA       LYS  69 -15.675  -1.379   4.064
  521   1HB   LYS  69          2HB       LYS  69 -16.078   0.364   1.820
  522   2HB   LYS  69          3HB       LYS  69 -16.098  -1.261   1.150
  523   1HG   LYS  69          2HG       LYS  69 -18.322  -0.963   1.653
  524   2HG   LYS  69          3HG       LYS  69 -17.777  -1.802   3.102
  525   1HD   LYS  69          2HD       LYS  69 -17.460   0.483   4.194
  526   2HD   LYS  69          3HD       LYS  69 -18.163   1.207   2.736
  527   1HE   LYS  69          2HE       LYS  69 -20.231  -0.262   3.157
  528   2HE   LYS  69          3HE       LYS  69 -19.494  -0.724   4.700
  529   1HZ   LYS  69          1HZ       LYS  69 -19.491   1.634   5.289
  530   2HZ   LYS  69          2HZ       LYS  69 -20.270   1.998   3.885
  531   3HZ   LYS  69          3HZ       LYS  69 -21.011   1.063   5.015
  532    H    GLU  70           H        GLU  70 -16.091  -3.558   2.802
  533    HA   GLU  70           HA       GLU  70 -15.065  -5.617   2.706
  534   1HB   GLU  70          2HB       GLU  70 -15.173  -4.143   0.084
  535   2HB   GLU  70          3HB       GLU  70 -14.644  -5.827   0.158
  536   1HG   GLU  70          2HG       GLU  70 -16.981  -5.851  -0.297
  537   2HG   GLU  70          3HG       GLU  70 -16.753  -6.457   1.339
  538    H    ALA  71           H        ALA  71 -13.309  -5.904   3.931
  539    HA   ALA  71           HA       ALA  71 -10.658  -5.012   3.317
  540   1HB   ALA  71          1HB       ALA  71 -11.646  -7.256   5.132
  541   2HB   ALA  71          2HB       ALA  71 -10.033  -6.517   5.176
  542   3HB   ALA  71          3HB       ALA  71 -11.465  -5.556   5.616
  Start of MODEL    7
    1   1H    MET   1           H1       MET   1  -6.809 -15.507  -4.088
    2   2H    MET   1           H2       MET   1  -7.015 -16.824  -5.093
    3   3H    MET   1           H3       MET   1  -7.071 -15.347  -5.728
    4    HA   MET   1           HA       MET   1  -9.230 -15.821  -5.681
    5   1HB   MET   1          2HB       MET   1  -8.844 -17.072  -2.923
    6   2HB   MET   1          3HB       MET   1 -10.359 -16.956  -3.833
    7   1HG   MET   1          2HG       MET   1  -9.559 -19.158  -4.196
    8   2HG   MET   1          3HG       MET   1  -9.231 -18.274  -5.689
    9   1HE   MET   1          1HE       MET   1  -7.508 -19.872  -6.709
   10   2HE   MET   1          2HE       MET   1  -6.211 -20.661  -5.784
   11   3HE   MET   1          3HE       MET   1  -7.912 -21.017  -5.404
   12    H    ALA   2           H        ALA   2  -9.446 -13.506  -5.737
   13    HA   ALA   2           HA       ALA   2 -10.550 -12.197  -3.503
   14   1HB   ALA   2          1HB       ALA   2  -7.698 -11.360  -4.190
   15   2HB   ALA   2          2HB       ALA   2  -8.770 -10.539  -3.043
   16   3HB   ALA   2          3HB       ALA   2  -8.165 -12.149  -2.676
   17    H    GLU   3           H        GLU   3  -9.942  -9.529  -4.337
   18    HA   GLU   3           HA       GLU   3 -10.347  -9.362  -7.215
   19   1HB   GLU   3          2HB       GLU   3 -12.649  -9.681  -5.831
   20   2HB   GLU   3          3HB       GLU   3 -12.427  -7.962  -5.518
   21   1HG   GLU   3          2HG       GLU   3 -12.198  -7.754  -8.137
   22   2HG   GLU   3          3HG       GLU   3 -12.725  -9.436  -8.171
   23    H    LYS   4           H        LYS   4 -11.258  -6.579  -6.944
   24    HA   LYS   4           HA       LYS   4  -8.679  -5.348  -6.157
   25   1HB   LYS   4          2HB       LYS   4  -9.677  -3.298  -7.156
   26   2HB   LYS   4          3HB       LYS   4  -9.449  -4.642  -8.299
   27   1HG   LYS   4          2HG       LYS   4 -11.737  -5.054  -8.526
   28   2HG   LYS   4          3HG       LYS   4 -12.144  -4.315  -6.985
   29   1HD   LYS   4          2HD       LYS   4 -12.922  -2.961  -8.804
   30   2HD   LYS   4          3HD       LYS   4 -11.755  -2.069  -7.839
   31   1HE   LYS   4          2HE       LYS   4 -11.030  -3.508 -10.454
   32   2HE   LYS   4          3HE       LYS   4 -11.656  -1.857 -10.408
   33   1HZ   LYS   4          1HZ       LYS   4  -9.089  -2.716  -9.197
   34   2HZ   LYS   4          2HZ       LYS   4  -9.322  -1.777 -10.505
   35   3HZ   LYS   4          3HZ       LYS   4  -9.772  -1.236  -9.028
   36    H    THR   5           H        THR   5  -8.600  -3.476  -4.711
   37    HA   THR   5           HA       THR   5 -10.990  -2.725  -3.249
   38    HB   THR   5           HB       THR   5  -8.750  -4.194  -1.738
   39    HG1  THR   5           1HG      THR   5 -11.111  -4.794  -2.769
   40   1HG2  THR   5          1HG2      THR   5  -9.547  -2.379  -0.257
   41   2HG2  THR   5          2HG2      THR   5 -11.235  -2.721  -0.701
   42   3HG2  THR   5          3HG2      THR   5 -10.305  -3.887   0.248
   43    H    VAL   6           H        VAL   6 -10.506  -0.835  -1.846
   44    HA   VAL   6           HA       VAL   6  -7.773  -0.083  -1.947
   45    HB   VAL   6           HB       VAL   6  -8.695   1.222  -3.708
   46   1HG1  VAL   6          1HG1      VAL   6 -10.597   2.717  -3.579
   47   2HG1  VAL   6          2HG1      VAL   6 -11.038   1.021  -3.395
   48   3HG1  VAL   6          3HG1      VAL   6 -10.990   2.082  -1.959
   49   1HG2  VAL   6          1HG2      VAL   6  -8.413   3.559  -3.038
   50   2HG2  VAL   6          2HG2      VAL   6  -8.774   3.159  -1.342
   51   3HG2  VAL   6          3HG2      VAL   6  -7.271   2.608  -2.091
   52    H    TYR   7           H        TYR   7  -7.012   1.238  -0.269
   53    HA   TYR   7           HA       TYR   7  -8.671   1.109   2.210
   54   1HB   TYR   7          2HB       TYR   7  -5.762   0.287   1.926
   55   2HB   TYR   7          3HB       TYR   7  -6.811   0.082   3.327
   56    HD1  TYR   7           HD1      TYR   7  -6.141  -1.102  -0.165
   57    HD2  TYR   7           HD2      TYR   7  -7.760  -2.007   3.704
   58    HE1  TYR   7           HE1      TYR   7  -6.461  -3.459  -0.840
   59    HE2  TYR   7           HE2      TYR   7  -8.220  -4.324   2.982
   60    HH   TYR   7           HH       TYR   7  -8.164  -5.835   1.123
   61    H    ARG   8           H        ARG   8  -8.123   2.771   3.735
   62    HA   ARG   8           HA       ARG   8  -6.599   5.060   2.546
   63   1HB   ARG   8          2HB       ARG   8  -8.273   4.938   5.079
   64   2HB   ARG   8          3HB       ARG   8  -7.470   6.365   4.393
   65   1HG   ARG   8          2HG       ARG   8  -8.851   5.988   2.272
   66   2HG   ARG   8          3HG       ARG   8  -9.750   4.766   3.198
   67   1HD   ARG   8          2HD       ARG   8 -10.071   6.622   4.980
   68   2HD   ARG   8          3HD       ARG   8  -9.522   7.763   3.723
   69    HE   ARG   8           HE       ARG   8 -11.531   6.091   2.596
   70   1HH1  ARG   8          2HH2      ARG   8 -11.432   8.567   5.102
   71   2HH1  ARG   8          1HH2      ARG   8 -13.160   8.773   5.137
   72   1HH2  ARG   8          2HH1      ARG   8 -13.573   6.272   2.577
   73   2HH2  ARG   8          1HH1      ARG   8 -14.511   7.366   3.604
   74    H    VAL   9           H        VAL   9  -4.578   5.569   3.259
   75    HA   VAL   9           HA       VAL   9  -3.472   4.176   5.661
   76    HB   VAL   9           HB       VAL   9  -2.094   3.573   3.908
   77   1HG1  VAL   9          1HG1      VAL   9  -2.944   4.879   2.070
   78   2HG1  VAL   9          2HG1      VAL   9  -2.312   6.386   2.785
   79   3HG1  VAL   9          3HG1      VAL   9  -1.215   5.115   2.189
   80   1HG2  VAL   9          1HG2      VAL   9   0.004   4.635   4.331
   81   2HG2  VAL   9          2HG2      VAL   9  -0.764   6.118   4.878
   82   3HG2  VAL   9          3HG2      VAL   9  -0.905   4.602   5.824
   83    H    ASP  10           H        ASP  10  -2.263   5.430   7.172
   84    HA   ASP  10           HA       ASP  10  -2.225   8.349   6.772
   85   1HB   ASP  10          2HB       ASP  10  -4.399   7.635   8.038
   86   2HB   ASP  10          3HB       ASP  10  -3.287   7.004   9.221
   87    H    GLY  11           H        GLY  11  -0.703   9.294   8.220
   88   1HA   GLY  11          1HA       GLY  11   0.510   9.110  10.299
   89   2HA   GLY  11          2HA       GLY  11   1.058   7.488   9.856
   90    H    LEU  12           H        LEU  12   1.984   7.644   7.414
   91    HA   LEU  12           HA       LEU  12   4.514   8.908   7.741
   92   1HB   LEU  12          2HB       LEU  12   5.134   7.819   5.770
   93   2HB   LEU  12          3HB       LEU  12   4.028   6.764   6.595
   94    HG   LEU  12           HG       LEU  12   3.274   6.488   4.521
   95   1HD1  LEU  12          1HD1      LEU  12   1.276   7.534   3.881
   96   2HD1  LEU  12          2HD1      LEU  12   1.256   7.425   5.629
   97   3HD1  LEU  12          3HD1      LEU  12   1.594   8.974   4.837
   98   1HD2  LEU  12          1HD2      LEU  12   3.525   7.901   2.627
   99   2HD2  LEU  12          2HD2      LEU  12   3.722   9.342   3.624
  100   3HD2  LEU  12          3HD2      LEU  12   4.995   8.098   3.567
  101    H    SER  13           H        SER  13   5.539  10.196   5.834
  102    HA   SER  13           HA       SER  13   3.761  11.904   4.293
  103   1HB   SER  13          2HB       SER  13   4.455  14.034   5.305
  104   2HB   SER  13          3HB       SER  13   3.587  13.045   6.486
  105    HG   SER  13           HG       SER  13   6.405  13.256   6.212
  106    H    CYS  14           H        CYS  14   5.413  10.315   3.028
  107    HA   CYS  14           HA       CYS  14   7.443  12.156   1.998
  108   1HB   CYS  14          2HB       CYS  14   8.651  11.026   3.864
  109   2HB   CYS  14          3HB       CYS  14   8.297   9.453   3.112
  110    HG   CYS  14           HG       CYS  14   9.887  12.081   1.909
  111    H    THR  15           H        THR  15   7.182  12.088  -0.136
  112    HA   THR  15           HA       THR  15   5.797  10.146  -1.595
  113    HB   THR  15           HB       THR  15   6.179  12.373  -2.436
  114    HG1  THR  15           1HG      THR  15   5.901  10.676  -3.950
  115   1HG2  THR  15          1HG2      THR  15   9.118  11.645  -2.823
  116   2HG2  THR  15          2HG2      THR  15   8.310  13.129  -3.339
  117   3HG2  THR  15          3HG2      THR  15   8.505  12.798  -1.614
  118    H    ASN  16           H        ASN  16   9.292  10.261  -0.799
  119    HA   ASN  16           HA       ASN  16  10.132   8.184  -2.433
  120   1HB   ASN  16          2HB       ASN  16  11.592   9.707  -1.054
  121   2HB   ASN  16          3HB       ASN  16  11.149   8.750   0.374
  122   1HD2  ASN  16          1HD2      ASN  16  13.536   8.450   0.534
  123   2HD2  ASN  16          2HD2      ASN  16  14.265   7.182  -0.435
  124    H    CYS  17           H        CYS  17   8.468   8.107   0.728
  125    HA   CYS  17           HA       CYS  17   8.779   5.230   1.083
  126   1HB   CYS  17          2HB       CYS  17   7.176   7.362   2.508
  127   2HB   CYS  17          3HB       CYS  17   6.924   5.642   2.813
  128    HG   CYS  17           HG       CYS  17   9.313   5.012   3.403
  129    H    ALA  18           H        ALA  18   6.263   7.418  -0.252
  130    HA   ALA  18           HA       ALA  18   4.330   5.393  -0.824
  131   1HB   ALA  18          1HB       ALA  18   3.440   6.896  -2.477
  132   2HB   ALA  18          2HB       ALA  18   3.959   7.863  -1.080
  133   3HB   ALA  18          3HB       ALA  18   4.942   7.821  -2.556
  134    H    ALA  19           H        ALA  19   7.195   6.495  -2.639
  135    HA   ALA  19           HA       ALA  19   6.857   4.762  -4.900
  136   1HB   ALA  19          1HB       ALA  19   8.353   6.721  -4.915
  137   2HB   ALA  19          2HB       ALA  19   9.446   5.913  -3.773
  138   3HB   ALA  19          3HB       ALA  19   9.198   5.233  -5.390
  139    H    LYS  20           H        LYS  20   8.817   4.409  -1.914
  140    HA   LYS  20           HA       LYS  20   9.808   1.831  -2.304
  141   1HB   LYS  20          2HB       LYS  20  10.004   3.594  -0.265
  142   2HB   LYS  20          3HB       LYS  20   8.704   2.623   0.412
  143   1HG   LYS  20          2HG       LYS  20  10.467   1.480   1.291
  144   2HG   LYS  20          3HG       LYS  20  10.367   0.605  -0.245
  145   1HD   LYS  20          2HD       LYS  20  12.030   2.325  -1.186
  146   2HD   LYS  20          3HD       LYS  20  12.165   2.978   0.460
  147   1HE   LYS  20          2HE       LYS  20  12.891   0.668   1.241
  148   2HE   LYS  20          3HE       LYS  20  12.900   0.153  -0.455
  149   1HZ   LYS  20          1HZ       LYS  20  14.565   2.281   0.726
  150   2HZ   LYS  20          2HZ       LYS  20  15.077   0.794   0.252
  151   3HZ   LYS  20          3HZ       LYS  20  14.556   1.878  -0.870
  152    H    PHE  21           H        PHE  21   6.690   2.842  -0.935
  153    HA   PHE  21           HA       PHE  21   5.596   0.317  -0.418
  154   1HB   PHE  21          2HB       PHE  21   4.519   3.080  -0.735
  155   2HB   PHE  21          3HB       PHE  21   3.372   1.801  -1.033
  156    HD1  PHE  21           1HD      PHE  21   4.731   3.830   1.500
  157    HD2  PHE  21           2HD      PHE  21   3.367  -0.189   0.704
  158    HE1  PHE  21           1HE      PHE  21   4.528   3.420   3.921
  159    HE2  PHE  21           2HE      PHE  21   2.972  -0.528   3.119
  160    HZ   PHE  21           HZ       PHE  21   3.572   1.271   4.735
  161    H    GLU  22           H        GLU  22   4.903   2.334  -3.429
  162    HA   GLU  22           HA       GLU  22   3.306   0.253  -4.454
  163   1HB   GLU  22          2HB       GLU  22   3.298   1.272  -6.558
  164   2HB   GLU  22          3HB       GLU  22   3.241   2.503  -5.319
  165   1HG   GLU  22          2HG       GLU  22   4.621   3.497  -6.834
  166   2HG   GLU  22          3HG       GLU  22   5.782   2.781  -5.724
  167    H    ARG  23           H        ARG  23   6.757   0.783  -4.865
  168    HA   ARG  23           HA       ARG  23   7.275  -1.415  -6.595
  169   1HB   ARG  23          2HB       ARG  23   8.729   0.542  -5.946
  170   2HB   ARG  23          3HB       ARG  23   9.135  -0.285  -4.443
  171   1HG   ARG  23          2HG       ARG  23  10.452  -1.878  -5.525
  172   2HG   ARG  23          3HG       ARG  23   9.510  -1.807  -7.031
  173   1HD   ARG  23          2HD       ARG  23  10.348   0.386  -7.570
  174   2HD   ARG  23          3HD       ARG  23  11.246   0.482  -6.030
  175    HE   ARG  23           HE       ARG  23  12.143  -1.829  -7.352
  176   1HH1  ARG  23          2HH2      ARG  23  12.072   1.637  -7.934
  177   2HH1  ARG  23          1HH2      ARG  23  13.567   1.714  -8.815
  178   1HH2  ARG  23          2HH1      ARG  23  14.162  -1.796  -8.519
  179   2HH2  ARG  23          1HH1      ARG  23  14.785  -0.308  -9.157
  180    H    ASN  24           H        ASN  24   7.429  -1.307  -2.969
  181    HA   ASN  24           HA       ASN  24   8.011  -4.074  -2.588
  182   1HB   ASN  24          2HB       ASN  24   6.858  -1.848  -0.925
  183   2HB   ASN  24          3HB       ASN  24   6.307  -3.455  -0.496
  184   1HD2  ASN  24          1HD2      ASN  24   7.434  -2.612   1.554
  185   2HD2  ASN  24          2HD2      ASN  24   9.017  -3.319   1.752
  186    H    VAL  25           H        VAL  25   4.891  -2.406  -3.006
  187    HA   VAL  25           HA       VAL  25   3.296  -4.751  -2.747
  188    HB   VAL  25           HB       VAL  25   2.748  -2.112  -4.172
  189   1HG1  VAL  25          1HG1      VAL  25   0.338  -2.790  -3.846
  190   2HG1  VAL  25          2HG1      VAL  25   1.200  -3.716  -5.087
  191   3HG1  VAL  25          3HG1      VAL  25   0.889  -4.430  -3.486
  192   1HG2  VAL  25          1HG2      VAL  25   1.402  -1.679  -2.103
  193   2HG2  VAL  25          2HG2      VAL  25   1.994  -3.225  -1.450
  194   3HG2  VAL  25          3HG2      VAL  25   3.108  -1.901  -1.708
  195    H    LYS  26           H        LYS  26   4.699  -3.191  -5.696
  196    HA   LYS  26           HA       LYS  26   3.760  -5.047  -7.582
  197   1HB   LYS  26          2HB       LYS  26   6.066  -3.148  -7.303
  198   2HB   LYS  26          3HB       LYS  26   6.117  -4.251  -8.646
  199   1HG   LYS  26          2HG       LYS  26   4.061  -3.443  -9.542
  200   2HG   LYS  26          3HG       LYS  26   3.639  -2.584  -8.036
  201   1HD   LYS  26          2HD       LYS  26   5.369  -0.972  -8.320
  202   2HD   LYS  26          3HD       LYS  26   6.205  -1.954  -9.500
  203   1HE   LYS  26          2HE       LYS  26   5.178  -0.116 -10.675
  204   2HE   LYS  26          3HE       LYS  26   4.295  -1.583 -11.137
  205   1HZ   LYS  26          1HZ       LYS  26   2.804   0.225 -10.615
  206   2HZ   LYS  26          2HZ       LYS  26   2.646  -0.896  -9.412
  207   3HZ   LYS  26          3HZ       LYS  26   3.573   0.465  -9.177
  208    H    GLU  27           H        GLU  27   6.583  -5.356  -5.361
  209    HA   GLU  27           HA       GLU  27   7.575  -7.763  -6.514
  210   1HB   GLU  27          2HB       GLU  27   7.665  -6.817  -3.640
  211   2HB   GLU  27          3HB       GLU  27   8.575  -8.176  -4.280
  212   1HG   GLU  27          2HG       GLU  27   8.901  -5.637  -5.841
  213   2HG   GLU  27          3HG       GLU  27   9.498  -5.596  -4.182
  214    H    ILE  28           H        ILE  28   4.600  -7.272  -4.664
  215    HA   ILE  28           HA       ILE  28   4.395 -10.026  -3.745
  216    HB   ILE  28           HB       ILE  28   2.257  -7.947  -4.143
  217   1HG1  ILE  28          2HG1      ILE  28   3.520  -8.669  -1.471
  218   2HG1  ILE  28          3HG1      ILE  28   4.117  -7.329  -2.458
  219   1HG2  ILE  28          1HG2      ILE  28   2.211 -10.643  -2.823
  220   2HG2  ILE  28          2HG2      ILE  28   1.042  -9.389  -2.370
  221   3HG2  ILE  28          3HG2      ILE  28   1.109  -9.940  -4.028
  222   1HD1  ILE  28          1HD1      ILE  28   1.321  -7.540  -1.297
  223   2HD1  ILE  28          2HD1      ILE  28   2.592  -6.386  -0.879
  224   3HD1  ILE  28          3HD1      ILE  28   1.810  -6.341  -2.476
  225    H    GLU  29           H        GLU  29   3.671 -11.736  -4.939
  226    HA   GLU  29           HA       GLU  29   3.160 -11.468  -7.748
  227   1HB   GLU  29          2HB       GLU  29   3.302 -13.729  -5.698
  228   2HB   GLU  29          3HB       GLU  29   2.699 -14.018  -7.313
  229   1HG   GLU  29          2HG       GLU  29   4.801 -13.163  -8.298
  230   2HG   GLU  29          3HG       GLU  29   5.449 -12.888  -6.671
  231    H    GLY  30           H        GLY  30   1.206 -11.721  -4.977
  232   1HA   GLY  30          1HA       GLY  30  -1.196 -12.745  -6.157
  233   2HA   GLY  30          2HA       GLY  30  -1.071 -11.889  -4.618
  234    H    VAL  31           H        VAL  31   0.126  -9.406  -6.072
  235    HA   VAL  31           HA       VAL  31  -2.492  -8.290  -6.822
  236    HB   VAL  31           HB       VAL  31  -1.014  -7.296  -5.040
  237   1HG1  VAL  31          1HG1      VAL  31   0.666  -6.370  -7.413
  238   2HG1  VAL  31          2HG1      VAL  31   0.843  -5.895  -5.713
  239   3HG1  VAL  31          3HG1      VAL  31   1.164  -7.562  -6.193
  240   1HG2  VAL  31          1HG2      VAL  31  -2.807  -6.085  -6.273
  241   2HG2  VAL  31          2HG2      VAL  31  -1.508  -5.069  -5.603
  242   3HG2  VAL  31          3HG2      VAL  31  -1.543  -5.409  -7.340
  243    H    THR  32           H        THR  32  -2.411  -6.737  -8.708
  244    HA   THR  32           HA       THR  32  -0.479  -7.543 -10.835
  245    HB   THR  32           HB       THR  32  -3.427  -6.908 -11.259
  246    HG1  THR  32           1HG      THR  32  -1.995  -9.321 -10.973
  247   1HG2  THR  32          1HG2      THR  32  -1.995  -6.359 -13.194
  248   2HG2  THR  32          2HG2      THR  32  -1.270  -7.980 -13.131
  249   3HG2  THR  32          3HG2      THR  32  -2.992  -7.787 -13.522
  250    H    GLU  33           H        GLU  33  -2.985  -5.070  -9.954
  251    HA   GLU  33           HA       GLU  33  -0.903  -2.961 -10.552
  252   1HB   GLU  33          2HB       GLU  33  -3.755  -3.128 -11.569
  253   2HB   GLU  33          3HB       GLU  33  -2.860  -1.608 -11.447
  254   1HG   GLU  33          2HG       GLU  33  -1.274  -3.719 -12.798
  255   2HG   GLU  33          3HG       GLU  33  -2.792  -3.352 -13.609
  256    H    ALA  34           H        ALA  34  -0.511  -2.079  -8.621
  257    HA   ALA  34           HA       ALA  34  -2.825  -1.471  -6.842
  258   1HB   ALA  34          1HB       ALA  34   0.153  -1.597  -6.217
  259   2HB   ALA  34          2HB       ALA  34  -1.124  -1.117  -5.079
  260   3HB   ALA  34          3HB       ALA  34  -1.091  -2.771  -5.721
  261    H    ILE  35           H        ILE  35  -3.305   0.699  -6.528
  262    HA   ILE  35           HA       ILE  35  -1.495   2.678  -7.932
  263    HB   ILE  35           HB       ILE  35  -4.498   2.940  -7.652
  264   1HG1  ILE  35          2HG1      ILE  35  -4.010   1.262  -9.355
  265   2HG1  ILE  35          3HG1      ILE  35  -4.623   2.752 -10.061
  266   1HG2  ILE  35          1HG2      ILE  35  -4.133   4.933  -9.099
  267   2HG2  ILE  35          2HG2      ILE  35  -3.416   5.081  -7.490
  268   3HG2  ILE  35          3HG2      ILE  35  -2.380   4.735  -8.883
  269   1HD1  ILE  35          1HD1      ILE  35  -1.700   1.870 -10.054
  270   2HD1  ILE  35          2HD1      ILE  35  -2.819   1.839 -11.419
  271   3HD1  ILE  35          3HD1      ILE  35  -2.313   3.392 -10.742
  272    H    VAL  36           H        VAL  36  -0.237   3.201  -6.224
  273    HA   VAL  36           HA       VAL  36  -1.572   3.665  -3.634
  274    HB   VAL  36           HB       VAL  36   0.234   3.076  -2.609
  275   1HG1  VAL  36          1HG1      VAL  36   1.313   1.169  -3.519
  276   2HG1  VAL  36          2HG1      VAL  36  -0.340   1.195  -4.148
  277   3HG1  VAL  36          3HG1      VAL  36   1.004   1.690  -5.188
  278   1HG2  VAL  36          1HG2      VAL  36   2.593   3.324  -3.341
  279   2HG2  VAL  36          2HG2      VAL  36   2.004   4.152  -4.814
  280   3HG2  VAL  36          3HG2      VAL  36   1.746   4.860  -3.221
  281    H    ASN  37           H        ASN  37  -1.759   5.667  -2.729
  282    HA   ASN  37           HA       ASN  37  -0.303   7.929  -4.086
  283   1HB   ASN  37          2HB       ASN  37  -2.926   7.915  -2.569
  284   2HB   ASN  37          3HB       ASN  37  -2.031   9.361  -3.069
  285   1HD2  ASN  37          1HD2      ASN  37  -3.457   6.323  -4.457
  286   2HD2  ASN  37          2HD2      ASN  37  -3.917   7.096  -5.964
  287    H    PHE  38           H        PHE  38  -1.451   6.679  -0.900
  288    HA   PHE  38           HA       PHE  38  -0.636   7.058   1.212
  289   1HB   PHE  38          2HB       PHE  38   1.922   6.820  -0.399
  290   2HB   PHE  38          3HB       PHE  38   1.998   7.091   1.308
  291    HD1  PHE  38           1HD      PHE  38   0.828   4.691  -1.213
  292    HD2  PHE  38           2HD      PHE  38   1.748   5.378   2.921
  293    HE1  PHE  38           1HE      PHE  38   0.766   2.212  -0.741
  294    HE2  PHE  38           2HE      PHE  38   1.334   2.980   3.408
  295    HZ   PHE  38           HZ       PHE  38   0.798   1.416   1.586
  296    H    GLY  39           H        GLY  39   1.484   8.740   2.239
  297   1HA   GLY  39          1HA       GLY  39   2.064  10.897   2.623
  298   2HA   GLY  39          2HA       GLY  39   1.267  11.399   1.126
  299    H    ALA  40           H        ALA  40  -1.187  11.211   1.222
  300    HA   ALA  40           HA       ALA  40  -2.566  11.461   3.760
  301   1HB   ALA  40          1HB       ALA  40  -1.566  13.720   3.720
  302   2HB   ALA  40          2HB       ALA  40  -2.184  13.984   2.075
  303   3HB   ALA  40          3HB       ALA  40  -3.312  13.813   3.437
  304    H    SER  41           H        SER  41  -3.000   9.613   2.015
  305    HA   SER  41           HA       SER  41  -5.521  10.216   0.669
  306   1HB   SER  41          2HB       SER  41  -2.979   9.696  -0.906
  307   2HB   SER  41          3HB       SER  41  -4.607   9.427  -1.580
  308    HG   SER  41           HG       SER  41  -4.171  11.891  -0.398
  309    H    LYS  42           H        LYS  42  -4.007   7.584  -0.887
  310    HA   LYS  42           HA       LYS  42  -4.853   5.588   1.016
  311   1HB   LYS  42          2HB       LYS  42  -6.823   4.846  -0.311
  312   2HB   LYS  42          3HB       LYS  42  -7.008   6.429   0.425
  313   1HG   LYS  42          2HG       LYS  42  -6.181   7.260  -2.006
  314   2HG   LYS  42          3HG       LYS  42  -6.802   5.682  -2.485
  315   1HD   LYS  42          2HD       LYS  42  -8.279   7.858  -0.933
  316   2HD   LYS  42          3HD       LYS  42  -8.485   7.508  -2.658
  317   1HE   LYS  42          2HE       LYS  42  -9.473   5.340  -2.203
  318   2HE   LYS  42          3HE       LYS  42  -9.052   5.417  -0.485
  319   1HZ   LYS  42          1HZ       LYS  42 -10.628   7.195  -0.240
  320   2HZ   LYS  42          2HZ       LYS  42 -11.088   7.042  -1.828
  321   3HZ   LYS  42          3HZ       LYS  42 -11.266   5.789  -0.767
  322    H    ILE  43           H        ILE  43  -5.152   3.443  -0.216
  323    HA   ILE  43           HA       ILE  43  -3.157   3.155  -2.376
  324    HB   ILE  43           HB       ILE  43  -1.964   2.859  -0.356
  325   1HG1  ILE  43          2HG1      ILE  43  -1.321   1.324  -2.145
  326   2HG1  ILE  43          3HG1      ILE  43  -0.964   0.730  -0.522
  327   1HG2  ILE  43          1HG2      ILE  43  -4.029   0.858   0.575
  328   2HG2  ILE  43          2HG2      ILE  43  -2.443   1.114   1.305
  329   3HG2  ILE  43          3HG2      ILE  43  -3.620   2.430   1.294
  330   1HD1  ILE  43          1HD1      ILE  43  -3.157  -0.282  -2.325
  331   2HD1  ILE  43          2HD1      ILE  43  -1.683  -1.102  -1.825
  332   3HD1  ILE  43          3HD1      ILE  43  -2.943  -0.772  -0.626
  333    H    THR  44           H        THR  44  -4.239   2.339  -4.049
  334    HA   THR  44           HA       THR  44  -6.474   0.439  -3.616
  335    HB   THR  44           HB       THR  44  -5.417   1.699  -6.162
  336    HG1  THR  44           1HG      THR  44  -6.988   2.477  -4.189
  337   1HG2  THR  44          1HG2      THR  44  -7.593   1.003  -7.124
  338   2HG2  THR  44          2HG2      THR  44  -6.594  -0.392  -6.694
  339   3HG2  THR  44          3HG2      THR  44  -7.950   0.085  -5.650
  340    H    VAL  45           H        VAL  45  -6.364  -1.625  -4.228
  341    HA   VAL  45           HA       VAL  45  -3.831  -2.803  -5.276
  342    HB   VAL  45           HB       VAL  45  -5.854  -3.765  -3.243
  343   1HG1  VAL  45          1HG1      VAL  45  -4.515  -5.811  -2.999
  344   2HG1  VAL  45          2HG1      VAL  45  -5.080  -5.681  -4.670
  345   3HG1  VAL  45          3HG1      VAL  45  -3.400  -5.256  -4.249
  346   1HG2  VAL  45          1HG2      VAL  45  -3.846  -3.921  -1.712
  347   2HG2  VAL  45          2HG2      VAL  45  -2.909  -3.069  -2.959
  348   3HG2  VAL  45          3HG2      VAL  45  -4.304  -2.281  -2.174
  349    H    THR  46           H        THR  46  -4.301  -3.730  -7.325
  350    HA   THR  46           HA       THR  46  -6.885  -5.124  -7.501
  351    HB   THR  46           HB       THR  46  -5.697  -3.323  -9.681
  352    HG1  THR  46           1HG      THR  46  -7.254  -3.103  -7.743
  353   1HG2  THR  46          1HG2      THR  46  -7.615  -4.091 -11.075
  354   2HG2  THR  46          2HG2      THR  46  -6.420  -5.364 -10.819
  355   3HG2  THR  46          3HG2      THR  46  -7.939  -5.390  -9.904
  356    H    GLY  47           H        GLY  47  -6.676  -7.066  -8.293
  357   1HA   GLY  47          1HA       GLY  47  -5.093  -8.182 -10.100
  358   2HA   GLY  47          2HA       GLY  47  -4.000  -8.161  -8.712
  359    H    GLU  48           H        GLU  48  -4.280  -9.616  -7.069
  360    HA   GLU  48           HA       GLU  48  -6.888 -10.678  -6.379
  361   1HB   GLU  48          2HB       GLU  48  -5.575 -12.029  -8.396
  362   2HB   GLU  48          3HB       GLU  48  -4.899 -12.854  -7.002
  363   1HG   GLU  48          2HG       GLU  48  -7.248 -13.244  -6.209
  364   2HG   GLU  48          3HG       GLU  48  -7.856 -12.447  -7.676
  365    H    ALA  49           H        ALA  49  -5.342  -9.031  -4.860
  366    HA   ALA  49           HA       ALA  49  -4.696 -10.765  -2.565
  367   1HB   ALA  49          1HB       ALA  49  -2.554  -9.580  -2.140
  368   2HB   ALA  49          2HB       ALA  49  -2.527 -10.461  -3.668
  369   3HB   ALA  49          3HB       ALA  49  -2.743  -8.697  -3.671
  370    H    SER  50           H        SER  50  -4.081  -9.212  -0.660
  371    HA   SER  50           HA       SER  50  -6.072  -7.000  -0.525
  372   1HB   SER  50          2HB       SER  50  -5.448  -9.256   1.439
  373   2HB   SER  50          3HB       SER  50  -6.380  -7.823   1.876
  374    HG   SER  50           HG       SER  50  -7.690  -9.635   1.165
  375    H    ILE  51           H        ILE  51  -5.628  -5.502   1.315
  376    HA   ILE  51           HA       ILE  51  -3.083  -4.452   1.301
  377    HB   ILE  51           HB       ILE  51  -5.126  -3.339   2.232
  378   1HG1  ILE  51          2HG1      ILE  51  -2.803  -2.407   2.266
  379   2HG1  ILE  51          3HG1      ILE  51  -4.058  -1.692   3.260
  380   1HG2  ILE  51          1HG2      ILE  51  -5.739  -5.038   3.964
  381   2HG2  ILE  51          2HG2      ILE  51  -4.269  -4.606   4.872
  382   3HG2  ILE  51          3HG2      ILE  51  -5.542  -3.403   4.633
  383   1HD1  ILE  51          1HD1      ILE  51  -3.178  -2.603   5.296
  384   2HD1  ILE  51          2HD1      ILE  51  -2.085  -3.663   4.421
  385   3HD1  ILE  51          3HD1      ILE  51  -1.789  -1.954   4.414
  386    H    GLN  52           H        GLN  52  -4.196  -7.017   3.503
  387    HA   GLN  52           HA       GLN  52  -2.493  -7.187   5.520
  388   1HB   GLN  52          2HB       GLN  52  -3.157  -9.382   3.513
  389   2HB   GLN  52          3HB       GLN  52  -2.353  -9.718   5.044
  390   1HG   GLN  52          2HG       GLN  52  -5.072  -8.336   4.857
  391   2HG   GLN  52          3HG       GLN  52  -4.847 -10.082   5.026
  392   1HE2  GLN  52          1HE2      GLN  52  -6.341  -8.973   6.977
  393   2HE2  GLN  52          2HE2      GLN  52  -5.391  -8.829   8.446
  394    H    GLN  53           H        GLN  53  -1.454  -8.184   2.258
  395    HA   GLN  53           HA       GLN  53   1.264  -8.807   3.072
  396   1HB   GLN  53          2HB       GLN  53   0.084  -8.317   0.337
  397   2HB   GLN  53          3HB       GLN  53   1.744  -8.868   0.692
  398   1HG   GLN  53          2HG       GLN  53   0.458 -10.688   2.181
  399   2HG   GLN  53          3HG       GLN  53  -0.910 -10.259   1.143
  400   1HE2  GLN  53          1HE2      GLN  53  -0.904 -12.421   0.360
  401   2HE2  GLN  53          2HE2      GLN  53   0.319 -12.976  -0.781
  402    H    VAL  54           H        VAL  54  -0.291  -5.948   1.671
  403    HA   VAL  54           HA       VAL  54   2.050  -4.325   1.316
  404    HB   VAL  54           HB       VAL  54  -0.805  -3.362   1.764
  405   1HG1  VAL  54          1HG1      VAL  54   0.719  -1.567   1.907
  406   2HG1  VAL  54          2HG1      VAL  54   1.636  -2.112   0.501
  407   3HG1  VAL  54          3HG1      VAL  54  -0.018  -1.489   0.305
  408   1HG2  VAL  54          1HG2      VAL  54  -0.893  -3.364  -0.796
  409   2HG2  VAL  54          2HG2      VAL  54   0.454  -4.524  -0.733
  410   3HG2  VAL  54          3HG2      VAL  54  -1.089  -4.920   0.013
  411    H    GLU  55           H        GLU  55  -0.243  -4.970   3.996
  412    HA   GLU  55           HA       GLU  55   0.648  -2.976   5.767
  413   1HB   GLU  55          2HB       GLU  55  -1.328  -4.799   6.040
  414   2HB   GLU  55          3HB       GLU  55  -0.086  -5.643   6.947
  415   1HG   GLU  55          2HG       GLU  55   0.312  -3.465   8.222
  416   2HG   GLU  55          3HG       GLU  55  -1.138  -2.832   7.424
  417    H    GLN  56           H        GLN  56   1.519  -6.444   5.461
  418    HA   GLN  56           HA       GLN  56   3.583  -6.626   7.266
  419   1HB   GLN  56          2HB       GLN  56   2.353  -8.425   5.851
  420   2HB   GLN  56          3HB       GLN  56   3.537  -8.073   4.586
  421   1HG   GLN  56          2HG       GLN  56   4.324  -9.946   5.765
  422   2HG   GLN  56          3HG       GLN  56   5.352  -8.597   6.276
  423   1HE2  GLN  56          1HE2      GLN  56   5.437  -8.150   8.531
  424   2HE2  GLN  56          2HE2      GLN  56   4.412  -8.974   9.695
  425    H    ALA  57           H        ALA  57   3.818  -5.708   3.784
  426    HA   ALA  57           HA       ALA  57   6.580  -5.126   3.694
  427   1HB   ALA  57          1HB       ALA  57   5.906  -3.726   1.757
  428   2HB   ALA  57          2HB       ALA  57   5.112  -5.302   1.729
  429   3HB   ALA  57          3HB       ALA  57   4.223  -3.852   2.226
  430    H    GLY  58           H        GLY  58   3.798  -2.941   4.440
  431   1HA   GLY  58          1HA       GLY  58   5.251  -0.561   4.751
  432   2HA   GLY  58          2HA       GLY  58   3.617  -0.934   5.374
  433    H    ALA  59           H        ALA  59   4.845  -3.255   6.938
  434    HA   ALA  59           HA       ALA  59   5.463  -2.271   9.421
  435   1HB   ALA  59          1HB       ALA  59   5.274  -4.685   8.791
  436   2HB   ALA  59          2HB       ALA  59   6.930  -4.589   8.130
  437   3HB   ALA  59          3HB       ALA  59   6.646  -4.316   9.856
  438    H    PHE  60           H        PHE  60   7.595  -2.017   6.545
  439    HA   PHE  60           HA       PHE  60   9.993  -1.444   7.881
  440   1HB   PHE  60          2HB       PHE  60  10.693  -0.170   5.979
  441   2HB   PHE  60          3HB       PHE  60   9.946  -1.688   5.518
  442    HD1  PHE  60           1HD      PHE  60   9.181   1.994   5.859
  443    HD2  PHE  60           2HD      PHE  60   8.560  -1.628   3.624
  444    HE1  PHE  60           1HE      PHE  60   7.754   3.232   4.268
  445    HE2  PHE  60           2HE      PHE  60   7.273  -0.345   1.926
  446    HZ   PHE  60           HZ       PHE  60   6.895   2.079   2.225
  447    H    GLU  61           H        GLU  61   7.198   0.729   7.448
  448    HA   GLU  61           HA       GLU  61   8.512   2.715   9.296
  449   1HB   GLU  61          2HB       GLU  61   6.756   3.044   6.889
  450   2HB   GLU  61          3HB       GLU  61   6.430   4.083   8.282
  451   1HG   GLU  61          2HG       GLU  61   8.768   4.854   8.299
  452   2HG   GLU  61          3HG       GLU  61   9.056   3.989   6.785
  453    H    HIS  62           H        HIS  62   6.007   0.382   9.007
  454    HA   HIS  62           HA       HIS  62   4.558  -0.414  10.560
  455   1HB   HIS  62          2HB       HIS  62   4.989   1.897  12.458
  456   2HB   HIS  62          3HB       HIS  62   4.455   0.259  12.796
  457    HD1  HIS  62           1HD      HIS  62   7.156  -1.052  11.227
  458    HD2  HIS  62           2HD      HIS  62   6.971   1.984  14.136
  459    HE1  HIS  62           1HE      HIS  62   9.414  -1.005  12.366
  460    H    LEU  63           H        LEU  63   3.640   0.872   8.358
  461    HA   LEU  63           HA       LEU  63   1.986   3.147   9.002
  462   1HB   LEU  63          2HB       LEU  63   2.236   1.237   6.667
  463   2HB   LEU  63          3HB       LEU  63   0.805   2.250   6.761
  464    HG   LEU  63           HG       LEU  63   2.450   3.314   5.397
  465   1HD1  LEU  63          1HD1      LEU  63   2.431   5.025   7.883
  466   2HD1  LEU  63          2HD1      LEU  63   2.165   5.442   6.185
  467   3HD1  LEU  63          3HD1      LEU  63   0.910   4.589   7.085
  468   1HD2  LEU  63          1HD2      LEU  63   4.521   2.398   6.463
  469   2HD2  LEU  63          2HD2      LEU  63   4.568   4.155   6.216
  470   3HD2  LEU  63          3HD2      LEU  63   4.259   3.498   7.832
  471    H    LYS  64           H        LYS  64  -0.439   3.269   8.843
  472    HA   LYS  64           HA       LYS  64  -1.753   0.769   9.743
  473   1HB   LYS  64          2HB       LYS  64  -3.164   2.190  11.210
  474   2HB   LYS  64          3HB       LYS  64  -1.488   1.961  11.698
  475   1HG   LYS  64          2HG       LYS  64  -1.800   4.097  12.278
  476   2HG   LYS  64          3HG       LYS  64  -1.015   4.323  10.727
  477   1HD   LYS  64          2HD       LYS  64  -2.874   5.123   9.737
  478   2HD   LYS  64          3HD       LYS  64  -3.996   4.150  10.651
  479   1HE   LYS  64          2HE       LYS  64  -3.563   5.543  12.712
  480   2HE   LYS  64          3HE       LYS  64  -2.513   6.612  11.768
  481   1HZ   LYS  64          1HZ       LYS  64  -4.794   7.394  12.198
  482   2HZ   LYS  64          2HZ       LYS  64  -4.368   7.504  10.683
  483   3HZ   LYS  64          3HZ       LYS  64  -5.382   6.269  11.150
  484    H    ILE  65           H        ILE  65  -3.016   0.184   8.096
  485    HA   ILE  65           HA       ILE  65  -4.249   2.314   6.448
  486    HB   ILE  65           HB       ILE  65  -3.716  -0.406   5.334
  487   1HG1  ILE  65          2HG1      ILE  65  -1.641   1.740   5.710
  488   2HG1  ILE  65          3HG1      ILE  65  -1.542  -0.028   5.882
  489   1HG2  ILE  65          1HG2      ILE  65  -3.833   2.296   3.982
  490   2HG2  ILE  65          2HG2      ILE  65  -3.929   0.697   3.237
  491   3HG2  ILE  65          3HG2      ILE  65  -5.241   1.283   4.268
  492   1HD1  ILE  65          1HD1      ILE  65  -1.472   1.608   3.330
  493   2HD1  ILE  65          2HD1      ILE  65  -0.245   0.529   3.990
  494   3HD1  ILE  65          3HD1      ILE  65  -1.741  -0.132   3.309
  495    H    ILE  66           H        ILE  66  -6.421   2.245   6.254
  496    HA   ILE  66           HA       ILE  66  -7.845   0.160   7.799
  497    HB   ILE  66           HB       ILE  66  -8.591   3.014   7.100
  498   1HG1  ILE  66          2HG1      ILE  66  -6.783   3.020   8.719
  499   2HG1  ILE  66          3HG1      ILE  66  -8.294   3.523   9.464
  500   1HG2  ILE  66          1HG2      ILE  66 -10.615   1.716   7.290
  501   2HG2  ILE  66          2HG2      ILE  66 -10.059   0.951   8.788
  502   3HG2  ILE  66          3HG2      ILE  66 -10.435   2.686   8.754
  503   1HD1  ILE  66          1HD1      ILE  66  -6.971   0.789   9.778
  504   2HD1  ILE  66          2HD1      ILE  66  -7.060   2.084  10.977
  505   3HD1  ILE  66          3HD1      ILE  66  -8.539   1.249  10.485
  506    HA   PRO  67           HA       PRO  67  -9.710  -0.799   3.719
  507   1HB   PRO  67          2HB       PRO  67 -11.426  -2.770   4.532
  508   2HB   PRO  67          3HB       PRO  67  -9.677  -3.061   4.396
  509   1HG   PRO  67          2HG       PRO  67 -11.239  -2.433   6.893
  510   2HG   PRO  67          3HG       PRO  67  -9.989  -3.685   6.656
  511   1HD   PRO  67          2HD       PRO  67  -9.489  -1.261   7.794
  512   2HD   PRO  67          3HD       PRO  67  -8.251  -2.095   6.807
  513    H    GLU  68           H        GLU  68 -10.794   1.219   3.411
  514    HA   GLU  68           HA       GLU  68 -13.043   1.948   4.980
  515   1HB   GLU  68          2HB       GLU  68 -13.626   3.478   3.172
  516   2HB   GLU  68          3HB       GLU  68 -11.970   3.650   3.762
  517   1HG   GLU  68          2HG       GLU  68 -11.107   2.503   1.751
  518   2HG   GLU  68          3HG       GLU  68 -12.759   2.224   1.183
  519    H    LYS  69           H        LYS  69 -15.324   1.771   4.499
  520    HA   LYS  69           HA       LYS  69 -16.332  -0.165   2.639
  521   1HB   LYS  69          2HB       LYS  69 -15.125  -1.286   4.860
  522   2HB   LYS  69          3HB       LYS  69 -16.703  -0.926   5.533
  523   1HG   LYS  69          2HG       LYS  69 -17.401  -2.875   4.709
  524   2HG   LYS  69          3HG       LYS  69 -17.293  -2.207   3.082
  525   1HD   LYS  69          2HD       LYS  69 -14.927  -3.507   4.477
  526   2HD   LYS  69          3HD       LYS  69 -16.105  -4.428   3.552
  527   1HE   LYS  69          2HE       LYS  69 -15.108  -2.046   2.079
  528   2HE   LYS  69          3HE       LYS  69 -13.810  -3.153   2.517
  529   1HZ   LYS  69          1HZ       LYS  69 -16.268  -3.891   1.065
  530   2HZ   LYS  69          2HZ       LYS  69 -14.795  -3.632   0.378
  531   3HZ   LYS  69          3HZ       LYS  69 -15.009  -4.900   1.403
  532    H    GLU  70           H        GLU  70 -18.867  -0.505   3.551
  533    HA   GLU  70           HA       GLU  70 -19.938   1.977   4.661
  534   1HB   GLU  70          2HB       GLU  70 -19.677   1.549   1.685
  535   2HB   GLU  70          3HB       GLU  70 -21.253   2.089   2.259
  536   1HG   GLU  70          2HG       GLU  70 -18.670   3.557   2.915
  537   2HG   GLU  70          3HG       GLU  70 -19.736   3.939   1.557
  538    H    ALA  71           H        ALA  71 -20.866  -0.375   2.219
  539    HA   ALA  71           HA       ALA  71 -22.683  -1.873   4.016
  540   1HB   ALA  71          1HB       ALA  71 -23.163  -1.854   1.544
  541   2HB   ALA  71          2HB       ALA  71 -21.541  -2.534   1.260
  542   3HB   ALA  71          3HB       ALA  71 -22.752  -3.472   2.158
  Start of MODEL    8
    1   1H    MET   1           H1       MET   1 -17.335  -9.577  -9.074
    2   2H    MET   1           H2       MET   1 -18.169 -10.707  -9.954
    3   3H    MET   1           H3       MET   1 -16.635 -11.031  -9.387
    4    HA   MET   1           HA       MET   1 -16.477 -10.636 -11.656
    5   1HB   MET   1          2HB       MET   1 -17.886  -7.983 -11.094
    6   2HB   MET   1          3HB       MET   1 -17.074  -8.430 -12.606
    7   1HG   MET   1          2HG       MET   1 -19.393  -8.845 -12.919
    8   2HG   MET   1          3HG       MET   1 -18.607 -10.418 -12.768
    9   1HE   MET   1          1HE       MET   1 -22.036 -11.252 -11.191
   10   2HE   MET   1          2HE       MET   1 -21.658 -10.320 -12.657
   11   3HE   MET   1          3HE       MET   1 -20.740 -11.799 -12.282
   12    H    ALA   2           H        ALA   2 -16.084  -7.311 -10.495
   13    HA   ALA   2           HA       ALA   2 -13.361  -7.348 -11.125
   14   1HB   ALA   2          1HB       ALA   2 -13.334  -5.090 -10.179
   15   2HB   ALA   2          2HB       ALA   2 -14.812  -5.342 -11.126
   16   3HB   ALA   2          3HB       ALA   2 -14.877  -5.392  -9.347
   17    H    GLU   3           H        GLU   3 -11.564  -6.834  -9.820
   18    HA   GLU   3           HA       GLU   3 -11.387  -8.164  -7.167
   19   1HB   GLU   3          2HB       GLU   3  -9.447  -9.351  -8.098
   20   2HB   GLU   3          3HB       GLU   3 -10.933  -9.752  -8.958
   21   1HG   GLU   3          2HG       GLU   3  -8.767  -7.856  -9.983
   22   2HG   GLU   3          3HG       GLU   3  -8.993  -9.535 -10.447
   23    H    LYS   4           H        LYS   4 -11.570  -5.506  -7.244
   24    HA   LYS   4           HA       LYS   4  -8.813  -4.541  -6.714
   25   1HB   LYS   4          2HB       LYS   4  -9.471  -2.308  -7.515
   26   2HB   LYS   4          3HB       LYS   4  -9.446  -3.521  -8.803
   27   1HG   LYS   4          2HG       LYS   4 -11.862  -3.698  -8.789
   28   2HG   LYS   4          3HG       LYS   4 -11.976  -2.563  -7.418
   29   1HD   LYS   4          2HD       LYS   4 -10.961  -0.769  -8.797
   30   2HD   LYS   4          3HD       LYS   4 -10.656  -1.916 -10.100
   31   1HE   LYS   4          2HE       LYS   4 -12.573  -0.545 -10.673
   32   2HE   LYS   4          3HE       LYS   4 -13.057  -2.235 -10.489
   33   1HZ   LYS   4          1HZ       LYS   4 -13.901  -1.687  -8.306
   34   2HZ   LYS   4          2HZ       LYS   4 -13.427  -0.116  -8.468
   35   3HZ   LYS   4          3HZ       LYS   4 -14.599  -0.729  -9.445
   36    H    THR   5           H        THR   5  -8.589  -3.117  -4.960
   37    HA   THR   5           HA       THR   5 -10.990  -2.330  -3.458
   38    HB   THR   5           HB       THR   5  -8.790  -4.070  -2.202
   39    HG1  THR   5           1HG      THR   5 -11.189  -4.396  -3.349
   40   1HG2  THR   5          1HG2      THR   5  -9.656  -2.411  -0.534
   41   2HG2  THR   5          2HG2      THR   5 -11.322  -2.838  -0.983
   42   3HG2  THR   5          3HG2      THR   5 -10.280  -4.031  -0.194
   43    H    VAL   6           H        VAL   6 -10.561  -0.518  -2.145
   44    HA   VAL   6           HA       VAL   6  -7.797   0.172  -1.998
   45    HB   VAL   6           HB       VAL   6  -8.526   1.519  -3.770
   46   1HG1  VAL   6          1HG1      VAL   6 -10.884   1.322  -3.706
   47   2HG1  VAL   6          2HG1      VAL   6 -10.984   2.382  -2.270
   48   3HG1  VAL   6          3HG1      VAL   6 -10.407   3.012  -3.841
   49   1HG2  VAL   6          1HG2      VAL   6  -7.241   2.831  -2.039
   50   2HG2  VAL   6          2HG2      VAL   6  -8.323   3.858  -2.998
   51   3HG2  VAL   6          3HG2      VAL   6  -8.780   3.382  -1.356
   52    H    TYR   7           H        TYR   7  -7.063   1.193  -0.247
   53    HA   TYR   7           HA       TYR   7  -8.860   1.092   2.138
   54   1HB   TYR   7          2HB       TYR   7  -5.911   0.386   1.984
   55   2HB   TYR   7          3HB       TYR   7  -7.026   0.131   3.321
   56    HD1  TYR   7           HD1      TYR   7  -6.315  -0.971  -0.217
   57    HD2  TYR   7           HD2      TYR   7  -7.739  -2.060   3.689
   58    HE1  TYR   7           HE1      TYR   7  -6.592  -3.292  -0.971
   59    HE2  TYR   7           HE2      TYR   7  -8.048  -4.391   2.920
   60    HH   TYR   7           HH       TYR   7  -7.350  -5.432  -0.387
   61    H    ARG   8           H        ARG   8  -8.247   2.699   3.779
   62    HA   ARG   8           HA       ARG   8  -6.892   5.096   2.594
   63   1HB   ARG   8          2HB       ARG   8  -8.528   4.612   5.130
   64   2HB   ARG   8          3HB       ARG   8  -7.374   5.930   5.042
   65   1HG   ARG   8          2HG       ARG   8  -9.296   6.962   4.524
   66   2HG   ARG   8          3HG       ARG   8  -8.500   6.785   2.961
   67   1HD   ARG   8          2HD       ARG   8 -10.558   4.784   3.991
   68   2HD   ARG   8          3HD       ARG   8 -11.107   6.295   3.310
   69    HE   ARG   8           HE       ARG   8 -10.118   4.000   1.846
   70   1HH1  ARG   8          2HH2      ARG   8 -10.037   7.473   1.643
   71   2HH1  ARG   8          1HH2      ARG   8 -10.650   7.586   0.016
   72   1HH2  ARG   8          2HH1      ARG   8 -11.491   4.200  -0.167
   73   2HH2  ARG   8          1HH1      ARG   8 -11.138   5.561  -1.138
   74    H    VAL   9           H        VAL   9  -4.993   5.983   3.620
   75    HA   VAL   9           HA       VAL   9  -3.806   4.485   5.835
   76    HB   VAL   9           HB       VAL   9  -2.678   3.328   4.084
   77   1HG1  VAL   9          1HG1      VAL   9  -2.052   6.015   2.783
   78   2HG1  VAL   9          2HG1      VAL   9  -1.407   4.440   2.277
   79   3HG1  VAL   9          3HG1      VAL   9  -3.135   4.760   2.146
   80   1HG2  VAL   9          1HG2      VAL   9  -0.750   5.514   4.887
   81   2HG2  VAL   9          2HG2      VAL   9  -1.332   4.247   6.008
   82   3HG2  VAL   9          3HG2      VAL   9  -0.437   3.804   4.568
   83    H    ASP  10           H        ASP  10  -2.419   5.730   7.091
   84    HA   ASP  10           HA       ASP  10  -1.955   8.546   6.382
   85   1HB   ASP  10          2HB       ASP  10  -3.826   7.547   8.524
   86   2HB   ASP  10          3HB       ASP  10  -2.643   8.736   9.059
   87    H    GLY  11           H        GLY  11  -0.423   9.460   7.976
   88   1HA   GLY  11          1HA       GLY  11   0.999   9.026   9.909
   89   2HA   GLY  11          2HA       GLY  11   1.367   7.419   9.280
   90    H    LEU  12           H        LEU  12   2.384   7.417   7.000
   91    HA   LEU  12           HA       LEU  12   4.764   9.031   7.217
   92   1HB   LEU  12          2HB       LEU  12   5.665   7.824   5.472
   93   2HB   LEU  12          3HB       LEU  12   4.664   6.689   6.344
   94    HG   LEU  12           HG       LEU  12   2.864   7.125   4.482
   95   1HD1  LEU  12          1HD1      LEU  12   5.343   8.501   3.353
   96   2HD1  LEU  12          2HD1      LEU  12   4.257   7.668   2.247
   97   3HD1  LEU  12          3HD1      LEU  12   3.644   8.999   3.203
   98   1HD2  LEU  12          1HD2      LEU  12   3.866   5.049   4.549
   99   2HD2  LEU  12          2HD2      LEU  12   4.259   5.567   2.919
  100   3HD2  LEU  12          3HD2      LEU  12   5.485   5.661   4.212
  101    H    SER  13           H        SER  13   5.575  10.514   5.546
  102    HA   SER  13           HA       SER  13   3.542  11.842   3.832
  103   1HB   SER  13          2HB       SER  13   4.346  14.052   4.936
  104   2HB   SER  13          3HB       SER  13   3.120  13.066   5.749
  105    HG   SER  13           HG       SER  13   4.667  12.255   7.121
  106    H    CYS  14           H        CYS  14   5.235  10.431   2.500
  107    HA   CYS  14           HA       CYS  14   7.026  12.408   1.341
  108   1HB   CYS  14          2HB       CYS  14   8.329  11.411   3.336
  109   2HB   CYS  14          3HB       CYS  14   8.331   9.882   2.431
  110    HG   CYS  14           HG       CYS  14   9.365  12.883   1.572
  111    H    THR  15           H        THR  15   6.884  12.147  -0.847
  112    HA   THR  15           HA       THR  15   5.644  10.161  -2.192
  113    HB   THR  15           HB       THR  15   8.071  11.649  -3.273
  114    HG1  THR  15           1HG      THR  15   6.539  13.390  -3.507
  115   1HG2  THR  15          1HG2      THR  15   5.341  10.966  -4.473
  116   2HG2  THR  15          2HG2      THR  15   6.654  11.838  -5.294
  117   3HG2  THR  15          3HG2      THR  15   6.868  10.138  -4.844
  118    H    ASN  16           H        ASN  16   9.187  10.283  -1.482
  119    HA   ASN  16           HA       ASN  16   9.924   8.023  -2.888
  120   1HB   ASN  16          2HB       ASN  16  11.073   9.182  -0.322
  121   2HB   ASN  16          3HB       ASN  16  11.809   7.841  -1.213
  122   1HD2  ASN  16          1HD2      ASN  16  13.728   8.965  -1.799
  123   2HD2  ASN  16          2HD2      ASN  16  13.677  10.281  -2.959
  124    H    CYS  17           H        CYS  17   8.325   8.221   0.284
  125    HA   CYS  17           HA       CYS  17   8.795   5.402   0.952
  126   1HB   CYS  17          2HB       CYS  17   7.082   7.597   2.138
  127   2HB   CYS  17          3HB       CYS  17   6.890   5.893   2.572
  128    HG   CYS  17           HG       CYS  17   9.744   7.510   2.539
  129    H    ALA  18           H        ALA  18   6.188   7.387  -0.526
  130    HA   ALA  18           HA       ALA  18   4.315   5.264  -0.882
  131   1HB   ALA  18          1HB       ALA  18   4.784   7.586  -2.802
  132   2HB   ALA  18          2HB       ALA  18   3.322   6.622  -2.610
  133   3HB   ALA  18          3HB       ALA  18   3.844   7.702  -1.303
  134    H    ALA  19           H        ALA  19   7.009   6.389  -2.928
  135    HA   ALA  19           HA       ALA  19   6.732   4.569  -5.067
  136   1HB   ALA  19          1HB       ALA  19   9.307   5.777  -4.009
  137   2HB   ALA  19          2HB       ALA  19   9.038   5.063  -5.608
  138   3HB   ALA  19          3HB       ALA  19   8.171   6.539  -5.142
  139    H    LYS  20           H        LYS  20   8.810   4.324  -2.160
  140    HA   LYS  20           HA       LYS  20   9.854   1.732  -2.481
  141   1HB   LYS  20          2HB       LYS  20  10.410   3.489  -0.708
  142   2HB   LYS  20          3HB       LYS  20   8.901   3.084   0.092
  143   1HG   LYS  20          2HG       LYS  20  10.529   2.004   1.290
  144   2HG   LYS  20          3HG       LYS  20   9.753   0.710   0.381
  145   1HD   LYS  20          2HD       LYS  20  11.559   0.537  -1.173
  146   2HD   LYS  20          3HD       LYS  20  12.253   2.092  -0.710
  147   1HE   LYS  20          2HE       LYS  20  12.148  -0.389   1.078
  148   2HE   LYS  20          3HE       LYS  20  13.551   0.136   0.137
  149   1HZ   LYS  20          1HZ       LYS  20  12.308   1.645   2.342
  150   2HZ   LYS  20          2HZ       LYS  20  13.753   0.871   2.374
  151   3HZ   LYS  20          3HZ       LYS  20  13.553   2.190   1.415
  152    H    PHE  21           H        PHE  21   6.827   2.726  -0.813
  153    HA   PHE  21           HA       PHE  21   5.852   0.184  -0.196
  154   1HB   PHE  21          2HB       PHE  21   4.691   2.909  -0.471
  155   2HB   PHE  21          3HB       PHE  21   3.567   1.628  -0.795
  156    HD1  PHE  21           1HD      PHE  21   3.395  -0.354   0.854
  157    HD2  PHE  21           2HD      PHE  21   5.095   3.496   1.806
  158    HE1  PHE  21           1HE      PHE  21   2.758  -0.649   3.230
  159    HE2  PHE  21           2HE      PHE  21   4.766   3.021   4.214
  160    HZ   PHE  21           HZ       PHE  21   3.365   1.094   4.901
  161    H    GLU  22           H        GLU  22   4.945   2.086  -3.207
  162    HA   GLU  22           HA       GLU  22   3.327  -0.024  -4.113
  163   1HB   GLU  22          2HB       GLU  22   3.500   0.885  -6.385
  164   2HB   GLU  22          3HB       GLU  22   3.025   2.060  -5.170
  165   1HG   GLU  22          2HG       GLU  22   5.247   3.024  -5.171
  166   2HG   GLU  22          3HG       GLU  22   5.806   1.831  -6.362
  167    H    ARG  23           H        ARG  23   6.813   0.576  -4.734
  168    HA   ARG  23           HA       ARG  23   7.331  -1.684  -6.424
  169   1HB   ARG  23          2HB       ARG  23   8.905  -0.004  -4.465
  170   2HB   ARG  23          3HB       ARG  23   9.544  -1.611  -4.738
  171   1HG   ARG  23          2HG       ARG  23   9.515  -1.178  -7.213
  172   2HG   ARG  23          3HG       ARG  23   9.023   0.501  -6.861
  173   1HD   ARG  23          2HD       ARG  23  11.061   0.748  -5.432
  174   2HD   ARG  23          3HD       ARG  23  11.533  -0.923  -5.848
  175    HE   ARG  23           HE       ARG  23  11.147   0.502  -8.260
  176   1HH1  ARG  23          2HH2      ARG  23  13.347   0.392  -5.523
  177   2HH1  ARG  23          1HH2      ARG  23  14.712   1.078  -6.353
  178   1HH2  ARG  23          2HH1      ARG  23  12.940   1.412  -9.433
  179   2HH2  ARG  23          1HH1      ARG  23  14.465   1.659  -8.649
  180    H    ASN  24           H        ASN  24   7.445  -1.538  -2.816
  181    HA   ASN  24           HA       ASN  24   7.996  -4.249  -2.408
  182   1HB   ASN  24          2HB       ASN  24   7.390  -2.042  -0.777
  183   2HB   ASN  24          3HB       ASN  24   6.057  -3.140  -0.441
  184   1HD2  ASN  24          1HD2      ASN  24   8.219  -2.257   1.339
  185   2HD2  ASN  24          2HD2      ASN  24   9.063  -3.724   1.818
  186    H    VAL  25           H        VAL  25   4.858  -2.640  -2.870
  187    HA   VAL  25           HA       VAL  25   3.244  -5.003  -2.671
  188    HB   VAL  25           HB       VAL  25   2.742  -2.336  -4.077
  189   1HG1  VAL  25          1HG1      VAL  25   0.327  -2.941  -3.837
  190   2HG1  VAL  25          2HG1      VAL  25   1.203  -3.877  -5.049
  191   3HG1  VAL  25          3HG1      VAL  25   0.812  -4.600  -3.465
  192   1HG2  VAL  25          1HG2      VAL  25   3.037  -1.996  -1.699
  193   2HG2  VAL  25          2HG2      VAL  25   1.303  -1.991  -1.999
  194   3HG2  VAL  25          3HG2      VAL  25   2.110  -3.435  -1.331
  195    H    LYS  26           H        LYS  26   4.703  -3.411  -5.550
  196    HA   LYS  26           HA       LYS  26   3.675  -5.195  -7.478
  197   1HB   LYS  26          2HB       LYS  26   5.979  -3.263  -7.235
  198   2HB   LYS  26          3HB       LYS  26   5.804  -4.176  -8.704
  199   1HG   LYS  26          2HG       LYS  26   3.674  -3.261  -9.167
  200   2HG   LYS  26          3HG       LYS  26   3.446  -2.652  -7.516
  201   1HD   LYS  26          2HD       LYS  26   5.229  -1.028  -7.772
  202   2HD   LYS  26          3HD       LYS  26   5.642  -1.650  -9.351
  203   1HE   LYS  26          2HE       LYS  26   2.941  -0.382  -8.572
  204   2HE   LYS  26          3HE       LYS  26   4.284   0.521  -9.279
  205   1HZ   LYS  26          1HZ       LYS  26   2.903  -1.696 -10.633
  206   2HZ   LYS  26          2HZ       LYS  26   2.667  -0.092 -10.907
  207   3HZ   LYS  26          3HZ       LYS  26   4.122  -0.771 -11.247
  208    H    GLU  27           H        GLU  27   6.460  -5.560  -5.265
  209    HA   GLU  27           HA       GLU  27   7.460  -7.931  -6.562
  210   1HB   GLU  27          2HB       GLU  27   7.734  -6.956  -3.695
  211   2HB   GLU  27          3HB       GLU  27   8.567  -8.360  -4.367
  212   1HG   GLU  27          2HG       GLU  27   9.674  -6.982  -6.057
  213   2HG   GLU  27          3HG       GLU  27   8.816  -5.538  -5.501
  214    H    ILE  28           H        ILE  28   4.561  -7.474  -4.621
  215    HA   ILE  28           HA       ILE  28   4.351 -10.251  -3.768
  216    HB   ILE  28           HB       ILE  28   2.175  -8.198  -4.169
  217   1HG1  ILE  28          2HG1      ILE  28   3.357  -8.813  -1.453
  218   2HG1  ILE  28          3HG1      ILE  28   4.001  -7.512  -2.461
  219   1HG2  ILE  28          1HG2      ILE  28   0.963  -9.628  -2.418
  220   2HG2  ILE  28          2HG2      ILE  28   1.179 -10.351  -3.996
  221   3HG2  ILE  28          3HG2      ILE  28   2.241 -10.825  -2.648
  222   1HD1  ILE  28          1HD1      ILE  28   1.729  -6.516  -2.657
  223   2HD1  ILE  28          2HD1      ILE  28   1.094  -7.695  -1.551
  224   3HD1  ILE  28          3HD1      ILE  28   2.330  -6.562  -0.982
  225    H    GLU  29           H        GLU  29   3.597 -11.948  -5.040
  226    HA   GLU  29           HA       GLU  29   3.172 -11.548  -7.848
  227   1HB   GLU  29          2HB       GLU  29   3.242 -13.892  -5.899
  228   2HB   GLU  29          3HB       GLU  29   2.556 -14.105  -7.491
  229   1HG   GLU  29          2HG       GLU  29   4.641 -13.357  -8.561
  230   2HG   GLU  29          3HG       GLU  29   5.372 -13.073  -6.971
  231    H    GLY  30           H        GLY  30   1.139 -11.996  -5.149
  232   1HA   GLY  30          1HA       GLY  30  -1.289 -12.781  -6.377
  233   2HA   GLY  30          2HA       GLY  30  -1.164 -11.896  -4.852
  234    H    VAL  31           H        VAL  31   0.166  -9.472  -6.111
  235    HA   VAL  31           HA       VAL  31  -2.382  -8.275  -6.931
  236    HB   VAL  31           HB       VAL  31  -0.892  -7.403  -5.082
  237   1HG1  VAL  31          1HG1      VAL  31   1.268  -7.611  -6.290
  238   2HG1  VAL  31          2HG1      VAL  31   0.772  -6.310  -7.392
  239   3HG1  VAL  31          3HG1      VAL  31   0.952  -5.997  -5.655
  240   1HG2  VAL  31          1HG2      VAL  31  -2.705  -6.142  -6.194
  241   2HG2  VAL  31          2HG2      VAL  31  -1.397  -5.130  -5.542
  242   3HG2  VAL  31          3HG2      VAL  31  -1.494  -5.426  -7.289
  243    H    THR  32           H        THR  32  -2.404  -6.797  -8.765
  244    HA   THR  32           HA       THR  32  -0.501  -7.491 -10.960
  245    HB   THR  32           HB       THR  32  -3.455  -6.807 -11.246
  246    HG1  THR  32           1HG      THR  32  -2.035  -9.235 -11.078
  247   1HG2  THR  32          1HG2      THR  32  -1.369  -7.818 -13.234
  248   2HG2  THR  32          2HG2      THR  32  -3.102  -7.612 -13.559
  249   3HG2  THR  32          3HG2      THR  32  -2.095  -6.196 -13.213
  250    H    GLU  33           H        GLU  33  -2.906  -5.028  -9.822
  251    HA   GLU  33           HA       GLU  33  -0.713  -2.999 -10.339
  252   1HB   GLU  33          2HB       GLU  33  -3.609  -2.626 -11.205
  253   2HB   GLU  33          3HB       GLU  33  -2.379  -1.363 -11.086
  254   1HG   GLU  33          2HG       GLU  33  -0.961  -3.020 -12.629
  255   2HG   GLU  33          3HG       GLU  33  -2.570  -3.610 -13.077
  256    H    ALA  34           H        ALA  34  -0.499  -1.347  -8.866
  257    HA   ALA  34           HA       ALA  34  -2.650  -1.072  -6.881
  258   1HB   ALA  34          1HB       ALA  34  -1.005  -2.560  -5.813
  259   2HB   ALA  34          2HB       ALA  34   0.303  -1.411  -6.174
  260   3HB   ALA  34          3HB       ALA  34  -0.980  -0.967  -5.030
  261    H    ILE  35           H        ILE  35  -3.070   1.068  -6.418
  262    HA   ILE  35           HA       ILE  35  -1.270   3.060  -7.803
  263    HB   ILE  35           HB       ILE  35  -4.287   3.318  -7.537
  264   1HG1  ILE  35          2HG1      ILE  35  -4.048   3.128 -10.105
  265   2HG1  ILE  35          3HG1      ILE  35  -2.540   2.267  -9.792
  266   1HG2  ILE  35          1HG2      ILE  35  -2.188   4.856  -9.121
  267   2HG2  ILE  35          2HG2      ILE  35  -3.930   5.187  -9.081
  268   3HG2  ILE  35          3HG2      ILE  35  -2.955   5.436  -7.633
  269   1HD1  ILE  35          1HD1      ILE  35  -3.837   0.466  -8.674
  270   2HD1  ILE  35          2HD1      ILE  35  -5.306   1.467  -8.753
  271   3HD1  ILE  35          3HD1      ILE  35  -4.561   0.841 -10.234
  272    H    VAL  36           H        VAL  36  -0.057   3.176  -5.854
  273    HA   VAL  36           HA       VAL  36  -1.531   3.675  -3.426
  274    HB   VAL  36           HB       VAL  36   0.326   3.247  -2.261
  275   1HG1  VAL  36          1HG1      VAL  36   0.839   1.593  -4.765
  276   2HG1  VAL  36          2HG1      VAL  36   1.116   1.139  -3.073
  277   3HG1  VAL  36          3HG1      VAL  36  -0.537   1.336  -3.691
  278   1HG2  VAL  36          1HG2      VAL  36   1.934   4.803  -3.106
  279   2HG2  VAL  36          2HG2      VAL  36   2.653   3.194  -3.170
  280   3HG2  VAL  36          3HG2      VAL  36   2.035   3.966  -4.659
  281    H    ASN  37           H        ASN  37  -1.677   5.492  -2.214
  282    HA   ASN  37           HA       ASN  37  -0.328   7.992  -3.089
  283   1HB   ASN  37          2HB       ASN  37  -3.317   7.637  -2.544
  284   2HB   ASN  37          3HB       ASN  37  -2.470   9.176  -2.656
  285   1HD2  ASN  37          1HD2      ASN  37  -2.643   6.177  -4.758
  286   2HD2  ASN  37          2HD2      ASN  37  -2.841   7.147  -6.208
  287    H    PHE  38           H        PHE  38   0.820   6.610  -1.247
  288    HA   PHE  38           HA       PHE  38  -0.198   6.979   1.454
  289   1HB   PHE  38          2HB       PHE  38   2.616   6.512   0.374
  290   2HB   PHE  38          3HB       PHE  38   2.215   6.704   2.068
  291    HD1  PHE  38           1HD      PHE  38   1.738   4.453  -0.846
  292    HD2  PHE  38           2HD      PHE  38   1.499   4.920   3.419
  293    HE1  PHE  38           1HE      PHE  38   1.192   2.033  -0.599
  294    HE2  PHE  38           2HE      PHE  38   1.068   2.495   3.645
  295    HZ   PHE  38           HZ       PHE  38   0.759   1.086   1.643
  296    H    GLY  39           H        GLY  39   0.066   8.775   2.754
  297   1HA   GLY  39          1HA       GLY  39   1.891  10.665   2.920
  298   2HA   GLY  39          2HA       GLY  39   1.034  11.268   1.493
  299    H    ALA  40           H        ALA  40  -1.487  10.789   1.856
  300    HA   ALA  40           HA       ALA  40  -2.710  11.108   4.398
  301   1HB   ALA  40          1HB       ALA  40  -2.397  13.683   2.771
  302   2HB   ALA  40          2HB       ALA  40  -3.521  13.467   4.130
  303   3HB   ALA  40          3HB       ALA  40  -1.781  13.402   4.412
  304    H    SER  41           H        SER  41  -3.254   9.292   2.565
  305    HA   SER  41           HA       SER  41  -5.807   9.963   1.399
  306   1HB   SER  41          2HB       SER  41  -3.384   9.934  -0.389
  307   2HB   SER  41          3HB       SER  41  -4.952   9.370  -0.993
  308    HG   SER  41           HG       SER  41  -4.756  11.831   0.338
  309    H    LYS  42           H        LYS  42  -3.859   7.589  -0.249
  310    HA   LYS  42           HA       LYS  42  -5.191   5.409   1.131
  311   1HB   LYS  42          2HB       LYS  42  -6.832   4.884  -0.633
  312   2HB   LYS  42          3HB       LYS  42  -7.141   6.460   0.058
  313   1HG   LYS  42          2HG       LYS  42  -7.521   6.577  -2.265
  314   2HG   LYS  42          3HG       LYS  42  -6.083   7.540  -1.940
  315   1HD   LYS  42          2HD       LYS  42  -4.646   5.817  -2.899
  316   2HD   LYS  42          3HD       LYS  42  -5.981   4.657  -2.940
  317   1HE   LYS  42          2HE       LYS  42  -7.128   6.178  -4.615
  318   2HE   LYS  42          3HE       LYS  42  -5.691   7.215  -4.586
  319   1HZ   LYS  42          1HZ       LYS  42  -4.432   5.189  -5.346
  320   2HZ   LYS  42          2HZ       LYS  42  -5.857   4.410  -5.483
  321   3HZ   LYS  42          3HZ       LYS  42  -5.562   5.732  -6.417
  322    H    ILE  43           H        ILE  43  -5.239   3.411  -0.075
  323    HA   ILE  43           HA       ILE  43  -3.042   3.177  -2.052
  324    HB   ILE  43           HB       ILE  43  -2.030   2.860   0.071
  325   1HG1  ILE  43          2HG1      ILE  43  -1.049   1.476  -1.596
  326   2HG1  ILE  43          3HG1      ILE  43  -1.030   0.682  -0.042
  327   1HG2  ILE  43          1HG2      ILE  43  -4.069   0.729   0.712
  328   2HG2  ILE  43          2HG2      ILE  43  -2.609   1.125   1.636
  329   3HG2  ILE  43          3HG2      ILE  43  -3.896   2.315   1.491
  330   1HD1  ILE  43          1HD1      ILE  43  -2.764   0.000  -2.415
  331   2HD1  ILE  43          2HD1      ILE  43  -1.530  -0.977  -1.623
  332   3HD1  ILE  43          3HD1      ILE  43  -3.067  -0.667  -0.795
  333    H    THR  44           H        THR  44  -3.973   2.386  -3.834
  334    HA   THR  44           HA       THR  44  -6.355   0.626  -3.612
  335    HB   THR  44           HB       THR  44  -5.075   1.855  -6.073
  336    HG1  THR  44           1HG      THR  44  -6.929   2.724  -4.249
  337   1HG2  THR  44          1HG2      THR  44  -6.462  -0.044  -6.663
  338   2HG2  THR  44          2HG2      THR  44  -7.787   0.543  -5.648
  339   3HG2  THR  44          3HG2      THR  44  -7.301   1.453  -7.091
  340    H    VAL  45           H        VAL  45  -6.208  -1.493  -4.143
  341    HA   VAL  45           HA       VAL  45  -3.724  -2.565  -5.350
  342    HB   VAL  45           HB       VAL  45  -5.171  -3.266  -2.818
  343   1HG1  VAL  45          1HG1      VAL  45  -5.762  -5.291  -4.011
  344   2HG1  VAL  45          2HG1      VAL  45  -4.091  -5.480  -4.589
  345   3HG1  VAL  45          3HG1      VAL  45  -4.462  -5.630  -2.865
  346   1HG2  VAL  45          1HG2      VAL  45  -2.858  -2.326  -2.965
  347   2HG2  VAL  45          2HG2      VAL  45  -2.960  -3.856  -2.067
  348   3HG2  VAL  45          3HG2      VAL  45  -2.326  -3.832  -3.728
  349    H    THR  46           H        THR  46  -4.135  -3.985  -7.027
  350    HA   THR  46           HA       THR  46  -6.818  -5.080  -7.423
  351    HB   THR  46           HB       THR  46  -5.292  -3.404  -9.502
  352    HG1  THR  46           1HG      THR  46  -7.127  -3.058  -7.624
  353   1HG2  THR  46          1HG2      THR  46  -7.384  -3.784 -10.872
  354   2HG2  THR  46          2HG2      THR  46  -6.426  -5.256 -10.655
  355   3HG2  THR  46          3HG2      THR  46  -7.896  -5.012  -9.695
  356    H    GLY  47           H        GLY  47  -6.696  -7.047  -8.191
  357   1HA   GLY  47          1HA       GLY  47  -5.148  -8.110 -10.065
  358   2HA   GLY  47          2HA       GLY  47  -4.001  -8.157  -8.748
  359    H    GLU  48           H        GLU  48  -4.197  -9.523  -7.059
  360    HA   GLU  48           HA       GLU  48  -6.672 -10.695  -6.145
  361   1HB   GLU  48          2HB       GLU  48  -5.874 -12.149  -8.154
  362   2HB   GLU  48          3HB       GLU  48  -4.548 -12.659  -7.108
  363   1HG   GLU  48          2HG       GLU  48  -6.268 -13.465  -5.446
  364   2HG   GLU  48          3HG       GLU  48  -7.544 -12.950  -6.567
  365    H    ALA  49           H        ALA  49  -5.259  -8.948  -4.718
  366    HA   ALA  49           HA       ALA  49  -4.196 -10.629  -2.549
  367   1HB   ALA  49          1HB       ALA  49  -2.168  -9.938  -3.788
  368   2HB   ALA  49          2HB       ALA  49  -2.669  -8.234  -3.659
  369   3HB   ALA  49          3HB       ALA  49  -2.242  -9.156  -2.198
  370    H    SER  50           H        SER  50  -3.847  -9.200  -0.552
  371    HA   SER  50           HA       SER  50  -5.924  -7.092  -0.339
  372   1HB   SER  50          2HB       SER  50  -5.412  -9.441   1.554
  373   2HB   SER  50          3HB       SER  50  -6.464  -8.067   1.906
  374    HG   SER  50           HG       SER  50  -7.555  -8.710  -0.162
  375    H    ILE  51           H        ILE  51  -5.564  -5.616   1.561
  376    HA   ILE  51           HA       ILE  51  -3.055  -4.671   1.433
  377    HB   ILE  51           HB       ILE  51  -5.153  -3.477   2.401
  378   1HG1  ILE  51          2HG1      ILE  51  -3.781  -2.023   3.776
  379   2HG1  ILE  51          3HG1      ILE  51  -2.399  -3.047   3.411
  380   1HG2  ILE  51          1HG2      ILE  51  -3.966  -4.356   5.052
  381   2HG2  ILE  51          2HG2      ILE  51  -5.419  -3.393   4.768
  382   3HG2  ILE  51          3HG2      ILE  51  -5.430  -5.116   4.359
  383   1HD1  ILE  51          1HD1      ILE  51  -4.145  -1.492   1.447
  384   2HD1  ILE  51          2HD1      ILE  51  -2.434  -1.195   1.811
  385   3HD1  ILE  51          3HD1      ILE  51  -2.904  -2.624   0.902
  386    H    GLN  52           H        GLN  52  -4.089  -7.108   3.755
  387    HA   GLN  52           HA       GLN  52  -2.252  -7.149   5.741
  388   1HB   GLN  52          2HB       GLN  52  -2.952  -9.468   3.902
  389   2HB   GLN  52          3HB       GLN  52  -2.215  -9.651   5.496
  390   1HG   GLN  52          2HG       GLN  52  -4.178  -9.427   6.574
  391   2HG   GLN  52          3HG       GLN  52  -4.627  -7.984   5.675
  392   1HE2  GLN  52          1HE2      GLN  52  -6.713  -8.376   4.911
  393   2HE2  GLN  52          2HE2      GLN  52  -7.147  -9.831   4.029
  394    H    GLN  53           H        GLN  53  -1.529  -8.154   2.392
  395    HA   GLN  53           HA       GLN  53   1.228  -8.902   2.821
  396   1HB   GLN  53          2HB       GLN  53  -0.228  -7.915   0.348
  397   2HB   GLN  53          3HB       GLN  53   1.362  -8.696   0.374
  398   1HG   GLN  53          2HG       GLN  53  -0.775 -10.291   1.719
  399   2HG   GLN  53          3HG       GLN  53  -1.095  -9.935   0.020
  400   1HE2  GLN  53          1HE2      GLN  53  -0.844 -12.129  -0.633
  401   2HE2  GLN  53          2HE2      GLN  53   0.743 -12.874  -0.651
  402    H    VAL  54           H        VAL  54  -0.360  -5.900   1.761
  403    HA   VAL  54           HA       VAL  54   2.023  -4.423   1.136
  404    HB   VAL  54           HB       VAL  54  -0.788  -3.430   1.781
  405   1HG1  VAL  54          1HG1      VAL  54  -0.080  -1.510   0.288
  406   2HG1  VAL  54          2HG1      VAL  54   0.661  -1.581   1.887
  407   3HG1  VAL  54          3HG1      VAL  54   1.588  -2.096   0.476
  408   1HG2  VAL  54          1HG2      VAL  54  -1.149  -4.929   0.015
  409   2HG2  VAL  54          2HG2      VAL  54  -0.979  -3.363  -0.782
  410   3HG2  VAL  54          3HG2      VAL  54   0.360  -4.529  -0.794
  411    H    GLU  55           H        GLU  55  -0.086  -4.809   3.973
  412    HA   GLU  55           HA       GLU  55   0.923  -2.708   5.562
  413   1HB   GLU  55          2HB       GLU  55  -1.304  -3.896   5.719
  414   2HB   GLU  55          3HB       GLU  55  -0.464  -5.273   6.458
  415   1HG   GLU  55          2HG       GLU  55   0.314  -3.810   8.280
  416   2HG   GLU  55          3HG       GLU  55  -0.414  -2.404   7.476
  417    H    GLN  56           H        GLN  56   1.519  -6.271   5.389
  418    HA   GLN  56           HA       GLN  56   3.585  -6.473   7.259
  419   1HB   GLN  56          2HB       GLN  56   2.488  -8.375   6.135
  420   2HB   GLN  56          3HB       GLN  56   3.310  -7.977   4.618
  421   1HG   GLN  56          2HG       GLN  56   5.501  -8.334   5.671
  422   2HG   GLN  56          3HG       GLN  56   4.721  -8.662   7.226
  423   1HE2  GLN  56          1HE2      GLN  56   3.071 -10.542   7.189
  424   2HE2  GLN  56          2HE2      GLN  56   3.521 -11.922   6.198
  425    H    ALA  57           H        ALA  57   3.907  -5.738   3.701
  426    HA   ALA  57           HA       ALA  57   6.660  -5.064   3.707
  427   1HB   ALA  57          1HB       ALA  57   5.944  -3.412   1.898
  428   2HB   ALA  57          2HB       ALA  57   5.614  -5.141   1.622
  429   3HB   ALA  57          3HB       ALA  57   4.313  -4.042   2.094
  430    H    GLY  58           H        GLY  58   3.831  -2.941   4.483
  431   1HA   GLY  58          1HA       GLY  58   5.224  -0.576   4.928
  432   2HA   GLY  58          2HA       GLY  58   3.615  -1.039   5.568
  433    H    ALA  59           H        ALA  59   5.146  -3.423   6.953
  434    HA   ALA  59           HA       ALA  59   5.624  -2.384   9.483
  435   1HB   ALA  59          1HB       ALA  59   6.979  -4.352   9.902
  436   2HB   ALA  59          2HB       ALA  59   5.568  -4.800   8.924
  437   3HB   ALA  59          3HB       ALA  59   7.176  -4.641   8.164
  438    H    PHE  60           H        PHE  60   7.694  -2.037   6.588
  439    HA   PHE  60           HA       PHE  60  10.072  -1.332   7.889
  440   1HB   PHE  60          2HB       PHE  60  10.785  -0.201   5.979
  441   2HB   PHE  60          3HB       PHE  60   9.906  -1.635   5.481
  442    HD1  PHE  60           1HD      PHE  60   8.343  -1.415   3.709
  443    HD2  PHE  60           2HD      PHE  60   9.654   2.108   5.811
  444    HE1  PHE  60           1HE      PHE  60   7.111   0.011   2.096
  445    HE2  PHE  60           2HE      PHE  60   8.469   3.528   4.177
  446    HZ   PHE  60           HZ       PHE  60   7.262   2.469   2.245
  447    H    GLU  61           H        GLU  61   7.131   0.612   7.651
  448    HA   GLU  61           HA       GLU  61   8.401   2.586   9.513
  449   1HB   GLU  61          2HB       GLU  61   8.485   3.427   7.254
  450   2HB   GLU  61          3HB       GLU  61   6.743   3.250   7.055
  451   1HG   GLU  61          2HG       GLU  61   6.389   5.001   8.775
  452   2HG   GLU  61          3HG       GLU  61   8.134   5.062   9.086
  453    H    HIS  62           H        HIS  62   5.790   0.459   9.069
  454    HA   HIS  62           HA       HIS  62   4.194  -0.140  10.503
  455   1HB   HIS  62          2HB       HIS  62   4.804   2.132  12.395
  456   2HB   HIS  62          3HB       HIS  62   4.119   0.550  12.737
  457    HD1  HIS  62           1HD      HIS  62   6.842  -0.848  11.048
  458    HD2  HIS  62           2HD      HIS  62   6.636   1.859  14.273
  459    HE1  HIS  62           1HE      HIS  62   9.006  -1.070  12.317
  460    H    LEU  63           H        LEU  63   3.141   0.876   8.410
  461    HA   LEU  63           HA       LEU  63   1.577   3.298   8.992
  462   1HB   LEU  63          2HB       LEU  63   1.766   1.436   6.610
  463   2HB   LEU  63          3HB       LEU  63   0.559   2.715   6.708
  464    HG   LEU  63           HG       LEU  63   2.495   3.383   5.421
  465   1HD1  LEU  63          1HD1      LEU  63   1.038   5.009   6.586
  466   2HD1  LEU  63          2HD1      LEU  63   2.199   5.069   7.936
  467   3HD1  LEU  63          3HD1      LEU  63   2.677   5.588   6.324
  468   1HD2  LEU  63          1HD2      LEU  63   4.631   3.941   6.393
  469   2HD2  LEU  63          2HD2      LEU  63   4.105   3.487   8.007
  470   3HD2  LEU  63          3HD2      LEU  63   4.310   2.237   6.755
  471    H    LYS  64           H        LYS  64  -0.851   3.287   8.639
  472    HA   LYS  64           HA       LYS  64  -2.038   0.965  10.116
  473   1HB   LYS  64          2HB       LYS  64  -3.365   2.638  11.372
  474   2HB   LYS  64          3HB       LYS  64  -1.670   2.521  11.830
  475   1HG   LYS  64          2HG       LYS  64  -2.611   4.651   9.879
  476   2HG   LYS  64          3HG       LYS  64  -2.817   4.875  11.607
  477   1HD   LYS  64          2HD       LYS  64  -0.077   4.179  10.473
  478   2HD   LYS  64          3HD       LYS  64  -0.722   5.785  10.409
  479   1HE   LYS  64          2HE       LYS  64  -0.777   5.934  12.831
  480   2HE   LYS  64          3HE       LYS  64  -0.577   4.185  13.009
  481   1HZ   LYS  64          1HZ       LYS  64   1.480   5.998  11.944
  482   2HZ   LYS  64          2HZ       LYS  64   1.465   5.329  13.443
  483   3HZ   LYS  64          3HZ       LYS  64   1.645   4.367  12.118
  484    H    ILE  65           H        ILE  65  -2.434   0.420   7.965
  485    HA   ILE  65           HA       ILE  65  -4.142   2.084   6.337
  486    HB   ILE  65           HB       ILE  65  -3.560  -0.813   5.713
  487   1HG1  ILE  65          2HG1      ILE  65  -1.592   1.449   5.736
  488   2HG1  ILE  65          3HG1      ILE  65  -1.453  -0.255   6.264
  489   1HG2  ILE  65          1HG2      ILE  65  -5.110   0.387   4.299
  490   2HG2  ILE  65          2HG2      ILE  65  -3.949   1.680   4.011
  491   3HG2  ILE  65          3HG2      ILE  65  -3.638   0.076   3.385
  492   1HD1  ILE  65          1HD1      ILE  65  -1.374  -0.971   3.919
  493   2HD1  ILE  65          2HD1      ILE  65  -1.377   0.748   3.421
  494   3HD1  ILE  65          3HD1      ILE  65  -0.044   0.100   4.380
  495    H    ILE  66           H        ILE  66  -6.382   1.875   5.989
  496    HA   ILE  66           HA       ILE  66  -7.798  -0.204   7.610
  497    HB   ILE  66           HB       ILE  66  -8.430   2.730   7.285
  498   1HG1  ILE  66          2HG1      ILE  66  -6.713   2.275   8.986
  499   2HG1  ILE  66          3HG1      ILE  66  -8.210   2.878   9.683
  500   1HG2  ILE  66          1HG2      ILE  66 -10.555   1.617   7.178
  501   2HG2  ILE  66          2HG2      ILE  66 -10.137   0.531   8.514
  502   3HG2  ILE  66          3HG2      ILE  66 -10.377   2.264   8.808
  503   1HD1  ILE  66          1HD1      ILE  66  -8.820   0.559  10.390
  504   2HD1  ILE  66          2HD1      ILE  66  -7.269  -0.025   9.747
  505   3HD1  ILE  66          3HD1      ILE  66  -7.296   1.126  11.082
  506    HA   PRO  67           HA       PRO  67  -9.785  -0.913   3.615
  507   1HB   PRO  67          2HB       PRO  67 -11.548  -2.880   4.360
  508   2HB   PRO  67          3HB       PRO  67  -9.811  -3.193   4.143
  509   1HG   PRO  67          2HG       PRO  67 -11.285  -2.655   6.718
  510   2HG   PRO  67          3HG       PRO  67 -10.078  -3.929   6.389
  511   1HD   PRO  67          2HD       PRO  67  -9.456  -1.600   7.637
  512   2HD   PRO  67          3HD       PRO  67  -8.289  -2.382   6.529
  513    H    GLU  68           H        GLU  68 -10.836   0.972   3.259
  514    HA   GLU  68           HA       GLU  68 -13.007   2.114   4.554
  515   1HB   GLU  68          2HB       GLU  68 -11.500   3.055   2.934
  516   2HB   GLU  68          3HB       GLU  68 -12.018   1.952   1.658
  517   1HG   GLU  68          2HG       GLU  68 -14.257   3.437   2.815
  518   2HG   GLU  68          3HG       GLU  68 -12.987   4.511   2.215
  519    H    LYS  69           H        LYS  69 -12.932  -0.101   1.725
  520    HA   LYS  69           HA       LYS  69 -15.796  -0.602   1.835
  521   1HB   LYS  69          2HB       LYS  69 -13.460  -1.639   0.214
  522   2HB   LYS  69          3HB       LYS  69 -14.996  -2.514   0.178
  523   1HG   LYS  69          2HG       LYS  69 -14.949   0.488  -0.232
  524   2HG   LYS  69          3HG       LYS  69 -14.595  -0.597  -1.584
  525   1HD   LYS  69          2HD       LYS  69 -16.714  -1.597  -1.566
  526   2HD   LYS  69          3HD       LYS  69 -17.057  -1.140   0.104
  527   1HE   LYS  69          2HE       LYS  69 -17.216   1.247  -0.537
  528   2HE   LYS  69          3HE       LYS  69 -16.943   0.812  -2.233
  529   1HZ   LYS  69          1HZ       LYS  69 -19.286   1.047  -1.682
  530   2HZ   LYS  69          2HZ       LYS  69 -18.961  -0.497  -2.153
  531   3HZ   LYS  69          3HZ       LYS  69 -19.185  -0.153  -0.560
  532    H    GLU  70           H        GLU  70 -16.654  -1.712   3.408
  533    HA   GLU  70           HA       GLU  70 -15.217  -4.010   4.657
  534   1HB   GLU  70          2HB       GLU  70 -15.669  -1.845   5.960
  535   2HB   GLU  70          3HB       GLU  70 -17.381  -2.283   5.940
  536   1HG   GLU  70          2HG       GLU  70 -15.178  -4.120   7.003
  537   2HG   GLU  70          3HG       GLU  70 -15.991  -2.907   7.998
  538    H    ALA  71           H        ALA  71 -18.496  -2.691   3.840
  539    HA   ALA  71           HA       ALA  71 -19.211  -5.099   2.470
  540   1HB   ALA  71          1HB       ALA  71 -21.338  -5.406   3.674
  541   2HB   ALA  71          2HB       ALA  71 -19.974  -5.656   4.782
  542   3HB   ALA  71          3HB       ALA  71 -20.893  -4.136   4.837
  Start of MODEL    9
    1   1H    MET   1           H1       MET   1 -15.293  -9.851  -5.114
    2   2H    MET   1           H2       MET   1 -15.596  -9.747  -3.508
    3   3H    MET   1           H3       MET   1 -14.130  -9.320  -4.136
    4    HA   MET   1           HA       MET   1 -13.896 -11.432  -3.064
    5   1HB   MET   1          2HB       MET   1 -16.401 -11.905  -3.417
    6   2HB   MET   1          3HB       MET   1 -15.974 -12.492  -5.024
    7   1HG   MET   1          2HG       MET   1 -14.451 -14.177  -3.927
    8   2HG   MET   1          3HG       MET   1 -14.954 -13.536  -2.351
    9   1HE   MET   1          1HE       MET   1 -16.787 -16.924  -2.195
   10   2HE   MET   1          2HE       MET   1 -15.125 -16.558  -2.716
   11   3HE   MET   1          3HE       MET   1 -15.824 -15.729  -1.300
   12    H    ALA   2           H        ALA   2 -11.809 -11.534  -3.912
   13    HA   ALA   2           HA       ALA   2 -10.104 -11.583  -5.358
   14   1HB   ALA   2          1HB       ALA   2 -10.196 -13.146  -7.256
   15   2HB   ALA   2          2HB       ALA   2 -10.869 -13.870  -5.788
   16   3HB   ALA   2          3HB       ALA   2 -11.947 -13.299  -7.083
   17    H    GLU   3           H        GLU   3 -10.820  -9.228  -5.394
   18    HA   GLU   3           HA       GLU   3 -11.196  -8.237  -8.146
   19   1HB   GLU   3          2HB       GLU   3 -13.046  -7.695  -5.778
   20   2HB   GLU   3          3HB       GLU   3 -12.964  -6.609  -7.160
   21   1HG   GLU   3          2HG       GLU   3 -13.683  -8.316  -8.699
   22   2HG   GLU   3          3HG       GLU   3 -13.660  -9.555  -7.444
   23    H    LYS   4           H        LYS   4 -11.143  -5.742  -7.942
   24    HA   LYS   4           HA       LYS   4  -8.624  -5.018  -6.633
   25   1HB   LYS   4          2HB       LYS   4  -8.820  -2.979  -7.921
   26   2HB   LYS   4          3HB       LYS   4  -9.188  -4.378  -8.947
   27   1HG   LYS   4          2HG       LYS   4 -11.677  -3.858  -8.530
   28   2HG   LYS   4          3HG       LYS   4 -11.153  -2.375  -7.754
   29   1HD   LYS   4          2HD       LYS   4  -9.738  -2.499 -10.260
   30   2HD   LYS   4          3HD       LYS   4 -11.356  -3.096 -10.599
   31   1HE   LYS   4          2HE       LYS   4 -11.362  -0.736 -11.004
   32   2HE   LYS   4          3HE       LYS   4 -12.312  -1.014  -9.538
   33   1HZ   LYS   4          1HZ       LYS   4 -10.365  -0.361  -8.259
   34   2HZ   LYS   4          2HZ       LYS   4  -9.489  -0.136  -9.631
   35   3HZ   LYS   4          3HZ       LYS   4 -10.783   0.832  -9.314
   36    H    THR   5           H        THR   5  -8.467  -2.977  -5.263
   37    HA   THR   5           HA       THR   5 -10.903  -2.139  -3.870
   38    HB   THR   5           HB       THR   5  -8.776  -3.792  -2.385
   39    HG1  THR   5           1HG      THR   5 -11.174  -4.207  -3.540
   40   1HG2  THR   5          1HG2      THR   5  -9.646  -2.098  -0.809
   41   2HG2  THR   5          2HG2      THR   5 -11.309  -2.389  -1.374
   42   3HG2  THR   5          3HG2      THR   5 -10.436  -3.639  -0.480
   43    H    VAL   6           H        VAL   6 -10.419  -0.391  -2.318
   44    HA   VAL   6           HA       VAL   6  -7.673   0.270  -2.225
   45    HB   VAL   6           HB       VAL   6  -8.420   1.699  -3.952
   46   1HG1  VAL   6          1HG1      VAL   6 -10.847   2.513  -2.375
   47   2HG1  VAL   6          2HG1      VAL   6 -10.301   3.215  -3.923
   48   3HG1  VAL   6          3HG1      VAL   6 -10.778   1.522  -3.859
   49   1HG2  VAL   6          1HG2      VAL   6  -8.220   4.025  -3.130
   50   2HG2  VAL   6          2HG2      VAL   6  -8.649   3.510  -1.487
   51   3HG2  VAL   6          3HG2      VAL   6  -7.112   3.008  -2.214
   52    H    TYR   7           H        TYR   7  -6.956   1.295  -0.374
   53    HA   TYR   7           HA       TYR   7  -8.826   1.045   1.956
   54   1HB   TYR   7          2HB       TYR   7  -5.911   0.243   1.799
   55   2HB   TYR   7          3HB       TYR   7  -7.012   0.000   3.151
   56    HD1  TYR   7           HD1      TYR   7  -8.037  -2.082   3.420
   57    HD2  TYR   7           HD2      TYR   7  -6.253  -1.083  -0.357
   58    HE1  TYR   7           HE1      TYR   7  -8.581  -4.341   2.583
   59    HE2  TYR   7           HE2      TYR   7  -6.629  -3.408  -1.130
   60    HH   TYR   7           HH       TYR   7  -8.533  -5.773   0.705
   61    H    ARG   8           H        ARG   8  -8.139   2.336   3.830
   62    HA   ARG   8           HA       ARG   8  -6.935   4.916   2.950
   63   1HB   ARG   8          2HB       ARG   8  -8.665   3.912   5.251
   64   2HB   ARG   8          3HB       ARG   8  -7.727   5.366   5.511
   65   1HG   ARG   8          2HG       ARG   8  -9.642   5.100   3.157
   66   2HG   ARG   8          3HG       ARG   8 -10.122   5.611   4.791
   67   1HD   ARG   8          2HD       ARG   8  -8.137   7.311   4.565
   68   2HD   ARG   8          3HD       ARG   8  -8.412   7.106   2.826
   69    HE   ARG   8           HE       ARG   8 -10.948   7.445   3.848
   70   1HH1  ARG   8          2HH2      ARG   8  -7.984   9.339   4.169
   71   2HH1  ARG   8          1HH2      ARG   8  -8.770  10.785   4.715
   72   1HH2  ARG   8          2HH1      ARG   8 -12.031   9.319   4.548
   73   2HH2  ARG   8          1HH1      ARG   8 -11.169  10.795   4.859
   74    H    VAL   9           H        VAL   9  -4.789   5.167   3.332
   75    HA   VAL   9           HA       VAL   9  -3.497   3.749   5.622
   76    HB   VAL   9           HB       VAL   9  -2.413   3.132   3.595
   77   1HG1  VAL   9          1HG1      VAL   9  -1.977   6.086   2.941
   78   2HG1  VAL   9          2HG1      VAL   9  -1.412   4.685   2.025
   79   3HG1  VAL   9          3HG1      VAL   9  -3.137   5.033   2.096
   80   1HG2  VAL   9          1HG2      VAL   9  -0.968   3.684   5.555
   81   2HG2  VAL   9          2HG2      VAL   9  -0.173   3.915   3.983
   82   3HG2  VAL   9          3HG2      VAL   9  -0.732   5.321   4.890
   83    H    ASP  10           H        ASP  10  -2.603   4.925   7.252
   84    HA   ASP  10           HA       ASP  10  -2.129   7.795   6.827
   85   1HB   ASP  10          2HB       ASP  10  -4.209   6.685   8.705
   86   2HB   ASP  10          3HB       ASP  10  -3.082   7.895   9.366
   87    H    GLY  11           H        GLY  11  -0.655   8.625   8.330
   88   1HA   GLY  11          1HA       GLY  11   0.729   7.998  10.386
   89   2HA   GLY  11          2HA       GLY  11   1.224   6.576   9.453
   90    H    LEU  12           H        LEU  12   2.076   7.068   7.190
   91    HA   LEU  12           HA       LEU  12   4.186   9.071   7.548
   92   1HB   LEU  12          2HB       LEU  12   5.277   7.958   5.693
   93   2HB   LEU  12          3HB       LEU  12   4.893   6.896   7.045
   94    HG   LEU  12           HG       LEU  12   3.246   5.721   5.886
   95   1HD1  LEU  12          1HD1      LEU  12   1.894   7.327   4.769
   96   2HD1  LEU  12          2HD1      LEU  12   3.238   7.795   3.678
   97   3HD1  LEU  12          3HD1      LEU  12   2.502   6.184   3.609
   98   1HD2  LEU  12          1HD2      LEU  12   4.602   4.857   4.039
   99   2HD2  LEU  12          2HD2      LEU  12   5.352   6.451   3.812
  100   3HD2  LEU  12          3HD2      LEU  12   5.740   5.478   5.241
  101    H    SER  13           H        SER  13   5.004  10.186   5.548
  102    HA   SER  13           HA       SER  13   3.127  10.890   3.424
  103   1HB   SER  13          2HB       SER  13   3.986  12.913   5.540
  104   2HB   SER  13          3HB       SER  13   3.386  13.375   3.941
  105    HG   SER  13           HG       SER  13   1.777  13.249   5.691
  106    H    CYS  14           H        CYS  14   4.992   9.834   2.234
  107    HA   CYS  14           HA       CYS  14   6.824  11.929   1.404
  108   1HB   CYS  14          2HB       CYS  14   8.097  11.090   3.327
  109   2HB   CYS  14          3HB       CYS  14   7.979   9.431   2.702
  110    HG   CYS  14           HG       CYS  14  10.375  10.424   2.302
  111    H    THR  15           H        THR  15   7.484  11.694  -0.675
  112    HA   THR  15           HA       THR  15   6.141   9.862  -2.370
  113    HB   THR  15           HB       THR  15   8.617  11.557  -2.922
  114    HG1  THR  15           1HG      THR  15   6.144  12.258  -2.246
  115   1HG2  THR  15          1HG2      THR  15   7.725  11.594  -5.246
  116   2HG2  THR  15          2HG2      THR  15   8.212   9.968  -4.743
  117   3HG2  THR  15          3HG2      THR  15   6.490  10.405  -4.783
  118    H    ASN  16           H        ASN  16   9.604   9.901  -1.253
  119    HA   ASN  16           HA       ASN  16  10.357   7.659  -2.723
  120   1HB   ASN  16          2HB       ASN  16  11.447   8.779  -0.119
  121   2HB   ASN  16          3HB       ASN  16  12.166   7.394  -0.957
  122   1HD2  ASN  16          1HD2      ASN  16  14.084   8.989  -0.927
  123   2HD2  ASN  16          2HD2      ASN  16  14.191  10.033  -2.332
  124    H    CYS  17           H        CYS  17   8.875   7.885   0.517
  125    HA   CYS  17           HA       CYS  17   8.906   5.074   1.090
  126   1HB   CYS  17          2HB       CYS  17   6.949   7.234   1.982
  127   2HB   CYS  17          3HB       CYS  17   6.969   5.544   2.514
  128    HG   CYS  17           HG       CYS  17   9.370   5.523   3.458
  129    H    ALA  18           H        ALA  18   6.531   7.189  -0.619
  130    HA   ALA  18           HA       ALA  18   4.602   5.209  -1.208
  131   1HB   ALA  18          1HB       ALA  18   5.345   7.430  -3.142
  132   2HB   ALA  18          2HB       ALA  18   3.783   6.675  -2.863
  133   3HB   ALA  18          3HB       ALA  18   4.468   7.738  -1.630
  134    H    ALA  19           H        ALA  19   7.546   6.096  -2.987
  135    HA   ALA  19           HA       ALA  19   7.258   4.274  -5.150
  136   1HB   ALA  19          1HB       ALA  19   8.927   6.102  -5.097
  137   2HB   ALA  19          2HB       ALA  19   9.869   5.208  -3.887
  138   3HB   ALA  19          3HB       ALA  19   9.643   4.531  -5.505
  139    H    LYS  20           H        LYS  20   8.966   3.909  -2.027
  140    HA   LYS  20           HA       LYS  20   9.771   1.234  -2.209
  141   1HB   LYS  20          2HB       LYS  20   9.758   3.174  -0.185
  142   2HB   LYS  20          3HB       LYS  20   8.531   2.079   0.402
  143   1HG   LYS  20          2HG       LYS  20  10.331   1.195   1.409
  144   2HG   LYS  20          3HG       LYS  20  10.293   0.187  -0.041
  145   1HD   LYS  20          2HD       LYS  20  12.381   0.934  -0.663
  146   2HD   LYS  20          3HD       LYS  20  11.822   2.595  -0.631
  147   1HE   LYS  20          2HE       LYS  20  13.622   2.535   0.907
  148   2HE   LYS  20          3HE       LYS  20  12.153   2.641   1.880
  149   1HZ   LYS  20          1HZ       LYS  20  13.734   0.204   1.348
  150   2HZ   LYS  20          2HZ       LYS  20  13.646   1.021   2.770
  151   3HZ   LYS  20          3HZ       LYS  20  12.326   0.226   2.197
  152    H    PHE  21           H        PHE  21   6.651   2.569  -1.118
  153    HA   PHE  21           HA       PHE  21   5.541   0.088  -0.368
  154   1HB   PHE  21          2HB       PHE  21   4.819   2.581   0.128
  155   2HB   PHE  21          3HB       PHE  21   3.794   2.391  -1.283
  156    HD1  PHE  21           1HD      PHE  21   1.536   1.952  -0.559
  157    HD2  PHE  21           2HD      PHE  21   4.807   0.199   1.654
  158    HE1  PHE  21           1HE      PHE  21   0.063   1.591   1.417
  159    HE2  PHE  21           2HE      PHE  21   3.233  -0.480   3.392
  160    HZ   PHE  21           HZ       PHE  21   1.001   0.527   3.465
  161    H    GLU  22           H        GLU  22   4.913   2.054  -3.382
  162    HA   GLU  22           HA       GLU  22   3.151   0.096  -4.427
  163   1HB   GLU  22          2HB       GLU  22   3.188   1.132  -6.461
  164   2HB   GLU  22          3HB       GLU  22   3.332   2.434  -5.282
  165   1HG   GLU  22          2HG       GLU  22   5.640   2.806  -5.867
  166   2HG   GLU  22          3HG       GLU  22   5.694   1.346  -6.874
  167    H    ARG  23           H        ARG  23   6.674   0.529  -4.781
  168    HA   ARG  23           HA       ARG  23   7.001  -1.598  -6.620
  169   1HB   ARG  23          2HB       ARG  23   8.793   0.105  -5.971
  170   2HB   ARG  23          3HB       ARG  23   9.063  -0.820  -4.495
  171   1HG   ARG  23          2HG       ARG  23  10.170  -2.498  -5.580
  172   2HG   ARG  23          3HG       ARG  23   8.986  -2.587  -6.870
  173   1HD   ARG  23          2HD       ARG  23  10.935  -2.000  -7.958
  174   2HD   ARG  23          3HD       ARG  23   9.983  -0.501  -7.868
  175    HE   ARG  23           HE       ARG  23  11.880  -0.977  -5.667
  176   1HH1  ARG  23          2HH2      ARG  23  11.521   0.420  -8.882
  177   2HH1  ARG  23          1HH2      ARG  23  12.951   1.400  -8.813
  178   1HH2  ARG  23          2HH1      ARG  23  13.838   0.249  -5.554
  179   2HH2  ARG  23          1HH1      ARG  23  14.308   1.290  -6.861
  180    H    ASN  24           H        ASN  24   7.224  -1.657  -2.994
  181    HA   ASN  24           HA       ASN  24   7.632  -4.423  -2.635
  182   1HB   ASN  24          2HB       ASN  24   6.023  -2.383  -1.052
  183   2HB   ASN  24          3HB       ASN  24   5.956  -4.088  -0.648
  184   1HD2  ASN  24          1HD2      ASN  24   7.373  -1.376   0.316
  185   2HD2  ASN  24          2HD2      ASN  24   8.710  -2.156   1.172
  186    H    VAL  25           H        VAL  25   4.504  -2.674  -3.114
  187    HA   VAL  25           HA       VAL  25   2.930  -5.033  -3.072
  188    HB   VAL  25           HB       VAL  25   2.275  -2.517  -4.660
  189   1HG1  VAL  25          1HG1      VAL  25   0.712  -4.180  -5.209
  190   2HG1  VAL  25          2HG1      VAL  25   0.655  -4.838  -3.555
  191   3HG1  VAL  25          3HG1      VAL  25  -0.087  -3.288  -3.908
  192   1HG2  VAL  25          1HG2      VAL  25   2.525  -2.887  -1.750
  193   2HG2  VAL  25          2HG2      VAL  25   2.293  -1.409  -2.711
  194   3HG2  VAL  25          3HG2      VAL  25   0.910  -2.352  -2.233
  195    H    LYS  26           H        LYS  26   4.349  -3.346  -5.889
  196    HA   LYS  26           HA       LYS  26   3.558  -5.118  -7.929
  197   1HB   LYS  26          2HB       LYS  26   5.796  -3.143  -7.521
  198   2HB   LYS  26          3HB       LYS  26   6.008  -4.346  -8.767
  199   1HG   LYS  26          2HG       LYS  26   5.142  -2.697 -10.003
  200   2HG   LYS  26          3HG       LYS  26   3.696  -3.614  -9.616
  201   1HD   LYS  26          2HD       LYS  26   3.158  -1.963  -7.828
  202   2HD   LYS  26          3HD       LYS  26   4.602  -1.025  -8.277
  203   1HE   LYS  26          2HE       LYS  26   3.728  -0.746 -10.588
  204   2HE   LYS  26          3HE       LYS  26   2.297  -1.698 -10.182
  205   1HZ   LYS  26          1HZ       LYS  26   2.984   0.976  -9.106
  206   2HZ   LYS  26          2HZ       LYS  26   1.809   0.573 -10.196
  207   3HZ   LYS  26          3HZ       LYS  26   1.631   0.123  -8.659
  208    H    GLU  27           H        GLU  27   6.300  -5.432  -5.620
  209    HA   GLU  27           HA       GLU  27   7.387  -7.784  -6.839
  210   1HB   GLU  27          2HB       GLU  27   7.654  -6.652  -4.032
  211   2HB   GLU  27          3HB       GLU  27   8.548  -8.046  -4.617
  212   1HG   GLU  27          2HG       GLU  27   9.688  -6.766  -6.297
  213   2HG   GLU  27          3HG       GLU  27   8.665  -5.353  -6.033
  214    H    ILE  28           H        ILE  28   4.469  -7.435  -4.905
  215    HA   ILE  28           HA       ILE  28   4.573 -10.162  -3.856
  216    HB   ILE  28           HB       ILE  28   2.170  -8.421  -4.214
  217   1HG1  ILE  28          2HG1      ILE  28   3.747  -8.536  -1.618
  218   2HG1  ILE  28          3HG1      ILE  28   3.894  -7.236  -2.799
  219   1HG2  ILE  28          1HG2      ILE  28   2.096 -10.107  -1.850
  220   2HG2  ILE  28          2HG2      ILE  28   1.010 -10.075  -3.251
  221   3HG2  ILE  28          3HG2      ILE  28   2.462 -11.097  -3.249
  222   1HD1  ILE  28          1HD1      ILE  28   1.512  -6.729  -2.674
  223   2HD1  ILE  28          2HD1      ILE  28   1.255  -8.021  -1.523
  224   3HD1  ILE  28          3HD1      ILE  28   2.255  -6.625  -1.062
  225    H    GLU  29           H        GLU  29   4.184 -11.921  -5.115
  226    HA   GLU  29           HA       GLU  29   3.289 -11.843  -7.785
  227   1HB   GLU  29          2HB       GLU  29   3.736 -14.031  -5.697
  228   2HB   GLU  29          3HB       GLU  29   3.223 -14.369  -7.337
  229   1HG   GLU  29          2HG       GLU  29   5.220 -13.270  -8.258
  230   2HG   GLU  29          3HG       GLU  29   5.784 -12.886  -6.621
  231    H    GLY  30           H        GLY  30   1.504 -11.843  -4.908
  232   1HA   GLY  30          1HA       GLY  30  -0.881 -13.240  -5.789
  233   2HA   GLY  30          2HA       GLY  30  -0.745 -12.147  -4.403
  234    H    VAL  31           H        VAL  31   0.284  -9.858  -6.039
  235    HA   VAL  31           HA       VAL  31  -2.404  -8.931  -6.765
  236    HB   VAL  31           HB       VAL  31  -0.706  -7.966  -5.038
  237   1HG1  VAL  31          1HG1      VAL  31   0.170  -6.302  -7.412
  238   2HG1  VAL  31          2HG1      VAL  31   0.730  -6.305  -5.733
  239   3HG1  VAL  31          3HG1      VAL  31   1.124  -7.666  -6.787
  240   1HG2  VAL  31          1HG2      VAL  31  -1.641  -5.799  -5.222
  241   2HG2  VAL  31          2HG2      VAL  31  -2.271  -6.106  -6.843
  242   3HG2  VAL  31          3HG2      VAL  31  -2.893  -7.039  -5.466
  243    H    THR  32           H        THR  32  -1.995  -6.918  -8.496
  244    HA   THR  32           HA       THR  32  -0.237  -7.796 -10.681
  245    HB   THR  32           HB       THR  32  -3.165  -7.101 -11.117
  246    HG1  THR  32           1HG      THR  32  -1.745  -9.433 -10.788
  247   1HG2  THR  32          1HG2      THR  32  -0.954  -7.812 -13.083
  248   2HG2  THR  32          2HG2      THR  32  -2.682  -7.653 -13.466
  249   3HG2  THR  32          3HG2      THR  32  -1.764  -6.235 -12.934
  250    H    GLU  33           H        GLU  33  -2.625  -5.117  -9.885
  251    HA   GLU  33           HA       GLU  33  -0.262  -3.312 -10.090
  252   1HB   GLU  33          2HB       GLU  33  -3.040  -3.285 -11.236
  253   2HB   GLU  33          3HB       GLU  33  -2.478  -1.739 -10.575
  254   1HG   GLU  33          2HG       GLU  33  -0.661  -3.382 -12.365
  255   2HG   GLU  33          3HG       GLU  33  -1.947  -2.370 -12.978
  256    H    ALA  34           H        ALA  34  -0.496  -1.332  -9.015
  257    HA   ALA  34           HA       ALA  34  -2.461  -1.087  -6.949
  258   1HB   ALA  34          1HB       ALA  34  -1.067  -2.588  -5.698
  259   2HB   ALA  34          2HB       ALA  34   0.395  -1.616  -6.024
  260   3HB   ALA  34          3HB       ALA  34  -0.894  -0.975  -4.979
  261    H    ILE  35           H        ILE  35  -2.782   1.032  -6.416
  262    HA   ILE  35           HA       ILE  35  -0.744   2.992  -7.436
  263    HB   ILE  35           HB       ILE  35  -3.752   3.410  -7.514
  264   1HG1  ILE  35          2HG1      ILE  35  -3.401   3.396 -10.000
  265   2HG1  ILE  35          3HG1      ILE  35  -1.857   2.576  -9.760
  266   1HG2  ILE  35          1HG2      ILE  35  -1.406   4.953  -8.683
  267   2HG2  ILE  35          2HG2      ILE  35  -3.123   5.371  -8.841
  268   3HG2  ILE  35          3HG2      ILE  35  -2.348   5.435  -7.257
  269   1HD1  ILE  35          1HD1      ILE  35  -4.484   1.455  -8.685
  270   2HD1  ILE  35          2HD1      ILE  35  -3.999   1.226 -10.372
  271   3HD1  ILE  35          3HD1      ILE  35  -2.997   0.564  -9.092
  272    H    VAL  36           H        VAL  36   0.231   3.525  -5.559
  273    HA   VAL  36           HA       VAL  36  -1.310   4.022  -3.099
  274    HB   VAL  36           HB       VAL  36   0.842   2.830  -3.036
  275   1HG1  VAL  36          1HG1      VAL  36   2.941   3.921  -3.424
  276   2HG1  VAL  36          2HG1      VAL  36   1.992   4.133  -4.906
  277   3HG1  VAL  36          3HG1      VAL  36   2.164   5.471  -3.772
  278   1HG2  VAL  36          1HG2      VAL  36   1.858   4.137  -1.210
  279   2HG2  VAL  36          2HG2      VAL  36   0.896   5.546  -1.657
  280   3HG2  VAL  36          3HG2      VAL  36   0.088   4.080  -1.054
  281    H    ASN  37           H        ASN  37  -1.950   6.126  -2.404
  282    HA   ASN  37           HA       ASN  37  -0.932   8.450  -3.984
  283   1HB   ASN  37          2HB       ASN  37  -2.826   8.315  -1.627
  284   2HB   ASN  37          3HB       ASN  37  -2.340   9.775  -2.473
  285   1HD2  ASN  37          1HD2      ASN  37  -3.988   6.622  -2.958
  286   2HD2  ASN  37          2HD2      ASN  37  -4.939   7.158  -4.346
  287    H    PHE  38           H        PHE  38  -1.097   7.433  -0.562
  288    HA   PHE  38           HA       PHE  38  -0.030   8.163   1.313
  289   1HB   PHE  38          2HB       PHE  38   2.337   8.359  -0.600
  290   2HB   PHE  38          3HB       PHE  38   2.460   8.814   1.079
  291    HD1  PHE  38           1HD      PHE  38   0.209   6.020   0.954
  292    HD2  PHE  38           2HD      PHE  38   4.380   7.144   0.809
  293    HE1  PHE  38           1HE      PHE  38   0.835   3.846   1.874
  294    HE2  PHE  38           2HE      PHE  38   4.985   4.852   1.565
  295    HZ   PHE  38           HZ       PHE  38   3.222   3.235   2.159
  296    H    GLY  39           H        GLY  39   1.413  10.203   2.131
  297   1HA   GLY  39          1HA       GLY  39   1.303  12.458   2.528
  298   2HA   GLY  39          2HA       GLY  39   0.671  12.713   0.895
  299    H    ALA  40           H        ALA  40  -0.751  10.508   3.264
  300    HA   ALA  40           HA       ALA  40  -2.566  10.526   4.609
  301   1HB   ALA  40          1HB       ALA  40  -2.737  13.547   4.226
  302   2HB   ALA  40          2HB       ALA  40  -3.566  12.555   5.433
  303   3HB   ALA  40          3HB       ALA  40  -1.799  12.703   5.479
  304    H    SER  41           H        SER  41  -3.328   9.251   2.822
  305    HA   SER  41           HA       SER  41  -5.694  10.308   1.519
  306   1HB   SER  41          2HB       SER  41  -3.132   9.937  -0.032
  307   2HB   SER  41          3HB       SER  41  -4.720   9.759  -0.823
  308    HG   SER  41           HG       SER  41  -4.128  12.032   0.728
  309    H    LYS  42           H        LYS  42  -4.236   7.800  -0.324
  310    HA   LYS  42           HA       LYS  42  -5.296   5.623   1.243
  311   1HB   LYS  42          2HB       LYS  42  -7.110   5.044  -0.327
  312   2HB   LYS  42          3HB       LYS  42  -7.366   6.564   0.511
  313   1HG   LYS  42          2HG       LYS  42  -6.281   7.610  -1.726
  314   2HG   LYS  42          3HG       LYS  42  -6.794   6.055  -2.410
  315   1HD   LYS  42          2HD       LYS  42  -9.065   6.477  -1.372
  316   2HD   LYS  42          3HD       LYS  42  -8.461   8.074  -0.863
  317   1HE   LYS  42          2HE       LYS  42  -8.084   8.674  -3.266
  318   2HE   LYS  42          3HE       LYS  42  -8.752   7.104  -3.747
  319   1HZ   LYS  42          1HZ       LYS  42 -10.398   8.829  -3.876
  320   2HZ   LYS  42          2HZ       LYS  42 -10.833   7.756  -2.710
  321   3HZ   LYS  42          3HZ       LYS  42 -10.208   9.219  -2.294
  322    H    ILE  43           H        ILE  43  -5.216   3.594   0.056
  323    HA   ILE  43           HA       ILE  43  -3.189   3.554  -2.147
  324    HB   ILE  43           HB       ILE  43  -1.995   3.145  -0.160
  325   1HG1  ILE  43          2HG1      ILE  43  -1.276   1.732  -2.034
  326   2HG1  ILE  43          3HG1      ILE  43  -0.958   1.022  -0.454
  327   1HG2  ILE  43          1HG2      ILE  43  -3.635   2.609   1.454
  328   2HG2  ILE  43          2HG2      ILE  43  -4.092   1.125   0.616
  329   3HG2  ILE  43          3HG2      ILE  43  -2.503   1.255   1.393
  330   1HD1  ILE  43          1HD1      ILE  43  -1.606  -0.744  -1.794
  331   2HD1  ILE  43          2HD1      ILE  43  -2.984  -0.431  -0.726
  332   3HD1  ILE  43          3HD1      ILE  43  -3.016   0.093  -2.416
  333    H    THR  44           H        THR  44  -3.964   2.647  -3.918
  334    HA   THR  44           HA       THR  44  -6.247   0.778  -3.773
  335    HB   THR  44           HB       THR  44  -4.917   2.196  -6.084
  336    HG1  THR  44           1HG      THR  44  -7.102   2.969  -6.133
  337   1HG2  THR  44          1HG2      THR  44  -6.852   1.416  -7.442
  338   2HG2  THR  44          2HG2      THR  44  -5.835   0.074  -6.954
  339   3HG2  THR  44          3HG2      THR  44  -7.363   0.381  -6.096
  340    H    VAL  45           H        VAL  45  -6.211  -1.174  -4.664
  341    HA   VAL  45           HA       VAL  45  -3.644  -2.524  -5.376
  342    HB   VAL  45           HB       VAL  45  -5.848  -3.376  -3.488
  343   1HG1  VAL  45          1HG1      VAL  45  -3.266  -4.827  -4.159
  344   2HG1  VAL  45          2HG1      VAL  45  -4.496  -5.395  -3.019
  345   3HG1  VAL  45          3HG1      VAL  45  -4.871  -5.330  -4.749
  346   1HG2  VAL  45          1HG2      VAL  45  -4.457  -1.823  -2.306
  347   2HG2  VAL  45          2HG2      VAL  45  -4.014  -3.435  -1.744
  348   3HG2  VAL  45          3HG2      VAL  45  -2.971  -2.600  -2.913
  349    H    THR  46           H        THR  46  -3.993  -3.834  -7.238
  350    HA   THR  46           HA       THR  46  -6.755  -4.450  -8.112
  351    HB   THR  46           HB       THR  46  -4.791  -2.720  -9.688
  352    HG1  THR  46           1HG      THR  46  -6.644  -2.432  -7.935
  353   1HG2  THR  46          1HG2      THR  46  -7.518  -3.870 -10.493
  354   2HG2  THR  46          2HG2      THR  46  -6.685  -2.551 -11.340
  355   3HG2  THR  46          3HG2      THR  46  -5.977  -4.169 -11.316
  356    H    GLY  47           H        GLY  47  -5.948  -6.412  -7.392
  357   1HA   GLY  47          1HA       GLY  47  -5.014  -7.944  -9.680
  358   2HA   GLY  47          2HA       GLY  47  -3.881  -7.954  -8.328
  359    H    GLU  48           H        GLU  48  -4.222  -9.639  -6.944
  360    HA   GLU  48           HA       GLU  48  -6.919 -10.340  -6.043
  361   1HB   GLU  48          2HB       GLU  48  -5.911 -11.816  -8.098
  362   2HB   GLU  48          3HB       GLU  48  -5.175 -12.693  -6.762
  363   1HG   GLU  48          2HG       GLU  48  -8.136 -12.073  -7.158
  364   2HG   GLU  48          3HG       GLU  48  -7.355 -13.632  -7.450
  365    H    ALA  49           H        ALA  49  -5.523  -8.851  -4.500
  366    HA   ALA  49           HA       ALA  49  -4.612 -10.619  -2.357
  367   1HB   ALA  49          1HB       ALA  49  -2.821  -8.466  -3.572
  368   2HB   ALA  49          2HB       ALA  49  -2.543  -9.252  -2.013
  369   3HB   ALA  49          3HB       ALA  49  -2.490 -10.214  -3.507
  370    H    SER  50           H        SER  50  -4.315  -9.410  -0.356
  371    HA   SER  50           HA       SER  50  -6.204  -7.119  -0.134
  372   1HB   SER  50          2HB       SER  50  -5.465  -9.363   1.793
  373   2HB   SER  50          3HB       SER  50  -6.429  -7.951   2.245
  374    HG   SER  50           HG       SER  50  -7.713  -9.791   1.563
  375    H    ILE  51           H        ILE  51  -5.714  -5.566   1.560
  376    HA   ILE  51           HA       ILE  51  -3.262  -4.503   1.307
  377    HB   ILE  51           HB       ILE  51  -5.445  -3.490   2.325
  378   1HG1  ILE  51          2HG1      ILE  51  -4.212  -1.781   3.470
  379   2HG1  ILE  51          3HG1      ILE  51  -2.724  -2.735   3.293
  380   1HG2  ILE  51          1HG2      ILE  51  -4.071  -4.157   4.953
  381   2HG2  ILE  51          2HG2      ILE  51  -5.585  -3.283   4.704
  382   3HG2  ILE  51          3HG2      ILE  51  -5.516  -5.016   4.349
  383   1HD1  ILE  51          1HD1      ILE  51  -3.951  -2.545   0.677
  384   2HD1  ILE  51          2HD1      ILE  51  -4.035  -0.956   1.415
  385   3HD1  ILE  51          3HD1      ILE  51  -2.467  -1.746   1.242
  386    H    GLN  52           H        GLN  52  -4.102  -6.869   3.803
  387    HA   GLN  52           HA       GLN  52  -2.162  -6.754   5.652
  388   1HB   GLN  52          2HB       GLN  52  -3.283  -9.087   4.097
  389   2HB   GLN  52          3HB       GLN  52  -2.051  -9.384   5.325
  390   1HG   GLN  52          2HG       GLN  52  -4.450  -7.678   6.071
  391   2HG   GLN  52          3HG       GLN  52  -4.598  -9.436   5.965
  392   1HE2  GLN  52          1HE2      GLN  52  -2.769  -6.790   7.761
  393   2HE2  GLN  52          2HE2      GLN  52  -2.343  -7.903   9.033
  394    H    GLN  53           H        GLN  53  -1.493  -7.974   2.333
  395    HA   GLN  53           HA       GLN  53   1.270  -8.627   2.997
  396   1HB   GLN  53          2HB       GLN  53  -0.074  -8.155   0.319
  397   2HB   GLN  53          3HB       GLN  53   1.555  -8.839   0.571
  398   1HG   GLN  53          2HG       GLN  53   0.568 -10.701   1.877
  399   2HG   GLN  53          3HG       GLN  53  -1.060 -10.074   1.554
  400   1HE2  GLN  53          1HE2      GLN  53   0.675 -12.599   0.642
  401   2HE2  GLN  53          2HE2      GLN  53   0.284 -12.645  -1.068
  402    H    VAL  54           H        VAL  54  -0.351  -5.742   1.752
  403    HA   VAL  54           HA       VAL  54   2.065  -4.325   1.011
  404    HB   VAL  54           HB       VAL  54  -0.773  -3.272   1.502
  405   1HG1  VAL  54          1HG1      VAL  54  -0.018  -1.456  -0.032
  406   2HG1  VAL  54          2HG1      VAL  54   0.711  -1.503   1.573
  407   3HG1  VAL  54          3HG1      VAL  54   1.650  -2.051   0.177
  408   1HG2  VAL  54          1HG2      VAL  54   0.528  -4.365  -1.018
  409   2HG2  VAL  54          2HG2      VAL  54  -0.916  -4.989  -0.202
  410   3HG2  VAL  54          3HG2      VAL  54  -0.977  -3.413  -0.988
  411    H    GLU  55           H        GLU  55  -0.207  -4.417   3.732
  412    HA   GLU  55           HA       GLU  55   0.778  -2.488   5.478
  413   1HB   GLU  55          2HB       GLU  55  -1.372  -3.848   5.501
  414   2HB   GLU  55          3HB       GLU  55  -0.436  -5.198   6.157
  415   1HG   GLU  55          2HG       GLU  55   0.076  -3.918   8.152
  416   2HG   GLU  55          3HG       GLU  55  -0.693  -2.477   7.454
  417    H    GLN  56           H        GLN  56   1.577  -6.020   5.173
  418    HA   GLN  56           HA       GLN  56   3.547  -6.188   7.080
  419   1HB   GLN  56          2HB       GLN  56   2.456  -8.018   5.595
  420   2HB   GLN  56          3HB       GLN  56   3.677  -7.598   4.389
  421   1HG   GLN  56          2HG       GLN  56   4.509  -9.439   5.545
  422   2HG   GLN  56          3HG       GLN  56   5.431  -8.051   6.157
  423   1HE2  GLN  56          1HE2      GLN  56   5.671 -10.152   7.760
  424   2HE2  GLN  56          2HE2      GLN  56   4.583 -10.063   9.136
  425    H    ALA  57           H        ALA  57   4.081  -5.286   3.550
  426    HA   ALA  57           HA       ALA  57   6.826  -4.678   3.811
  427   1HB   ALA  57          1HB       ALA  57   4.600  -3.621   2.019
  428   2HB   ALA  57          2HB       ALA  57   6.260  -3.056   1.933
  429   3HB   ALA  57          3HB       ALA  57   5.890  -4.775   1.644
  430    H    GLY  58           H        GLY  58   3.925  -2.642   4.338
  431   1HA   GLY  58          1HA       GLY  58   5.111  -0.193   4.914
  432   2HA   GLY  58          2HA       GLY  58   3.547  -0.768   5.533
  433    H    ALA  59           H        ALA  59   5.185  -3.108   6.887
  434    HA   ALA  59           HA       ALA  59   5.579  -2.196   9.467
  435   1HB   ALA  59          1HB       ALA  59   5.789  -4.557   8.804
  436   2HB   ALA  59          2HB       ALA  59   7.321  -4.187   7.965
  437   3HB   ALA  59          3HB       ALA  59   7.203  -4.013   9.725
  438    H    PHE  60           H        PHE  60   7.694  -1.627   6.620
  439    HA   PHE  60           HA       PHE  60   9.991  -0.773   7.939
  440   1HB   PHE  60          2HB       PHE  60  10.549   0.569   6.028
  441   2HB   PHE  60          3HB       PHE  60   9.979  -1.031   5.583
  442    HD1  PHE  60           1HD      PHE  60   8.806   2.552   5.862
  443    HD2  PHE  60           2HD      PHE  60   8.583  -1.155   3.692
  444    HE1  PHE  60           1HE      PHE  60   7.214   3.582   4.286
  445    HE2  PHE  60           2HE      PHE  60   7.065  -0.098   2.060
  446    HZ   PHE  60           HZ       PHE  60   6.340   2.267   2.361
  447    H    GLU  61           H        GLU  61   6.971   1.069   7.627
  448    HA   GLU  61           HA       GLU  61   8.099   3.110   9.522
  449   1HB   GLU  61          2HB       GLU  61   6.629   3.492   6.926
  450   2HB   GLU  61          3HB       GLU  61   6.366   4.652   8.228
  451   1HG   GLU  61          2HG       GLU  61   9.219   3.988   7.488
  452   2HG   GLU  61          3HG       GLU  61   8.265   5.054   6.435
  453    H    HIS  62           H        HIS  62   6.177   0.551   9.405
  454    HA   HIS  62           HA       HIS  62   4.566  -0.237  10.771
  455   1HB   HIS  62          2HB       HIS  62   4.886   2.262  12.464
  456   2HB   HIS  62          3HB       HIS  62   4.338   0.666  12.970
  457    HD1  HIS  62           1HD      HIS  62   6.908  -0.893  11.516
  458    HD2  HIS  62           2HD      HIS  62   7.021   2.546  13.929
  459    HE1  HIS  62           1HE      HIS  62   9.217  -0.809  12.533
  460    H    LEU  63           H        LEU  63   3.631   0.856   8.501
  461    HA   LEU  63           HA       LEU  63   1.740   2.987   8.890
  462   1HB   LEU  63          2HB       LEU  63   2.182   0.884   6.752
  463   2HB   LEU  63          3HB       LEU  63   0.716   1.870   6.737
  464    HG   LEU  63           HG       LEU  63   1.975   3.934   6.711
  465   1HD1  LEU  63          1HD1      LEU  63   4.453   2.172   6.744
  466   2HD1  LEU  63          2HD1      LEU  63   4.454   3.872   6.285
  467   3HD1  LEU  63          3HD1      LEU  63   4.000   3.436   7.923
  468   1HD2  LEU  63          1HD2      LEU  63   3.160   2.120   4.588
  469   2HD2  LEU  63          2HD2      LEU  63   1.438   2.551   4.613
  470   3HD2  LEU  63          3HD2      LEU  63   2.653   3.821   4.455
  471    H    LYS  64           H        LYS  64  -0.607   2.938   8.907
  472    HA   LYS  64           HA       LYS  64  -1.786   0.379   9.852
  473   1HB   LYS  64          2HB       LYS  64  -3.119   1.669  11.467
  474   2HB   LYS  64          3HB       LYS  64  -1.398   1.622  11.796
  475   1HG   LYS  64          2HG       LYS  64  -1.870   3.732  12.372
  476   2HG   LYS  64          3HG       LYS  64  -1.239   3.990  10.756
  477   1HD   LYS  64          2HD       LYS  64  -3.274   4.769   9.965
  478   2HD   LYS  64          3HD       LYS  64  -4.150   3.497  10.786
  479   1HE   LYS  64          2HE       LYS  64  -4.966   5.392  11.862
  480   2HE   LYS  64          3HE       LYS  64  -3.728   4.848  12.991
  481   1HZ   LYS  64          1HZ       LYS  64  -2.236   6.474  11.857
  482   2HZ   LYS  64          2HZ       LYS  64  -3.537   7.001  10.998
  483   3HZ   LYS  64          3HZ       LYS  64  -3.515   7.174  12.629
  484    H    ILE  65           H        ILE  65  -3.012  -0.217   8.159
  485    HA   ILE  65           HA       ILE  65  -4.344   1.935   6.614
  486    HB   ILE  65           HB       ILE  65  -3.868  -0.784   5.453
  487   1HG1  ILE  65          2HG1      ILE  65  -1.797   1.401   5.657
  488   2HG1  ILE  65          3HG1      ILE  65  -1.708  -0.330   6.066
  489   1HG2  ILE  65          1HG2      ILE  65  -4.104   1.967   4.220
  490   2HG2  ILE  65          2HG2      ILE  65  -4.189   0.448   3.358
  491   3HG2  ILE  65          3HG2      ILE  65  -5.468   0.887   4.486
  492   1HD1  ILE  65          1HD1      ILE  65  -2.251  -0.475   3.382
  493   2HD1  ILE  65          2HD1      ILE  65  -1.265   0.984   3.486
  494   3HD1  ILE  65          3HD1      ILE  65  -0.681  -0.579   4.135
  495    H    ILE  66           H        ILE  66  -6.541   1.919   6.629
  496    HA   ILE  66           HA       ILE  66  -7.835  -0.409   7.957
  497    HB   ILE  66           HB       ILE  66  -8.883   2.421   7.715
  498   1HG1  ILE  66          2HG1      ILE  66  -8.541   1.936  10.394
  499   2HG1  ILE  66          3HG1      ILE  66  -7.178   1.016   9.764
  500   1HG2  ILE  66          1HG2      ILE  66  -9.885   0.005   9.287
  501   2HG2  ILE  66          2HG2      ILE  66 -10.573   1.639   9.327
  502   3HG2  ILE  66          3HG2      ILE  66 -10.661   0.692   7.842
  503   1HD1  ILE  66          1HD1      ILE  66  -7.796   3.966   9.256
  504   2HD1  ILE  66          2HD1      ILE  66  -6.553   3.323  10.341
  505   3HD1  ILE  66          3HD1      ILE  66  -6.389   3.107   8.589
  506    HA   PRO  67           HA       PRO  67  -9.873  -0.945   3.874
  507   1HB   PRO  67          2HB       PRO  67 -11.649  -2.886   4.600
  508   2HB   PRO  67          3HB       PRO  67  -9.934  -3.246   4.281
  509   1HG   PRO  67          2HG       PRO  67 -11.267  -2.845   6.954
  510   2HG   PRO  67          3HG       PRO  67 -10.101  -4.113   6.482
  511   1HD   PRO  67          2HD       PRO  67  -9.399  -1.870   7.848
  512   2HD   PRO  67          3HD       PRO  67  -8.278  -2.617   6.672
  513    H    GLU  68           H        GLU  68 -10.879   0.994   3.700
  514    HA   GLU  68           HA       GLU  68 -12.851   2.045   5.383
  515   1HB   GLU  68          2HB       GLU  68 -12.009   2.425   2.527
  516   2HB   GLU  68          3HB       GLU  68 -13.678   2.886   2.859
  517   1HG   GLU  68          2HG       GLU  68 -11.411   3.825   4.620
  518   2HG   GLU  68          3HG       GLU  68 -11.953   4.716   3.171
  519    H    LYS  69           H        LYS  69 -15.151   2.304   4.935
  520    HA   LYS  69           HA       LYS  69 -16.230  -0.427   4.775
  521   1HB   LYS  69          2HB       LYS  69 -16.999   1.714   6.284
  522   2HB   LYS  69          3HB       LYS  69 -18.142   1.860   4.942
  523   1HG   LYS  69          2HG       LYS  69 -19.179   0.497   6.631
  524   2HG   LYS  69          3HG       LYS  69 -18.734  -0.574   5.306
  525   1HD   LYS  69          2HD       LYS  69 -16.447  -0.714   6.883
  526   2HD   LYS  69          3HD       LYS  69 -17.649  -0.359   8.112
  527   1HE   LYS  69          2HE       LYS  69 -18.941  -2.351   7.527
  528   2HE   LYS  69          3HE       LYS  69 -17.964  -2.624   6.073
  529   1HZ   LYS  69          1HZ       LYS  69 -16.077  -3.070   7.441
  530   2HZ   LYS  69          2HZ       LYS  69 -16.943  -2.823   8.821
  531   3HZ   LYS  69          3HZ       LYS  69 -17.313  -4.080   7.827
  532    H    GLU  70           H        GLU  70 -17.765  -1.235   3.322
  533    HA   GLU  70           HA       GLU  70 -17.246  -0.556   0.599
  534   1HB   GLU  70          2HB       GLU  70 -19.188  -2.433   1.992
  535   2HB   GLU  70          3HB       GLU  70 -19.152  -2.263   0.237
  536   1HG   GLU  70          2HG       GLU  70 -16.549  -2.868   1.660
  537   2HG   GLU  70          3HG       GLU  70 -17.738  -4.152   1.379
  538    H    ALA  71           H        ALA  71 -17.792   1.698   0.826
  539    HA   ALA  71           HA       ALA  71 -18.941   3.383  -0.169
  540   1HB   ALA  71          1HB       ALA  71 -21.071   3.183  -1.208
  541   2HB   ALA  71          2HB       ALA  71 -20.179   1.697  -1.591
  542   3HB   ALA  71          3HB       ALA  71 -21.456   1.688  -0.350
  Start of MODEL   10
    1   1H    MET   1           H1       MET   1 -16.724  -9.471 -10.219
    2   2H    MET   1           H2       MET   1 -17.907  -8.876 -11.240
    3   3H    MET   1           H3       MET   1 -16.692  -9.866 -11.799
    4    HA   MET   1           HA       MET   1 -16.019  -7.756 -12.428
    5   1HB   MET   1          2HB       MET   1 -17.657  -6.725 -10.684
    6   2HB   MET   1          3HB       MET   1 -16.320  -6.845  -9.533
    7   1HG   MET   1          2HG       MET   1 -14.962  -5.374 -11.034
    8   2HG   MET   1          3HG       MET   1 -16.314  -5.339 -12.186
    9   1HE   MET   1          1HE       MET   1 -15.013  -2.688 -11.353
   10   2HE   MET   1          2HE       MET   1 -16.494  -2.761 -12.340
   11   3HE   MET   1          3HE       MET   1 -16.423  -1.692 -10.922
   12    H    ALA   2           H        ALA   2 -13.675  -6.984 -11.944
   13    HA   ALA   2           HA       ALA   2 -12.109  -9.229 -11.023
   14   1HB   ALA   2          1HB       ALA   2 -11.290  -6.367 -11.691
   15   2HB   ALA   2          2HB       ALA   2 -10.195  -7.751 -11.495
   16   3HB   ALA   2          3HB       ALA   2 -11.355  -7.728 -12.838
   17    H    GLU   3           H        GLU   3 -10.599  -9.228  -9.215
   18    HA   GLU   3           HA       GLU   3 -11.709  -8.073  -6.834
   19   1HB   GLU   3          2HB       GLU   3 -10.481 -10.313  -7.007
   20   2HB   GLU   3          3HB       GLU   3  -8.986  -9.383  -7.165
   21   1HG   GLU   3          2HG       GLU   3  -9.078  -9.910  -4.892
   22   2HG   GLU   3          3HG       GLU   3  -9.704  -8.259  -4.901
   23    H    LYS   4           H        LYS   4 -11.584  -5.952  -6.531
   24    HA   LYS   4           HA       LYS   4  -8.959  -4.617  -6.583
   25   1HB   LYS   4          2HB       LYS   4  -9.973  -2.575  -7.517
   26   2HB   LYS   4          3HB       LYS   4  -9.886  -3.889  -8.679
   27   1HG   LYS   4          2HG       LYS   4 -12.168  -4.384  -8.589
   28   2HG   LYS   4          3HG       LYS   4 -12.498  -3.403  -7.175
   29   1HD   LYS   4          2HD       LYS   4 -11.434  -2.120  -9.722
   30   2HD   LYS   4          3HD       LYS   4 -13.131  -2.571  -9.578
   31   1HE   LYS   4          2HE       LYS   4 -12.833  -0.216  -8.985
   32   2HE   LYS   4          3HE       LYS   4 -13.482  -1.163  -7.640
   33   1HZ   LYS   4          1HZ       LYS   4 -11.309  -1.206  -6.674
   34   2HZ   LYS   4          2HZ       LYS   4 -10.660  -0.373  -7.937
   35   3HZ   LYS   4          3HZ       LYS   4 -11.756   0.354  -6.945
   36    H    THR   5           H        THR   5  -8.636  -3.323  -4.780
   37    HA   THR   5           HA       THR   5 -10.961  -2.351  -3.296
   38    HB   THR   5           HB       THR   5  -8.959  -4.262  -1.976
   39    HG1  THR   5           1HG      THR   5 -11.372  -4.368  -3.128
   40   1HG2  THR   5          1HG2      THR   5  -9.676  -2.509  -0.327
   41   2HG2  THR   5          2HG2      THR   5 -11.366  -2.741  -0.822
   42   3HG2  THR   5          3HG2      THR   5 -10.495  -4.040   0.004
   43    H    VAL   6           H        VAL   6 -10.388  -0.708  -1.818
   44    HA   VAL   6           HA       VAL   6  -7.644  -0.005  -1.898
   45    HB   VAL   6           HB       VAL   6  -8.536   1.274  -3.674
   46   1HG1  VAL   6          1HG1      VAL   6 -10.888   1.040  -3.396
   47   2HG1  VAL   6          2HG1      VAL   6 -10.878   2.129  -1.982
   48   3HG1  VAL   6          3HG1      VAL   6 -10.468   2.737  -3.608
   49   1HG2  VAL   6          1HG2      VAL   6  -7.152   2.710  -2.129
   50   2HG2  VAL   6          2HG2      VAL   6  -8.352   3.630  -3.037
   51   3HG2  VAL   6          3HG2      VAL   6  -8.650   3.231  -1.329
   52    H    TYR   7           H        TYR   7  -6.855   1.087  -0.122
   53    HA   TYR   7           HA       TYR   7  -8.628   0.900   2.283
   54   1HB   TYR   7          2HB       TYR   7  -5.739  -0.006   2.074
   55   2HB   TYR   7          3HB       TYR   7  -6.868  -0.264   3.401
   56    HD1  TYR   7           HD1      TYR   7  -6.119  -1.206  -0.156
   57    HD2  TYR   7           HD2      TYR   7  -7.962  -2.329   3.567
   58    HE1  TYR   7           HE1      TYR   7  -6.588  -3.448  -1.067
   59    HE2  TYR   7           HE2      TYR   7  -8.403  -4.593   2.661
   60    HH   TYR   7           HH       TYR   7  -7.625  -5.507  -0.686
   61    H    ARG   8           H        ARG   8  -8.226   2.539   3.851
   62    HA   ARG   8           HA       ARG   8  -6.826   4.856   2.740
   63   1HB   ARG   8          2HB       ARG   8  -9.195   4.777   3.934
   64   2HB   ARG   8          3HB       ARG   8  -8.232   4.794   5.427
   65   1HG   ARG   8          2HG       ARG   8  -6.963   6.774   4.389
   66   2HG   ARG   8          3HG       ARG   8  -8.177   6.734   3.097
   67   1HD   ARG   8          2HD       ARG   8  -9.956   7.161   4.848
   68   2HD   ARG   8          3HD       ARG   8  -8.680   7.207   6.069
   69    HE   ARG   8           HE       ARG   8  -7.973   9.260   5.382
   70   1HH1  ARG   8          2HH2      ARG   8 -10.219   7.956   2.922
   71   2HH1  ARG   8          1HH2      ARG   8 -10.309   9.446   2.035
   72   1HH2  ARG   8          2HH1      ARG   8  -7.845  11.100   4.012
   73   2HH2  ARG   8          1HH1      ARG   8  -8.824  11.226   2.585
   74    H    VAL   9           H        VAL   9  -4.905   5.706   3.588
   75    HA   VAL   9           HA       VAL   9  -3.651   4.275   5.884
   76    HB   VAL   9           HB       VAL   9  -2.388   3.441   4.143
   77   1HG1  VAL   9          1HG1      VAL   9  -3.304   4.542   2.223
   78   2HG1  VAL   9          2HG1      VAL   9  -2.574   6.101   2.686
   79   3HG1  VAL   9          3HG1      VAL   9  -1.563   4.733   2.178
   80   1HG2  VAL   9          1HG2      VAL   9  -0.878   6.011   4.612
   81   2HG2  VAL   9          2HG2      VAL   9  -1.011   4.714   5.843
   82   3HG2  VAL   9          3HG2      VAL   9  -0.242   4.389   4.317
   83    H    ASP  10           H        ASP  10  -2.483   5.491   7.290
   84    HA   ASP  10           HA       ASP  10  -2.004   8.341   6.771
   85   1HB   ASP  10          2HB       ASP  10  -3.752   7.188   8.973
   86   2HB   ASP  10          3HB       ASP  10  -2.670   8.518   9.372
   87    H    GLY  11           H        GLY  11  -0.101   8.983   7.857
   88   1HA   GLY  11          1HA       GLY  11   1.118   8.410  10.038
   89   2HA   GLY  11          2HA       GLY  11   1.510   6.877   9.248
   90    H    LEU  12           H        LEU  12   2.441   7.130   6.995
   91    HA   LEU  12           HA       LEU  12   4.881   8.569   7.148
   92   1HB   LEU  12          2HB       LEU  12   5.371   7.633   5.015
   93   2HB   LEU  12          3HB       LEU  12   4.587   6.437   5.996
   94    HG   LEU  12           HG       LEU  12   3.537   6.018   4.049
   95   1HD1  LEU  12          1HD1      LEU  12   1.606   6.484   5.333
   96   2HD1  LEU  12          2HD1      LEU  12   1.643   8.208   4.907
   97   3HD1  LEU  12          3HD1      LEU  12   1.357   7.007   3.673
   98   1HD2  LEU  12          1HD2      LEU  12   4.491   7.316   2.432
   99   2HD2  LEU  12          2HD2      LEU  12   2.948   8.190   2.490
  100   3HD2  LEU  12          3HD2      LEU  12   4.335   8.815   3.347
  101    H    SER  13           H        SER  13   5.704  10.097   5.431
  102    HA   SER  13           HA       SER  13   3.758  11.599   3.876
  103   1HB   SER  13          2HB       SER  13   4.149  13.772   4.961
  104   2HB   SER  13          3HB       SER  13   3.379  12.647   6.088
  105    HG   SER  13           HG       SER  13   6.156  13.213   5.907
  106    H    CYS  14           H        CYS  14   5.559  10.321   2.566
  107    HA   CYS  14           HA       CYS  14   7.292  12.408   1.572
  108   1HB   CYS  14          2HB       CYS  14   8.669  11.431   3.479
  109   2HB   CYS  14          3HB       CYS  14   8.683   9.890   2.595
  110    HG   CYS  14           HG       CYS  14   9.654  10.916   0.376
  111    H    THR  15           H        THR  15   7.634  12.117  -0.615
  112    HA   THR  15           HA       THR  15   6.178  10.234  -2.118
  113    HB   THR  15           HB       THR  15   7.883  11.010  -3.910
  114    HG1  THR  15           1HG      THR  15   9.226  12.701  -3.188
  115   1HG2  THR  15          1HG2      THR  15   5.690  12.116  -3.586
  116   2HG2  THR  15          2HG2      THR  15   6.374  13.135  -2.303
  117   3HG2  THR  15          3HG2      THR  15   6.946  13.303  -3.975
  118    H    ASN  16           H        ASN  16   9.655  10.356  -1.383
  119    HA   ASN  16           HA       ASN  16  10.626   8.001  -2.282
  120   1HB   ASN  16          2HB       ASN  16  11.107   9.001   0.558
  121   2HB   ASN  16          3HB       ASN  16  12.141   7.884  -0.340
  122   1HD2  ASN  16          1HD2      ASN  16  12.993  10.428   0.781
  123   2HD2  ASN  16          2HD2      ASN  16  13.482  11.415  -0.584
  124    H    CYS  17           H        CYS  17   8.736   8.209   0.805
  125    HA   CYS  17           HA       CYS  17   8.885   5.374   1.331
  126   1HB   CYS  17          2HB       CYS  17   7.143   7.611   2.430
  127   2HB   CYS  17          3HB       CYS  17   6.817   5.904   2.780
  128    HG   CYS  17           HG       CYS  17   8.064   6.667   4.831
  129    H    ALA  18           H        ALA  18   6.443   7.490  -0.239
  130    HA   ALA  18           HA       ALA  18   4.526   5.478  -0.751
  131   1HB   ALA  18          1HB       ALA  18   4.193   7.944  -1.106
  132   2HB   ALA  18          2HB       ALA  18   5.186   7.842  -2.571
  133   3HB   ALA  18          3HB       ALA  18   3.665   6.953  -2.485
  134    H    ALA  19           H        ALA  19   7.327   6.483  -2.672
  135    HA   ALA  19           HA       ALA  19   6.938   4.770  -4.904
  136   1HB   ALA  19          1HB       ALA  19   9.527   5.921  -3.787
  137   2HB   ALA  19          2HB       ALA  19   9.294   5.230  -5.405
  138   3HB   ALA  19          3HB       ALA  19   8.432   6.710  -4.941
  139    H    LYS  20           H        LYS  20   8.927   4.387  -1.920
  140    HA   LYS  20           HA       LYS  20   9.871   1.784  -2.450
  141   1HB   LYS  20          2HB       LYS  20  10.254   3.514  -0.373
  142   2HB   LYS  20          3HB       LYS  20   9.058   2.459   0.375
  143   1HG   LYS  20          2HG       LYS  20  11.054   1.384   0.937
  144   2HG   LYS  20          3HG       LYS  20  10.590   0.510  -0.530
  145   1HD   LYS  20          2HD       LYS  20  11.998   2.438  -1.741
  146   2HD   LYS  20          3HD       LYS  20  12.681   2.681  -0.125
  147   1HE   LYS  20          2HE       LYS  20  13.364   0.248  -0.102
  148   2HE   LYS  20          3HE       LYS  20  12.694   0.072  -1.734
  149   1HZ   LYS  20          1HZ       LYS  20  15.035   0.415  -1.829
  150   2HZ   LYS  20          2HZ       LYS  20  14.291   1.727  -2.480
  151   3HZ   LYS  20          3HZ       LYS  20  14.944   1.815  -0.972
  152    H    PHE  21           H        PHE  21   6.893   2.859  -0.828
  153    HA   PHE  21           HA       PHE  21   5.820   0.359  -0.207
  154   1HB   PHE  21          2HB       PHE  21   4.825   3.128  -0.360
  155   2HB   PHE  21          3HB       PHE  21   3.622   1.983  -0.870
  156    HD1  PHE  21           1HD      PHE  21   4.407   3.787   1.827
  157    HD2  PHE  21           2HD      PHE  21   3.717  -0.327   0.714
  158    HE1  PHE  21           1HE      PHE  21   3.446   3.355   4.028
  159    HE2  PHE  21           2HE      PHE  21   2.788  -0.775   2.963
  160    HZ   PHE  21           HZ       PHE  21   2.520   1.083   4.575
  161    H    GLU  22           H        GLU  22   4.997   2.355  -3.188
  162    HA   GLU  22           HA       GLU  22   3.272   0.327  -4.168
  163   1HB   GLU  22          2HB       GLU  22   3.318   1.347  -6.305
  164   2HB   GLU  22          3HB       GLU  22   3.306   2.626  -5.098
  165   1HG   GLU  22          2HG       GLU  22   5.726   2.969  -5.432
  166   2HG   GLU  22          3HG       GLU  22   5.689   1.724  -6.704
  167    H    ARG  23           H        ARG  23   6.745   0.825  -4.644
  168    HA   ARG  23           HA       ARG  23   7.125  -1.296  -6.472
  169   1HB   ARG  23          2HB       ARG  23   8.696   0.605  -5.673
  170   2HB   ARG  23          3HB       ARG  23   9.227  -0.514  -4.406
  171   1HG   ARG  23          2HG       ARG  23   9.991  -2.109  -6.125
  172   2HG   ARG  23          3HG       ARG  23   9.215  -1.137  -7.398
  173   1HD   ARG  23          2HD       ARG  23  10.671   0.808  -6.668
  174   2HD   ARG  23          3HD       ARG  23  11.620  -0.362  -5.712
  175    HE   ARG  23           HE       ARG  23  11.572  -1.538  -8.157
  176   1HH1  ARG  23          2HH2      ARG  23  12.479   1.704  -7.109
  177   2HH1  ARG  23          1HH2      ARG  23  13.453   2.073  -8.497
  178   1HH2  ARG  23          2HH1      ARG  23  12.849  -1.079 -10.045
  179   2HH2  ARG  23          1HH1      ARG  23  13.690   0.429 -10.191
  180    H    ASN  24           H        ASN  24   7.355  -1.327  -2.855
  181    HA   ASN  24           HA       ASN  24   7.808  -4.079  -2.457
  182   1HB   ASN  24          2HB       ASN  24   6.133  -2.079  -0.866
  183   2HB   ASN  24          3HB       ASN  24   6.199  -3.781  -0.458
  184   1HD2  ASN  24          1HD2      ASN  24   6.870  -2.435   1.553
  185   2HD2  ASN  24          2HD2      ASN  24   8.592  -2.503   1.820
  186    H    VAL  25           H        VAL  25   4.641  -2.409  -2.961
  187    HA   VAL  25           HA       VAL  25   3.111  -4.836  -2.868
  188    HB   VAL  25           HB       VAL  25   2.420  -2.231  -4.310
  189   1HG1  VAL  25          1HG1      VAL  25   0.740  -4.605  -3.396
  190   2HG1  VAL  25          2HG1      VAL  25   0.066  -3.030  -3.846
  191   3HG1  VAL  25          3HG1      VAL  25   0.954  -3.972  -5.046
  192   1HG2  VAL  25          1HG2      VAL  25   2.788  -1.681  -1.988
  193   2HG2  VAL  25          2HG2      VAL  25   1.054  -1.871  -2.164
  194   3HG2  VAL  25          3HG2      VAL  25   2.034  -3.177  -1.455
  195    H    LYS  26           H        LYS  26   4.530  -3.119  -5.646
  196    HA   LYS  26           HA       LYS  26   3.670  -4.881  -7.698
  197   1HB   LYS  26          2HB       LYS  26   5.857  -2.860  -7.314
  198   2HB   LYS  26          3HB       LYS  26   5.980  -3.918  -8.706
  199   1HG   LYS  26          2HG       LYS  26   4.194  -3.019  -9.760
  200   2HG   LYS  26          3HG       LYS  26   3.294  -2.701  -8.262
  201   1HD   LYS  26          2HD       LYS  26   4.534  -0.711  -7.797
  202   2HD   LYS  26          3HD       LYS  26   5.672  -1.023  -9.120
  203   1HE   LYS  26          2HE       LYS  26   3.752  -0.840 -10.744
  204   2HE   LYS  26          3HE       LYS  26   2.657  -0.494  -9.394
  205   1HZ   LYS  26          1HZ       LYS  26   3.906   1.559  -8.991
  206   2HZ   LYS  26          2HZ       LYS  26   4.940   1.205 -10.189
  207   3HZ   LYS  26          3HZ       LYS  26   3.362   1.505 -10.513
  208    H    GLU  27           H        GLU  27   6.496  -5.173  -5.481
  209    HA   GLU  27           HA       GLU  27   7.545  -7.496  -6.786
  210   1HB   GLU  27          2HB       GLU  27   7.819  -6.499  -3.926
  211   2HB   GLU  27          3HB       GLU  27   8.670  -7.902  -4.569
  212   1HG   GLU  27          2HG       GLU  27   9.783  -6.562  -6.264
  213   2HG   GLU  27          3HG       GLU  27   8.875  -5.120  -5.796
  214    H    ILE  28           H        ILE  28   4.594  -7.212  -4.913
  215    HA   ILE  28           HA       ILE  28   4.679  -9.962  -3.929
  216    HB   ILE  28           HB       ILE  28   2.334  -8.147  -4.227
  217   1HG1  ILE  28          2HG1      ILE  28   4.037  -8.510  -1.716
  218   2HG1  ILE  28          3HG1      ILE  28   4.116  -7.108  -2.784
  219   1HG2  ILE  28          1HG2      ILE  28   2.689 -10.469  -2.297
  220   2HG2  ILE  28          2HG2      ILE  28   1.210  -9.532  -2.603
  221   3HG2  ILE  28          3HG2      ILE  28   1.835 -10.602  -3.845
  222   1HD1  ILE  28          1HD1      ILE  28   1.700  -6.647  -2.374
  223   2HD1  ILE  28          2HD1      ILE  28   1.696  -7.937  -1.165
  224   3HD1  ILE  28          3HD1      ILE  28   2.723  -6.518  -0.926
  225    H    GLU  29           H        GLU  29   4.472 -11.584  -5.270
  226    HA   GLU  29           HA       GLU  29   3.195 -11.533  -7.890
  227   1HB   GLU  29          2HB       GLU  29   4.732 -13.491  -6.140
  228   2HB   GLU  29          3HB       GLU  29   3.815 -14.099  -7.495
  229   1HG   GLU  29          2HG       GLU  29   5.772 -11.837  -7.956
  230   2HG   GLU  29          3HG       GLU  29   6.322 -13.519  -7.865
  231    H    GLY  30           H        GLY  30   1.388 -10.719  -6.609
  232   1HA   GLY  30          1HA       GLY  30  -0.752 -12.767  -6.408
  233   2HA   GLY  30          2HA       GLY  30  -0.438 -11.837  -4.933
  234    H    VAL  31           H        VAL  31   0.190  -9.268  -6.326
  235    HA   VAL  31           HA       VAL  31  -2.550  -8.450  -6.949
  236    HB   VAL  31           HB       VAL  31  -1.077  -7.285  -5.310
  237   1HG1  VAL  31          1HG1      VAL  31   0.690  -5.797  -6.155
  238   2HG1  VAL  31          2HG1      VAL  31   1.099  -7.490  -6.367
  239   3HG1  VAL  31          3HG1      VAL  31   0.568  -6.525  -7.761
  240   1HG2  VAL  31          1HG2      VAL  31  -2.938  -6.177  -6.556
  241   2HG2  VAL  31          2HG2      VAL  31  -1.696  -5.107  -5.876
  242   3HG2  VAL  31          3HG2      VAL  31  -1.701  -5.442  -7.615
  243    H    THR  32           H        THR  32  -2.641  -6.831  -8.861
  244    HA   THR  32           HA       THR  32  -0.879  -7.629 -11.134
  245    HB   THR  32           HB       THR  32  -3.849  -6.953 -11.262
  246    HG1  THR  32           1HG      THR  32  -2.377  -9.324 -11.136
  247   1HG2  THR  32          1HG2      THR  32  -3.615  -7.685 -13.623
  248   2HG2  THR  32          2HG2      THR  32  -2.686  -6.218 -13.278
  249   3HG2  THR  32          3HG2      THR  32  -1.853  -7.782 -13.412
  250    H    GLU  33           H        GLU  33  -3.248  -5.124 -10.021
  251    HA   GLU  33           HA       GLU  33  -1.115  -3.082 -10.719
  252   1HB   GLU  33          2HB       GLU  33  -4.097  -2.846 -11.278
  253   2HB   GLU  33          3HB       GLU  33  -2.931  -1.522 -11.304
  254   1HG   GLU  33          2HG       GLU  33  -1.716  -3.468 -12.936
  255   2HG   GLU  33          3HG       GLU  33  -3.435  -3.587 -13.337
  256    H    ALA  34           H        ALA  34  -0.630  -1.680  -9.102
  257    HA   ALA  34           HA       ALA  34  -2.632  -1.351  -6.922
  258   1HB   ALA  34          1HB       ALA  34   0.382  -1.650  -6.580
  259   2HB   ALA  34          2HB       ALA  34  -0.779  -1.208  -5.306
  260   3HB   ALA  34          3HB       ALA  34  -0.868  -2.809  -6.072
  261    H    ILE  35           H        ILE  35  -3.139   0.771  -6.618
  262    HA   ILE  35           HA       ILE  35  -1.372   2.805  -7.938
  263    HB   ILE  35           HB       ILE  35  -4.392   3.052  -7.623
  264   1HG1  ILE  35          2HG1      ILE  35  -4.141   2.882 -10.246
  265   2HG1  ILE  35          3HG1      ILE  35  -2.747   1.867  -9.861
  266   1HG2  ILE  35          1HG2      ILE  35  -3.034   5.130  -7.708
  267   2HG2  ILE  35          2HG2      ILE  35  -2.325   4.587  -9.242
  268   3HG2  ILE  35          3HG2      ILE  35  -4.062   4.935  -9.132
  269   1HD1  ILE  35          1HD1      ILE  35  -5.635   1.442  -8.941
  270   2HD1  ILE  35          2HD1      ILE  35  -4.832   0.578 -10.262
  271   3HD1  ILE  35          3HD1      ILE  35  -4.296   0.328  -8.599
  272    H    VAL  36           H        VAL  36  -0.161   3.269  -6.087
  273    HA   VAL  36           HA       VAL  36  -1.671   3.598  -3.584
  274    HB   VAL  36           HB       VAL  36   0.194   3.346  -2.452
  275   1HG1  VAL  36          1HG1      VAL  36   1.316   1.386  -3.238
  276   2HG1  VAL  36          2HG1      VAL  36  -0.336   1.322  -3.873
  277   3HG1  VAL  36          3HG1      VAL  36   1.000   1.788  -4.935
  278   1HG2  VAL  36          1HG2      VAL  36   1.603   5.117  -3.286
  279   2HG2  VAL  36          2HG2      VAL  36   2.537   3.625  -3.361
  280   3HG2  VAL  36          3HG2      VAL  36   1.815   4.295  -4.845
  281    H    ASN  37           H        ASN  37  -2.014   5.559  -2.533
  282    HA   ASN  37           HA       ASN  37  -0.542   7.947  -3.584
  283   1HB   ASN  37          2HB       ASN  37  -3.452   7.860  -2.702
  284   2HB   ASN  37          3HB       ASN  37  -2.518   9.300  -3.147
  285   1HD2  ASN  37          1HD2      ASN  37  -4.280   6.507  -4.372
  286   2HD2  ASN  37          2HD2      ASN  37  -4.186   6.998  -6.055
  287    H    PHE  38           H        PHE  38   0.469   6.275  -1.687
  288    HA   PHE  38           HA       PHE  38  -0.083   6.885   1.019
  289   1HB   PHE  38          2HB       PHE  38   2.461   6.240  -0.487
  290   2HB   PHE  38          3HB       PHE  38   2.457   6.460   1.248
  291    HD1  PHE  38           1HD      PHE  38   2.154   4.002  -1.248
  292    HD2  PHE  38           2HD      PHE  38   1.036   5.037   2.721
  293    HE1  PHE  38           1HE      PHE  38   1.322   1.675  -0.896
  294    HE2  PHE  38           2HE      PHE  38   0.420   2.664   3.159
  295    HZ   PHE  38           HZ       PHE  38   0.509   1.006   1.342
  296    H    GLY  39           H        GLY  39  -0.011   8.789   2.078
  297   1HA   GLY  39          1HA       GLY  39   1.916  10.615   2.366
  298   2HA   GLY  39          2HA       GLY  39   1.202  11.174   0.839
  299    H    ALA  40           H        ALA  40  -1.423  10.861   1.024
  300    HA   ALA  40           HA       ALA  40  -2.536  11.642   3.608
  301   1HB   ALA  40          1HB       ALA  40  -2.344  13.714   1.373
  302   2HB   ALA  40          2HB       ALA  40  -3.234  13.912   2.897
  303   3HB   ALA  40          3HB       ALA  40  -1.473  13.781   2.918
  304    H    SER  41           H        SER  41  -3.070   9.510   1.730
  305    HA   SER  41           HA       SER  41  -5.859  10.111   0.921
  306   1HB   SER  41          2HB       SER  41  -3.633   9.454  -1.007
  307   2HB   SER  41          3HB       SER  41  -5.350   9.290  -1.396
  308    HG   SER  41           HG       SER  41  -4.326  11.334  -1.992
  309    H    LYS  42           H        LYS  42  -4.386   7.459  -0.704
  310    HA   LYS  42           HA       LYS  42  -5.033   5.453   1.217
  311   1HB   LYS  42          2HB       LYS  42  -6.937   4.489  -0.160
  312   2HB   LYS  42          3HB       LYS  42  -7.338   5.888   0.809
  313   1HG   LYS  42          2HG       LYS  42  -6.464   6.592  -1.935
  314   2HG   LYS  42          3HG       LYS  42  -7.849   5.538  -1.917
  315   1HD   LYS  42          2HD       LYS  42  -8.163   7.756   0.040
  316   2HD   LYS  42          3HD       LYS  42  -7.859   8.315  -1.597
  317   1HE   LYS  42          2HE       LYS  42 -10.245   8.154  -1.306
  318   2HE   LYS  42          3HE       LYS  42  -9.718   6.937  -2.470
  319   1HZ   LYS  42          1HZ       LYS  42 -10.502   6.409   0.375
  320   2HZ   LYS  42          2HZ       LYS  42 -11.293   5.982  -0.907
  321   3HZ   LYS  42          3HZ       LYS  42  -9.845   5.298  -0.623
  322    H    ILE  43           H        ILE  43  -4.992   3.272   0.194
  323    HA   ILE  43           HA       ILE  43  -3.054   3.194  -2.063
  324    HB   ILE  43           HB       ILE  43  -1.880   2.689  -0.114
  325   1HG1  ILE  43          2HG1      ILE  43  -1.559   1.123  -2.072
  326   2HG1  ILE  43          3HG1      ILE  43  -0.936   0.623  -0.499
  327   1HG2  ILE  43          1HG2      ILE  43  -2.471   0.843   1.450
  328   2HG2  ILE  43          2HG2      ILE  43  -3.498   2.274   1.567
  329   3HG2  ILE  43          3HG2      ILE  43  -4.093   0.817   0.748
  330   1HD1  ILE  43          1HD1      ILE  43  -3.407  -0.528  -1.795
  331   2HD1  ILE  43          2HD1      ILE  43  -1.812  -1.262  -1.573
  332   3HD1  ILE  43          3HD1      ILE  43  -2.816  -0.921  -0.166
  333    H    THR  44           H        THR  44  -3.971   2.299  -3.907
  334    HA   THR  44           HA       THR  44  -6.248   0.437  -3.517
  335    HB   THR  44           HB       THR  44  -5.182   1.795  -5.993
  336    HG1  THR  44           1HG      THR  44  -7.381   2.580  -5.781
  337   1HG2  THR  44          1HG2      THR  44  -6.168  -0.349  -6.664
  338   2HG2  THR  44          2HG2      THR  44  -7.576  -0.051  -5.621
  339   3HG2  THR  44          3HG2      THR  44  -7.282   0.951  -7.054
  340    H    VAL  45           H        VAL  45  -6.225  -1.531  -4.275
  341    HA   VAL  45           HA       VAL  45  -3.802  -2.773  -5.461
  342    HB   VAL  45           HB       VAL  45  -5.244  -3.472  -2.914
  343   1HG1  VAL  45          1HG1      VAL  45  -5.678  -5.507  -4.160
  344   2HG1  VAL  45          2HG1      VAL  45  -3.991  -5.568  -4.718
  345   3HG1  VAL  45          3HG1      VAL  45  -4.364  -5.784  -3.003
  346   1HG2  VAL  45          1HG2      VAL  45  -2.969  -2.393  -3.086
  347   2HG2  VAL  45          2HG2      VAL  45  -3.006  -3.889  -2.126
  348   3HG2  VAL  45          3HG2      VAL  45  -2.357  -3.897  -3.782
  349    H    THR  46           H        THR  46  -4.336  -4.051  -7.179
  350    HA   THR  46           HA       THR  46  -7.040  -5.133  -7.449
  351    HB   THR  46           HB       THR  46  -5.627  -3.337  -9.496
  352    HG1  THR  46           1HG      THR  46  -7.330  -3.119  -7.559
  353   1HG2  THR  46          1HG2      THR  46  -6.648  -5.197 -10.740
  354   2HG2  THR  46          2HG2      THR  46  -8.143  -5.052  -9.792
  355   3HG2  THR  46          3HG2      THR  46  -7.660  -3.753 -10.905
  356    H    GLY  47           H        GLY  47  -6.967  -7.098  -8.195
  357   1HA   GLY  47          1HA       GLY  47  -5.443  -8.224 -10.089
  358   2HA   GLY  47          2HA       GLY  47  -4.276  -8.216  -8.786
  359    H    GLU  48           H        GLU  48  -4.465  -9.497  -7.004
  360    HA   GLU  48           HA       GLU  48  -6.885 -10.773  -6.158
  361   1HB   GLU  48          2HB       GLU  48  -6.096 -12.188  -8.142
  362   2HB   GLU  48          3HB       GLU  48  -4.707 -12.664  -7.168
  363   1HG   GLU  48          2HG       GLU  48  -6.001 -14.064  -5.858
  364   2HG   GLU  48          3HG       GLU  48  -7.403 -12.985  -5.877
  365    H    ALA  49           H        ALA  49  -5.400  -8.955  -4.824
  366    HA   ALA  49           HA       ALA  49  -4.343 -10.518  -2.559
  367   1HB   ALA  49          1HB       ALA  49  -2.327  -9.994  -3.858
  368   2HB   ALA  49          2HB       ALA  49  -2.807  -8.284  -3.957
  369   3HB   ALA  49          3HB       ALA  49  -2.361  -8.994  -2.396
  370    H    SER  50           H        SER  50  -3.867  -8.891  -0.703
  371    HA   SER  50           HA       SER  50  -5.808  -6.665  -0.634
  372   1HB   SER  50          2HB       SER  50  -5.597  -9.058   1.244
  373   2HB   SER  50          3HB       SER  50  -6.404  -7.564   1.728
  374    HG   SER  50           HG       SER  50  -7.827  -7.829  -0.048
  375    H    ILE  51           H        ILE  51  -5.551  -5.395   1.431
  376    HA   ILE  51           HA       ILE  51  -3.015  -4.341   1.566
  377    HB   ILE  51           HB       ILE  51  -5.127  -3.297   2.425
  378   1HG1  ILE  51          2HG1      ILE  51  -3.089  -2.108   2.561
  379   2HG1  ILE  51          3HG1      ILE  51  -4.213  -1.803   3.880
  380   1HG2  ILE  51          1HG2      ILE  51  -4.429  -4.713   5.033
  381   2HG2  ILE  51          2HG2      ILE  51  -5.675  -3.483   4.794
  382   3HG2  ILE  51          3HG2      ILE  51  -5.840  -5.068   4.010
  383   1HD1  ILE  51          1HD1      ILE  51  -2.765  -3.422   5.301
  384   2HD1  ILE  51          2HD1      ILE  51  -1.570  -3.232   3.988
  385   3HD1  ILE  51          3HD1      ILE  51  -2.068  -1.873   4.924
  386    H    GLN  52           H        GLN  52  -4.279  -7.026   3.603
  387    HA   GLN  52           HA       GLN  52  -2.581  -7.219   5.655
  388   1HB   GLN  52          2HB       GLN  52  -3.209  -9.526   3.766
  389   2HB   GLN  52          3HB       GLN  52  -2.597  -9.671   5.410
  390   1HG   GLN  52          2HG       GLN  52  -4.709  -9.778   6.107
  391   2HG   GLN  52          3HG       GLN  52  -4.790  -8.038   5.828
  392   1HE2  GLN  52          1HE2      GLN  52  -6.944  -7.824   5.082
  393   2HE2  GLN  52          2HE2      GLN  52  -7.564  -8.732   3.714
  394    H    GLN  53           H        GLN  53  -1.562  -8.219   2.377
  395    HA   GLN  53           HA       GLN  53   1.149  -8.908   3.244
  396   1HB   GLN  53          2HB       GLN  53   0.014  -8.395   0.490
  397   2HB   GLN  53          3HB       GLN  53   1.663  -8.971   0.846
  398   1HG   GLN  53          2HG       GLN  53   0.775 -10.941   2.019
  399   2HG   GLN  53          3HG       GLN  53  -0.887 -10.432   1.671
  400   1HE2  GLN  53          1HE2      GLN  53  -1.255  -9.918  -0.786
  401   2HE2  GLN  53          2HE2      GLN  53  -0.586 -11.125  -1.874
  402    H    VAL  54           H        VAL  54  -0.352  -6.038   1.803
  403    HA   VAL  54           HA       VAL  54   2.027  -4.490   1.396
  404    HB   VAL  54           HB       VAL  54  -0.822  -3.478   1.807
  405   1HG1  VAL  54          1HG1      VAL  54   0.711  -1.683   1.994
  406   2HG1  VAL  54          2HG1      VAL  54   1.650  -2.227   0.595
  407   3HG1  VAL  54          3HG1      VAL  54  -0.002  -1.605   0.384
  408   1HG2  VAL  54          1HG2      VAL  54   0.555  -4.582  -0.659
  409   2HG2  VAL  54          2HG2      VAL  54  -0.997  -5.059   0.037
  410   3HG2  VAL  54          3HG2      VAL  54  -0.839  -3.482  -0.737
  411    H    GLU  55           H        GLU  55  -0.142  -5.122   4.116
  412    HA   GLU  55           HA       GLU  55   0.513  -3.047   5.850
  413   1HB   GLU  55          2HB       GLU  55  -1.311  -4.934   5.983
  414   2HB   GLU  55          3HB       GLU  55  -0.096  -5.832   6.882
  415   1HG   GLU  55          2HG       GLU  55  -1.083  -3.039   7.585
  416   2HG   GLU  55          3HG       GLU  55  -1.616  -4.547   8.341
  417    H    GLN  56           H        GLN  56   1.655  -6.431   5.687
  418    HA   GLN  56           HA       GLN  56   3.770  -6.293   7.484
  419   1HB   GLN  56          2HB       GLN  56   2.754  -8.334   6.512
  420   2HB   GLN  56          3HB       GLN  56   3.607  -8.054   4.990
  421   1HG   GLN  56          2HG       GLN  56   5.309  -8.045   7.465
  422   2HG   GLN  56          3HG       GLN  56   4.520  -9.576   7.099
  423   1HE2  GLN  56          1HE2      GLN  56   5.322 -10.874   5.436
  424   2HE2  GLN  56          2HE2      GLN  56   6.676 -10.383   4.431
  425    H    ALA  57           H        ALA  57   3.873  -5.692   3.908
  426    HA   ALA  57           HA       ALA  57   6.572  -4.920   3.732
  427   1HB   ALA  57          1HB       ALA  57   4.159  -4.661   2.127
  428   2HB   ALA  57          2HB       ALA  57   5.093  -3.169   2.049
  429   3HB   ALA  57          3HB       ALA  57   5.849  -4.727   1.631
  430    H    GLY  58           H        GLY  58   3.719  -2.883   4.665
  431   1HA   GLY  58          1HA       GLY  58   5.128  -0.437   4.929
  432   2HA   GLY  58          2HA       GLY  58   3.539  -0.879   5.593
  433    H    ALA  59           H        ALA  59   5.187  -3.315   6.935
  434    HA   ALA  59           HA       ALA  59   5.584  -2.238   9.471
  435   1HB   ALA  59          1HB       ALA  59   5.564  -4.669   8.954
  436   2HB   ALA  59          2HB       ALA  59   7.202  -4.502   8.257
  437   3HB   ALA  59          3HB       ALA  59   6.928  -4.176   9.974
  438    H    PHE  60           H        PHE  60   7.629  -1.859   6.587
  439    HA   PHE  60           HA       PHE  60  10.024  -1.119   7.851
  440   1HB   PHE  60          2HB       PHE  60  10.653   0.044   5.927
  441   2HB   PHE  60          3HB       PHE  60   9.771  -1.385   5.421
  442    HD1  PHE  60           1HD      PHE  60   9.549   2.330   5.859
  443    HD2  PHE  60           2HD      PHE  60   8.158  -1.099   3.689
  444    HE1  PHE  60           1HE      PHE  60   8.119   3.799   4.471
  445    HE2  PHE  60           2HE      PHE  60   6.758   0.363   2.262
  446    HZ   PHE  60           HZ       PHE  60   6.768   2.820   2.624
  447    H    GLU  61           H        GLU  61   7.003   0.734   7.672
  448    HA   GLU  61           HA       GLU  61   8.199   2.705   9.560
  449   1HB   GLU  61          2HB       GLU  61   8.402   3.557   7.304
  450   2HB   GLU  61          3HB       GLU  61   6.665   3.413   7.016
  451   1HG   GLU  61          2HG       GLU  61   6.256   5.271   8.498
  452   2HG   GLU  61          3HG       GLU  61   7.890   5.169   9.184
  453    H    HIS  62           H        HIS  62   5.946   0.398   9.315
  454    HA   HIS  62           HA       HIS  62   4.238  -0.181  10.688
  455   1HB   HIS  62          2HB       HIS  62   5.278   2.097  12.427
  456   2HB   HIS  62          3HB       HIS  62   4.175   0.821  12.938
  457    HD1  HIS  62           1HD      HIS  62   6.213  -1.362  11.197
  458    HD2  HIS  62           2HD      HIS  62   6.946   1.216  14.435
  459    HE1  HIS  62           1HE      HIS  62   8.128  -2.383  12.507
  460    H    LEU  63           H        LEU  63   2.977   0.770   8.724
  461    HA   LEU  63           HA       LEU  63   1.592   3.281   9.340
  462   1HB   LEU  63          2HB       LEU  63   1.269   1.296   7.061
  463   2HB   LEU  63          3HB       LEU  63   0.359   2.802   7.211
  464    HG   LEU  63           HG       LEU  63   2.051   3.222   5.732
  465   1HD1  LEU  63          1HD1      LEU  63   1.504   4.989   7.429
  466   2HD1  LEU  63          2HD1      LEU  63   3.018   4.561   8.277
  467   3HD1  LEU  63          3HD1      LEU  63   3.065   5.126   6.611
  468   1HD2  LEU  63          1HD2      LEU  63   4.232   2.557   7.746
  469   2HD2  LEU  63          2HD2      LEU  63   3.695   1.427   6.493
  470   3HD2  LEU  63          3HD2      LEU  63   4.423   2.985   6.059
  471    H    LYS  64           H        LYS  64  -1.075   2.825   8.579
  472    HA   LYS  64           HA       LYS  64  -2.162   0.739  10.307
  473   1HB   LYS  64          2HB       LYS  64  -3.520   2.398  11.610
  474   2HB   LYS  64          3HB       LYS  64  -1.861   2.208  12.121
  475   1HG   LYS  64          2HG       LYS  64  -2.790   4.440  10.266
  476   2HG   LYS  64          3HG       LYS  64  -2.861   4.565  12.012
  477   1HD   LYS  64          2HD       LYS  64  -0.270   4.286  10.383
  478   2HD   LYS  64          3HD       LYS  64  -0.996   5.675  11.044
  479   1HE   LYS  64          2HE       LYS  64   0.579   5.210  12.696
  480   2HE   LYS  64          3HE       LYS  64  -0.856   4.437  13.376
  481   1HZ   LYS  64          1HZ       LYS  64   1.479   3.182  12.064
  482   2HZ   LYS  64          2HZ       LYS  64   0.890   2.904  13.557
  483   3HZ   LYS  64          3HZ       LYS  64   0.115   2.334  12.213
  484    H    ILE  65           H        ILE  65  -2.378   0.549   7.938
  485    HA   ILE  65           HA       ILE  65  -4.300   2.195   6.627
  486    HB   ILE  65           HB       ILE  65  -3.616  -0.543   5.629
  487   1HG1  ILE  65          2HG1      ILE  65  -1.723   1.780   5.835
  488   2HG1  ILE  65          3HG1      ILE  65  -1.471   0.037   6.096
  489   1HG2  ILE  65          1HG2      ILE  65  -4.043   2.074   4.141
  490   2HG2  ILE  65          2HG2      ILE  65  -3.871   0.464   3.429
  491   3HG2  ILE  65          3HG2      ILE  65  -5.274   0.851   4.425
  492   1HD1  ILE  65          1HD1      ILE  65  -1.617   1.497   3.450
  493   2HD1  ILE  65          2HD1      ILE  65  -0.236   0.662   4.177
  494   3HD1  ILE  65          3HD1      ILE  65  -1.611  -0.264   3.573
  495    H    ILE  66           H        ILE  66  -6.529   1.838   6.248
  496    HA   ILE  66           HA       ILE  66  -7.766  -0.517   7.611
  497    HB   ILE  66           HB       ILE  66  -8.775   2.345   7.573
  498   1HG1  ILE  66          2HG1      ILE  66  -7.430   0.751   9.807
  499   2HG1  ILE  66          3HG1      ILE  66  -6.762   2.157   8.965
  500   1HG2  ILE  66          1HG2      ILE  66  -9.772  -0.062   9.163
  501   2HG2  ILE  66          2HG2      ILE  66 -10.472   1.569   9.151
  502   3HG2  ILE  66          3HG2      ILE  66 -10.571   0.580   7.709
  503   1HD1  ILE  66          1HD1      ILE  66  -7.544   2.928  11.052
  504   2HD1  ILE  66          2HD1      ILE  66  -8.647   3.551   9.810
  505   3HD1  ILE  66          3HD1      ILE  66  -9.132   2.182  10.844
  506    HA   PRO  67           HA       PRO  67  -9.898  -0.871   3.603
  507   1HB   PRO  67          2HB       PRO  67 -11.824  -2.708   4.265
  508   2HB   PRO  67          3HB       PRO  67 -10.119  -3.130   3.997
  509   1HG   PRO  67          2HG       PRO  67 -11.500  -2.634   6.634
  510   2HG   PRO  67          3HG       PRO  67 -10.412  -3.984   6.198
  511   1HD   PRO  67          2HD       PRO  67  -9.543  -1.823   7.573
  512   2HD   PRO  67          3HD       PRO  67  -8.495  -2.592   6.348
  513    H    GLU  68           H        GLU  68 -10.438   1.363   3.944
  514    HA   GLU  68           HA       GLU  68 -12.654   2.606   4.903
  515   1HB   GLU  68          2HB       GLU  68 -10.718   3.150   3.022
  516   2HB   GLU  68          3HB       GLU  68 -12.106   2.943   1.964
  517   1HG   GLU  68          2HG       GLU  68 -13.290   4.700   3.306
  518   2HG   GLU  68          3HG       GLU  68 -11.821   4.929   4.265
  519    H    LYS  69           H        LYS  69 -14.823   2.089   4.876
  520    HA   LYS  69           HA       LYS  69 -15.912   0.427   2.627
  521   1HB   LYS  69          2HB       LYS  69 -15.976  -0.625   4.930
  522   2HB   LYS  69          3HB       LYS  69 -17.003   0.712   5.451
  523   1HG   LYS  69          2HG       LYS  69 -18.552  -0.939   4.939
  524   2HG   LYS  69          3HG       LYS  69 -18.566   0.049   3.473
  525   1HD   LYS  69          2HD       LYS  69 -16.689  -1.671   2.659
  526   2HD   LYS  69          3HD       LYS  69 -17.322  -2.690   3.944
  527   1HE   LYS  69          2HE       LYS  69 -18.790  -1.569   1.503
  528   2HE   LYS  69          3HE       LYS  69 -18.385  -3.260   1.821
  529   1HZ   LYS  69          1HZ       LYS  69 -19.922  -3.183   3.697
  530   2HZ   LYS  69          2HZ       LYS  69 -20.317  -1.624   3.336
  531   3HZ   LYS  69          3HZ       LYS  69 -20.676  -2.826   2.279
  532    H    GLU  70           H        GLU  70 -16.785   3.023   4.951
  533    HA   GLU  70           HA       GLU  70 -18.471   4.358   2.949
  534   1HB   GLU  70          2HB       GLU  70 -19.755   2.703   4.477
  535   2HB   GLU  70          3HB       GLU  70 -19.388   3.797   5.816
  536   1HG   GLU  70          2HG       GLU  70 -20.701   5.563   4.756
  537   2HG   GLU  70          3HG       GLU  70 -20.852   4.616   3.261
  538    H    ALA  71           H        ALA  71 -18.666   6.731   3.653
  539    HA   ALA  71           HA       ALA  71 -16.511   7.623   5.454
  540   1HB   ALA  71          1HB       ALA  71 -15.453   7.312   3.203
  541   2HB   ALA  71          2HB       ALA  71 -16.735   8.317   2.486
  542   3HB   ALA  71          3HB       ALA  71 -15.595   9.028   3.646
  Start of MODEL   11
    1   1H    MET   1           H1       MET   1 -11.779 -12.618  -6.909
    2   2H    MET   1           H2       MET   1 -11.206 -13.885  -7.791
    3   3H    MET   1           H3       MET   1 -10.773 -12.401  -8.126
    4    HA   MET   1           HA       MET   1 -12.527 -12.932  -9.732
    5   1HB   MET   1          2HB       MET   1 -13.607 -14.694  -8.428
    6   2HB   MET   1          3HB       MET   1 -14.107 -13.523  -7.200
    7   1HG   MET   1          2HG       MET   1 -16.006 -14.033  -8.493
    8   2HG   MET   1          3HG       MET   1 -15.568 -12.403  -8.947
    9   1HE   MET   1          1HE       MET   1 -16.341 -15.950 -10.030
   10   2HE   MET   1          2HE       MET   1 -17.529 -14.667 -10.373
   11   3HE   MET   1          3HE       MET   1 -16.759 -15.549 -11.711
   12    H    ALA   2           H        ALA   2 -12.075 -10.728 -10.170
   13    HA   ALA   2           HA       ALA   2 -12.449  -8.520 -10.299
   14   1HB   ALA   2          1HB       ALA   2 -14.976  -8.890  -8.641
   15   2HB   ALA   2          2HB       ALA   2 -14.575  -7.562  -9.730
   16   3HB   ALA   2          3HB       ALA   2 -14.862  -9.183 -10.391
   17    H    GLU   3           H        GLU   3 -10.940  -9.732  -7.988
   18    HA   GLU   3           HA       GLU   3 -11.196  -8.031  -5.718
   19   1HB   GLU   3          2HB       GLU   3  -9.295 -10.067  -6.760
   20   2HB   GLU   3          3HB       GLU   3  -8.576  -8.849  -5.704
   21   1HG   GLU   3          2HG       GLU   3  -9.364 -10.874  -4.486
   22   2HG   GLU   3          3HG       GLU   3 -10.035  -9.350  -3.893
   23    H    LYS   4           H        LYS   4 -11.443  -5.971  -6.413
   24    HA   LYS   4           HA       LYS   4  -8.869  -4.542  -6.694
   25   1HB   LYS   4          2HB       LYS   4 -10.165  -2.712  -7.862
   26   2HB   LYS   4          3HB       LYS   4  -9.770  -4.119  -8.856
   27   1HG   LYS   4          2HG       LYS   4 -11.977  -4.929  -8.896
   28   2HG   LYS   4          3HG       LYS   4 -12.441  -4.074  -7.448
   29   1HD   LYS   4          2HD       LYS   4 -13.386  -2.508  -8.630
   30   2HD   LYS   4          3HD       LYS   4 -11.810  -1.945  -9.160
   31   1HE   LYS   4          2HE       LYS   4 -13.503  -4.085 -10.559
   32   2HE   LYS   4          3HE       LYS   4 -13.472  -2.376 -11.007
   33   1HZ   LYS   4          1HZ       LYS   4 -12.008  -3.689 -12.377
   34   2HZ   LYS   4          2HZ       LYS   4 -11.152  -2.576 -11.521
   35   3HZ   LYS   4          3HZ       LYS   4 -11.126  -4.155 -11.065
   36    H    THR   5           H        THR   5  -8.628  -2.973  -5.026
   37    HA   THR   5           HA       THR   5 -11.009  -1.918  -3.734
   38    HB   THR   5           HB       THR   5  -9.097  -3.754  -2.167
   39    HG1  THR   5           1HG      THR   5 -11.486  -3.915  -3.332
   40   1HG2  THR   5          1HG2      THR   5 -10.665  -3.247  -0.242
   41   2HG2  THR   5          2HG2      THR   5  -9.656  -1.870  -0.687
   42   3HG2  THR   5          3HG2      THR   5 -11.360  -1.928  -1.196
   43    H    VAL   6           H        VAL   6 -10.484  -0.062  -2.521
   44    HA   VAL   6           HA       VAL   6  -7.674   0.370  -2.242
   45    HB   VAL   6           HB       VAL   6  -8.231   1.896  -3.910
   46   1HG1  VAL   6          1HG1      VAL   6 -10.072   3.464  -3.965
   47   2HG1  VAL   6          2HG1      VAL   6 -10.579   1.781  -4.029
   48   3HG1  VAL   6          3HG1      VAL   6 -10.761   2.700  -2.506
   49   1HG2  VAL   6          1HG2      VAL   6  -8.597   3.632  -1.417
   50   2HG2  VAL   6          2HG2      VAL   6  -7.025   3.061  -1.999
   51   3HG2  VAL   6          3HG2      VAL   6  -7.984   4.160  -2.995
   52    H    TYR   7           H        TYR   7  -6.924   1.234  -0.392
   53    HA   TYR   7           HA       TYR   7  -8.797   1.153   1.950
   54   1HB   TYR   7          2HB       TYR   7  -5.899   0.235   1.817
   55   2HB   TYR   7          3HB       TYR   7  -7.013   0.089   3.173
   56    HD1  TYR   7           HD1      TYR   7  -8.108  -1.930   3.540
   57    HD2  TYR   7           HD2      TYR   7  -6.313  -1.187  -0.300
   58    HE1  TYR   7           HE1      TYR   7  -8.645  -4.243   2.846
   59    HE2  TYR   7           HE2      TYR   7  -6.787  -3.528  -0.963
   60    HH   TYR   7           HH       TYR   7  -8.795  -5.686   0.982
   61    H    ARG   8           H        ARG   8  -8.070   2.677   3.710
   62    HA   ARG   8           HA       ARG   8  -6.466   4.921   2.559
   63   1HB   ARG   8          2HB       ARG   8  -8.208   4.820   5.048
   64   2HB   ARG   8          3HB       ARG   8  -7.162   6.171   4.578
   65   1HG   ARG   8          2HG       ARG   8  -8.458   6.133   2.301
   66   2HG   ARG   8          3HG       ARG   8  -9.615   5.150   3.198
   67   1HD   ARG   8          2HD       ARG   8  -9.525   7.032   4.994
   68   2HD   ARG   8          3HD       ARG   8  -8.713   8.008   3.737
   69    HE   ARG   8           HE       ARG   8 -11.073   6.841   2.627
   70   1HH1  ARG   8          2HH2      ARG   8 -10.341   9.297   5.034
   71   2HH1  ARG   8          1HH2      ARG   8 -11.987   9.859   5.145
   72   1HH2  ARG   8          2HH1      ARG   8 -13.060   7.374   2.780
   73   2HH2  ARG   8          1HH1      ARG   8 -13.679   8.727   3.731
   74    H    VAL   9           H        VAL   9  -4.512   5.532   3.360
   75    HA   VAL   9           HA       VAL   9  -3.363   3.830   5.556
   76    HB   VAL   9           HB       VAL   9  -2.277   3.171   3.606
   77   1HG1  VAL   9          1HG1      VAL   9  -1.846   6.084   2.826
   78   2HG1  VAL   9          2HG1      VAL   9  -1.189   4.669   1.991
   79   3HG1  VAL   9          3HG1      VAL   9  -2.930   4.928   2.010
   80   1HG2  VAL   9          1HG2      VAL   9  -0.479   5.312   4.805
   81   2HG2  VAL   9          2HG2      VAL   9  -0.772   3.730   5.541
   82   3HG2  VAL   9          3HG2      VAL   9   0.016   3.839   3.956
   83    H    ASP  10           H        ASP  10  -2.431   4.856   7.302
   84    HA   ASP  10           HA       ASP  10  -2.186   7.834   7.135
   85   1HB   ASP  10          2HB       ASP  10  -4.432   7.156   7.996
   86   2HB   ASP  10          3HB       ASP  10  -3.674   6.239   9.256
   87    H    GLY  11           H        GLY  11  -1.168   8.642   9.211
   88   1HA   GLY  11          1HA       GLY  11   0.397   8.505  10.932
   89   2HA   GLY  11          2HA       GLY  11   0.774   6.828  10.521
   90    H    LEU  12           H        LEU  12   1.444   7.046   7.843
   91    HA   LEU  12           HA       LEU  12   4.154   7.830   7.969
   92   1HB   LEU  12          2HB       LEU  12   4.213   7.340   5.572
   93   2HB   LEU  12          3HB       LEU  12   3.339   6.128   6.497
   94    HG   LEU  12           HG       LEU  12   1.144   7.212   5.742
   95   1HD1  LEU  12          1HD1      LEU  12   3.078   8.657   3.832
   96   2HD1  LEU  12          2HD1      LEU  12   1.356   8.432   3.499
   97   3HD1  LEU  12          3HD1      LEU  12   1.835   9.429   4.850
   98   1HD2  LEU  12          1HD2      LEU  12   1.954   5.174   4.783
   99   2HD2  LEU  12          2HD2      LEU  12   1.379   6.192   3.466
  100   3HD2  LEU  12          3HD2      LEU  12   3.125   6.061   3.802
  101    H    SER  13           H        SER  13   5.284   9.353   6.433
  102    HA   SER  13           HA       SER  13   3.817  11.509   5.238
  103   1HB   SER  13          2HB       SER  13   3.764  12.166   7.723
  104   2HB   SER  13          3HB       SER  13   5.517  12.367   7.611
  105    HG   SER  13           HG       SER  13   4.312  14.302   7.213
  106    H    CYS  14           H        CYS  14   5.388  10.005   3.737
  107    HA   CYS  14           HA       CYS  14   7.423  11.951   3.003
  108   1HB   CYS  14          2HB       CYS  14   8.742  10.564   4.578
  109   2HB   CYS  14          3HB       CYS  14   8.253   9.106   3.692
  110    HG   CYS  14           HG       CYS  14   9.938  11.749   2.672
  111    H    THR  15           H        THR  15   7.659  12.006   0.798
  112    HA   THR  15           HA       THR  15   5.854  10.424  -0.811
  113    HB   THR  15           HB       THR  15   8.075  12.343  -1.616
  114    HG1  THR  15           1HG      THR  15   6.083  12.988  -0.327
  115   1HG2  THR  15          1HG2      THR  15   6.788  12.510  -3.746
  116   2HG2  THR  15          2HG2      THR  15   7.491  10.900  -3.525
  117   3HG2  THR  15          3HG2      THR  15   5.759  11.163  -3.219
  118    H    ASN  16           H        ASN  16   9.452  10.381  -0.348
  119    HA   ASN  16           HA       ASN  16   9.986   8.493  -2.320
  120   1HB   ASN  16          2HB       ASN  16  11.405   8.991   0.325
  121   2HB   ASN  16          3HB       ASN  16  12.032   7.927  -0.939
  122   1HD2  ASN  16          1HD2      ASN  16  13.115  10.557   0.169
  123   2HD2  ASN  16          2HD2      ASN  16  13.334  11.524  -1.278
  124    H    CYS  17           H        CYS  17   8.976   8.007   1.050
  125    HA   CYS  17           HA       CYS  17   9.118   5.187   1.177
  126   1HB   CYS  17          2HB       CYS  17   7.290   7.217   2.506
  127   2HB   CYS  17          3HB       CYS  17   7.226   5.498   2.868
  128    HG   CYS  17           HG       CYS  17   9.755   5.215   3.460
  129    H    ALA  18           H        ALA  18   6.757   7.300  -0.463
  130    HA   ALA  18           HA       ALA  18   4.699   5.350  -0.853
  131   1HB   ALA  18          1HB       ALA  18   5.340   7.536  -2.851
  132   2HB   ALA  18          2HB       ALA  18   3.780   6.847  -2.392
  133   3HB   ALA  18          3HB       ALA  18   4.646   7.922  -1.269
  134    H    ALA  19           H        ALA  19   7.699   6.212  -2.587
  135    HA   ALA  19           HA       ALA  19   7.206   4.584  -4.917
  136   1HB   ALA  19          1HB       ALA  19   9.546   4.903  -5.429
  137   2HB   ALA  19          2HB       ALA  19   8.867   6.441  -4.862
  138   3HB   ALA  19          3HB       ALA  19   9.899   5.465  -3.791
  139    H    LYS  20           H        LYS  20   8.973   4.148  -1.859
  140    HA   LYS  20           HA       LYS  20   9.804   1.470  -2.186
  141   1HB   LYS  20          2HB       LYS  20  10.009   3.316  -0.193
  142   2HB   LYS  20          3HB       LYS  20   8.786   2.271   0.528
  143   1HG   LYS  20          2HG       LYS  20  11.509   1.401  -0.532
  144   2HG   LYS  20          3HG       LYS  20  11.115   1.759   1.162
  145   1HD   LYS  20          2HD       LYS  20   9.457  -0.135   1.101
  146   2HD   LYS  20          3HD       LYS  20   9.910  -0.458  -0.570
  147   1HE   LYS  20          2HE       LYS  20  11.029  -2.033   0.903
  148   2HE   LYS  20          3HE       LYS  20  12.199  -1.013   0.067
  149   1HZ   LYS  20          1HZ       LYS  20  12.689  -1.306   2.415
  150   2HZ   LYS  20          2HZ       LYS  20  12.446   0.276   2.057
  151   3HZ   LYS  20          3HZ       LYS  20  11.273  -0.575   2.837
  152    H    PHE  21           H        PHE  21   6.695   2.794  -0.996
  153    HA   PHE  21           HA       PHE  21   5.500   0.289  -0.511
  154   1HB   PHE  21          2HB       PHE  21   4.760   2.868  -0.028
  155   2HB   PHE  21          3HB       PHE  21   3.687   2.521  -1.369
  156    HD1  PHE  21           1HD      PHE  21   1.484   1.951  -0.505
  157    HD2  PHE  21           2HD      PHE  21   4.998   0.577   1.580
  158    HE1  PHE  21           1HE      PHE  21   0.098   1.207   1.424
  159    HE2  PHE  21           2HE      PHE  21   3.548  -0.639   3.140
  160    HZ   PHE  21           HZ       PHE  21   1.161  -0.177   3.217
  161    H    GLU  22           H        GLU  22   5.045   2.393  -3.451
  162    HA   GLU  22           HA       GLU  22   3.269   0.624  -4.700
  163   1HB   GLU  22          2HB       GLU  22   3.532   1.832  -6.681
  164   2HB   GLU  22          3HB       GLU  22   3.910   3.031  -5.436
  165   1HG   GLU  22          2HG       GLU  22   6.292   2.736  -5.841
  166   2HG   GLU  22          3HG       GLU  22   5.914   1.609  -7.167
  167    H    ARG  23           H        ARG  23   6.837   0.814  -4.888
  168    HA   ARG  23           HA       ARG  23   7.140  -1.310  -6.736
  169   1HB   ARG  23          2HB       ARG  23   8.851   0.490  -5.940
  170   2HB   ARG  23          3HB       ARG  23   9.176  -0.600  -4.578
  171   1HG   ARG  23          2HG       ARG  23   9.543  -2.422  -6.411
  172   2HG   ARG  23          3HG       ARG  23   9.525  -1.075  -7.560
  173   1HD   ARG  23          2HD       ARG  23  11.322   0.006  -6.021
  174   2HD   ARG  23          3HD       ARG  23  11.493  -1.591  -5.284
  175    HE   ARG  23           HE       ARG  23  12.451  -0.653  -7.856
  176   1HH1  ARG  23          2HH2      ARG  23  11.431  -3.619  -6.146
  177   2HH1  ARG  23          1HH2      ARG  23  12.209  -4.686  -7.253
  178   1HH2  ARG  23          2HH1      ARG  23  13.458  -2.077  -9.349
  179   2HH2  ARG  23          1HH1      ARG  23  13.391  -3.794  -9.106
  180    H    ASN  24           H        ASN  24   7.360  -1.318  -3.112
  181    HA   ASN  24           HA       ASN  24   7.787  -4.064  -2.703
  182   1HB   ASN  24          2HB       ASN  24   6.212  -1.970  -1.144
  183   2HB   ASN  24          3HB       ASN  24   6.192  -3.663  -0.676
  184   1HD2  ASN  24          1HD2      ASN  24   7.025  -2.252   1.265
  185   2HD2  ASN  24          2HD2      ASN  24   8.728  -2.551   1.511
  186    H    VAL  25           H        VAL  25   4.649  -2.358  -3.206
  187    HA   VAL  25           HA       VAL  25   3.116  -4.746  -3.017
  188    HB   VAL  25           HB       VAL  25   2.364  -2.269  -4.617
  189   1HG1  VAL  25          1HG1      VAL  25   0.871  -4.121  -5.025
  190   2HG1  VAL  25          2HG1      VAL  25   0.769  -4.516  -3.307
  191   3HG1  VAL  25          3HG1      VAL  25   0.043  -3.032  -3.886
  192   1HG2  VAL  25          1HG2      VAL  25   2.176  -1.073  -2.739
  193   2HG2  VAL  25          2HG2      VAL  25   1.114  -2.280  -2.042
  194   3HG2  VAL  25          3HG2      VAL  25   2.849  -2.400  -1.768
  195    H    LYS  26           H        LYS  26   4.431  -3.060  -5.884
  196    HA   LYS  26           HA       LYS  26   3.619  -4.894  -7.888
  197   1HB   LYS  26          2HB       LYS  26   5.825  -2.891  -7.522
  198   2HB   LYS  26          3HB       LYS  26   5.994  -4.021  -8.850
  199   1HG   LYS  26          2HG       LYS  26   4.406  -3.051 -10.072
  200   2HG   LYS  26          3HG       LYS  26   3.307  -2.812  -8.702
  201   1HD   LYS  26          2HD       LYS  26   4.214  -0.798  -8.060
  202   2HD   LYS  26          3HD       LYS  26   5.723  -1.002  -8.949
  203   1HE   LYS  26          2HE       LYS  26   2.991  -0.754 -10.311
  204   2HE   LYS  26          3HE       LYS  26   3.943   0.663  -9.844
  205   1HZ   LYS  26          1HZ       LYS  26   5.702  -0.048 -11.232
  206   2HZ   LYS  26          2HZ       LYS  26   4.922  -1.441 -11.652
  207   3HZ   LYS  26          3HZ       LYS  26   4.322   0.020 -12.120
  208    H    GLU  27           H        GLU  27   6.349  -5.152  -5.586
  209    HA   GLU  27           HA       GLU  27   7.449  -7.506  -6.807
  210   1HB   GLU  27          2HB       GLU  27   7.751  -6.331  -4.025
  211   2HB   GLU  27          3HB       GLU  27   8.661  -7.715  -4.609
  212   1HG   GLU  27          2HG       GLU  27   9.784  -6.455  -6.278
  213   2HG   GLU  27          3HG       GLU  27   8.685  -5.084  -6.133
  214    H    ILE  28           H        ILE  28   4.468  -7.223  -5.045
  215    HA   ILE  28           HA       ILE  28   4.617  -9.904  -3.865
  216    HB   ILE  28           HB       ILE  28   2.297  -8.067  -4.321
  217   1HG1  ILE  28          2HG1      ILE  28   3.554  -8.545  -1.614
  218   2HG1  ILE  28          3HG1      ILE  28   4.078  -7.233  -2.678
  219   1HG2  ILE  28          1HG2      ILE  28   2.432 -10.814  -3.199
  220   2HG2  ILE  28          2HG2      ILE  28   1.490  -9.686  -2.240
  221   3HG2  ILE  28          3HG2      ILE  28   1.071  -9.918  -3.925
  222   1HD1  ILE  28          1HD1      ILE  28   1.202  -7.606  -1.724
  223   2HD1  ILE  28          2HD1      ILE  28   2.356  -6.373  -1.176
  224   3HD1  ILE  28          3HD1      ILE  28   1.759  -6.406  -2.852
  225    H    GLU  29           H        GLU  29   4.058 -11.739  -4.866
  226    HA   GLU  29           HA       GLU  29   3.270 -11.848  -7.681
  227   1HB   GLU  29          2HB       GLU  29   4.340 -13.698  -5.528
  228   2HB   GLU  29          3HB       GLU  29   3.584 -14.397  -6.933
  229   1HG   GLU  29          2HG       GLU  29   5.665 -12.288  -7.448
  230   2HG   GLU  29          3HG       GLU  29   6.190 -13.881  -6.882
  231    H    GLY  30           H        GLY  30   1.318 -11.031  -5.467
  232   1HA   GLY  30          1HA       GLY  30  -0.865 -13.046  -5.979
  233   2HA   GLY  30          2HA       GLY  30  -0.639 -12.186  -4.455
  234    H    VAL  31           H        VAL  31   0.166  -9.757  -6.472
  235    HA   VAL  31           HA       VAL  31  -2.595  -8.818  -6.842
  236    HB   VAL  31           HB       VAL  31  -1.269  -7.870  -4.910
  237   1HG1  VAL  31          1HG1      VAL  31   0.560  -6.403  -5.279
  238   2HG1  VAL  31          2HG1      VAL  31   0.973  -7.912  -6.107
  239   3HG1  VAL  31          3HG1      VAL  31   0.425  -6.516  -7.048
  240   1HG2  VAL  31          1HG2      VAL  31  -3.083  -6.668  -6.054
  241   2HG2  VAL  31          2HG2      VAL  31  -1.846  -5.587  -5.361
  242   3HG2  VAL  31          3HG2      VAL  31  -1.863  -5.899  -7.110
  243    H    THR  32           H        THR  32  -2.726  -7.317  -8.682
  244    HA   THR  32           HA       THR  32  -0.828  -8.003 -10.882
  245    HB   THR  32           HB       THR  32  -3.773  -7.245 -11.043
  246    HG1  THR  32           1HG      THR  32  -3.867  -9.490 -11.744
  247   1HG2  THR  32          1HG2      THR  32  -3.517  -7.950 -13.419
  248   2HG2  THR  32          2HG2      THR  32  -2.527  -6.535 -13.038
  249   3HG2  THR  32          3HG2      THR  32  -1.768  -8.135 -13.162
  250    H    GLU  33           H        GLU  33  -3.130  -5.444  -9.762
  251    HA   GLU  33           HA       GLU  33  -1.017  -3.433 -10.583
  252   1HB   GLU  33          2HB       GLU  33  -4.029  -3.165 -10.949
  253   2HB   GLU  33          3HB       GLU  33  -2.877  -1.827 -10.949
  254   1HG   GLU  33          2HG       GLU  33  -1.612  -3.259 -12.770
  255   2HG   GLU  33          3HG       GLU  33  -3.182  -4.049 -12.966
  256    H    ALA  34           H        ALA  34  -0.650  -1.702  -9.214
  257    HA   ALA  34           HA       ALA  34  -2.403  -1.398  -6.911
  258   1HB   ALA  34          1HB       ALA  34  -0.489  -1.445  -5.322
  259   2HB   ALA  34          2HB       ALA  34  -0.858  -3.036  -6.049
  260   3HB   ALA  34          3HB       ALA  34   0.550  -2.093  -6.617
  261    H    ILE  35           H        ILE  35  -2.613   0.731  -6.440
  262    HA   ILE  35           HA       ILE  35  -0.599   2.645  -7.579
  263    HB   ILE  35           HB       ILE  35  -3.617   2.901  -7.757
  264   1HG1  ILE  35          2HG1      ILE  35  -2.036   2.751 -10.262
  265   2HG1  ILE  35          3HG1      ILE  35  -2.145   1.220  -9.438
  266   1HG2  ILE  35          1HG2      ILE  35  -2.476   5.056  -7.582
  267   2HG2  ILE  35          2HG2      ILE  35  -1.343   4.597  -8.865
  268   3HG2  ILE  35          3HG2      ILE  35  -3.063   4.825  -9.234
  269   1HD1  ILE  35          1HD1      ILE  35  -4.555   2.900 -10.167
  270   2HD1  ILE  35          2HD1      ILE  35  -3.979   1.440 -11.000
  271   3HD1  ILE  35          3HD1      ILE  35  -4.571   1.327  -9.334
  272    H    VAL  36           H        VAL  36   0.309   3.344  -5.701
  273    HA   VAL  36           HA       VAL  36  -1.390   3.851  -3.341
  274    HB   VAL  36           HB       VAL  36   0.563   2.638  -2.855
  275   1HG1  VAL  36          1HG1      VAL  36   1.961   2.995  -4.656
  276   2HG1  VAL  36          2HG1      VAL  36   2.082   4.757  -4.398
  277   3HG1  VAL  36          3HG1      VAL  36   2.843   3.631  -3.259
  278   1HG2  VAL  36          1HG2      VAL  36   1.073   5.509  -2.008
  279   2HG2  VAL  36          2HG2      VAL  36  -0.087   4.396  -1.229
  280   3HG2  VAL  36          3HG2      VAL  36   1.657   4.041  -1.239
  281    H    ASN  37           H        ASN  37  -1.721   5.843  -2.400
  282    HA   ASN  37           HA       ASN  37  -0.632   8.281  -3.727
  283   1HB   ASN  37          2HB       ASN  37  -3.523   7.531  -3.237
  284   2HB   ASN  37          3HB       ASN  37  -3.002   9.228  -3.223
  285   1HD2  ASN  37          1HD2      ASN  37  -2.850   6.305  -5.366
  286   2HD2  ASN  37          2HD2      ASN  37  -2.997   7.257  -6.828
  287    H    PHE  38           H        PHE  38   0.741   7.526  -1.750
  288    HA   PHE  38           HA       PHE  38   0.021   8.135   0.945
  289   1HB   PHE  38          2HB       PHE  38   2.583   8.533  -0.666
  290   2HB   PHE  38          3HB       PHE  38   2.467   8.957   1.035
  291    HD1  PHE  38           1HD      PHE  38   0.504   6.004   0.545
  292    HD2  PHE  38           2HD      PHE  38   4.480   7.540   1.222
  293    HE1  PHE  38           1HE      PHE  38   1.168   3.879   1.481
  294    HE2  PHE  38           2HE      PHE  38   5.159   5.361   2.078
  295    HZ   PHE  38           HZ       PHE  38   3.555   3.446   2.117
  296    H    GLY  39           H        GLY  39   0.415  10.263  -1.811
  297   1HA   GLY  39          1HA       GLY  39   1.063  12.558  -0.400
  298   2HA   GLY  39          2HA       GLY  39   0.151  12.519  -1.936
  299    H    ALA  40           H        ALA  40  -1.923  10.708  -0.347
  300    HA   ALA  40           HA       ALA  40  -2.821  12.584   1.749
  301   1HB   ALA  40          1HB       ALA  40  -4.665  11.268  -0.291
  302   2HB   ALA  40          2HB       ALA  40  -5.186  12.077   1.212
  303   3HB   ALA  40          3HB       ALA  40  -4.377  13.001  -0.065
  304    H    SER  41           H        SER  41  -4.668   9.710   1.056
  305    HA   SER  41           HA       SER  41  -3.257   7.976   2.848
  306   1HB   SER  41          2HB       SER  41  -5.834   9.451   3.646
  307   2HB   SER  41          3HB       SER  41  -5.330   7.934   4.402
  308    HG   SER  41           HG       SER  41  -3.422   8.909   5.037
  309    H    LYS  42           H        LYS  42  -3.504   7.140   0.471
  310    HA   LYS  42           HA       LYS  42  -5.784   5.354   0.502
  311   1HB   LYS  42          2HB       LYS  42  -6.070   6.099  -2.087
  312   2HB   LYS  42          3HB       LYS  42  -7.110   6.641  -0.775
  313   1HG   LYS  42          2HG       LYS  42  -6.145   8.752  -0.639
  314   2HG   LYS  42          3HG       LYS  42  -4.660   8.271  -1.479
  315   1HD   LYS  42          2HD       LYS  42  -5.861   8.019  -3.588
  316   2HD   LYS  42          3HD       LYS  42  -7.414   8.330  -2.791
  317   1HE   LYS  42          2HE       LYS  42  -6.829  10.620  -2.309
  318   2HE   LYS  42          3HE       LYS  42  -5.137  10.371  -2.765
  319   1HZ   LYS  42          1HZ       LYS  42  -7.395  10.219  -4.647
  320   2HZ   LYS  42          2HZ       LYS  42  -6.401  11.513  -4.455
  321   3HZ   LYS  42          3HZ       LYS  42  -5.793  10.100  -5.024
  322    H    ILE  43           H        ILE  43  -5.322   3.451  -0.430
  323    HA   ILE  43           HA       ILE  43  -3.161   3.286  -2.422
  324    HB   ILE  43           HB       ILE  43  -2.046   2.961  -0.342
  325   1HG1  ILE  43          2HG1      ILE  43  -1.248   1.540  -2.181
  326   2HG1  ILE  43          3HG1      ILE  43  -0.933   0.895  -0.565
  327   1HG2  ILE  43          1HG2      ILE  43  -2.542   1.173   1.222
  328   2HG2  ILE  43          2HG2      ILE  43  -3.817   2.382   1.166
  329   3HG2  ILE  43          3HG2      ILE  43  -4.052   0.812   0.372
  330   1HD1  ILE  43          1HD1      ILE  43  -2.764  -0.720  -0.813
  331   2HD1  ILE  43          2HD1      ILE  43  -3.023  -0.146  -2.470
  332   3HD1  ILE  43          3HD1      ILE  43  -1.481  -0.871  -2.025
  333    H    THR  44           H        THR  44  -3.991   2.387  -4.167
  334    HA   THR  44           HA       THR  44  -6.321   0.572  -3.971
  335    HB   THR  44           HB       THR  44  -4.895   1.756  -6.365
  336    HG1  THR  44           1HG      THR  44  -6.425   2.797  -4.651
  337   1HG2  THR  44          1HG2      THR  44  -7.503   0.187  -6.195
  338   2HG2  THR  44          2HG2      THR  44  -6.912   1.054  -7.627
  339   3HG2  THR  44          3HG2      THR  44  -6.019  -0.345  -7.018
  340    H    VAL  45           H        VAL  45  -6.151  -1.549  -4.228
  341    HA   VAL  45           HA       VAL  45  -3.681  -2.787  -5.297
  342    HB   VAL  45           HB       VAL  45  -5.210  -3.239  -2.750
  343   1HG1  VAL  45          1HG1      VAL  45  -4.601  -5.623  -2.596
  344   2HG1  VAL  45          2HG1      VAL  45  -5.853  -5.329  -3.807
  345   3HG1  VAL  45          3HG1      VAL  45  -4.173  -5.626  -4.315
  346   1HG2  VAL  45          1HG2      VAL  45  -3.070  -3.790  -1.876
  347   2HG2  VAL  45          2HG2      VAL  45  -2.383  -4.060  -3.496
  348   3HG2  VAL  45          3HG2      VAL  45  -2.823  -2.425  -2.986
  349    H    THR  46           H        THR  46  -4.160  -4.285  -6.924
  350    HA   THR  46           HA       THR  46  -6.897  -5.274  -7.215
  351    HB   THR  46           HB       THR  46  -5.394  -3.567  -9.252
  352    HG1  THR  46           1HG      THR  46  -7.208  -3.277  -7.478
  353   1HG2  THR  46          1HG2      THR  46  -7.292  -4.076 -10.820
  354   2HG2  THR  46          2HG2      THR  46  -6.248  -5.478 -10.550
  355   3HG2  THR  46          3HG2      THR  46  -7.820  -5.374  -9.723
  356    H    GLY  47           H        GLY  47  -6.889  -7.283  -7.890
  357   1HA   GLY  47          1HA       GLY  47  -5.365  -8.460  -9.761
  358   2HA   GLY  47          2HA       GLY  47  -4.267  -8.559  -8.401
  359    H    GLU  48           H        GLU  48  -4.685  -9.935  -6.662
  360    HA   GLU  48           HA       GLU  48  -7.318 -10.818  -5.978
  361   1HB   GLU  48          2HB       GLU  48  -6.505 -12.425  -7.911
  362   2HB   GLU  48          3HB       GLU  48  -5.466 -13.097  -6.661
  363   1HG   GLU  48          2HG       GLU  48  -7.245 -14.467  -6.317
  364   2HG   GLU  48          3HG       GLU  48  -7.884 -13.138  -5.353
  365    H    ALA  49           H        ALA  49  -5.657  -9.207  -4.563
  366    HA   ALA  49           HA       ALA  49  -5.096 -10.850  -2.192
  367   1HB   ALA  49          1HB       ALA  49  -2.929 -10.823  -3.379
  368   2HB   ALA  49          2HB       ALA  49  -2.979  -9.047  -3.445
  369   3HB   ALA  49          3HB       ALA  49  -2.843  -9.883  -1.884
  370    H    SER  50           H        SER  50  -4.333  -9.251  -0.366
  371    HA   SER  50           HA       SER  50  -6.135  -6.866  -0.351
  372   1HB   SER  50          2HB       SER  50  -5.705  -9.103   1.682
  373   2HB   SER  50          3HB       SER  50  -6.419  -7.558   2.135
  374    HG   SER  50           HG       SER  50  -7.946  -7.918   0.357
  375    H    ILE  51           H        ILE  51  -5.639  -5.376   1.554
  376    HA   ILE  51           HA       ILE  51  -3.152  -4.415   1.253
  377    HB   ILE  51           HB       ILE  51  -5.194  -3.228   2.378
  378   1HG1  ILE  51          2HG1      ILE  51  -3.714  -1.843   3.756
  379   2HG1  ILE  51          3HG1      ILE  51  -2.373  -2.896   3.326
  380   1HG2  ILE  51          1HG2      ILE  51  -5.392  -4.940   4.285
  381   2HG2  ILE  51          2HG2      ILE  51  -3.891  -4.218   4.938
  382   3HG2  ILE  51          3HG2      ILE  51  -5.343  -3.233   4.755
  383   1HD1  ILE  51          1HD1      ILE  51  -4.117  -1.272   1.425
  384   2HD1  ILE  51          2HD1      ILE  51  -2.416  -0.964   1.840
  385   3HD1  ILE  51          3HD1      ILE  51  -2.845  -2.366   0.873
  386    H    GLN  52           H        GLN  52  -4.102  -6.820   3.663
  387    HA   GLN  52           HA       GLN  52  -2.230  -6.916   5.555
  388   1HB   GLN  52          2HB       GLN  52  -3.091  -9.163   3.695
  389   2HB   GLN  52          3HB       GLN  52  -2.192  -9.473   5.187
  390   1HG   GLN  52          2HG       GLN  52  -3.928  -8.729   6.585
  391   2HG   GLN  52          3HG       GLN  52  -4.779  -7.881   5.290
  392   1HE2  GLN  52          1HE2      GLN  52  -6.343  -9.474   6.788
  393   2HE2  GLN  52          2HE2      GLN  52  -6.753 -10.919   5.881
  394    H    GLN  53           H        GLN  53  -1.536  -8.080   2.248
  395    HA   GLN  53           HA       GLN  53   1.215  -8.791   2.662
  396   1HB   GLN  53          2HB       GLN  53  -0.213  -7.809   0.171
  397   2HB   GLN  53          3HB       GLN  53   1.359  -8.618   0.217
  398   1HG   GLN  53          2HG       GLN  53  -0.768 -10.171   1.607
  399   2HG   GLN  53          3HG       GLN  53  -1.170  -9.789  -0.068
  400   1HE2  GLN  53          1HE2      GLN  53  -1.067 -12.054  -0.579
  401   2HE2  GLN  53          2HE2      GLN  53   0.494 -12.826  -0.768
  402    H    VAL  54           H        VAL  54  -0.319  -5.800   1.540
  403    HA   VAL  54           HA       VAL  54   2.068  -4.319   0.892
  404    HB   VAL  54           HB       VAL  54  -0.827  -3.421   1.374
  405   1HG1  VAL  54          1HG1      VAL  54  -0.119  -1.512  -0.104
  406   2HG1  VAL  54          2HG1      VAL  54   0.369  -1.560   1.582
  407   3HG1  VAL  54          3HG1      VAL  54   1.561  -1.951   0.315
  408   1HG2  VAL  54          1HG2      VAL  54  -0.870  -5.017  -0.402
  409   2HG2  VAL  54          2HG2      VAL  54  -0.853  -3.423  -1.161
  410   3HG2  VAL  54          3HG2      VAL  54   0.641  -4.387  -1.082
  411    H    GLU  55           H        GLU  55  -0.151  -4.489   3.688
  412    HA   GLU  55           HA       GLU  55   0.984  -2.429   5.200
  413   1HB   GLU  55          2HB       GLU  55  -1.312  -3.621   5.379
  414   2HB   GLU  55          3HB       GLU  55  -0.487  -4.821   6.375
  415   1HG   GLU  55          2HG       GLU  55   0.077  -3.163   8.023
  416   2HG   GLU  55          3HG       GLU  55  -0.272  -1.830   6.911
  417    H    GLN  56           H        GLN  56   1.494  -6.020   5.170
  418    HA   GLN  56           HA       GLN  56   3.476  -6.228   7.102
  419   1HB   GLN  56          2HB       GLN  56   2.291  -8.062   5.681
  420   2HB   GLN  56          3HB       GLN  56   3.490  -7.706   4.437
  421   1HG   GLN  56          2HG       GLN  56   4.305  -9.541   5.601
  422   2HG   GLN  56          3HG       GLN  56   5.277  -8.167   6.161
  423   1HE2  GLN  56          1HE2      GLN  56   5.595 -10.101   7.863
  424   2HE2  GLN  56          2HE2      GLN  56   4.506 -10.014   9.237
  425    H    ALA  57           H        ALA  57   3.861  -5.499   3.565
  426    HA   ALA  57           HA       ALA  57   6.617  -4.980   3.605
  427   1HB   ALA  57          1HB       ALA  57   6.287  -4.353   1.483
  428   2HB   ALA  57          2HB       ALA  57   4.622  -4.867   1.697
  429   3HB   ALA  57          3HB       ALA  57   5.033  -3.153   1.874
  430    H    GLY  58           H        GLY  58   3.898  -2.759   4.286
  431   1HA   GLY  58          1HA       GLY  58   5.294  -0.367   4.736
  432   2HA   GLY  58          2HA       GLY  58   3.701  -0.808   5.385
  433    H    ALA  59           H        ALA  59   5.320  -3.241   6.722
  434    HA   ALA  59           HA       ALA  59   5.784  -2.275   9.282
  435   1HB   ALA  59          1HB       ALA  59   7.389  -4.391   7.800
  436   2HB   ALA  59          2HB       ALA  59   7.325  -4.160   9.558
  437   3HB   ALA  59          3HB       ALA  59   5.863  -4.657   8.689
  438    H    PHE  60           H        PHE  60   7.807  -1.778   6.364
  439    HA   PHE  60           HA       PHE  60  10.168  -0.989   7.650
  440   1HB   PHE  60          2HB       PHE  60  10.743   0.298   5.733
  441   2HB   PHE  60          3HB       PHE  60  10.067  -1.263   5.281
  442    HD1  PHE  60           1HD      PHE  60   8.504  -1.295   3.500
  443    HD2  PHE  60           2HD      PHE  60   9.172   2.393   5.619
  444    HE1  PHE  60           1HE      PHE  60   7.075  -0.093   1.885
  445    HE2  PHE  60           2HE      PHE  60   7.586   3.541   4.124
  446    HZ   PHE  60           HZ       PHE  60   6.570   2.329   2.210
  447    H    GLU  61           H        GLU  61   7.166   0.885   7.385
  448    HA   GLU  61           HA       GLU  61   8.383   2.999   9.150
  449   1HB   GLU  61          2HB       GLU  61   6.768   3.207   6.639
  450   2HB   GLU  61          3HB       GLU  61   6.416   4.369   7.923
  451   1HG   GLU  61          2HG       GLU  61   9.308   4.011   7.185
  452   2HG   GLU  61          3HG       GLU  61   8.238   4.859   6.050
  453    H    HIS  62           H        HIS  62   6.313   0.426   9.133
  454    HA   HIS  62           HA       HIS  62   4.746  -0.316  10.590
  455   1HB   HIS  62          2HB       HIS  62   5.486   2.077  12.330
  456   2HB   HIS  62          3HB       HIS  62   4.501   0.699  12.806
  457    HD1  HIS  62           1HD      HIS  62   7.161  -0.953  11.005
  458    HD2  HIS  62           2HD      HIS  62   6.795   1.065  14.680
  459    HE1  HIS  62           1HE      HIS  62   8.989  -1.856  12.509
  460    H    LEU  63           H        LEU  63   3.759   0.788   8.422
  461    HA   LEU  63           HA       LEU  63   2.000   3.038   8.877
  462   1HB   LEU  63          2HB       LEU  63   2.179   0.850   6.781
  463   2HB   LEU  63          3HB       LEU  63   0.833   2.001   6.790
  464    HG   LEU  63           HG       LEU  63   2.149   3.861   6.472
  465   1HD1  LEU  63          1HD1      LEU  63   4.595   3.867   6.216
  466   2HD1  LEU  63          2HD1      LEU  63   4.097   3.521   7.871
  467   3HD1  LEU  63          3HD1      LEU  63   4.655   2.195   6.816
  468   1HD2  LEU  63          1HD2      LEU  63   3.311   1.610   4.756
  469   2HD2  LEU  63          2HD2      LEU  63   1.757   2.415   4.455
  470   3HD2  LEU  63          3HD2      LEU  63   3.280   3.324   4.325
  471    H    LYS  64           H        LYS  64  -0.335   3.016   8.919
  472    HA   LYS  64           HA       LYS  64  -1.596   0.462   9.704
  473   1HB   LYS  64          2HB       LYS  64  -3.146   1.831  11.200
  474   2HB   LYS  64          3HB       LYS  64  -1.575   1.291  11.784
  475   1HG   LYS  64          2HG       LYS  64  -1.692   3.333  12.681
  476   2HG   LYS  64          3HG       LYS  64  -0.702   3.681  11.278
  477   1HD   LYS  64          2HD       LYS  64  -2.321   4.945  10.282
  478   2HD   LYS  64          3HD       LYS  64  -3.664   3.959  10.868
  479   1HE   LYS  64          2HE       LYS  64  -3.151   4.922  13.230
  480   2HE   LYS  64          3HE       LYS  64  -2.156   6.129  12.392
  481   1HZ   LYS  64          1HZ       LYS  64  -4.131   6.870  11.264
  482   2HZ   LYS  64          2HZ       LYS  64  -5.041   5.664  11.906
  483   3HZ   LYS  64          3HZ       LYS  64  -4.414   6.865  12.844
  484    H    ILE  65           H        ILE  65  -2.974  -0.040   8.192
  485    HA   ILE  65           HA       ILE  65  -4.272   2.123   6.637
  486    HB   ILE  65           HB       ILE  65  -3.625  -0.669   5.638
  487   1HG1  ILE  65          2HG1      ILE  65  -1.913   1.790   5.664
  488   2HG1  ILE  65          3HG1      ILE  65  -1.517   0.129   6.175
  489   1HG2  ILE  65          1HG2      ILE  65  -4.077   1.911   4.093
  490   2HG2  ILE  65          2HG2      ILE  65  -4.034   0.286   3.432
  491   3HG2  ILE  65          3HG2      ILE  65  -5.371   0.763   4.472
  492   1HD1  ILE  65          1HD1      ILE  65  -1.285  -0.607   3.935
  493   2HD1  ILE  65          2HD1      ILE  65  -1.885   0.948   3.293
  494   3HD1  ILE  65          3HD1      ILE  65  -0.374   0.909   4.184
  495    H    ILE  66           H        ILE  66  -6.528   1.885   6.258
  496    HA   ILE  66           HA       ILE  66  -7.780  -0.423   7.669
  497    HB   ILE  66           HB       ILE  66  -8.671   2.464   7.924
  498   1HG1  ILE  66          2HG1      ILE  66  -8.193   1.598  10.474
  499   2HG1  ILE  66          3HG1      ILE  66  -6.950   0.677   9.643
  500   1HG2  ILE  66          1HG2      ILE  66  -9.723  -0.071   9.252
  501   2HG2  ILE  66          2HG2      ILE  66 -10.300   1.582   9.524
  502   3HG2  ILE  66          3HG2      ILE  66 -10.549   0.822   7.952
  503   1HD1  ILE  66          1HD1      ILE  66  -6.083   2.870   8.693
  504   2HD1  ILE  66          2HD1      ILE  66  -7.352   3.703   9.616
  505   3HD1  ILE  66          3HD1      ILE  66  -6.079   2.803  10.464
  506    HA   PRO  67           HA       PRO  67 -10.050  -0.473   3.746
  507   1HB   PRO  67          2HB       PRO  67 -11.922  -2.375   4.383
  508   2HB   PRO  67          3HB       PRO  67 -10.240  -2.785   3.977
  509   1HG   PRO  67          2HG       PRO  67 -11.473  -2.523   6.718
  510   2HG   PRO  67          3HG       PRO  67 -10.384  -3.805   6.118
  511   1HD   PRO  67          2HD       PRO  67  -9.524  -1.717   7.620
  512   2HD   PRO  67          3HD       PRO  67  -8.490  -2.408   6.338
  513    H    GLU  68           H        GLU  68 -11.153   1.443   3.612
  514    HA   GLU  68           HA       GLU  68 -12.943   2.664   5.286
  515   1HB   GLU  68          2HB       GLU  68 -13.128   2.391   2.243
  516   2HB   GLU  68          3HB       GLU  68 -14.033   3.566   3.213
  517   1HG   GLU  68          2HG       GLU  68 -11.930   4.555   4.019
  518   2HG   GLU  68          3HG       GLU  68 -10.993   3.376   3.080
  519    H    LYS  69           H        LYS  69 -13.701   0.109   2.936
  520    HA   LYS  69           HA       LYS  69 -15.379  -1.390   2.741
  521   1HB   LYS  69          2HB       LYS  69 -14.486  -1.751   5.153
  522   2HB   LYS  69          3HB       LYS  69 -15.995  -1.001   5.692
  523   1HG   LYS  69          2HG       LYS  69 -17.236  -2.747   4.325
  524   2HG   LYS  69          3HG       LYS  69 -15.647  -3.484   3.973
  525   1HD   LYS  69          2HD       LYS  69 -15.357  -3.430   6.607
  526   2HD   LYS  69          3HD       LYS  69 -17.111  -3.247   6.635
  527   1HE   LYS  69          2HE       LYS  69 -15.476  -5.530   5.406
  528   2HE   LYS  69          3HE       LYS  69 -16.461  -5.616   6.872
  529   1HZ   LYS  69          1HZ       LYS  69 -18.412  -5.230   5.508
  530   2HZ   LYS  69          2HZ       LYS  69 -17.496  -5.140   4.150
  531   3HZ   LYS  69          3HZ       LYS  69 -17.589  -6.555   4.979
  532    H    GLU  70           H        GLU  70 -16.090   0.977   1.782
  533    HA   GLU  70           HA       GLU  70 -18.507   2.071   2.883
  534   1HB   GLU  70          2HB       GLU  70 -16.682   3.203   1.458
  535   2HB   GLU  70          3HB       GLU  70 -17.419   2.416   0.061
  536   1HG   GLU  70          2HG       GLU  70 -18.285   4.642   0.190
  537   2HG   GLU  70          3HG       GLU  70 -19.601   3.579   0.700
  538    H    ALA  71           H        ALA  71 -19.515  -0.254   3.059
  539    HA   ALA  71           HA       ALA  71 -21.609  -0.435   1.109
  540   1HB   ALA  71          1HB       ALA  71 -21.156  -2.773   0.442
  541   2HB   ALA  71          2HB       ALA  71 -19.865  -1.715  -0.152
  542   3HB   ALA  71          3HB       ALA  71 -19.597  -2.729   1.286
  Start of MODEL   12
    1   1H    MET   1           H1       MET   1 -11.369  -7.877 -13.521
    2   2H    MET   1           H2       MET   1 -11.996  -6.987 -14.791
    3   3H    MET   1           H3       MET   1 -11.701  -6.296 -13.307
    4    HA   MET   1           HA       MET   1 -13.983  -6.655 -13.311
    5   1HB   MET   1          2HB       MET   1 -14.823  -9.025 -13.639
    6   2HB   MET   1          3HB       MET   1 -14.332  -8.178 -15.105
    7   1HG   MET   1          2HG       MET   1 -12.512  -9.545 -15.475
    8   2HG   MET   1          3HG       MET   1 -12.263  -9.917 -13.763
    9   1HE   MET   1          1HE       MET   1 -12.704 -13.424 -15.310
   10   2HE   MET   1          2HE       MET   1 -12.037 -12.030 -16.191
   11   3HE   MET   1          3HE       MET   1 -11.606 -12.296 -14.481
   12    H    ALA   2           H        ALA   2 -14.914  -7.197 -11.286
   13    HA   ALA   2           HA       ALA   2 -14.726  -7.377  -9.041
   14   1HB   ALA   2          1HB       ALA   2 -13.745 -10.158  -9.775
   15   2HB   ALA   2          2HB       ALA   2 -14.559  -9.668  -8.264
   16   3HB   ALA   2          3HB       ALA   2 -15.434  -9.620  -9.795
   17    H    GLU   3           H        GLU   3 -12.579  -9.351  -7.891
   18    HA   GLU   3           HA       GLU   3 -10.989  -8.517  -6.305
   19   1HB   GLU   3          2HB       GLU   3 -10.113  -9.752  -8.892
   20   2HB   GLU   3          3HB       GLU   3  -8.892  -9.328  -7.689
   21   1HG   GLU   3          2HG       GLU   3  -9.751 -11.694  -7.550
   22   2HG   GLU   3          3HG       GLU   3  -9.723 -10.760  -6.054
   23    H    LYS   4           H        LYS   4 -11.652  -6.211  -6.476
   24    HA   LYS   4           HA       LYS   4  -9.222  -4.608  -6.852
   25   1HB   LYS   4          2HB       LYS   4 -10.673  -2.681  -7.643
   26   2HB   LYS   4          3HB       LYS   4 -10.329  -3.945  -8.812
   27   1HG   LYS   4          2HG       LYS   4 -12.448  -4.229  -9.246
   28   2HG   LYS   4          3HG       LYS   4 -12.822  -4.695  -7.597
   29   1HD   LYS   4          2HD       LYS   4 -12.730  -1.808  -8.584
   30   2HD   LYS   4          3HD       LYS   4 -14.176  -2.831  -8.598
   31   1HE   LYS   4          2HE       LYS   4 -13.929  -3.171  -6.107
   32   2HE   LYS   4          3HE       LYS   4 -12.612  -1.985  -6.114
   33   1HZ   LYS   4          1HZ       LYS   4 -14.708  -1.017  -5.502
   34   2HZ   LYS   4          2HZ       LYS   4 -14.198  -0.354  -6.918
   35   3HZ   LYS   4          3HZ       LYS   4 -15.406  -1.474  -6.913
   36    H    THR   5           H        THR   5  -8.875  -3.344  -5.017
   37    HA   THR   5           HA       THR   5 -11.159  -2.492  -3.401
   38    HB   THR   5           HB       THR   5  -8.923  -4.205  -2.167
   39    HG1  THR   5           1HG      THR   5 -11.387  -4.590  -3.191
   40   1HG2  THR   5          1HG2      THR   5  -9.753  -2.541  -0.507
   41   2HG2  THR   5          2HG2      THR   5 -11.433  -2.919  -0.950
   42   3HG2  THR   5          3HG2      THR   5 -10.429  -4.133  -0.145
   43    H    VAL   6           H        VAL   6 -10.544  -0.750  -1.984
   44    HA   VAL   6           HA       VAL   6  -7.782  -0.143  -2.041
   45    HB   VAL   6           HB       VAL   6  -8.559   1.184  -3.819
   46   1HG1  VAL   6          1HG1      VAL   6 -10.396   2.740  -3.846
   47   2HG1  VAL   6          2HG1      VAL   6 -10.916   1.069  -3.649
   48   3HG1  VAL   6          3HG1      VAL   6 -10.918   2.163  -2.238
   49   1HG2  VAL   6          1HG2      VAL   6  -8.259   3.535  -3.172
   50   2HG2  VAL   6          2HG2      VAL   6  -8.702   3.163  -1.494
   51   3HG2  VAL   6          3HG2      VAL   6  -7.178   2.559  -2.173
   52    H    TYR   7           H        TYR   7  -6.972   0.883  -0.246
   53    HA   TYR   7           HA       TYR   7  -8.793   0.817   2.139
   54   1HB   TYR   7          2HB       TYR   7  -5.919  -0.144   1.889
   55   2HB   TYR   7          3HB       TYR   7  -6.940  -0.194   3.329
   56    HD1  TYR   7           HD1      TYR   7  -6.553  -1.611  -0.119
   57    HD2  TYR   7           HD2      TYR   7  -8.063  -2.144   3.879
   58    HE1  TYR   7           HE1      TYR   7  -6.900  -4.013  -0.564
   59    HE2  TYR   7           HE2      TYR   7  -8.449  -4.536   3.413
   60    HH   TYR   7           HH       TYR   7  -7.936  -6.064   0.337
   61    H    ARG   8           H        ARG   8  -8.206   2.357   3.815
   62    HA   ARG   8           HA       ARG   8  -6.951   4.737   2.674
   63   1HB   ARG   8          2HB       ARG   8  -9.174   4.414   4.198
   64   2HB   ARG   8          3HB       ARG   8  -8.003   4.539   5.517
   65   1HG   ARG   8          2HG       ARG   8  -7.172   6.691   4.352
   66   2HG   ARG   8          3HG       ARG   8  -8.575   6.490   3.279
   67   1HD   ARG   8          2HD       ARG   8  -9.721   6.196   5.792
   68   2HD   ARG   8          3HD       ARG   8  -8.428   7.339   6.141
   69    HE   ARG   8           HE       ARG   8 -10.609   7.544   4.049
   70   1HH1  ARG   8          2HH2      ARG   8  -8.551   9.301   6.346
   71   2HH1  ARG   8          1HH2      ARG   8  -9.292  10.835   6.036
   72   1HH2  ARG   8          2HH1      ARG   8 -11.476   9.436   3.552
   73   2HH2  ARG   8          1HH1      ARG   8 -11.003  10.950   4.302
   74    H    VAL   9           H        VAL   9  -4.863   5.416   3.239
   75    HA   VAL   9           HA       VAL   9  -3.489   3.918   5.429
   76    HB   VAL   9           HB       VAL   9  -2.586   3.004   3.475
   77   1HG1  VAL   9          1HG1      VAL   9  -1.482   4.346   1.698
   78   2HG1  VAL   9          2HG1      VAL   9  -3.232   4.537   1.733
   79   3HG1  VAL   9          3HG1      VAL   9  -2.191   5.823   2.383
   80   1HG2  VAL   9          1HG2      VAL   9  -0.570   5.124   4.184
   81   2HG2  VAL   9          2HG2      VAL   9  -1.033   3.851   5.341
   82   3HG2  VAL   9          3HG2      VAL   9  -0.329   3.411   3.785
   83    H    ASP  10           H        ASP  10  -2.463   5.066   6.911
   84    HA   ASP  10           HA       ASP  10  -2.179   8.008   6.618
   85   1HB   ASP  10          2HB       ASP  10  -3.763   6.416   8.680
   86   2HB   ASP  10          3HB       ASP  10  -3.041   7.970   9.096
   87    H    GLY  11           H        GLY  11  -0.841   8.840   8.416
   88   1HA   GLY  11          1HA       GLY  11   0.797   8.564  10.120
   89   2HA   GLY  11          2HA       GLY  11   1.131   6.915   9.578
   90    H    LEU  12           H        LEU  12   1.495   7.166   6.918
   91    HA   LEU  12           HA       LEU  12   4.156   7.948   6.682
   92   1HB   LEU  12          2HB       LEU  12   3.962   7.408   4.378
   93   2HB   LEU  12          3HB       LEU  12   2.962   6.286   5.282
   94    HG   LEU  12           HG       LEU  12   1.733   6.706   3.431
   95   1HD1  LEU  12          1HD1      LEU  12  -0.296   7.827   3.957
   96   2HD1  LEU  12          2HD1      LEU  12   0.286   6.929   5.360
   97   3HD1  LEU  12          3HD1      LEU  12   0.453   8.702   5.296
   98   1HD2  LEU  12          1HD2      LEU  12   2.075   9.717   3.498
   99   2HD2  LEU  12          2HD2      LEU  12   3.047   8.601   2.509
  100   3HD2  LEU  12          3HD2      LEU  12   1.296   8.703   2.295
  101    H    SER  13           H        SER  13   5.188   9.527   5.253
  102    HA   SER  13           HA       SER  13   3.713  11.737   4.113
  103   1HB   SER  13          2HB       SER  13   4.712  13.470   5.739
  104   2HB   SER  13          3HB       SER  13   3.363  12.515   6.335
  105    HG   SER  13           HG       SER  13   4.939  12.455   7.895
  106    H    CYS  14           H        CYS  14   5.580  10.150   2.755
  107    HA   CYS  14           HA       CYS  14   7.469  12.236   2.089
  108   1HB   CYS  14          2HB       CYS  14   8.394  10.795   4.179
  109   2HB   CYS  14          3HB       CYS  14   8.932   9.719   2.880
  110    HG   CYS  14           HG       CYS  14  10.712  11.505   3.849
  111    H    THR  15           H        THR  15   8.365  12.072   0.035
  112    HA   THR  15           HA       THR  15   7.043  10.458  -1.808
  113    HB   THR  15           HB       THR  15   9.752  11.793  -2.206
  114    HG1  THR  15           1HG      THR  15   7.179  12.977  -2.204
  115   1HG2  THR  15          1HG2      THR  15   8.899  10.539  -4.162
  116   2HG2  THR  15          2HG2      THR  15   7.353  11.407  -4.061
  117   3HG2  THR  15          3HG2      THR  15   8.846  12.286  -4.452
  118    H    ASN  16           H        ASN  16  10.424  10.115  -0.562
  119    HA   ASN  16           HA       ASN  16  11.066   7.813  -2.001
  120   1HB   ASN  16          2HB       ASN  16  12.676   7.325  -0.090
  121   2HB   ASN  16          3HB       ASN  16  12.856   8.864  -0.935
  122   1HD2  ASN  16          1HD2      ASN  16  12.739  10.772   0.225
  123   2HD2  ASN  16          2HD2      ASN  16  12.192  10.850   1.887
  124    H    CYS  17           H        CYS  17   9.338   8.148   1.137
  125    HA   CYS  17           HA       CYS  17   9.025   5.346   1.572
  126   1HB   CYS  17          2HB       CYS  17   7.272   7.656   2.527
  127   2HB   CYS  17          3HB       CYS  17   7.120   5.942   2.938
  128    HG   CYS  17           HG       CYS  17   8.153   6.604   4.931
  129    H    ALA  18           H        ALA  18   6.961   7.737  -0.165
  130    HA   ALA  18           HA       ALA  18   4.865   6.039  -0.907
  131   1HB   ALA  18          1HB       ALA  18   6.067   8.096  -2.805
  132   2HB   ALA  18          2HB       ALA  18   4.403   7.541  -2.695
  133   3HB   ALA  18          3HB       ALA  18   5.093   8.544  -1.396
  134    H    ALA  19           H        ALA  19   7.993   6.581  -2.491
  135    HA   ALA  19           HA       ALA  19   7.670   4.814  -4.695
  136   1HB   ALA  19          1HB       ALA  19  10.253   5.650  -3.326
  137   2HB   ALA  19          2HB       ALA  19  10.088   4.936  -4.938
  138   3HB   ALA  19          3HB       ALA  19   9.404   6.540  -4.605
  139    H    LYS  20           H        LYS  20   9.288   4.320  -1.524
  140    HA   LYS  20           HA       LYS  20   9.968   1.615  -1.753
  141   1HB   LYS  20          2HB       LYS  20  10.524   3.234   0.126
  142   2HB   LYS  20          3HB       LYS  20   8.876   3.030   0.707
  143   1HG   LYS  20          2HG       LYS  20  10.158   1.664   2.022
  144   2HG   LYS  20          3HG       LYS  20   9.338   0.537   0.940
  145   1HD   LYS  20          2HD       LYS  20  11.273   0.100  -0.332
  146   2HD   LYS  20          3HD       LYS  20  12.127   1.537   0.247
  147   1HE   LYS  20          2HE       LYS  20  11.409  -0.916   1.933
  148   2HE   LYS  20          3HE       LYS  20  13.002  -0.565   1.246
  149   1HZ   LYS  20          1HZ       LYS  20  13.018   1.477   2.573
  150   2HZ   LYS  20          2HZ       LYS  20  11.603   1.036   3.289
  151   3HZ   LYS  20          3HZ       LYS  20  12.953   0.122   3.501
  152    H    PHE  21           H        PHE  21   6.847   3.094  -0.769
  153    HA   PHE  21           HA       PHE  21   5.566   0.615  -0.250
  154   1HB   PHE  21          2HB       PHE  21   4.896   3.220   0.207
  155   2HB   PHE  21          3HB       PHE  21   3.827   2.867  -1.124
  156    HD1  PHE  21           1HD      PHE  21   1.806   1.468  -0.653
  157    HD2  PHE  21           2HD      PHE  21   5.005   1.757   2.214
  158    HE1  PHE  21           1HE      PHE  21   0.262   0.800   1.194
  159    HE2  PHE  21           2HE      PHE  21   3.519   0.869   3.959
  160    HZ   PHE  21           HZ       PHE  21   1.157   0.434   3.479
  161    H    GLU  22           H        GLU  22   5.257   2.736  -3.237
  162    HA   GLU  22           HA       GLU  22   3.501   0.971  -4.533
  163   1HB   GLU  22          2HB       GLU  22   4.097   1.932  -6.687
  164   2HB   GLU  22          3HB       GLU  22   3.973   3.177  -5.461
  165   1HG   GLU  22          2HG       GLU  22   5.735   3.908  -6.683
  166   2HG   GLU  22          3HG       GLU  22   6.416   3.137  -5.280
  167    H    ARG  23           H        ARG  23   7.054   1.030  -4.483
  168    HA   ARG  23           HA       ARG  23   7.480  -1.118  -6.249
  169   1HB   ARG  23          2HB       ARG  23   9.111   0.633  -5.091
  170   2HB   ARG  23          3HB       ARG  23   9.220  -0.464  -3.761
  171   1HG   ARG  23          2HG       ARG  23  10.571  -1.935  -4.841
  172   2HG   ARG  23          3HG       ARG  23   9.614  -1.891  -6.322
  173   1HD   ARG  23          2HD       ARG  23  11.659   0.177  -5.457
  174   2HD   ARG  23          3HD       ARG  23  11.789  -1.004  -6.788
  175    HE   ARG  23           HE       ARG  23   9.443   0.846  -6.922
  176   1HH1  ARG  23          2HH2      ARG  23  12.819   0.502  -7.844
  177   2HH1  ARG  23          1HH2      ARG  23  12.729   1.676  -9.126
  178   1HH2  ARG  23          2HH1      ARG  23   9.251   2.316  -8.317
  179   2HH2  ARG  23          1HH1      ARG  23  10.511   2.774  -9.484
  180    H    ASN  24           H        ASN  24   7.553  -1.178  -2.621
  181    HA   ASN  24           HA       ASN  24   7.946  -3.921  -2.284
  182   1HB   ASN  24          2HB       ASN  24   6.351  -1.887  -0.654
  183   2HB   ASN  24          3HB       ASN  24   6.430  -3.608  -0.255
  184   1HD2  ASN  24          1HD2      ASN  24   7.293  -3.015   1.805
  185   2HD2  ASN  24          2HD2      ASN  24   9.011  -2.830   1.931
  186    H    VAL  25           H        VAL  25   4.873  -2.129  -2.728
  187    HA   VAL  25           HA       VAL  25   3.141  -4.404  -2.577
  188    HB   VAL  25           HB       VAL  25   2.787  -1.703  -3.941
  189   1HG1  VAL  25          1HG1      VAL  25   1.168  -3.296  -4.842
  190   2HG1  VAL  25          2HG1      VAL  25   0.794  -3.908  -3.220
  191   3HG1  VAL  25          3HG1      VAL  25   0.354  -2.249  -3.657
  192   1HG2  VAL  25          1HG2      VAL  25   3.166  -1.677  -1.395
  193   2HG2  VAL  25          2HG2      VAL  25   1.568  -1.108  -1.904
  194   3HG2  VAL  25          3HG2      VAL  25   1.793  -2.754  -1.279
  195    H    LYS  26           H        LYS  26   4.665  -2.753  -5.365
  196    HA   LYS  26           HA       LYS  26   3.585  -4.364  -7.434
  197   1HB   LYS  26          2HB       LYS  26   5.972  -2.561  -7.078
  198   2HB   LYS  26          3HB       LYS  26   5.860  -3.482  -8.554
  199   1HG   LYS  26          2HG       LYS  26   3.831  -2.521  -9.180
  200   2HG   LYS  26          3HG       LYS  26   3.448  -1.954  -7.551
  201   1HD   LYS  26          2HD       LYS  26   4.440  -0.024  -7.812
  202   2HD   LYS  26          3HD       LYS  26   5.923  -0.704  -8.447
  203   1HE   LYS  26          2HE       LYS  26   3.394  -0.358 -10.145
  204   2HE   LYS  26          3HE       LYS  26   4.561   0.948  -9.916
  205   1HZ   LYS  26          1HZ       LYS  26   5.265  -1.681 -11.010
  206   2HZ   LYS  26          2HZ       LYS  26   5.032  -0.305 -11.893
  207   3HZ   LYS  26          3HZ       LYS  26   6.265  -0.385 -10.804
  208    H    GLU  27           H        GLU  27   6.439  -4.921  -5.342
  209    HA   GLU  27           HA       GLU  27   7.225  -7.312  -6.754
  210   1HB   GLU  27          2HB       GLU  27   7.886  -6.350  -3.946
  211   2HB   GLU  27          3HB       GLU  27   8.633  -7.728  -4.767
  212   1HG   GLU  27          2HG       GLU  27   9.410  -6.236  -6.597
  213   2HG   GLU  27          3HG       GLU  27   8.743  -4.839  -5.745
  214    H    ILE  28           H        ILE  28   4.402  -6.826  -4.827
  215    HA   ILE  28           HA       ILE  28   4.448  -9.483  -3.607
  216    HB   ILE  28           HB       ILE  28   2.196  -7.600  -3.988
  217   1HG1  ILE  28          2HG1      ILE  28   3.864  -6.515  -2.596
  218   2HG1  ILE  28          3HG1      ILE  28   2.474  -6.937  -1.610
  219   1HG2  ILE  28          1HG2      ILE  28   1.289  -9.778  -3.584
  220   2HG2  ILE  28          2HG2      ILE  28   2.362 -10.022  -2.194
  221   3HG2  ILE  28          3HG2      ILE  28   1.081  -8.782  -2.154
  222   1HD1  ILE  28          1HD1      ILE  28   3.763  -8.935  -0.756
  223   2HD1  ILE  28          2HD1      ILE  28   5.160  -8.386  -1.713
  224   3HD1  ILE  28          3HD1      ILE  28   4.532  -7.380  -0.401
  225    H    GLU  29           H        GLU  29   4.344 -11.110  -4.830
  226    HA   GLU  29           HA       GLU  29   2.848 -11.552  -7.259
  227   1HB   GLU  29          2HB       GLU  29   4.271 -13.245  -5.152
  228   2HB   GLU  29          3HB       GLU  29   3.356 -13.967  -6.457
  229   1HG   GLU  29          2HG       GLU  29   5.504 -11.925  -7.111
  230   2HG   GLU  29          3HG       GLU  29   5.925 -13.613  -6.784
  231    H    GLY  30           H        GLY  30   0.900 -10.662  -6.674
  232   1HA   GLY  30          1HA       GLY  30  -1.157 -12.457  -5.808
  233   2HA   GLY  30          2HA       GLY  30  -0.734 -11.369  -4.467
  234    H    VAL  31           H        VAL  31  -0.035  -9.017  -5.997
  235    HA   VAL  31           HA       VAL  31  -2.726  -8.228  -6.929
  236    HB   VAL  31           HB       VAL  31  -1.662  -7.075  -4.975
  237   1HG1  VAL  31          1HG1      VAL  31   0.224  -5.888  -7.042
  238   2HG1  VAL  31          2HG1      VAL  31   0.069  -5.448  -5.326
  239   3HG1  VAL  31          3HG1      VAL  31   0.691  -7.044  -5.771
  240   1HG2  VAL  31          1HG2      VAL  31  -2.128  -5.330  -7.392
  241   2HG2  VAL  31          2HG2      VAL  31  -3.403  -6.146  -6.446
  242   3HG2  VAL  31          3HG2      VAL  31  -2.383  -4.923  -5.675
  243    H    THR  32           H        THR  32  -2.854  -7.027  -8.890
  244    HA   THR  32           HA       THR  32  -0.721  -7.657 -10.878
  245    HB   THR  32           HB       THR  32  -3.678  -7.111 -11.367
  246    HG1  THR  32           1HG      THR  32  -2.207  -9.515 -11.090
  247   1HG2  THR  32          1HG2      THR  32  -1.457  -8.198 -13.159
  248   2HG2  THR  32          2HG2      THR  32  -3.176  -8.077 -13.591
  249   3HG2  THR  32          3HG2      THR  32  -2.232  -6.607 -13.301
  250    H    GLU  33           H        GLU  33  -3.281  -5.246 -10.005
  251    HA   GLU  33           HA       GLU  33  -1.266  -3.113 -10.748
  252   1HB   GLU  33          2HB       GLU  33  -4.258  -2.975 -11.286
  253   2HB   GLU  33          3HB       GLU  33  -3.072  -1.674 -11.459
  254   1HG   GLU  33          2HG       GLU  33  -1.796  -3.312 -13.043
  255   2HG   GLU  33          3HG       GLU  33  -3.324  -4.208 -13.104
  256    H    ALA  34           H        ALA  34  -0.736  -1.874  -9.034
  257    HA   ALA  34           HA       ALA  34  -2.787  -1.477  -6.921
  258   1HB   ALA  34          1HB       ALA  34   0.173  -1.978  -6.435
  259   2HB   ALA  34          2HB       ALA  34  -1.098  -1.690  -5.218
  260   3HB   ALA  34          3HB       ALA  34  -1.094  -3.192  -6.166
  261    H    ILE  35           H        ILE  35  -2.888   0.640  -6.237
  262    HA   ILE  35           HA       ILE  35  -0.824   2.532  -7.393
  263    HB   ILE  35           HB       ILE  35  -3.840   2.876  -7.489
  264   1HG1  ILE  35          2HG1      ILE  35  -1.930   2.743  -9.853
  265   2HG1  ILE  35          3HG1      ILE  35  -2.729   1.296  -9.237
  266   1HG2  ILE  35          1HG2      ILE  35  -1.574   4.710  -8.385
  267   2HG2  ILE  35          2HG2      ILE  35  -3.297   4.990  -8.698
  268   3HG2  ILE  35          3HG2      ILE  35  -2.697   5.013  -7.043
  269   1HD1  ILE  35          1HD1      ILE  35  -4.938   2.257  -9.590
  270   2HD1  ILE  35          2HD1      ILE  35  -4.207   3.717 -10.296
  271   3HD1  ILE  35          3HD1      ILE  35  -3.990   2.146 -11.083
  272    H    VAL  36           H        VAL  36   0.241   3.322  -5.561
  273    HA   VAL  36           HA       VAL  36  -1.397   3.685  -3.128
  274    HB   VAL  36           HB       VAL  36   0.678   2.406  -3.062
  275   1HG1  VAL  36          1HG1      VAL  36   2.255   4.983  -3.332
  276   2HG1  VAL  36          2HG1      VAL  36   2.819   3.318  -3.253
  277   3HG1  VAL  36          3HG1      VAL  36   1.985   3.893  -4.707
  278   1HG2  VAL  36          1HG2      VAL  36   1.610   3.706  -1.077
  279   2HG2  VAL  36          2HG2      VAL  36   0.413   4.954  -1.452
  280   3HG2  VAL  36          3HG2      VAL  36  -0.120   3.324  -1.022
  281    H    ASN  37           H        ASN  37  -2.524   5.665  -2.957
  282    HA   ASN  37           HA       ASN  37  -1.108   8.123  -3.895
  283   1HB   ASN  37          2HB       ASN  37  -3.728   7.784  -2.416
  284   2HB   ASN  37          3HB       ASN  37  -2.984   9.305  -2.905
  285   1HD2  ASN  37          1HD2      ASN  37  -4.274  10.139  -4.511
  286   2HD2  ASN  37          2HD2      ASN  37  -4.745   9.227  -5.935
  287    H    PHE  38           H        PHE  38   0.746   7.343  -2.514
  288    HA   PHE  38           HA       PHE  38   0.401   7.490   0.383
  289   1HB   PHE  38          2HB       PHE  38   2.296   6.314  -1.282
  290   2HB   PHE  38          3HB       PHE  38   3.160   7.674  -0.626
  291    HD1  PHE  38           1HD      PHE  38   0.693   5.154   0.765
  292    HD2  PHE  38           2HD      PHE  38   4.518   7.103   1.231
  293    HE1  PHE  38           1HE      PHE  38   1.364   3.474   2.435
  294    HE2  PHE  38           2HE      PHE  38   5.047   5.538   3.093
  295    HZ   PHE  38           HZ       PHE  38   3.523   3.703   3.641
  296    H    GLY  39           H        GLY  39  -0.736   9.590   0.018
  297   1HA   GLY  39          1HA       GLY  39   0.994  11.750   0.978
  298   2HA   GLY  39          2HA       GLY  39   0.269  12.046  -0.617
  299    H    ALA  40           H        ALA  40  -0.916  10.349   2.274
  300    HA   ALA  40           HA       ALA  40  -2.571  10.717   3.784
  301   1HB   ALA  40          1HB       ALA  40  -1.725  13.025   4.019
  302   2HB   ALA  40          2HB       ALA  40  -2.795  13.563   2.707
  303   3HB   ALA  40          3HB       ALA  40  -3.487  12.918   4.201
  304    H    SER  41           H        SER  41  -3.306   9.100   2.131
  305    HA   SER  41           HA       SER  41  -6.008   9.679   1.307
  306   1HB   SER  41          2HB       SER  41  -3.803   9.594  -0.742
  307   2HB   SER  41          3HB       SER  41  -5.435   9.027  -1.162
  308    HG   SER  41           HG       SER  41  -5.027  11.538   0.036
  309    H    LYS  42           H        LYS  42  -4.461   7.281  -0.633
  310    HA   LYS  42           HA       LYS  42  -5.259   5.113   1.105
  311   1HB   LYS  42          2HB       LYS  42  -7.213   4.446  -0.239
  312   2HB   LYS  42          3HB       LYS  42  -7.408   5.943   0.657
  313   1HG   LYS  42          2HG       LYS  42  -6.748   7.094  -1.654
  314   2HG   LYS  42          3HG       LYS  42  -7.232   5.523  -2.322
  315   1HD   LYS  42          2HD       LYS  42  -9.350   5.720  -0.897
  316   2HD   LYS  42          3HD       LYS  42  -8.861   7.364  -0.493
  317   1HE   LYS  42          2HE       LYS  42  -9.536   6.296  -3.282
  318   2HE   LYS  42          3HE       LYS  42 -10.589   7.277  -2.256
  319   1HZ   LYS  42          1HZ       LYS  42  -8.972   9.057  -2.389
  320   2HZ   LYS  42          2HZ       LYS  42  -8.021   8.158  -3.396
  321   3HZ   LYS  42          3HZ       LYS  42  -9.522   8.626  -3.877
  322    H    ILE  43           H        ILE  43  -5.054   3.079   0.140
  323    HA   ILE  43           HA       ILE  43  -3.187   2.993  -2.180
  324    HB   ILE  43           HB       ILE  43  -2.046   2.566  -0.126
  325   1HG1  ILE  43          2HG1      ILE  43  -1.381   1.285  -2.222
  326   2HG1  ILE  43          3HG1      ILE  43  -0.814   0.658  -0.683
  327   1HG2  ILE  43          1HG2      ILE  43  -2.444   0.611   1.286
  328   2HG2  ILE  43          2HG2      ILE  43  -3.751   1.796   1.366
  329   3HG2  ILE  43          3HG2      ILE  43  -3.966   0.292   0.451
  330   1HD1  ILE  43          1HD1      ILE  43  -3.189  -0.500  -2.129
  331   2HD1  ILE  43          2HD1      ILE  43  -1.535  -1.121  -2.163
  332   3HD1  ILE  43          3HD1      ILE  43  -2.444  -1.109  -0.643
  333    H    THR  44           H        THR  44  -4.084   2.155  -3.914
  334    HA   THR  44           HA       THR  44  -6.412   0.346  -3.706
  335    HB   THR  44           HB       THR  44  -5.047   1.726  -6.018
  336    HG1  THR  44           1HG      THR  44  -7.246   2.441  -6.145
  337   1HG2  THR  44          1HG2      THR  44  -5.829  -0.437  -6.911
  338   2HG2  THR  44          2HG2      THR  44  -7.399  -0.213  -6.105
  339   3HG2  THR  44          3HG2      THR  44  -6.904   0.846  -7.439
  340    H    VAL  45           H        VAL  45  -6.419  -1.649  -4.430
  341    HA   VAL  45           HA       VAL  45  -3.963  -2.987  -5.372
  342    HB   VAL  45           HB       VAL  45  -5.657  -3.547  -2.923
  343   1HG1  VAL  45          1HG1      VAL  45  -4.348  -5.827  -4.441
  344   2HG1  VAL  45          2HG1      VAL  45  -4.960  -5.891  -2.784
  345   3HG1  VAL  45          3HG1      VAL  45  -6.085  -5.621  -4.116
  346   1HG2  VAL  45          1HG2      VAL  45  -3.526  -4.110  -1.912
  347   2HG2  VAL  45          2HG2      VAL  45  -2.714  -4.087  -3.493
  348   3HG2  VAL  45          3HG2      VAL  45  -3.374  -2.592  -2.812
  349    H    THR  46           H        THR  46  -4.491  -4.146  -7.235
  350    HA   THR  46           HA       THR  46  -7.174  -5.326  -7.478
  351    HB   THR  46           HB       THR  46  -5.803  -3.547  -9.570
  352    HG1  THR  46           1HG      THR  46  -7.459  -3.312  -7.596
  353   1HG2  THR  46          1HG2      THR  46  -6.908  -5.450 -10.729
  354   2HG2  THR  46          2HG2      THR  46  -8.390  -5.164  -9.789
  355   3HG2  THR  46          3HG2      THR  46  -7.822  -3.948 -10.948
  356    H    GLY  47           H        GLY  47  -7.053  -7.304  -8.215
  357   1HA   GLY  47          1HA       GLY  47  -5.405  -8.371 -10.091
  358   2HA   GLY  47          2HA       GLY  47  -4.317  -8.372  -8.730
  359    H    GLU  48           H        GLU  48  -4.600  -9.711  -6.944
  360    HA   GLU  48           HA       GLU  48  -7.110 -10.893  -6.254
  361   1HB   GLU  48          2HB       GLU  48  -6.138 -12.497  -8.100
  362   2HB   GLU  48          3HB       GLU  48  -4.942 -12.927  -6.883
  363   1HG   GLU  48          2HG       GLU  48  -7.314 -13.150  -5.446
  364   2HG   GLU  48          3HG       GLU  48  -7.855 -13.563  -7.076
  365    H    ALA  49           H        ALA  49  -5.761  -9.101  -4.775
  366    HA   ALA  49           HA       ALA  49  -4.544 -10.688  -2.567
  367   1HB   ALA  49          1HB       ALA  49  -3.291  -8.380  -4.082
  368   2HB   ALA  49          2HB       ALA  49  -2.769  -8.827  -2.449
  369   3HB   ALA  49          3HB       ALA  49  -2.625 -10.001  -3.763
  370    H    SER  50           H        SER  50  -4.012  -9.112  -0.709
  371    HA   SER  50           HA       SER  50  -6.206  -7.166  -0.275
  372   1HB   SER  50          2HB       SER  50  -5.462  -9.559   1.474
  373   2HB   SER  50          3HB       SER  50  -6.430  -8.201   2.056
  374    HG   SER  50           HG       SER  50  -7.115  -9.670  -0.276
  375    H    ILE  51           H        ILE  51  -5.803  -5.867   1.717
  376    HA   ILE  51           HA       ILE  51  -3.374  -4.560   1.594
  377    HB   ILE  51           HB       ILE  51  -5.431  -3.723   2.704
  378   1HG1  ILE  51          2HG1      ILE  51  -3.520  -2.397   2.726
  379   2HG1  ILE  51          3HG1      ILE  51  -4.495  -2.247   4.186
  380   1HG2  ILE  51          1HG2      ILE  51  -5.887  -5.627   4.236
  381   2HG2  ILE  51          2HG2      ILE  51  -4.442  -5.203   5.180
  382   3HG2  ILE  51          3HG2      ILE  51  -5.794  -4.070   5.083
  383   1HD1  ILE  51          1HD1      ILE  51  -2.333  -2.243   5.079
  384   2HD1  ILE  51          2HD1      ILE  51  -2.740  -3.931   5.229
  385   3HD1  ILE  51          3HD1      ILE  51  -1.728  -3.353   3.878
  386    H    GLN  52           H        GLN  52  -4.103  -7.291   3.785
  387    HA   GLN  52           HA       GLN  52  -2.136  -7.456   5.550
  388   1HB   GLN  52          2HB       GLN  52  -3.106  -9.617   3.685
  389   2HB   GLN  52          3HB       GLN  52  -2.053  -9.963   5.061
  390   1HG   GLN  52          2HG       GLN  52  -4.599  -8.367   5.544
  391   2HG   GLN  52          3HG       GLN  52  -4.673 -10.112   5.307
  392   1HE2  GLN  52          1HE2      GLN  52  -3.252  -7.542   7.483
  393   2HE2  GLN  52          2HE2      GLN  52  -3.006  -8.673   8.780
  394    H    GLN  53           H        GLN  53  -1.493  -8.212   2.118
  395    HA   GLN  53           HA       GLN  53   1.309  -8.888   2.609
  396   1HB   GLN  53          2HB       GLN  53  -0.129  -8.149   0.032
  397   2HB   GLN  53          3HB       GLN  53   1.509  -8.824   0.164
  398   1HG   GLN  53          2HG       GLN  53   0.604 -10.845   1.280
  399   2HG   GLN  53          3HG       GLN  53  -1.039 -10.204   1.148
  400   1HE2  GLN  53          1HE2      GLN  53   1.055 -12.348  -0.319
  401   2HE2  GLN  53          2HE2      GLN  53   0.357 -12.321  -1.926
  402    H    VAL  54           H        VAL  54  -0.397  -5.973   1.549
  403    HA   VAL  54           HA       VAL  54   1.912  -4.289   1.204
  404    HB   VAL  54           HB       VAL  54  -1.001  -3.462   1.636
  405   1HG1  VAL  54          1HG1      VAL  54   0.302  -1.617   2.014
  406   2HG1  VAL  54          2HG1      VAL  54   1.477  -2.004   0.757
  407   3HG1  VAL  54          3HG1      VAL  54  -0.166  -1.480   0.315
  408   1HG2  VAL  54          1HG2      VAL  54   0.466  -4.407  -0.833
  409   2HG2  VAL  54          2HG2      VAL  54  -1.108  -4.903  -0.210
  410   3HG2  VAL  54          3HG2      VAL  54  -0.922  -3.297  -0.916
  411    H    GLU  55           H        GLU  55  -0.200  -5.240   3.844
  412    HA   GLU  55           HA       GLU  55   0.436  -3.345   5.810
  413   1HB   GLU  55          2HB       GLU  55  -1.220  -5.452   5.655
  414   2HB   GLU  55          3HB       GLU  55   0.021  -6.198   6.658
  415   1HG   GLU  55          2HG       GLU  55  -0.226  -4.397   8.311
  416   2HG   GLU  55          3HG       GLU  55  -1.443  -3.604   7.291
  417    H    GLN  56           H        GLN  56   1.726  -6.633   5.172
  418    HA   GLN  56           HA       GLN  56   3.921  -6.572   6.912
  419   1HB   GLN  56          2HB       GLN  56   2.939  -8.546   5.742
  420   2HB   GLN  56          3HB       GLN  56   3.787  -8.090   4.262
  421   1HG   GLN  56          2HG       GLN  56   5.337  -8.424   6.863
  422   2HG   GLN  56          3HG       GLN  56   4.764  -9.842   5.992
  423   1HE2  GLN  56          1HE2      GLN  56   6.837  -6.892   5.535
  424   2HE2  GLN  56          2HE2      GLN  56   7.833  -7.689   4.325
  425    H    ALA  57           H        ALA  57   3.823  -5.636   3.401
  426    HA   ALA  57           HA       ALA  57   6.461  -4.767   3.108
  427   1HB   ALA  57          1HB       ALA  57   4.998  -4.755   1.210
  428   2HB   ALA  57          2HB       ALA  57   3.839  -3.694   2.017
  429   3HB   ALA  57          3HB       ALA  57   5.369  -3.032   1.537
  430    H    GLY  58           H        GLY  58   3.644  -2.905   4.423
  431   1HA   GLY  58          1HA       GLY  58   5.030  -0.494   4.809
  432   2HA   GLY  58          2HA       GLY  58   3.509  -1.007   5.591
  433    H    ALA  59           H        ALA  59   5.398  -3.433   6.607
  434    HA   ALA  59           HA       ALA  59   5.918  -2.572   9.191
  435   1HB   ALA  59          1HB       ALA  59   7.511  -4.410   9.332
  436   2HB   ALA  59          2HB       ALA  59   6.055  -4.914   8.451
  437   3HB   ALA  59          3HB       ALA  59   7.560  -4.545   7.563
  438    H    PHE  60           H        PHE  60   7.854  -1.847   6.255
  439    HA   PHE  60           HA       PHE  60  10.211  -1.117   7.641
  440   1HB   PHE  60          2HB       PHE  60  10.962   0.004   5.769
  441   2HB   PHE  60          3HB       PHE  60  10.080  -1.405   5.196
  442    HD1  PHE  60           1HD      PHE  60   8.342  -1.108   3.552
  443    HD2  PHE  60           2HD      PHE  60   9.925   2.335   5.608
  444    HE1  PHE  60           1HE      PHE  60   6.914   0.360   2.182
  445    HE2  PHE  60           2HE      PHE  60   8.531   3.808   4.194
  446    HZ   PHE  60           HZ       PHE  60   7.018   2.846   2.488
  447    H    GLU  61           H        GLU  61   7.181   0.652   7.390
  448    HA   GLU  61           HA       GLU  61   8.374   2.863   9.031
  449   1HB   GLU  61          2HB       GLU  61   8.202   3.586   6.772
  450   2HB   GLU  61          3HB       GLU  61   6.533   3.070   6.628
  451   1HG   GLU  61          2HG       GLU  61   5.877   4.864   8.233
  452   2HG   GLU  61          3HG       GLU  61   7.583   5.302   8.420
  453    H    HIS  62           H        HIS  62   6.026   0.392   8.973
  454    HA   HIS  62           HA       HIS  62   4.456  -0.212  10.461
  455   1HB   HIS  62          2HB       HIS  62   5.421   2.062  12.245
  456   2HB   HIS  62          3HB       HIS  62   4.366   0.732  12.694
  457    HD1  HIS  62           1HD      HIS  62   7.129  -0.788  10.723
  458    HD2  HIS  62           2HD      HIS  62   6.498   0.694  14.618
  459    HE1  HIS  62           1HE      HIS  62   8.885  -1.849  12.194
  460    H    LEU  63           H        LEU  63   3.265   0.791   8.455
  461    HA   LEU  63           HA       LEU  63   1.671   3.175   9.175
  462   1HB   LEU  63          2HB       LEU  63   1.427   1.383   6.738
  463   2HB   LEU  63          3HB       LEU  63   0.630   2.929   7.022
  464    HG   LEU  63           HG       LEU  63   2.351   3.423   5.582
  465   1HD1  LEU  63          1HD1      LEU  63   3.491   4.160   8.319
  466   2HD1  LEU  63          2HD1      LEU  63   3.860   4.932   6.784
  467   3HD1  LEU  63          3HD1      LEU  63   2.214   5.044   7.452
  468   1HD2  LEU  63          1HD2      LEU  63   4.556   2.669   5.581
  469   2HD2  LEU  63          2HD2      LEU  63   4.531   2.228   7.295
  470   3HD2  LEU  63          3HD2      LEU  63   3.647   1.247   6.124
  471    H    LYS  64           H        LYS  64  -0.774   2.994   8.750
  472    HA   LYS  64           HA       LYS  64  -1.872   0.627  10.201
  473   1HB   LYS  64          2HB       LYS  64  -3.116   2.199  11.643
  474   2HB   LYS  64          3HB       LYS  64  -1.389   2.136  11.976
  475   1HG   LYS  64          2HG       LYS  64  -2.542   4.315  10.198
  476   2HG   LYS  64          3HG       LYS  64  -2.645   4.442  11.941
  477   1HD   LYS  64          2HD       LYS  64   0.063   3.847  10.743
  478   2HD   LYS  64          3HD       LYS  64  -0.629   5.439  10.521
  479   1HE   LYS  64          2HE       LYS  64  -0.746   5.760  12.947
  480   2HE   LYS  64          3HE       LYS  64  -0.334   4.059  13.236
  481   1HZ   LYS  64          1HZ       LYS  64   1.562   5.487  13.535
  482   2HZ   LYS  64          2HZ       LYS  64   1.831   4.458  12.277
  483   3HZ   LYS  64          3HZ       LYS  64   1.461   6.039  11.992
  484    H    ILE  65           H        ILE  65  -2.399   0.245   7.920
  485    HA   ILE  65           HA       ILE  65  -4.199   2.097   6.644
  486    HB   ILE  65           HB       ILE  65  -3.822  -0.744   5.739
  487   1HG1  ILE  65          2HG1      ILE  65  -1.798   1.479   5.550
  488   2HG1  ILE  65          3HG1      ILE  65  -1.621  -0.216   6.061
  489   1HG2  ILE  65          1HG2      ILE  65  -5.510   0.751   4.655
  490   2HG2  ILE  65          2HG2      ILE  65  -4.185   1.770   4.102
  491   3HG2  ILE  65          3HG2      ILE  65  -4.313   0.102   3.544
  492   1HD1  ILE  65          1HD1      ILE  65  -1.431   0.945   3.365
  493   2HD1  ILE  65          2HD1      ILE  65  -0.670  -0.487   4.092
  494   3HD1  ILE  65          3HD1      ILE  65  -2.291  -0.604   3.450
  495    H    ILE  66           H        ILE  66  -6.443   1.996   6.511
  496    HA   ILE  66           HA       ILE  66  -7.827  -0.178   8.038
  497    HB   ILE  66           HB       ILE  66  -8.558   2.750   7.732
  498   1HG1  ILE  66          2HG1      ILE  66  -8.308   1.934  10.484
  499   2HG1  ILE  66          3HG1      ILE  66  -6.852   1.390   9.664
  500   1HG2  ILE  66          1HG2      ILE  66 -10.373   2.296   9.322
  501   2HG2  ILE  66          2HG2      ILE  66 -10.592   1.368   7.838
  502   3HG2  ILE  66          3HG2      ILE  66  -9.980   0.567   9.304
  503   1HD1  ILE  66          1HD1      ILE  66  -7.978   4.223   9.633
  504   2HD1  ILE  66          2HD1      ILE  66  -6.555   3.656  10.533
  505   3HD1  ILE  66          3HD1      ILE  66  -6.520   3.696   8.757
  506    HA   PRO  67           HA       PRO  67  -9.900  -0.661   3.990
  507   1HB   PRO  67          2HB       PRO  67 -11.970  -2.289   4.737
  508   2HB   PRO  67          3HB       PRO  67 -10.302  -2.876   4.527
  509   1HG   PRO  67          2HG       PRO  67 -11.675  -2.110   7.105
  510   2HG   PRO  67          3HG       PRO  67 -10.694  -3.566   6.772
  511   1HD   PRO  67          2HD       PRO  67  -9.682  -1.384   8.026
  512   2HD   PRO  67          3HD       PRO  67  -8.674  -2.329   6.893
  513    H    GLU  68           H        GLU  68 -10.599   1.475   3.666
  514    HA   GLU  68           HA       GLU  68 -12.581   2.818   5.117
  515   1HB   GLU  68          2HB       GLU  68 -10.932   3.460   2.997
  516   2HB   GLU  68          3HB       GLU  68 -12.462   3.236   2.146
  517   1HG   GLU  68          2HG       GLU  68 -13.517   4.829   3.754
  518   2HG   GLU  68          3HG       GLU  68 -11.937   5.072   4.527
  519    H    LYS  69           H        LYS  69 -14.832   2.832   4.936
  520    HA   LYS  69           HA       LYS  69 -16.134   0.457   4.011
  521   1HB   LYS  69          2HB       LYS  69 -16.828   2.890   5.472
  522   2HB   LYS  69          3HB       LYS  69 -18.015   2.649   4.204
  523   1HG   LYS  69          2HG       LYS  69 -17.240   0.575   6.302
  524   2HG   LYS  69          3HG       LYS  69 -18.654   1.643   6.343
  525   1HD   LYS  69          2HD       LYS  69 -19.270   0.645   4.024
  526   2HD   LYS  69          3HD       LYS  69 -18.083  -0.622   4.384
  527   1HE   LYS  69          2HE       LYS  69 -19.325  -1.099   6.535
  528   2HE   LYS  69          3HE       LYS  69 -20.541   0.099   6.056
  529   1HZ   LYS  69          1HZ       LYS  69 -20.966  -1.230   4.089
  530   2HZ   LYS  69          2HZ       LYS  69 -19.860  -2.348   4.561
  531   3HZ   LYS  69          3HZ       LYS  69 -21.222  -2.106   5.462
  532    H    GLU  70           H        GLU  70 -17.381   0.076   2.113
  533    HA   GLU  70           HA       GLU  70 -16.842   1.262  -0.305
  534   1HB   GLU  70          2HB       GLU  70 -19.393  -0.016   0.776
  535   2HB   GLU  70          3HB       GLU  70 -19.215   0.486  -0.906
  536   1HG   GLU  70          2HG       GLU  70 -18.737  -1.863  -0.777
  537   2HG   GLU  70          3HG       GLU  70 -17.250  -0.997  -1.171
  538    H    ALA  71           H        ALA  71 -17.778   2.868  -1.625
  539    HA   ALA  71           HA       ALA  71 -19.886   4.590  -0.809
  540   1HB   ALA  71          1HB       ALA  71 -18.476   6.644  -0.931
  541   2HB   ALA  71          2HB       ALA  71 -18.012   5.648   0.468
  542   3HB   ALA  71          3HB       ALA  71 -17.012   5.638  -1.003
  Start of MODEL   13
    1   1H    MET   1           H1       MET   1 -13.567 -13.084 -12.273
    2   2H    MET   1           H2       MET   1 -14.991 -12.915 -13.090
    3   3H    MET   1           H3       MET   1 -13.540 -12.406 -13.755
    4    HA   MET   1           HA       MET   1 -14.777 -10.528 -13.001
    5   1HB   MET   1          2HB       MET   1 -14.849 -10.255 -10.430
    6   2HB   MET   1          3HB       MET   1 -16.051 -11.278 -11.192
    7   1HG   MET   1          2HG       MET   1 -13.518 -12.500 -10.043
    8   2HG   MET   1          3HG       MET   1 -14.914 -12.101  -9.043
    9   1HE   MET   1          1HE       MET   1 -14.536 -14.461  -8.326
   10   2HE   MET   1          2HE       MET   1 -15.523 -15.775  -9.006
   11   3HE   MET   1          3HE       MET   1 -13.873 -15.499  -9.615
   12    H    ALA   2           H        ALA   2 -13.486  -8.994 -11.078
   13    HA   ALA   2           HA       ALA   2 -10.602  -9.479 -11.286
   14   1HB   ALA   2          1HB       ALA   2 -11.951  -6.967 -12.400
   15   2HB   ALA   2          2HB       ALA   2 -10.206  -7.193 -12.164
   16   3HB   ALA   2          3HB       ALA   2 -11.076  -8.187 -13.352
   17    H    GLU   3           H        GLU   3 -10.212  -9.366  -9.142
   18    HA   GLU   3           HA       GLU   3 -11.485  -7.614  -7.318
   19   1HB   GLU   3          2HB       GLU   3  -9.013  -9.384  -7.108
   20   2HB   GLU   3          3HB       GLU   3  -9.792  -8.535  -5.767
   21   1HG   GLU   3          2HG       GLU   3 -10.797 -10.583  -5.587
   22   2HG   GLU   3          3HG       GLU   3 -11.997  -9.746  -6.561
   23    H    LYS   4           H        LYS   4 -11.199  -5.560  -7.120
   24    HA   LYS   4           HA       LYS   4  -8.544  -4.371  -7.041
   25   1HB   LYS   4          2HB       LYS   4  -9.146  -2.354  -8.023
   26   2HB   LYS   4          3HB       LYS   4  -9.590  -3.561  -9.209
   27   1HG   LYS   4          2HG       LYS   4 -11.800  -2.597  -7.365
   28   2HG   LYS   4          3HG       LYS   4 -11.081  -1.403  -8.422
   29   1HD   LYS   4          2HD       LYS   4 -13.085  -2.379  -9.390
   30   2HD   LYS   4          3HD       LYS   4 -11.659  -2.666 -10.410
   31   1HE   LYS   4          2HE       LYS   4 -11.467  -4.931  -9.703
   32   2HE   LYS   4          3HE       LYS   4 -12.602  -4.704  -8.348
   33   1HZ   LYS   4          1HZ       LYS   4 -13.455  -5.925 -10.138
   34   2HZ   LYS   4          2HZ       LYS   4 -14.385  -4.584  -9.844
   35   3HZ   LYS   4          3HZ       LYS   4 -13.389  -4.640 -11.173
   36    H    THR   5           H        THR   5  -8.420  -2.830  -5.235
   37    HA   THR   5           HA       THR   5 -10.874  -2.295  -3.756
   38    HB   THR   5           HB       THR   5  -8.639  -3.948  -2.436
   39    HG1  THR   5           1HG      THR   5 -10.984  -4.423  -3.655
   40   1HG2  THR   5          1HG2      THR   5 -11.311  -2.877  -1.364
   41   2HG2  THR   5          2HG2      THR   5 -10.311  -4.077  -0.537
   42   3HG2  THR   5          3HG2      THR   5  -9.700  -2.433  -0.758
   43    H    VAL   6           H        VAL   6 -10.465  -0.601  -2.200
   44    HA   VAL   6           HA       VAL   6  -7.721   0.154  -2.067
   45    HB   VAL   6           HB       VAL   6  -8.511   1.565  -3.769
   46   1HG1  VAL   6          1HG1      VAL   6 -10.868   1.322  -3.672
   47   2HG1  VAL   6          2HG1      VAL   6 -10.958   2.301  -2.182
   48   3HG1  VAL   6          3HG1      VAL   6 -10.432   3.026  -3.726
   49   1HG2  VAL   6          1HG2      VAL   6  -8.300   3.845  -2.939
   50   2HG2  VAL   6          2HG2      VAL   6  -8.799   3.348  -1.305
   51   3HG2  VAL   6          3HG2      VAL   6  -7.235   2.835  -1.962
   52    H    TYR   7           H        TYR   7  -7.043   1.266  -0.268
   53    HA   TYR   7           HA       TYR   7  -8.808   0.929   2.119
   54   1HB   TYR   7          2HB       TYR   7  -5.870   0.173   1.874
   55   2HB   TYR   7          3HB       TYR   7  -6.939  -0.092   3.249
   56    HD1  TYR   7           HD1      TYR   7  -7.840  -2.236   3.544
   57    HD2  TYR   7           HD2      TYR   7  -6.318  -1.123  -0.316
   58    HE1  TYR   7           HE1      TYR   7  -8.319  -4.520   2.697
   59    HE2  TYR   7           HE2      TYR   7  -6.722  -3.411  -1.137
   60    HH   TYR   7           HH       TYR   7  -7.804  -5.441  -0.702
   61    H    ARG   8           H        ARG   8  -8.239   2.438   3.824
   62    HA   ARG   8           HA       ARG   8  -6.893   4.867   2.752
   63   1HB   ARG   8          2HB       ARG   8  -8.857   4.332   4.936
   64   2HB   ARG   8          3HB       ARG   8  -7.592   5.519   5.279
   65   1HG   ARG   8          2HG       ARG   8  -8.112   6.711   3.132
   66   2HG   ARG   8          3HG       ARG   8  -9.399   5.550   2.825
   67   1HD   ARG   8          2HD       ARG   8 -10.314   7.586   3.786
   68   2HD   ARG   8          3HD       ARG   8 -10.481   6.277   4.974
   69    HE   ARG   8           HE       ARG   8  -7.959   7.506   5.432
   70   1HH1  ARG   8          2HH2      ARG   8 -11.315   8.458   5.610
   71   2HH1  ARG   8          1HH2      ARG   8 -11.092   9.650   6.857
   72   1HH2  ARG   8          2HH1      ARG   8  -7.566   8.891   7.154
   73   2HH2  ARG   8          1HH1      ARG   8  -8.823   9.950   7.732
   74    H    VAL   9           H        VAL   9  -4.909   5.448   3.330
   75    HA   VAL   9           HA       VAL   9  -3.498   3.969   5.492
   76    HB   VAL   9           HB       VAL   9  -2.471   3.236   3.452
   77   1HG1  VAL   9          1HG1      VAL   9  -2.287   6.159   2.579
   78   2HG1  VAL   9          2HG1      VAL   9  -1.525   4.779   1.771
   79   3HG1  VAL   9          3HG1      VAL   9  -3.282   4.889   1.841
   80   1HG2  VAL   9          1HG2      VAL   9  -0.291   3.887   3.744
   81   2HG2  VAL   9          2HG2      VAL   9  -0.727   5.476   4.440
   82   3HG2  VAL   9          3HG2      VAL   9  -1.018   3.974   5.358
   83    H    ASP  10           H        ASP  10  -2.528   5.273   7.008
   84    HA   ASP  10           HA       ASP  10  -2.399   8.174   6.584
   85   1HB   ASP  10          2HB       ASP  10  -4.362   6.771   8.428
   86   2HB   ASP  10          3HB       ASP  10  -3.494   8.170   9.049
   87    H    GLY  11           H        GLY  11  -0.933   9.065   8.175
   88   1HA   GLY  11          1HA       GLY  11   0.485   8.525  10.171
   89   2HA   GLY  11          2HA       GLY  11   0.950   7.032   9.352
   90    H    LEU  12           H        LEU  12   2.034   7.264   7.190
   91    HA   LEU  12           HA       LEU  12   4.143   9.250   7.538
   92   1HB   LEU  12          2HB       LEU  12   5.477   7.927   6.262
   93   2HB   LEU  12          3HB       LEU  12   4.366   6.732   6.924
   94    HG   LEU  12           HG       LEU  12   3.057   6.880   4.756
   95   1HD1  LEU  12          1HD1      LEU  12   3.760   8.718   3.484
   96   2HD1  LEU  12          2HD1      LEU  12   5.483   8.517   3.947
   97   3HD1  LEU  12          3HD1      LEU  12   4.705   7.448   2.776
   98   1HD2  LEU  12          1HD2      LEU  12   4.958   5.462   3.644
   99   2HD2  LEU  12          2HD2      LEU  12   5.865   5.798   5.127
  100   3HD2  LEU  12          3HD2      LEU  12   4.279   4.996   5.161
  101    H    SER  13           H        SER  13   4.991  10.504   5.646
  102    HA   SER  13           HA       SER  13   3.057  11.161   3.515
  103   1HB   SER  13          2HB       SER  13   2.271  12.650   5.238
  104   2HB   SER  13          3HB       SER  13   3.925  13.117   5.678
  105    HG   SER  13           HG       SER  13   4.154  14.066   3.649
  106    H    CYS  14           H        CYS  14   4.894  10.059   2.292
  107    HA   CYS  14           HA       CYS  14   6.621  12.138   1.276
  108   1HB   CYS  14          2HB       CYS  14   7.916  11.313   3.313
  109   2HB   CYS  14          3HB       CYS  14   7.987   9.719   2.531
  110    HG   CYS  14           HG       CYS  14   9.048  12.666   1.503
  111    H    THR  15           H        THR  15   7.453  11.681  -0.776
  112    HA   THR  15           HA       THR  15   6.061   9.804  -2.329
  113    HB   THR  15           HB       THR  15   8.594  11.308  -3.088
  114    HG1  THR  15           1HG      THR  15   7.022  12.973  -3.596
  115   1HG2  THR  15          1HG2      THR  15   6.103  10.479  -4.659
  116   2HG2  THR  15          2HG2      THR  15   7.462  11.426  -5.298
  117   3HG2  THR  15          3HG2      THR  15   7.713   9.744  -4.804
  118    H    ASN  16           H        ASN  16   9.540   9.853  -1.274
  119    HA   ASN  16           HA       ASN  16  10.408   7.618  -2.628
  120   1HB   ASN  16          2HB       ASN  16  11.200   8.566   0.158
  121   2HB   ASN  16          3HB       ASN  16  12.093   7.367  -0.788
  122   1HD2  ASN  16          1HD2      ASN  16  13.830   8.221  -1.909
  123   2HD2  ASN  16          2HD2      ASN  16  13.891   9.868  -2.506
  124    H    CYS  17           H        CYS  17   8.755   7.796   0.499
  125    HA   CYS  17           HA       CYS  17   8.736   5.006   1.165
  126   1HB   CYS  17          2HB       CYS  17   6.974   7.376   1.859
  127   2HB   CYS  17          3HB       CYS  17   6.517   5.717   2.268
  128    HG   CYS  17           HG       CYS  17   9.361   7.197   3.004
  129    H    ALA  18           H        ALA  18   6.513   7.041  -0.806
  130    HA   ALA  18           HA       ALA  18   4.600   4.993  -1.381
  131   1HB   ALA  18          1HB       ALA  18   5.104   7.727  -2.256
  132   2HB   ALA  18          2HB       ALA  18   4.715   6.687  -3.637
  133   3HB   ALA  18          3HB       ALA  18   3.612   6.799  -2.260
  134    H    ALA  19           H        ALA  19   7.530   6.021  -3.146
  135    HA   ALA  19           HA       ALA  19   7.364   4.147  -5.263
  136   1HB   ALA  19          1HB       ALA  19   9.029   5.977  -5.170
  137   2HB   ALA  19          2HB       ALA  19   9.913   5.109  -3.897
  138   3HB   ALA  19          3HB       ALA  19   9.770   4.401  -5.511
  139    H    LYS  20           H        LYS  20   8.837   3.794  -2.014
  140    HA   LYS  20           HA       LYS  20   9.654   1.101  -2.377
  141   1HB   LYS  20          2HB       LYS  20  10.155   2.934  -0.518
  142   2HB   LYS  20          3HB       LYS  20   8.854   2.109   0.348
  143   1HG   LYS  20          2HG       LYS  20  10.130   0.011   0.323
  144   2HG   LYS  20          3HG       LYS  20  11.252   0.661  -0.880
  145   1HD   LYS  20          2HD       LYS  20  12.434   0.733   1.165
  146   2HD   LYS  20          3HD       LYS  20  12.011   2.399   0.743
  147   1HE   LYS  20          2HE       LYS  20   9.955   2.097   2.293
  148   2HE   LYS  20          3HE       LYS  20  10.701   0.573   2.805
  149   1HZ   LYS  20          1HZ       LYS  20  11.828   3.280   3.108
  150   2HZ   LYS  20          2HZ       LYS  20  11.182   2.355   4.295
  151   3HZ   LYS  20          3HZ       LYS  20  12.587   1.891   3.575
  152    H    PHE  21           H        PHE  21   6.614   2.438  -1.027
  153    HA   PHE  21           HA       PHE  21   5.329   0.000  -0.430
  154   1HB   PHE  21          2HB       PHE  21   4.654   2.707  -0.350
  155   2HB   PHE  21          3HB       PHE  21   3.561   2.096  -1.560
  156    HD1  PHE  21           1HD      PHE  21   4.816   0.652   1.717
  157    HD2  PHE  21           2HD      PHE  21   1.432   2.012  -0.576
  158    HE1  PHE  21           1HE      PHE  21   3.455   0.747   3.766
  159    HE2  PHE  21           2HE      PHE  21   0.119   2.224   1.505
  160    HZ   PHE  21           HZ       PHE  21   1.173   1.694   3.689
  161    H    GLU  22           H        GLU  22   4.882   1.946  -3.502
  162    HA   GLU  22           HA       GLU  22   3.210  -0.040  -4.580
  163   1HB   GLU  22          2HB       GLU  22   3.574   1.024  -6.768
  164   2HB   GLU  22          3HB       GLU  22   3.056   2.095  -5.480
  165   1HG   GLU  22          2HG       GLU  22   4.715   3.494  -6.042
  166   2HG   GLU  22          3HG       GLU  22   5.878   2.309  -5.457
  167    H    ARG  23           H        ARG  23   6.745   0.410  -4.903
  168    HA   ARG  23           HA       ARG  23   7.311  -1.778  -6.645
  169   1HB   ARG  23          2HB       ARG  23   8.957  -0.044  -5.887
  170   2HB   ARG  23          3HB       ARG  23   8.927  -0.758  -4.264
  171   1HG   ARG  23          2HG       ARG  23   9.652  -2.984  -5.464
  172   2HG   ARG  23          3HG       ARG  23  10.003  -1.954  -6.844
  173   1HD   ARG  23          2HD       ARG  23  11.217  -0.767  -4.456
  174   2HD   ARG  23          3HD       ARG  23  11.513  -2.492  -4.428
  175    HE   ARG  23           HE       ARG  23  12.947  -2.350  -6.175
  176   1HH1  ARG  23          2HH2      ARG  23  10.981   0.553  -6.112
  177   2HH1  ARG  23          1HH2      ARG  23  11.928   1.459  -7.252
  178   1HH2  ARG  23          2HH1      ARG  23  14.250  -1.218  -7.733
  179   2HH2  ARG  23          1HH1      ARG  23  13.841   0.396  -8.218
  180    H    ASN  24           H        ASN  24   7.175  -1.707  -3.019
  181    HA   ASN  24           HA       ASN  24   7.723  -4.451  -2.595
  182   1HB   ASN  24          2HB       ASN  24   5.995  -2.471  -1.030
  183   2HB   ASN  24          3HB       ASN  24   6.229  -4.149  -0.557
  184   1HD2  ASN  24          1HD2      ASN  24   6.876  -2.482   1.303
  185   2HD2  ASN  24          2HD2      ASN  24   8.606  -2.533   1.532
  186    H    VAL  25           H        VAL  25   4.616  -2.777  -3.131
  187    HA   VAL  25           HA       VAL  25   2.990  -5.114  -3.050
  188    HB   VAL  25           HB       VAL  25   2.512  -2.493  -4.540
  189   1HG1  VAL  25          1HG1      VAL  25   0.751  -4.877  -3.850
  190   2HG1  VAL  25          2HG1      VAL  25   0.070  -3.267  -4.004
  191   3HG1  VAL  25          3HG1      VAL  25   0.896  -4.000  -5.398
  192   1HG2  VAL  25          1HG2      VAL  25   1.239  -1.856  -2.554
  193   2HG2  VAL  25          2HG2      VAL  25   1.547  -3.452  -1.838
  194   3HG2  VAL  25          3HG2      VAL  25   2.854  -2.307  -2.000
  195    H    LYS  26           H        LYS  26   4.498  -3.495  -5.919
  196    HA   LYS  26           HA       LYS  26   3.730  -5.348  -7.875
  197   1HB   LYS  26          2HB       LYS  26   5.991  -3.435  -7.423
  198   2HB   LYS  26          3HB       LYS  26   6.114  -4.504  -8.798
  199   1HG   LYS  26          2HG       LYS  26   4.170  -3.606  -9.806
  200   2HG   LYS  26          3HG       LYS  26   3.597  -2.872  -8.289
  201   1HD   LYS  26          2HD       LYS  26   5.345  -1.265  -8.257
  202   2HD   LYS  26          3HD       LYS  26   6.230  -2.071  -9.549
  203   1HE   LYS  26          2HE       LYS  26   4.464  -1.440 -11.181
  204   2HE   LYS  26          3HE       LYS  26   3.468  -0.785  -9.866
  205   1HZ   LYS  26          1HZ       LYS  26   6.060   0.300 -10.754
  206   2HZ   LYS  26          2HZ       LYS  26   4.577   1.010 -10.918
  207   3HZ   LYS  26          3HZ       LYS  26   5.257   0.802  -9.434
  208    H    GLU  27           H        GLU  27   6.458  -5.621  -5.523
  209    HA   GLU  27           HA       GLU  27   7.472  -8.077  -6.590
  210   1HB   GLU  27          2HB       GLU  27   7.633  -6.862  -3.819
  211   2HB   GLU  27          3HB       GLU  27   8.456  -8.332  -4.270
  212   1HG   GLU  27          2HG       GLU  27   8.957  -6.129  -6.202
  213   2HG   GLU  27          3HG       GLU  27   9.404  -5.701  -4.549
  214    H    ILE  28           H        ILE  28   4.410  -7.612  -5.016
  215    HA   ILE  28           HA       ILE  28   4.388 -10.315  -3.842
  216    HB   ILE  28           HB       ILE  28   2.099  -8.460  -4.223
  217   1HG1  ILE  28          2HG1      ILE  28   3.684  -8.626  -1.635
  218   2HG1  ILE  28          3HG1      ILE  28   3.846  -7.328  -2.817
  219   1HG2  ILE  28          1HG2      ILE  28   2.218 -11.139  -3.304
  220   2HG2  ILE  28          2HG2      ILE  28   1.984 -10.176  -1.856
  221   3HG2  ILE  28          3HG2      ILE  28   0.845 -10.021  -3.210
  222   1HD1  ILE  28          1HD1      ILE  28   2.261  -6.669  -1.050
  223   2HD1  ILE  28          2HD1      ILE  28   1.464  -6.765  -2.636
  224   3HD1  ILE  28          3HD1      ILE  28   1.220  -8.049  -1.462
  225    H    GLU  29           H        GLU  29   4.207 -11.915  -5.245
  226    HA   GLU  29           HA       GLU  29   3.248 -11.982  -7.836
  227   1HB   GLU  29          2HB       GLU  29   3.933 -13.949  -5.693
  228   2HB   GLU  29          3HB       GLU  29   2.745 -14.536  -6.834
  229   1HG   GLU  29          2HG       GLU  29   4.946 -15.156  -7.615
  230   2HG   GLU  29          3HG       GLU  29   4.282 -13.950  -8.727
  231    H    GLY  30           H        GLY  30   1.369 -11.897  -5.008
  232   1HA   GLY  30          1HA       GLY  30  -1.072 -13.106  -6.028
  233   2HA   GLY  30          2HA       GLY  30  -0.907 -12.117  -4.571
  234    H    VAL  31           H        VAL  31   0.333  -9.803  -6.168
  235    HA   VAL  31           HA       VAL  31  -2.329  -8.669  -6.748
  236    HB   VAL  31           HB       VAL  31  -0.450  -7.883  -5.073
  237   1HG1  VAL  31          1HG1      VAL  31   1.269  -7.536  -6.903
  238   2HG1  VAL  31          2HG1      VAL  31   0.282  -6.167  -7.471
  239   3HG1  VAL  31          3HG1      VAL  31   0.920  -6.169  -5.834
  240   1HG2  VAL  31          1HG2      VAL  31  -2.689  -6.860  -5.426
  241   2HG2  VAL  31          2HG2      VAL  31  -1.369  -5.761  -4.973
  242   3HG2  VAL  31          3HG2      VAL  31  -1.944  -5.791  -6.641
  243    H    THR  32           H        THR  32  -1.903  -6.654  -8.482
  244    HA   THR  32           HA       THR  32  -0.173  -7.587 -10.692
  245    HB   THR  32           HB       THR  32  -3.108  -6.871 -11.076
  246    HG1  THR  32           1HG      THR  32  -1.750  -9.216 -10.628
  247   1HG2  THR  32          1HG2      THR  32  -1.766  -6.134 -12.980
  248   2HG2  THR  32          2HG2      THR  32  -0.931  -7.701 -13.044
  249   3HG2  THR  32          3HG2      THR  32  -2.664  -7.596 -13.420
  250    H    GLU  33           H        GLU  33  -2.518  -5.018  -9.706
  251    HA   GLU  33           HA       GLU  33  -0.182  -3.124 -10.032
  252   1HB   GLU  33          2HB       GLU  33  -2.959  -2.539 -11.154
  253   2HB   GLU  33          3HB       GLU  33  -1.652  -1.372 -10.929
  254   1HG   GLU  33          2HG       GLU  33  -0.211  -3.048 -12.344
  255   2HG   GLU  33          3HG       GLU  33  -1.780  -3.661 -12.887
  256    H    ALA  34           H        ALA  34  -0.246  -1.197  -8.725
  257    HA   ALA  34           HA       ALA  34  -2.496  -0.924  -6.908
  258   1HB   ALA  34          1HB       ALA  34  -1.160  -2.589  -5.712
  259   2HB   ALA  34          2HB       ALA  34   0.303  -1.581  -5.878
  260   3HB   ALA  34          3HB       ALA  34  -1.044  -1.036  -4.856
  261    H    ILE  35           H        ILE  35  -2.503   1.151  -5.870
  262    HA   ILE  35           HA       ILE  35  -0.459   3.086  -6.954
  263    HB   ILE  35           HB       ILE  35  -3.473   3.495  -6.933
  264   1HG1  ILE  35          2HG1      ILE  35  -1.727   3.437  -9.421
  265   2HG1  ILE  35          3HG1      ILE  35  -2.475   1.958  -8.816
  266   1HG2  ILE  35          1HG2      ILE  35  -1.178   5.281  -7.863
  267   2HG2  ILE  35          2HG2      ILE  35  -2.896   5.639  -8.107
  268   3HG2  ILE  35          3HG2      ILE  35  -2.244   5.577  -6.474
  269   1HD1  ILE  35          1HD1      ILE  35  -3.882   2.911 -10.515
  270   2HD1  ILE  35          2HD1      ILE  35  -4.704   2.916  -8.944
  271   3HD1  ILE  35          3HD1      ILE  35  -4.043   4.426  -9.609
  272    H    VAL  36           H        VAL  36   0.268   4.449  -5.361
  273    HA   VAL  36           HA       VAL  36  -1.090   4.347  -2.697
  274    HB   VAL  36           HB       VAL  36   0.856   3.029  -2.605
  275   1HG1  VAL  36          1HG1      VAL  36   2.549   5.308  -3.699
  276   2HG1  VAL  36          2HG1      VAL  36   3.080   3.717  -3.151
  277   3HG1  VAL  36          3HG1      VAL  36   2.086   3.860  -4.596
  278   1HG2  VAL  36          1HG2      VAL  36   2.163   4.218  -0.899
  279   2HG2  VAL  36          2HG2      VAL  36   1.477   5.764  -1.395
  280   3HG2  VAL  36          3HG2      VAL  36   0.431   4.525  -0.674
  281    H    ASN  37           H        ASN  37  -2.105   6.259  -2.394
  282    HA   ASN  37           HA       ASN  37  -0.637   8.776  -3.153
  283   1HB   ASN  37          2HB       ASN  37  -3.557   8.316  -2.471
  284   2HB   ASN  37          3HB       ASN  37  -2.785   9.883  -2.776
  285   1HD2  ASN  37          1HD2      ASN  37  -4.805   7.834  -4.277
  286   2HD2  ASN  37          2HD2      ASN  37  -4.250   8.041  -5.929
  287    H    PHE  38           H        PHE  38   0.861   8.222  -1.432
  288    HA   PHE  38           HA       PHE  38  -0.032   8.449   1.339
  289   1HB   PHE  38          2HB       PHE  38   2.663   8.675  -0.054
  290   2HB   PHE  38          3HB       PHE  38   2.488   9.077   1.637
  291    HD1  PHE  38           1HD      PHE  38   0.860   7.139   2.925
  292    HD2  PHE  38           2HD      PHE  38   4.026   6.787   0.076
  293    HE1  PHE  38           1HE      PHE  38   1.564   5.004   3.920
  294    HE2  PHE  38           2HE      PHE  38   4.567   4.524   0.962
  295    HZ   PHE  38           HZ       PHE  38   3.304   3.629   2.854
  296    H    GLY  39           H        GLY  39   0.834  10.272   2.703
  297   1HA   GLY  39          1HA       GLY  39   1.325  12.677   2.793
  298   2HA   GLY  39          2HA       GLY  39   0.255  12.922   1.409
  299    H    ALA  40           H        ALA  40  -1.966  11.932   1.664
  300    HA   ALA  40           HA       ALA  40  -3.089  11.343   4.236
  301   1HB   ALA  40          1HB       ALA  40  -3.599  14.146   3.126
  302   2HB   ALA  40          2HB       ALA  40  -4.533  13.377   4.426
  303   3HB   ALA  40          3HB       ALA  40  -2.825  13.754   4.675
  304    H    SER  41           H        SER  41  -3.419   9.661   2.376
  305    HA   SER  41           HA       SER  41  -6.181   9.985   1.501
  306   1HB   SER  41          2HB       SER  41  -3.973  10.139  -0.540
  307   2HB   SER  41          3HB       SER  41  -5.542   9.425  -0.950
  308    HG   SER  41           HG       SER  41  -5.453  11.916   0.316
  309    H    LYS  42           H        LYS  42  -4.356   7.743  -0.396
  310    HA   LYS  42           HA       LYS  42  -5.352   5.499   1.167
  311   1HB   LYS  42          2HB       LYS  42  -7.189   4.919  -0.319
  312   2HB   LYS  42          3HB       LYS  42  -7.431   6.475   0.465
  313   1HG   LYS  42          2HG       LYS  42  -6.329   7.365  -1.851
  314   2HG   LYS  42          3HG       LYS  42  -6.996   5.849  -2.443
  315   1HD   LYS  42          2HD       LYS  42  -8.488   8.071  -0.964
  316   2HD   LYS  42          3HD       LYS  42  -8.569   7.755  -2.703
  317   1HE   LYS  42          2HE       LYS  42  -9.658   5.589  -2.327
  318   2HE   LYS  42          3HE       LYS  42  -9.468   5.730  -0.571
  319   1HZ   LYS  42          1HZ       LYS  42 -11.163   7.448  -2.234
  320   2HZ   LYS  42          2HZ       LYS  42 -11.643   6.247  -1.205
  321   3HZ   LYS  42          3HZ       LYS  42 -10.946   7.592  -0.601
  322    H    ILE  43           H        ILE  43  -5.155   3.460   0.054
  323    HA   ILE  43           HA       ILE  43  -3.167   3.475  -2.142
  324    HB   ILE  43           HB       ILE  43  -1.973   3.130  -0.146
  325   1HG1  ILE  43          2HG1      ILE  43  -1.106   1.799  -2.014
  326   2HG1  ILE  43          3HG1      ILE  43  -0.810   1.056  -0.442
  327   1HG2  ILE  43          1HG2      ILE  43  -3.685   2.432   1.397
  328   2HG2  ILE  43          2HG2      ILE  43  -3.848   0.871   0.582
  329   3HG2  ILE  43          3HG2      ILE  43  -2.336   1.301   1.408
  330   1HD1  ILE  43          1HD1      ILE  43  -1.346  -0.633  -1.999
  331   2HD1  ILE  43          2HD1      ILE  43  -2.638  -0.533  -0.792
  332   3HD1  ILE  43          3HD1      ILE  43  -2.873   0.136  -2.414
  333    H    THR  44           H        THR  44  -4.005   2.538  -3.849
  334    HA   THR  44           HA       THR  44  -6.326   0.705  -3.662
  335    HB   THR  44           HB       THR  44  -5.111   2.128  -6.056
  336    HG1  THR  44           1HG      THR  44  -6.497   2.966  -4.152
  337   1HG2  THR  44          1HG2      THR  44  -6.212   0.058  -6.814
  338   2HG2  THR  44          2HG2      THR  44  -7.647   0.449  -5.838
  339   3HG2  THR  44          3HG2      THR  44  -7.200   1.468  -7.220
  340    H    VAL  45           H        VAL  45  -6.195  -1.334  -4.446
  341    HA   VAL  45           HA       VAL  45  -3.556  -2.467  -5.203
  342    HB   VAL  45           HB       VAL  45  -5.670  -3.396  -3.248
  343   1HG1  VAL  45          1HG1      VAL  45  -4.233  -5.357  -2.760
  344   2HG1  VAL  45          2HG1      VAL  45  -4.671  -5.353  -4.474
  345   3HG1  VAL  45          3HG1      VAL  45  -3.063  -4.785  -3.960
  346   1HG2  VAL  45          1HG2      VAL  45  -4.306  -1.760  -2.153
  347   2HG2  VAL  45          2HG2      VAL  45  -3.846  -3.343  -1.528
  348   3HG2  VAL  45          3HG2      VAL  45  -2.812  -2.544  -2.731
  349    H    THR  46           H        THR  46  -3.848  -3.939  -6.955
  350    HA   THR  46           HA       THR  46  -6.547  -4.869  -7.608
  351    HB   THR  46           HB       THR  46  -4.749  -3.220  -9.471
  352    HG1  THR  46           1HG      THR  46  -6.782  -2.867  -7.813
  353   1HG2  THR  46          1HG2      THR  46  -6.594  -3.502 -11.125
  354   2HG2  THR  46          2HG2      THR  46  -5.801  -5.049 -10.785
  355   3HG2  THR  46          3HG2      THR  46  -7.380  -4.679 -10.051
  356    H    GLY  47           H        GLY  47  -6.476  -6.875  -8.266
  357   1HA   GLY  47          1HA       GLY  47  -4.816  -8.049 -10.006
  358   2HA   GLY  47          2HA       GLY  47  -3.805  -8.114  -8.588
  359    H    GLU  48           H        GLU  48  -4.224  -9.438  -6.893
  360    HA   GLU  48           HA       GLU  48  -6.793 -10.482  -6.185
  361   1HB   GLU  48          2HB       GLU  48  -6.046 -12.023  -8.067
  362   2HB   GLU  48          3HB       GLU  48  -4.716 -12.554  -7.043
  363   1HG   GLU  48          2HG       GLU  48  -7.461 -12.683  -5.810
  364   2HG   GLU  48          3HG       GLU  48  -7.212 -13.705  -7.223
  365    H    ALA  49           H        ALA  49  -5.407  -8.777  -4.692
  366    HA   ALA  49           HA       ALA  49  -4.612 -10.451  -2.416
  367   1HB   ALA  49          1HB       ALA  49  -2.738  -8.394  -3.662
  368   2HB   ALA  49          2HB       ALA  49  -2.531  -9.099  -2.055
  369   3HB   ALA  49          3HB       ALA  49  -2.448 -10.142  -3.491
  370    H    SER  50           H        SER  50  -4.183  -9.071  -0.472
  371    HA   SER  50           HA       SER  50  -5.904  -6.649  -0.400
  372   1HB   SER  50          2HB       SER  50  -5.871  -9.086   1.423
  373   2HB   SER  50          3HB       SER  50  -6.440  -7.530   2.020
  374    HG   SER  50           HG       SER  50  -7.967  -7.435   0.369
  375    H    ILE  51           H        ILE  51  -5.575  -5.316   1.539
  376    HA   ILE  51           HA       ILE  51  -3.017  -4.480   1.502
  377    HB   ILE  51           HB       ILE  51  -5.190  -3.260   2.323
  378   1HG1  ILE  51          2HG1      ILE  51  -3.824  -1.670   3.560
  379   2HG1  ILE  51          3HG1      ILE  51  -2.440  -2.747   3.319
  380   1HG2  ILE  51          1HG2      ILE  51  -4.003  -3.949   5.032
  381   2HG2  ILE  51          2HG2      ILE  51  -5.441  -2.981   4.684
  382   3HG2  ILE  51          3HG2      ILE  51  -5.478  -4.726   4.386
  383   1HD1  ILE  51          1HD1      ILE  51  -4.152  -1.378   1.185
  384   2HD1  ILE  51          2HD1      ILE  51  -2.472  -0.989   1.602
  385   3HD1  ILE  51          3HD1      ILE  51  -2.851  -2.500   0.786
  386    H    GLN  52           H        GLN  52  -4.240  -6.926   3.675
  387    HA   GLN  52           HA       GLN  52  -2.468  -7.054   5.765
  388   1HB   GLN  52          2HB       GLN  52  -3.232  -9.266   3.793
  389   2HB   GLN  52          3HB       GLN  52  -2.460  -9.580   5.347
  390   1HG   GLN  52          2HG       GLN  52  -5.147  -8.134   5.154
  391   2HG   GLN  52          3HG       GLN  52  -4.986  -9.889   5.189
  392   1HE2  GLN  52          1HE2      GLN  52  -4.169  -6.934   7.109
  393   2HE2  GLN  52          2HE2      GLN  52  -4.151  -7.800   8.630
  394    H    GLN  53           H        GLN  53  -1.693  -8.026   2.399
  395    HA   GLN  53           HA       GLN  53   1.056  -8.717   3.096
  396   1HB   GLN  53          2HB       GLN  53  -0.227  -8.174   0.397
  397   2HB   GLN  53          3HB       GLN  53   1.385  -8.880   0.676
  398   1HG   GLN  53          2HG       GLN  53   0.332 -10.746   1.949
  399   2HG   GLN  53          3HG       GLN  53  -1.272 -10.100   1.557
  400   1HE2  GLN  53          1HE2      GLN  53   0.518 -12.621   0.703
  401   2HE2  GLN  53          2HE2      GLN  53   0.182 -12.664  -1.019
  402    H    VAL  54           H        VAL  54  -0.519  -5.787   1.835
  403    HA   VAL  54           HA       VAL  54   1.937  -4.448   1.143
  404    HB   VAL  54           HB       VAL  54  -0.763  -3.142   1.719
  405   1HG1  VAL  54          1HG1      VAL  54   1.638  -2.255   0.114
  406   2HG1  VAL  54          2HG1      VAL  54   0.051  -1.455   0.125
  407   3HG1  VAL  54          3HG1      VAL  54   1.014  -1.540   1.600
  408   1HG2  VAL  54          1HG2      VAL  54  -1.303  -4.812   0.113
  409   2HG2  VAL  54          2HG2      VAL  54  -0.983  -3.366  -0.852
  410   3HG2  VAL  54          3HG2      VAL  54   0.234  -4.660  -0.711
  411    H    GLU  55           H        GLU  55  -0.127  -4.640   3.998
  412    HA   GLU  55           HA       GLU  55   0.959  -2.627   5.623
  413   1HB   GLU  55          2HB       GLU  55  -1.260  -3.849   5.790
  414   2HB   GLU  55          3HB       GLU  55  -0.402  -5.242   6.445
  415   1HG   GLU  55          2HG       GLU  55  -0.154  -2.480   7.685
  416   2HG   GLU  55          3HG       GLU  55  -1.500  -3.570   8.058
  417    H    GLN  56           H        GLN  56   1.455  -6.229   5.499
  418    HA   GLN  56           HA       GLN  56   3.540  -6.480   7.245
  419   1HB   GLN  56          2HB       GLN  56   2.273  -8.283   5.972
  420   2HB   GLN  56          3HB       GLN  56   3.283  -7.915   4.566
  421   1HG   GLN  56          2HG       GLN  56   4.195  -9.807   5.616
  422   2HG   GLN  56          3HG       GLN  56   5.307  -8.474   5.951
  423   1HE2  GLN  56          1HE2      GLN  56   5.467  -7.692   8.172
  424   2HE2  GLN  56          2HE2      GLN  56   4.764  -8.619   9.490
  425    H    ALA  57           H        ALA  57   3.769  -5.476   3.772
  426    HA   ALA  57           HA       ALA  57   6.608  -5.172   3.795
  427   1HB   ALA  57          1HB       ALA  57   6.329  -4.420   1.658
  428   2HB   ALA  57          2HB       ALA  57   4.864  -5.357   1.829
  429   3HB   ALA  57          3HB       ALA  57   4.783  -3.590   1.964
  430    H    GLY  58           H        GLY  58   3.892  -2.914   4.366
  431   1HA   GLY  58          1HA       GLY  58   5.242  -0.472   4.691
  432   2HA   GLY  58          2HA       GLY  58   3.656  -0.939   5.353
  433    H    ALA  59           H        ALA  59   5.027  -3.245   6.848
  434    HA   ALA  59           HA       ALA  59   5.767  -2.323   9.303
  435   1HB   ALA  59          1HB       ALA  59   7.233  -4.259   9.525
  436   2HB   ALA  59          2HB       ALA  59   5.755  -4.707   8.652
  437   3HB   ALA  59          3HB       ALA  59   7.285  -4.461   7.764
  438    H    PHE  60           H        PHE  60   7.729  -1.889   6.329
  439    HA   PHE  60           HA       PHE  60  10.139  -1.117   7.508
  440   1HB   PHE  60          2HB       PHE  60  10.633   0.139   5.561
  441   2HB   PHE  60          3HB       PHE  60   9.890  -1.393   5.145
  442    HD1  PHE  60           1HD      PHE  60   8.997   2.264   5.595
  443    HD2  PHE  60           2HD      PHE  60   8.386  -1.354   3.353
  444    HE1  PHE  60           1HE      PHE  60   7.551   3.493   4.015
  445    HE2  PHE  60           2HE      PHE  60   7.110  -0.074   1.658
  446    HZ   PHE  60           HZ       PHE  60   6.632   2.342   2.019
  447    H    GLU  61           H        GLU  61   7.173   0.798   7.335
  448    HA   GLU  61           HA       GLU  61   8.419   2.896   9.096
  449   1HB   GLU  61          2HB       GLU  61   6.827   3.114   6.570
  450   2HB   GLU  61          3HB       GLU  61   6.514   4.310   7.824
  451   1HG   GLU  61          2HG       GLU  61   9.405   3.831   7.139
  452   2HG   GLU  61          3HG       GLU  61   8.392   4.667   5.944
  453    H    HIS  62           H        HIS  62   6.024   0.491   8.905
  454    HA   HIS  62           HA       HIS  62   4.601  -0.219  10.489
  455   1HB   HIS  62          2HB       HIS  62   5.141   2.199  12.231
  456   2HB   HIS  62          3HB       HIS  62   4.638   0.583  12.704
  457    HD1  HIS  62           1HD      HIS  62   7.178  -0.851  10.989
  458    HD2  HIS  62           2HD      HIS  62   7.305   2.418  13.640
  459    HE1  HIS  62           1HE      HIS  62   9.533  -0.736  11.875
  460    H    LEU  63           H        LEU  63   3.310   0.700   8.417
  461    HA   LEU  63           HA       LEU  63   1.708   3.065   9.062
  462   1HB   LEU  63          2HB       LEU  63   1.771   1.215   6.658
  463   2HB   LEU  63          3HB       LEU  63   0.580   2.502   6.836
  464    HG   LEU  63           HG       LEU  63   2.435   3.298   5.488
  465   1HD1  LEU  63          1HD1      LEU  63   2.594   5.388   6.434
  466   2HD1  LEU  63          2HD1      LEU  63   1.130   4.757   7.150
  467   3HD1  LEU  63          3HD1      LEU  63   2.639   4.798   8.095
  468   1HD2  LEU  63          1HD2      LEU  63   4.684   3.248   6.087
  469   2HD2  LEU  63          2HD2      LEU  63   4.325   3.120   7.814
  470   3HD2  LEU  63          3HD2      LEU  63   4.101   1.739   6.706
  471    H    LYS  64           H        LYS  64  -0.781   2.961   8.619
  472    HA   LYS  64           HA       LYS  64  -1.905   0.677  10.157
  473   1HB   LYS  64          2HB       LYS  64  -3.167   2.289  11.531
  474   2HB   LYS  64          3HB       LYS  64  -1.470   2.108  11.924
  475   1HG   LYS  64          2HG       LYS  64  -2.540   4.389  10.200
  476   2HG   LYS  64          3HG       LYS  64  -2.512   4.476  11.955
  477   1HD   LYS  64          2HD       LYS  64  -0.021   4.143  10.221
  478   2HD   LYS  64          3HD       LYS  64  -0.663   5.607  10.806
  479   1HE   LYS  64          2HE       LYS  64  -0.087   5.188  13.059
  480   2HE   LYS  64          3HE       LYS  64  -0.064   3.437  12.850
  481   1HZ   LYS  64          1HZ       LYS  64   1.989   5.235  11.759
  482   2HZ   LYS  64          2HZ       LYS  64   2.128   4.274  13.086
  483   3HZ   LYS  64          3HZ       LYS  64   1.961   3.592  11.624
  484    H    ILE  65           H        ILE  65  -2.169   0.429   7.865
  485    HA   ILE  65           HA       ILE  65  -4.118   2.039   6.503
  486    HB   ILE  65           HB       ILE  65  -3.444  -0.722   5.510
  487   1HG1  ILE  65          2HG1      ILE  65  -1.456   1.517   5.664
  488   2HG1  ILE  65          3HG1      ILE  65  -1.347  -0.201   6.161
  489   1HG2  ILE  65          1HG2      ILE  65  -3.553   0.497   3.311
  490   2HG2  ILE  65          2HG2      ILE  65  -5.034   0.579   4.270
  491   3HG2  ILE  65          3HG2      ILE  65  -3.949   1.959   4.204
  492   1HD1  ILE  65          1HD1      ILE  65  -0.012  -0.057   4.296
  493   2HD1  ILE  65          2HD1      ILE  65  -1.476  -0.853   3.766
  494   3HD1  ILE  65          3HD1      ILE  65  -1.218   0.863   3.360
  495    H    ILE  66           H        ILE  66  -6.324   1.744   6.329
  496    HA   ILE  66           HA       ILE  66  -7.482  -0.599   7.773
  497    HB   ILE  66           HB       ILE  66  -8.356   2.294   7.771
  498   1HG1  ILE  66          2HG1      ILE  66  -7.603   0.645  10.211
  499   2HG1  ILE  66          3HG1      ILE  66  -6.336   1.425   9.275
  500   1HG2  ILE  66          1HG2      ILE  66  -9.613  -0.146   9.119
  501   2HG2  ILE  66          2HG2      ILE  66 -10.093   1.532   9.410
  502   3HG2  ILE  66          3HG2      ILE  66 -10.341   0.819   7.818
  503   1HD1  ILE  66          1HD1      ILE  66  -8.658   2.910  10.539
  504   2HD1  ILE  66          2HD1      ILE  66  -6.979   2.856  11.107
  505   3HD1  ILE  66          3HD1      ILE  66  -7.358   3.619   9.552
  506    HA   PRO  67           HA       PRO  67  -9.777  -0.960   3.828
  507   1HB   PRO  67          2HB       PRO  67 -11.538  -2.925   4.585
  508   2HB   PRO  67          3HB       PRO  67  -9.848  -3.265   4.147
  509   1HG   PRO  67          2HG       PRO  67 -11.017  -2.966   6.908
  510   2HG   PRO  67          3HG       PRO  67  -9.880  -4.212   6.322
  511   1HD   PRO  67          2HD       PRO  67  -9.086  -2.035   7.729
  512   2HD   PRO  67          3HD       PRO  67  -8.055  -2.709   6.433
  513    H    GLU  68           H        GLU  68 -10.871   0.967   3.701
  514    HA   GLU  68           HA       GLU  68 -12.757   2.105   5.394
  515   1HB   GLU  68          2HB       GLU  68 -12.734   2.009   2.329
  516   2HB   GLU  68          3HB       GLU  68 -13.687   3.128   3.307
  517   1HG   GLU  68          2HG       GLU  68 -11.650   4.130   4.219
  518   2HG   GLU  68          3HG       GLU  68 -10.633   2.988   3.333
  519    H    LYS  69           H        LYS  69 -13.305  -0.200   2.753
  520    HA   LYS  69           HA       LYS  69 -14.944  -1.600   2.196
  521   1HB   LYS  69          2HB       LYS  69 -14.586  -2.098   4.910
  522   2HB   LYS  69          3HB       LYS  69 -16.321  -1.793   4.822
  523   1HG   LYS  69          2HG       LYS  69 -16.406  -3.480   2.912
  524   2HG   LYS  69          3HG       LYS  69 -14.687  -3.807   3.212
  525   1HD   LYS  69          2HD       LYS  69 -15.202  -4.468   5.542
  526   2HD   LYS  69          3HD       LYS  69 -16.919  -4.148   5.282
  527   1HE   LYS  69          2HE       LYS  69 -15.238  -6.235   3.797
  528   2HE   LYS  69          3HE       LYS  69 -16.354  -6.570   5.125
  529   1HZ   LYS  69          1HZ       LYS  69 -18.152  -5.714   3.736
  530   2HZ   LYS  69          2HZ       LYS  69 -17.110  -5.489   2.488
  531   3HZ   LYS  69          3HZ       LYS  69 -17.400  -7.005   3.043
  532    H    GLU  70           H        GLU  70 -17.626  -1.895   2.702
  533    HA   GLU  70           HA       GLU  70 -19.076   0.530   2.851
  534   1HB   GLU  70          2HB       GLU  70 -19.730   0.659   0.461
  535   2HB   GLU  70          3HB       GLU  70 -18.001   0.915   0.652
  536   1HG   GLU  70          2HG       GLU  70 -17.827  -1.691   0.157
  537   2HG   GLU  70          3HG       GLU  70 -19.446  -1.463  -0.517
  538    H    ALA  71           H        ALA  71 -21.322   0.010   2.672
  539    HA   ALA  71           HA       ALA  71 -23.079  -1.191   3.375
  540   1HB   ALA  71          1HB       ALA  71 -22.050  -3.384   1.534
  541   2HB   ALA  71          2HB       ALA  71 -23.715  -3.143   2.105
  542   3HB   ALA  71          3HB       ALA  71 -22.982  -1.964   1.001
  Start of MODEL   14
    1   1H    MET   1           H1       MET   1 -16.765 -10.189 -11.557
    2   2H    MET   1           H2       MET   1 -18.348  -9.911 -11.102
    3   3H    MET   1           H3       MET   1 -17.572  -8.933 -12.204
    4    HA   MET   1           HA       MET   1 -17.363  -7.674 -10.300
    5   1HB   MET   1          2HB       MET   1 -16.819 -10.360  -8.963
    6   2HB   MET   1          3HB       MET   1 -16.494  -8.811  -8.172
    7   1HG   MET   1          2HG       MET   1 -18.806  -8.163  -8.246
    8   2HG   MET   1          3HG       MET   1 -19.243  -9.545  -9.259
    9   1HE   MET   1          1HE       MET   1 -21.274 -10.058  -7.731
   10   2HE   MET   1          2HE       MET   1 -21.147 -10.316  -5.976
   11   3HE   MET   1          3HE       MET   1 -20.844  -8.701  -6.658
   12    H    ALA   2           H        ALA   2 -15.124  -6.977  -9.314
   13    HA   ALA   2           HA       ALA   2 -12.880  -8.042 -10.964
   14   1HB   ALA   2          1HB       ALA   2 -13.723  -5.125 -10.689
   15   2HB   ALA   2          2HB       ALA   2 -12.249  -5.720 -11.483
   16   3HB   ALA   2          3HB       ALA   2 -13.841  -6.117 -12.161
   17    H    GLU   3           H        GLU   3 -11.263  -8.557  -9.604
   18    HA   GLU   3           HA       GLU   3 -11.201  -7.718  -6.858
   19   1HB   GLU   3          2HB       GLU   3  -9.307  -9.286  -8.655
   20   2HB   GLU   3          3HB       GLU   3  -8.954  -8.954  -6.958
   21   1HG   GLU   3          2HG       GLU   3 -11.454 -10.411  -7.930
   22   2HG   GLU   3          3HG       GLU   3  -9.999 -11.175  -7.271
   23    H    LYS   4           H        LYS   4 -11.341  -5.457  -7.334
   24    HA   LYS   4           HA       LYS   4  -8.632  -4.338  -7.005
   25   1HB   LYS   4          2HB       LYS   4  -9.160  -2.303  -8.107
   26   2HB   LYS   4          3HB       LYS   4  -9.490  -3.620  -9.230
   27   1HG   LYS   4          2HG       LYS   4 -11.443  -2.527  -9.609
   28   2HG   LYS   4          3HG       LYS   4 -11.979  -3.350  -8.150
   29   1HD   LYS   4          2HD       LYS   4 -12.576  -1.083  -7.821
   30   2HD   LYS   4          3HD       LYS   4 -11.117  -1.286  -6.846
   31   1HE   LYS   4          2HE       LYS   4  -9.805  -0.373  -8.915
   32   2HE   LYS   4          3HE       LYS   4 -11.381   0.014  -9.606
   33   1HZ   LYS   4          1HZ       LYS   4 -10.280   1.066  -7.081
   34   2HZ   LYS   4          2HZ       LYS   4 -10.411   1.880  -8.500
   35   3HZ   LYS   4          3HZ       LYS   4 -11.769   1.435  -7.686
   36    H    THR   5           H        THR   5  -8.481  -2.820  -5.248
   37    HA   THR   5           HA       THR   5 -10.923  -2.167  -3.774
   38    HB   THR   5           HB       THR   5  -8.791  -4.000  -2.530
   39    HG1  THR   5           1HG      THR   5 -11.140  -4.272  -3.777
   40   1HG2  THR   5          1HG2      THR   5 -11.353  -2.784  -1.353
   41   2HG2  THR   5          2HG2      THR   5 -10.420  -4.089  -0.604
   42   3HG2  THR   5          3HG2      THR   5  -9.700  -2.486  -0.768
   43    H    VAL   6           H        VAL   6 -10.402  -0.620  -2.065
   44    HA   VAL   6           HA       VAL   6  -7.670   0.127  -2.066
   45    HB   VAL   6           HB       VAL   6  -8.531   1.534  -3.738
   46   1HG1  VAL   6          1HG1      VAL   6 -10.822   1.250  -3.699
   47   2HG1  VAL   6          2HG1      VAL   6 -10.987   2.015  -2.102
   48   3HG1  VAL   6          3HG1      VAL   6 -10.537   2.979  -3.537
   49   1HG2  VAL   6          1HG2      VAL   6  -7.241   2.884  -2.052
   50   2HG2  VAL   6          2HG2      VAL   6  -8.437   3.843  -2.929
   51   3HG2  VAL   6          3HG2      VAL   6  -8.780   3.305  -1.268
   52    H    TYR   7           H        TYR   7  -6.946   1.301  -0.261
   53    HA   TYR   7           HA       TYR   7  -8.647   0.967   2.172
   54   1HB   TYR   7          2HB       TYR   7  -5.729   0.160   1.910
   55   2HB   TYR   7          3HB       TYR   7  -6.813  -0.123   3.257
   56    HD1  TYR   7           HD1      TYR   7  -6.174  -1.069  -0.338
   57    HD2  TYR   7           HD2      TYR   7  -7.664  -2.298   3.497
   58    HE1  TYR   7           HE1      TYR   7  -6.722  -3.287  -1.266
   59    HE2  TYR   7           HE2      TYR   7  -8.205  -4.533   2.571
   60    HH   TYR   7           HH       TYR   7  -7.784  -5.335  -0.877
   61    H    ARG   8           H        ARG   8  -8.129   2.564   3.821
   62    HA   ARG   8           HA       ARG   8  -6.830   5.005   2.708
   63   1HB   ARG   8          2HB       ARG   8  -8.707   4.389   4.991
   64   2HB   ARG   8          3HB       ARG   8  -7.514   5.655   5.283
   65   1HG   ARG   8          2HG       ARG   8  -8.232   6.856   3.244
   66   2HG   ARG   8          3HG       ARG   8  -9.502   5.639   3.010
   67   1HD   ARG   8          2HD       ARG   8 -10.307   6.271   5.414
   68   2HD   ARG   8          3HD       ARG   8  -9.093   7.538   5.389
   69    HE   ARG   8           HE       ARG   8 -10.458   8.859   4.134
   70   1HH1  ARG   8          2HH2      ARG   8 -11.650   5.609   4.025
   71   2HH1  ARG   8          1HH2      ARG   8 -12.165   5.752   2.408
   72   1HH2  ARG   8          2HH1      ARG   8 -12.210   9.335   2.595
   73   2HH2  ARG   8          1HH1      ARG   8 -13.253   8.033   2.096
   74    H    VAL   9           H        VAL   9  -4.888   5.831   3.526
   75    HA   VAL   9           HA       VAL   9  -3.494   4.225   5.611
   76    HB   VAL   9           HB       VAL   9  -2.469   3.552   3.583
   77   1HG1  VAL   9          1HG1      VAL   9  -1.410   5.118   1.990
   78   2HG1  VAL   9          2HG1      VAL   9  -3.169   5.226   1.986
   79   3HG1  VAL   9          3HG1      VAL   9  -2.210   6.477   2.804
   80   1HG2  VAL   9          1HG2      VAL   9  -0.620   5.716   4.604
   81   2HG2  VAL   9          2HG2      VAL   9  -1.021   4.282   5.581
   82   3HG2  VAL   9          3HG2      VAL   9  -0.244   4.084   4.012
   83    H    ASP  10           H        ASP  10  -2.375   5.362   7.147
   84    HA   ASP  10           HA       ASP  10  -2.064   8.276   6.856
   85   1HB   ASP  10          2HB       ASP  10  -3.582   6.794   9.060
   86   2HB   ASP  10          3HB       ASP  10  -2.855   8.387   9.293
   87    H    GLY  11           H        GLY  11  -0.387   8.996   8.261
   88   1HA   GLY  11          1HA       GLY  11   1.079   8.378  10.180
   89   2HA   GLY  11          2HA       GLY  11   1.460   6.877   9.330
   90    H    LEU  12           H        LEU  12   2.463   7.099   7.140
   91    HA   LEU  12           HA       LEU  12   4.694   8.927   7.400
   92   1HB   LEU  12          2HB       LEU  12   5.761   7.690   5.759
   93   2HB   LEU  12          3HB       LEU  12   4.771   6.512   6.605
   94    HG   LEU  12           HG       LEU  12   3.048   6.785   4.716
   95   1HD1  LEU  12          1HD1      LEU  12   5.396   8.332   3.549
   96   2HD1  LEU  12          2HD1      LEU  12   4.405   7.342   2.470
   97   3HD1  LEU  12          3HD1      LEU  12   3.653   8.642   3.353
   98   1HD2  LEU  12          1HD2      LEU  12   5.789   5.534   4.485
   99   2HD2  LEU  12          2HD2      LEU  12   4.222   4.809   4.858
  100   3HD2  LEU  12          3HD2      LEU  12   4.561   5.295   3.212
  101    H    SER  13           H        SER  13   5.443  10.350   5.616
  102    HA   SER  13           HA       SER  13   3.566  10.997   3.495
  103   1HB   SER  13          2HB       SER  13   2.726  12.395   5.401
  104   2HB   SER  13          3HB       SER  13   4.298  13.225   5.429
  105    HG   SER  13           HG       SER  13   2.670  14.266   4.124
  106    H    CYS  14           H        CYS  14   5.238  10.234   2.156
  107    HA   CYS  14           HA       CYS  14   7.157  12.238   1.402
  108   1HB   CYS  14          2HB       CYS  14   8.470  11.301   3.272
  109   2HB   CYS  14          3HB       CYS  14   8.232   9.661   2.635
  110    HG   CYS  14           HG       CYS  14   9.687  12.270   1.240
  111    H    THR  15           H        THR  15   7.301  12.080  -0.817
  112    HA   THR  15           HA       THR  15   6.035  10.227  -2.362
  113    HB   THR  15           HB       THR  15   8.607  11.650  -3.153
  114    HG1  THR  15           1HG      THR  15   6.023  12.783  -2.911
  115   1HG2  THR  15          1HG2      THR  15   7.533  10.282  -4.918
  116   2HG2  THR  15          2HG2      THR  15   5.990  11.119  -4.646
  117   3HG2  THR  15          3HG2      THR  15   7.390  12.013  -5.275
  118    H    ASN  16           H        ASN  16   9.490  10.114  -1.308
  119    HA   ASN  16           HA       ASN  16  10.170   7.828  -2.775
  120   1HB   ASN  16          2HB       ASN  16  11.356   9.163  -0.341
  121   2HB   ASN  16          3HB       ASN  16  11.878   7.536  -0.768
  122   1HD2  ASN  16          1HD2      ASN  16  12.001  10.924  -1.802
  123   2HD2  ASN  16          2HD2      ASN  16  13.124  10.613  -3.113
  124    H    CYS  17           H        CYS  17   8.557   8.177   0.378
  125    HA   CYS  17           HA       CYS  17   8.788   5.355   1.098
  126   1HB   CYS  17          2HB       CYS  17   7.126   7.668   2.133
  127   2HB   CYS  17          3HB       CYS  17   6.765   5.993   2.553
  128    HG   CYS  17           HG       CYS  17   9.696   7.447   2.839
  129    H    ALA  18           H        ALA  18   6.273   7.443  -0.413
  130    HA   ALA  18           HA       ALA  18   4.328   5.425  -0.835
  131   1HB   ALA  18          1HB       ALA  18   3.455   6.864  -2.601
  132   2HB   ALA  18          2HB       ALA  18   3.947   7.848  -1.207
  133   3HB   ALA  18          3HB       ALA  18   4.966   7.785  -2.660
  134    H    ALA  19           H        ALA  19   7.033   6.459  -2.933
  135    HA   ALA  19           HA       ALA  19   6.638   4.674  -5.070
  136   1HB   ALA  19          1HB       ALA  19   9.264   5.784  -4.011
  137   2HB   ALA  19          2HB       ALA  19   8.990   5.072  -5.613
  138   3HB   ALA  19          3HB       ALA  19   8.168   6.579  -5.161
  139    H    LYS  20           H        LYS  20   8.736   4.319  -2.172
  140    HA   LYS  20           HA       LYS  20   9.659   1.722  -2.730
  141   1HB   LYS  20          2HB       LYS  20  10.629   3.255  -1.079
  142   2HB   LYS  20          3HB       LYS  20   9.237   3.036  -0.005
  143   1HG   LYS  20          2HG       LYS  20   9.787   0.759   0.422
  144   2HG   LYS  20          3HG       LYS  20  10.859   0.675  -0.997
  145   1HD   LYS  20          2HD       LYS  20  12.449   2.244   0.088
  146   2HD   LYS  20          3HD       LYS  20  11.358   2.417   1.464
  147   1HE   LYS  20          2HE       LYS  20  13.231   0.905   1.982
  148   2HE   LYS  20          3HE       LYS  20  11.668   0.085   2.110
  149   1HZ   LYS  20          1HZ       LYS  20  13.342  -1.233   0.975
  150   2HZ   LYS  20          2HZ       LYS  20  12.073  -0.925  -0.017
  151   3HZ   LYS  20          3HZ       LYS  20  13.489  -0.102  -0.209
  152    H    PHE  21           H        PHE  21   6.802   2.760  -0.798
  153    HA   PHE  21           HA       PHE  21   5.725   0.258  -0.181
  154   1HB   PHE  21          2HB       PHE  21   4.688   3.016  -0.444
  155   2HB   PHE  21          3HB       PHE  21   3.505   1.810  -0.865
  156    HD1  PHE  21           1HD      PHE  21   5.275   3.361   1.872
  157    HD2  PHE  21           2HD      PHE  21   3.040  -0.135   0.711
  158    HE1  PHE  21           1HE      PHE  21   4.924   2.765   4.257
  159    HE2  PHE  21           2HE      PHE  21   2.500  -0.576   3.102
  160    HZ   PHE  21           HZ       PHE  21   3.294   0.992   4.851
  161    H    GLU  22           H        GLU  22   4.892   2.208  -3.187
  162    HA   GLU  22           HA       GLU  22   3.221   0.142  -4.115
  163   1HB   GLU  22          2HB       GLU  22   3.091   1.132  -6.193
  164   2HB   GLU  22          3HB       GLU  22   3.186   2.454  -5.030
  165   1HG   GLU  22          2HG       GLU  22   5.375   3.036  -5.710
  166   2HG   GLU  22          3HG       GLU  22   5.589   1.568  -6.676
  167    H    ARG  23           H        ARG  23   6.662   0.694  -4.745
  168    HA   ARG  23           HA       ARG  23   7.059  -1.512  -6.518
  169   1HB   ARG  23          2HB       ARG  23   8.767   0.236  -6.010
  170   2HB   ARG  23          3HB       ARG  23   8.979  -0.454  -4.388
  171   1HG   ARG  23          2HG       ARG  23   9.618  -2.637  -5.414
  172   2HG   ARG  23          3HG       ARG  23   9.422  -1.931  -7.028
  173   1HD   ARG  23          2HD       ARG  23  11.188  -0.326  -6.571
  174   2HD   ARG  23          3HD       ARG  23  11.357  -0.933  -4.895
  175    HE   ARG  23           HE       ARG  23  11.697  -3.229  -6.241
  176   1HH1  ARG  23          2HH2      ARG  23  13.289  -0.104  -6.300
  177   2HH1  ARG  23          1HH2      ARG  23  14.706  -0.609  -7.169
  178   1HH2  ARG  23          2HH1      ARG  23  13.483  -3.946  -7.550
  179   2HH2  ARG  23          1HH1      ARG  23  14.824  -2.890  -7.905
  180    H    ASN  24           H        ASN  24   7.227  -1.410  -2.893
  181    HA   ASN  24           HA       ASN  24   7.822  -4.136  -2.553
  182   1HB   ASN  24          2HB       ASN  24   7.498  -2.071  -0.822
  183   2HB   ASN  24          3HB       ASN  24   5.962  -2.892  -0.539
  184   1HD2  ASN  24          1HD2      ASN  24   8.309  -2.527   1.251
  185   2HD2  ASN  24          2HD2      ASN  24   8.808  -4.160   1.673
  186    H    VAL  25           H        VAL  25   4.657  -2.513  -2.934
  187    HA   VAL  25           HA       VAL  25   3.056  -4.890  -2.751
  188    HB   VAL  25           HB       VAL  25   2.461  -2.314  -4.294
  189   1HG1  VAL  25          1HG1      VAL  25   0.710  -4.628  -3.375
  190   2HG1  VAL  25          2HG1      VAL  25   0.076  -3.039  -3.826
  191   3HG1  VAL  25          3HG1      VAL  25   0.939  -4.004  -5.027
  192   1HG2  VAL  25          1HG2      VAL  25   2.812  -1.708  -1.985
  193   2HG2  VAL  25          2HG2      VAL  25   1.073  -1.839  -2.194
  194   3HG2  VAL  25          3HG2      VAL  25   1.994  -3.163  -1.433
  195    H    LYS  26           H        LYS  26   4.442  -3.249  -5.641
  196    HA   LYS  26           HA       LYS  26   3.472  -5.038  -7.583
  197   1HB   LYS  26          2HB       LYS  26   5.799  -3.135  -7.310
  198   2HB   LYS  26          3HB       LYS  26   5.650  -4.084  -8.763
  199   1HG   LYS  26          2HG       LYS  26   3.479  -3.182  -9.254
  200   2HG   LYS  26          3HG       LYS  26   3.342  -2.402  -7.664
  201   1HD   LYS  26          2HD       LYS  26   4.965  -0.740  -8.177
  202   2HD   LYS  26          3HD       LYS  26   5.663  -1.739  -9.441
  203   1HE   LYS  26          2HE       LYS  26   4.541   0.037 -10.572
  204   2HE   LYS  26          3HE       LYS  26   3.556  -1.409 -10.827
  205   1HZ   LYS  26          1HZ       LYS  26   2.151   0.392 -10.286
  206   2HZ   LYS  26          2HZ       LYS  26   2.157  -0.532  -8.936
  207   3HZ   LYS  26          3HZ       LYS  26   3.059   0.850  -9.003
  208    H    GLU  27           H        GLU  27   6.331  -5.304  -5.454
  209    HA   GLU  27           HA       GLU  27   7.259  -7.775  -6.629
  210   1HB   GLU  27          2HB       GLU  27   7.845  -6.383  -4.014
  211   2HB   GLU  27          3HB       GLU  27   8.693  -7.827  -4.574
  212   1HG   GLU  27          2HG       GLU  27   9.439  -6.676  -6.623
  213   2HG   GLU  27          3HG       GLU  27   8.600  -5.200  -6.146
  214    H    ILE  28           H        ILE  28   4.342  -7.456  -5.210
  215    HA   ILE  28           HA       ILE  28   4.390 -10.157  -3.925
  216    HB   ILE  28           HB       ILE  28   2.179  -8.178  -4.109
  217   1HG1  ILE  28          2HG1      ILE  28   3.849  -8.694  -1.616
  218   2HG1  ILE  28          3HG1      ILE  28   4.101  -7.332  -2.717
  219   1HG2  ILE  28          1HG2      ILE  28   1.272 -10.384  -3.776
  220   2HG2  ILE  28          2HG2      ILE  28   2.439 -10.721  -2.485
  221   3HG2  ILE  28          3HG2      ILE  28   1.124  -9.555  -2.252
  222   1HD1  ILE  28          1HD1      ILE  28   1.620  -7.812  -1.055
  223   2HD1  ILE  28          2HD1      ILE  28   2.782  -6.494  -0.924
  224   3HD1  ILE  28          3HD1      ILE  28   1.718  -6.621  -2.346
  225    H    GLU  29           H        GLU  29   4.143 -11.700  -5.379
  226    HA   GLU  29           HA       GLU  29   3.111 -11.758  -7.902
  227   1HB   GLU  29          2HB       GLU  29   3.384 -13.820  -5.671
  228   2HB   GLU  29          3HB       GLU  29   2.738 -14.246  -7.238
  229   1HG   GLU  29          2HG       GLU  29   5.080 -14.792  -7.219
  230   2HG   GLU  29          3HG       GLU  29   4.804 -13.470  -8.360
  231    H    GLY  30           H        GLY  30   1.368 -12.081  -4.972
  232   1HA   GLY  30          1HA       GLY  30  -1.143 -13.082  -5.955
  233   2HA   GLY  30          2HA       GLY  30  -0.912 -12.176  -4.451
  234    H    VAL  31           H        VAL  31   0.295  -9.821  -6.017
  235    HA   VAL  31           HA       VAL  31  -2.330  -8.594  -6.609
  236    HB   VAL  31           HB       VAL  31  -0.227  -7.776  -5.059
  237   1HG1  VAL  31          1HG1      VAL  31   1.199  -7.355  -7.124
  238   2HG1  VAL  31          2HG1      VAL  31   0.039  -6.075  -7.559
  239   3HG1  VAL  31          3HG1      VAL  31   0.938  -5.984  -6.042
  240   1HG2  VAL  31          1HG2      VAL  31  -2.128  -5.902  -6.478
  241   2HG2  VAL  31          2HG2      VAL  31  -2.536  -6.921  -5.079
  242   3HG2  VAL  31          3HG2      VAL  31  -1.302  -5.658  -4.928
  243    H    THR  32           H        THR  32  -2.194  -6.940  -8.490
  244    HA   THR  32           HA       THR  32  -0.436  -7.903 -10.701
  245    HB   THR  32           HB       THR  32  -3.346  -7.074 -11.032
  246    HG1  THR  32           1HG      THR  32  -2.062  -9.521 -10.639
  247   1HG2  THR  32          1HG2      THR  32  -3.032  -7.927 -13.322
  248   2HG2  THR  32          2HG2      THR  32  -1.930  -6.575 -12.998
  249   3HG2  THR  32          3HG2      THR  32  -1.317  -8.246 -12.985
  250    H    GLU  33           H        GLU  33  -2.744  -5.274  -9.770
  251    HA   GLU  33           HA       GLU  33  -0.454  -3.358 -10.233
  252   1HB   GLU  33          2HB       GLU  33  -3.326  -3.260 -11.164
  253   2HB   GLU  33          3HB       GLU  33  -2.477  -1.749 -10.809
  254   1HG   GLU  33          2HG       GLU  33  -0.981  -3.761 -12.479
  255   2HG   GLU  33          3HG       GLU  33  -2.383  -2.978 -13.175
  256    H    ALA  34           H        ALA  34  -0.637  -1.328  -9.126
  257    HA   ALA  34           HA       ALA  34  -2.575  -1.093  -7.033
  258   1HB   ALA  34          1HB       ALA  34  -1.004  -2.535  -5.810
  259   2HB   ALA  34          2HB       ALA  34   0.347  -1.440  -6.192
  260   3HB   ALA  34          3HB       ALA  34  -0.969  -0.900  -5.124
  261    H    ILE  35           H        ILE  35  -2.889   1.062  -6.522
  262    HA   ILE  35           HA       ILE  35  -1.013   3.054  -7.741
  263    HB   ILE  35           HB       ILE  35  -4.041   3.293  -7.630
  264   1HG1  ILE  35          2HG1      ILE  35  -3.529   1.595  -9.294
  265   2HG1  ILE  35          3HG1      ILE  35  -4.114   3.080 -10.029
  266   1HG2  ILE  35          1HG2      ILE  35  -3.634   5.276  -9.070
  267   2HG2  ILE  35          2HG2      ILE  35  -2.917   5.431  -7.460
  268   3HG2  ILE  35          3HG2      ILE  35  -1.884   5.056  -8.850
  269   1HD1  ILE  35          1HD1      ILE  35  -2.280   2.096 -11.322
  270   2HD1  ILE  35          2HD1      ILE  35  -1.819   3.693 -10.710
  271   3HD1  ILE  35          3HD1      ILE  35  -1.187   2.221  -9.938
  272    H    VAL  36           H        VAL  36   0.021   3.692  -5.911
  273    HA   VAL  36           HA       VAL  36  -1.555   3.905  -3.418
  274    HB   VAL  36           HB       VAL  36   0.182   3.263  -2.234
  275   1HG1  VAL  36          1HG1      VAL  36   0.977   1.914  -4.826
  276   2HG1  VAL  36          2HG1      VAL  36   1.192   1.322  -3.169
  277   3HG1  VAL  36          3HG1      VAL  36  -0.432   1.470  -3.863
  278   1HG2  VAL  36          1HG2      VAL  36   2.580   3.346  -2.872
  279   2HG2  VAL  36          2HG2      VAL  36   2.129   4.260  -4.335
  280   3HG2  VAL  36          3HG2      VAL  36   1.840   4.939  -2.722
  281    H    ASN  37           H        ASN  37  -2.151   5.893  -2.727
  282    HA   ASN  37           HA       ASN  37  -0.903   8.232  -4.100
  283   1HB   ASN  37          2HB       ASN  37  -3.430   7.988  -2.440
  284   2HB   ASN  37          3HB       ASN  37  -2.765   9.488  -3.086
  285   1HD2  ASN  37          1HD2      ASN  37  -3.772   6.180  -4.214
  286   2HD2  ASN  37          2HD2      ASN  37  -4.409   6.777  -5.735
  287    H    PHE  38           H        PHE  38  -1.706   7.051  -0.800
  288    HA   PHE  38           HA       PHE  38  -0.769   7.503   1.229
  289   1HB   PHE  38          2HB       PHE  38   1.559   7.488  -0.678
  290   2HB   PHE  38          3HB       PHE  38   1.877   8.024   0.938
  291    HD1  PHE  38           1HD      PHE  38   2.087   6.531   2.736
  292    HD2  PHE  38           2HD      PHE  38   0.304   5.176  -0.924
  293    HE1  PHE  38           1HE      PHE  38   2.255   4.189   3.531
  294    HE2  PHE  38           2HE      PHE  38   0.425   2.812  -0.086
  295    HZ   PHE  38           HZ       PHE  38   1.355   2.346   2.146
  296    H    GLY  39           H        GLY  39   1.071   9.296   2.271
  297   1HA   GLY  39          1HA       GLY  39   1.467  11.507   2.741
  298   2HA   GLY  39          2HA       GLY  39   0.515  12.009   1.342
  299    H    ALA  40           H        ALA  40  -1.919  11.380   1.598
  300    HA   ALA  40           HA       ALA  40  -3.068  11.333   4.266
  301   1HB   ALA  40          1HB       ALA  40  -4.140  13.570   4.150
  302   2HB   ALA  40          2HB       ALA  40  -2.377  13.719   4.213
  303   3HB   ALA  40          3HB       ALA  40  -3.229  13.934   2.669
  304    H    SER  41           H        SER  41  -3.342   9.572   2.282
  305    HA   SER  41           HA       SER  41  -5.934  10.133   0.914
  306   1HB   SER  41          2HB       SER  41  -3.328   9.374  -0.456
  307   2HB   SER  41          3HB       SER  41  -4.909   9.603  -1.247
  308    HG   SER  41           HG       SER  41  -3.263  11.423  -1.142
  309    H    LYS  42           H        LYS  42  -4.476   7.592  -0.683
  310    HA   LYS  42           HA       LYS  42  -5.203   5.472   1.114
  311   1HB   LYS  42          2HB       LYS  42  -7.018   4.659  -0.483
  312   2HB   LYS  42          3HB       LYS  42  -7.442   5.925   0.636
  313   1HG   LYS  42          2HG       LYS  42  -6.473   7.064  -1.902
  314   2HG   LYS  42          3HG       LYS  42  -7.744   5.923  -2.207
  315   1HD   LYS  42          2HD       LYS  42  -8.349   7.800   0.059
  316   2HD   LYS  42          3HD       LYS  42  -8.073   8.582  -1.485
  317   1HE   LYS  42          2HE       LYS  42 -10.464   8.099  -1.149
  318   2HE   LYS  42          3HE       LYS  42  -9.809   7.306  -2.585
  319   1HZ   LYS  42          1HZ       LYS  42 -10.404   5.953   0.014
  320   2HZ   LYS  42          2HZ       LYS  42 -11.197   5.734  -1.339
  321   3HZ   LYS  42          3HZ       LYS  42  -9.682   5.241  -1.255
  322    H    ILE  43           H        ILE  43  -5.133   3.416   0.012
  323    HA   ILE  43           HA       ILE  43  -3.151   3.325  -2.207
  324    HB   ILE  43           HB       ILE  43  -1.935   2.857  -0.315
  325   1HG1  ILE  43          2HG1      ILE  43  -1.707   1.096  -2.132
  326   2HG1  ILE  43          3HG1      ILE  43  -1.038   0.751  -0.534
  327   1HG2  ILE  43          1HG2      ILE  43  -3.500   2.660   1.439
  328   2HG2  ILE  43          2HG2      ILE  43  -4.188   1.176   0.751
  329   3HG2  ILE  43          3HG2      ILE  43  -2.545   1.174   1.417
  330   1HD1  ILE  43          1HD1      ILE  43  -1.995  -1.228  -1.330
  331   2HD1  ILE  43          2HD1      ILE  43  -3.022  -0.682  -0.013
  332   3HD1  ILE  43          3HD1      ILE  43  -3.553  -0.476  -1.698
  333    H    THR  44           H        THR  44  -4.072   2.523  -3.983
  334    HA   THR  44           HA       THR  44  -6.356   0.644  -3.733
  335    HB   THR  44           HB       THR  44  -5.236   2.103  -6.137
  336    HG1  THR  44           1HG      THR  44  -6.546   2.984  -4.301
  337   1HG2  THR  44          1HG2      THR  44  -6.235  -0.044  -6.874
  338   2HG2  THR  44          2HG2      THR  44  -7.692   0.311  -5.920
  339   3HG2  THR  44          3HG2      THR  44  -7.263   1.326  -7.312
  340    H    VAL  45           H        VAL  45  -6.151  -1.412  -4.294
  341    HA   VAL  45           HA       VAL  45  -3.624  -2.473  -5.439
  342    HB   VAL  45           HB       VAL  45  -5.113  -3.181  -2.943
  343   1HG1  VAL  45          1HG1      VAL  45  -4.389  -5.559  -3.065
  344   2HG1  VAL  45          2HG1      VAL  45  -5.752  -5.168  -4.127
  345   3HG1  VAL  45          3HG1      VAL  45  -4.121  -5.357  -4.805
  346   1HG2  VAL  45          1HG2      VAL  45  -2.762  -2.271  -3.140
  347   2HG2  VAL  45          2HG2      VAL  45  -2.905  -3.772  -2.195
  348   3HG2  VAL  45          3HG2      VAL  45  -2.288  -3.813  -3.862
  349    H    THR  46           H        THR  46  -3.962  -4.063  -7.023
  350    HA   THR  46           HA       THR  46  -6.679  -4.960  -7.567
  351    HB   THR  46           HB       THR  46  -4.926  -3.439  -9.565
  352    HG1  THR  46           1HG      THR  46  -6.914  -2.959  -7.898
  353   1HG2  THR  46          1HG2      THR  46  -7.563  -4.930 -10.015
  354   2HG2  THR  46          2HG2      THR  46  -6.819  -3.799 -11.165
  355   3HG2  THR  46          3HG2      THR  46  -6.001  -5.318 -10.769
  356    H    GLY  47           H        GLY  47  -6.671  -6.973  -8.276
  357   1HA   GLY  47          1HA       GLY  47  -5.119  -8.235  -9.989
  358   2HA   GLY  47          2HA       GLY  47  -4.011  -8.283  -8.635
  359    H    GLU  48           H        GLU  48  -4.409  -9.462  -6.805
  360    HA   GLU  48           HA       GLU  48  -6.920 -10.593  -6.060
  361   1HB   GLU  48          2HB       GLU  48  -6.084 -12.163  -7.971
  362   2HB   GLU  48          3HB       GLU  48  -4.828 -12.670  -6.841
  363   1HG   GLU  48          2HG       GLU  48  -6.665 -13.356  -5.242
  364   2HG   GLU  48          3HG       GLU  48  -7.855 -12.865  -6.462
  365    H    ALA  49           H        ALA  49  -5.373  -8.836  -4.686
  366    HA   ALA  49           HA       ALA  49  -4.695 -10.444  -2.339
  367   1HB   ALA  49          1HB       ALA  49  -2.485  -9.440  -1.989
  368   2HB   ALA  49          2HB       ALA  49  -2.517 -10.298  -3.533
  369   3HB   ALA  49          3HB       ALA  49  -2.631  -8.527  -3.501
  370    H    SER  50           H        SER  50  -3.922  -8.745  -0.545
  371    HA   SER  50           HA       SER  50  -5.729  -6.400  -0.563
  372   1HB   SER  50          2HB       SER  50  -5.685  -8.762   1.377
  373   2HB   SER  50          3HB       SER  50  -6.383  -7.207   1.829
  374    HG   SER  50           HG       SER  50  -7.823  -7.355   0.107
  375    H    ILE  51           H        ILE  51  -5.435  -5.126   1.494
  376    HA   ILE  51           HA       ILE  51  -2.906  -4.135   1.635
  377    HB   ILE  51           HB       ILE  51  -4.982  -3.094   2.550
  378   1HG1  ILE  51          2HG1      ILE  51  -2.916  -1.957   2.667
  379   2HG1  ILE  51          3HG1      ILE  51  -4.020  -1.660   4.010
  380   1HG2  ILE  51          1HG2      ILE  51  -5.683  -4.905   4.113
  381   2HG2  ILE  51          2HG2      ILE  51  -4.264  -4.554   5.128
  382   3HG2  ILE  51          3HG2      ILE  51  -5.519  -3.330   4.912
  383   1HD1  ILE  51          1HD1      ILE  51  -2.611  -3.190   5.451
  384   2HD1  ILE  51          2HD1      ILE  51  -1.456  -3.263   4.094
  385   3HD1  ILE  51          3HD1      ILE  51  -1.749  -1.767   4.895
  386    H    GLN  52           H        GLN  52  -4.139  -6.740   3.823
  387    HA   GLN  52           HA       GLN  52  -2.277  -7.001   5.701
  388   1HB   GLN  52          2HB       GLN  52  -3.511  -9.117   3.945
  389   2HB   GLN  52          3HB       GLN  52  -2.442  -9.566   5.278
  390   1HG   GLN  52          2HG       GLN  52  -4.742  -7.656   5.827
  391   2HG   GLN  52          3HG       GLN  52  -5.028  -9.393   5.682
  392   1HE2  GLN  52          1HE2      GLN  52  -3.290  -6.897   7.683
  393   2HE2  GLN  52          2HE2      GLN  52  -3.044  -8.011   9.000
  394    H    GLN  53           H        GLN  53  -1.559  -8.030   2.346
  395    HA   GLN  53           HA       GLN  53   1.144  -8.894   3.113
  396   1HB   GLN  53          2HB       GLN  53  -0.017  -8.466   0.370
  397   2HB   GLN  53          3HB       GLN  53   1.596  -9.124   0.779
  398   1HG   GLN  53          2HG       GLN  53   0.322 -10.792   2.320
  399   2HG   GLN  53          3HG       GLN  53  -1.135 -10.268   1.462
  400   1HE2  GLN  53          1HE2      GLN  53  -1.537 -12.221   0.498
  401   2HE2  GLN  53          2HE2      GLN  53  -0.472 -12.977  -0.684
  402    H    VAL  54           H        VAL  54  -0.256  -5.977   1.686
  403    HA   VAL  54           HA       VAL  54   2.158  -4.448   1.329
  404    HB   VAL  54           HB       VAL  54  -0.676  -3.377   1.745
  405   1HG1  VAL  54          1HG1      VAL  54   1.842  -2.230   0.567
  406   2HG1  VAL  54          2HG1      VAL  54   0.218  -1.583   0.217
  407   3HG1  VAL  54          3HG1      VAL  54   0.817  -1.617   1.873
  408   1HG2  VAL  54          1HG2      VAL  54  -0.738  -3.421  -0.812
  409   2HG2  VAL  54          2HG2      VAL  54   0.565  -4.628  -0.718
  410   3HG2  VAL  54          3HG2      VAL  54  -1.004  -4.951   0.022
  411    H    GLU  55           H        GLU  55   0.040  -5.227   4.007
  412    HA   GLU  55           HA       GLU  55   0.746  -3.168   5.823
  413   1HB   GLU  55          2HB       GLU  55  -1.175  -5.006   5.752
  414   2HB   GLU  55          3HB       GLU  55  -0.074  -5.899   6.802
  415   1HG   GLU  55          2HG       GLU  55  -0.070  -4.032   8.394
  416   2HG   GLU  55          3HG       GLU  55  -1.130  -3.093   7.327
  417    H    GLN  56           H        GLN  56   1.704  -6.617   5.436
  418    HA   GLN  56           HA       GLN  56   3.825  -6.726   7.223
  419   1HB   GLN  56          2HB       GLN  56   2.634  -8.591   5.856
  420   2HB   GLN  56          3HB       GLN  56   3.738  -8.171   4.544
  421   1HG   GLN  56          2HG       GLN  56   4.682 -10.001   5.706
  422   2HG   GLN  56          3HG       GLN  56   5.657  -8.574   6.110
  423   1HE2  GLN  56          1HE2      GLN  56   6.324 -10.163   7.931
  424   2HE2  GLN  56          2HE2      GLN  56   5.318 -10.136   9.371
  425    H    ALA  57           H        ALA  57   3.900  -5.780   3.727
  426    HA   ALA  57           HA       ALA  57   6.643  -5.016   3.567
  427   1HB   ALA  57          1HB       ALA  57   4.185  -3.836   2.247
  428   2HB   ALA  57          2HB       ALA  57   5.834  -3.352   1.893
  429   3HB   ALA  57          3HB       ALA  57   5.317  -5.031   1.594
  430    H    GLY  58           H        GLY  58   3.809  -2.980   4.488
  431   1HA   GLY  58          1HA       GLY  58   5.173  -0.614   4.963
  432   2HA   GLY  58          2HA       GLY  58   3.576  -1.087   5.615
  433    H    ALA  59           H        ALA  59   4.990  -3.444   7.012
  434    HA   ALA  59           HA       ALA  59   5.584  -2.555   9.536
  435   1HB   ALA  59          1HB       ALA  59   7.168  -4.697   8.077
  436   2HB   ALA  59          2HB       ALA  59   6.946  -4.530   9.826
  437   3HB   ALA  59          3HB       ALA  59   5.556  -4.938   8.802
  438    H    PHE  60           H        PHE  60   7.698  -2.098   6.654
  439    HA   PHE  60           HA       PHE  60  10.045  -1.431   8.055
  440   1HB   PHE  60          2HB       PHE  60  10.775  -0.171   6.174
  441   2HB   PHE  60          3HB       PHE  60  10.074  -1.703   5.690
  442    HD1  PHE  60           1HD      PHE  60   9.355   1.988   5.907
  443    HD2  PHE  60           2HD      PHE  60   8.598  -1.719   3.846
  444    HE1  PHE  60           1HE      PHE  60   8.229   3.226   4.086
  445    HE2  PHE  60           2HE      PHE  60   7.346  -0.480   2.094
  446    HZ   PHE  60           HZ       PHE  60   7.277   1.991   2.137
  447    H    GLU  61           H        GLU  61   7.147   0.560   7.654
  448    HA   GLU  61           HA       GLU  61   8.347   2.620   9.495
  449   1HB   GLU  61          2HB       GLU  61   6.809   2.873   6.932
  450   2HB   GLU  61          3HB       GLU  61   6.498   4.058   8.209
  451   1HG   GLU  61          2HG       GLU  61   9.389   3.665   7.726
  452   2HG   GLU  61          3HG       GLU  61   8.497   4.222   6.301
  453    H    HIS  62           H        HIS  62   6.038   0.184   9.266
  454    HA   HIS  62           HA       HIS  62   4.452  -0.504  10.726
  455   1HB   HIS  62          2HB       HIS  62   5.045   1.863  12.539
  456   2HB   HIS  62          3HB       HIS  62   4.296   0.329  12.951
  457    HD1  HIS  62           1HD      HIS  62   7.073  -1.060  11.252
  458    HD2  HIS  62           2HD      HIS  62   6.679   1.388  14.655
  459    HE1  HIS  62           1HE      HIS  62   9.152  -1.421  12.647
  460    H    LEU  63           H        LEU  63   3.393   0.636   8.567
  461    HA   LEU  63           HA       LEU  63   1.875   3.029   9.215
  462   1HB   LEU  63          2HB       LEU  63   1.887   1.157   6.843
  463   2HB   LEU  63          3HB       LEU  63   0.681   2.431   6.986
  464    HG   LEU  63           HG       LEU  63   2.563   3.146   5.621
  465   1HD1  LEU  63          1HD1      LEU  63   2.789   5.299   6.484
  466   2HD1  LEU  63          2HD1      LEU  63   1.171   4.751   6.912
  467   3HD1  LEU  63          3HD1      LEU  63   2.460   4.814   8.146
  468   1HD2  LEU  63          1HD2      LEU  63   4.268   3.104   8.131
  469   2HD2  LEU  63          2HD2      LEU  63   4.384   1.904   6.816
  470   3HD2  LEU  63          3HD2      LEU  63   4.744   3.607   6.518
  471    H    LYS  64           H        LYS  64  -0.653   3.024   8.716
  472    HA   LYS  64           HA       LYS  64  -1.920   0.778  10.193
  473   1HB   LYS  64          2HB       LYS  64  -3.175   2.436  11.543
  474   2HB   LYS  64          3HB       LYS  64  -1.527   2.167  12.036
  475   1HG   LYS  64          2HG       LYS  64  -2.388   4.493  10.260
  476   2HG   LYS  64          3HG       LYS  64  -2.438   4.581  12.006
  477   1HD   LYS  64          2HD       LYS  64   0.153   4.196  10.385
  478   2HD   LYS  64          3HD       LYS  64  -0.547   5.655  10.936
  479   1HE   LYS  64          2HE       LYS  64   1.066   5.220  12.568
  480   2HE   LYS  64          3HE       LYS  64  -0.425   4.681  13.348
  481   1HZ   LYS  64          1HZ       LYS  64   0.226   2.398  12.659
  482   2HZ   LYS  64          2HZ       LYS  64   1.625   2.969  12.042
  483   3HZ   LYS  64          3HZ       LYS  64   1.337   3.100  13.639
  484    H    ILE  65           H        ILE  65  -2.131   0.608   7.852
  485    HA   ILE  65           HA       ILE  65  -4.060   2.314   6.550
  486    HB   ILE  65           HB       ILE  65  -3.251  -0.417   5.618
  487   1HG1  ILE  65          2HG1      ILE  65  -1.537   2.024   5.689
  488   2HG1  ILE  65          3HG1      ILE  65  -1.158   0.318   6.017
  489   1HG2  ILE  65          1HG2      ILE  65  -5.026   0.734   4.355
  490   2HG2  ILE  65          2HG2      ILE  65  -3.925   2.068   4.017
  491   3HG2  ILE  65          3HG2      ILE  65  -3.599   0.466   3.360
  492   1HD1  ILE  65          1HD1      ILE  65  -1.404   1.642   3.306
  493   2HD1  ILE  65          2HD1      ILE  65   0.032   0.969   4.073
  494   3HD1  ILE  65          3HD1      ILE  65  -1.260  -0.111   3.528
  495    H    ILE  66           H        ILE  66  -6.285   1.860   6.158
  496    HA   ILE  66           HA       ILE  66  -7.439  -0.456   7.641
  497    HB   ILE  66           HB       ILE  66  -8.367   2.436   7.603
  498   1HG1  ILE  66          2HG1      ILE  66  -7.349   0.700   9.909
  499   2HG1  ILE  66          3HG1      ILE  66  -6.410   1.959   9.099
  500   1HG2  ILE  66          1HG2      ILE  66 -10.292   0.823   7.596
  501   2HG2  ILE  66          2HG2      ILE  66  -9.615   0.051   9.045
  502   3HG2  ILE  66          3HG2      ILE  66 -10.184   1.729   9.090
  503   1HD1  ILE  66          1HD1      ILE  66  -7.229   2.887  11.118
  504   2HD1  ILE  66          2HD1      ILE  66  -8.089   3.662   9.774
  505   3HD1  ILE  66          3HD1      ILE  66  -8.897   2.421  10.768
  506    HA   PRO  67           HA       PRO  67  -9.512  -0.900   3.603
  507   1HB   PRO  67          2HB       PRO  67 -11.464  -2.700   4.314
  508   2HB   PRO  67          3HB       PRO  67  -9.769  -3.171   4.045
  509   1HG   PRO  67          2HG       PRO  67 -11.130  -2.604   6.677
  510   2HG   PRO  67          3HG       PRO  67 -10.053  -3.969   6.266
  511   1HD   PRO  67          2HD       PRO  67  -9.175  -1.787   7.595
  512   2HD   PRO  67          3HD       PRO  67  -8.126  -2.587   6.390
  513    H    GLU  68           H        GLU  68 -10.567   0.991   3.117
  514    HA   GLU  68           HA       GLU  68 -12.586   2.129   4.795
  515   1HB   GLU  68          2HB       GLU  68 -13.138   3.507   2.787
  516   2HB   GLU  68          3HB       GLU  68 -11.467   3.590   3.385
  517   1HG   GLU  68          2HG       GLU  68 -10.651   2.256   1.546
  518   2HG   GLU  68          3HG       GLU  68 -12.297   1.965   0.958
  519    H    LYS  69           H        LYS  69 -14.790   1.971   4.745
  520    HA   LYS  69           HA       LYS  69 -16.041  -0.135   3.070
  521   1HB   LYS  69          2HB       LYS  69 -15.620  -0.081   5.990
  522   2HB   LYS  69          3HB       LYS  69 -17.335  -0.093   5.612
  523   1HG   LYS  69          2HG       LYS  69 -15.338  -2.089   4.475
  524   2HG   LYS  69          3HG       LYS  69 -16.284  -2.322   5.954
  525   1HD   LYS  69          2HD       LYS  69 -18.404  -1.896   4.516
  526   2HD   LYS  69          3HD       LYS  69 -17.351  -1.981   3.106
  527   1HE   LYS  69          2HE       LYS  69 -18.348  -4.126   3.343
  528   2HE   LYS  69          3HE       LYS  69 -16.645  -4.296   3.792
  529   1HZ   LYS  69          1HZ       LYS  69 -18.910  -4.036   5.673
  530   2HZ   LYS  69          2HZ       LYS  69 -18.126  -5.433   5.309
  531   3HZ   LYS  69          3HZ       LYS  69 -17.333  -4.235   6.105
  532    H    GLU  70           H        GLU  70 -17.777   0.720   2.033
  533    HA   GLU  70           HA       GLU  70 -19.457   2.769   3.206
  534   1HB   GLU  70          2HB       GLU  70 -17.429   3.977   2.239
  535   2HB   GLU  70          3HB       GLU  70 -17.849   3.314   0.652
  536   1HG   GLU  70          2HG       GLU  70 -19.973   4.564   0.697
  537   2HG   GLU  70          3HG       GLU  70 -19.635   5.114   2.351
  538    H    ALA  71           H        ALA  71 -21.561   2.527   2.206
  539    HA   ALA  71           HA       ALA  71 -22.148   1.294  -0.223
  540   1HB   ALA  71          1HB       ALA  71 -23.106  -0.823   0.712
  541   2HB   ALA  71          2HB       ALA  71 -21.339  -0.824   0.823
  542   3HB   ALA  71          3HB       ALA  71 -22.321  -0.485   2.268
  Start of MODEL   15
    1   1H    MET   1           H1       MET   1 -13.285 -15.660  -5.494
    2   2H    MET   1           H2       MET   1 -14.879 -15.667  -5.006
    3   3H    MET   1           H3       MET   1 -14.456 -15.201  -6.545
    4    HA   MET   1           HA       MET   1 -14.844 -13.218  -5.361
    5   1HB   MET   1          2HB       MET   1 -13.567 -14.797  -3.218
    6   2HB   MET   1          3HB       MET   1 -12.799 -13.222  -3.390
    7   1HG   MET   1          2HG       MET   1 -14.926 -12.080  -3.119
    8   2HG   MET   1          3HG       MET   1 -15.787 -13.630  -3.017
    9   1HE   MET   1          1HE       MET   1 -15.965 -12.109   0.629
   10   2HE   MET   1          2HE       MET   1 -15.931 -11.172  -0.882
   11   3HE   MET   1          3HE       MET   1 -16.917 -12.655  -0.773
   12    H    ALA   2           H        ALA   2 -13.711 -11.576  -6.394
   13    HA   ALA   2           HA       ALA   2 -10.950 -11.206  -6.489
   14   1HB   ALA   2          1HB       ALA   2 -12.097 -12.497  -9.013
   15   2HB   ALA   2          2HB       ALA   2 -10.555 -11.622  -8.932
   16   3HB   ALA   2          3HB       ALA   2 -10.757 -13.118  -8.024
   17    H    GLU   3           H        GLU   3 -10.834  -9.002  -6.873
   18    HA   GLU   3           HA       GLU   3 -12.134  -7.507  -8.817
   19   1HB   GLU   3          2HB       GLU   3 -13.843  -7.994  -6.520
   20   2HB   GLU   3          3HB       GLU   3 -13.334  -6.320  -6.441
   21   1HG   GLU   3          2HG       GLU   3 -14.571  -7.579  -8.932
   22   2HG   GLU   3          3HG       GLU   3 -15.510  -6.797  -7.660
   23    H    LYS   4           H        LYS   4 -11.860  -5.044  -7.888
   24    HA   LYS   4           HA       LYS   4  -9.118  -4.856  -6.771
   25   1HB   LYS   4          2HB       LYS   4  -9.342  -2.451  -7.206
   26   2HB   LYS   4          3HB       LYS   4  -9.651  -3.405  -8.657
   27   1HG   LYS   4          2HG       LYS   4 -12.148  -2.944  -7.226
   28   2HG   LYS   4          3HG       LYS   4 -11.307  -1.405  -7.451
   29   1HD   LYS   4          2HD       LYS   4 -11.198  -1.722  -9.858
   30   2HD   LYS   4          3HD       LYS   4 -11.728  -3.390  -9.707
   31   1HE   LYS   4          2HE       LYS   4 -13.823  -2.107  -8.426
   32   2HE   LYS   4          3HE       LYS   4 -13.339  -0.859  -9.583
   33   1HZ   LYS   4          1HZ       LYS   4 -14.228  -3.642 -10.040
   34   2HZ   LYS   4          2HZ       LYS   4 -14.997  -2.283 -10.504
   35   3HZ   LYS   4          3HZ       LYS   4 -13.597  -2.711 -11.269
   36    H    THR   5           H        THR   5  -8.756  -3.207  -4.956
   37    HA   THR   5           HA       THR   5 -11.080  -2.600  -3.317
   38    HB   THR   5           HB       THR   5  -8.801  -4.297  -2.138
   39    HG1  THR   5           1HG      THR   5 -11.214  -4.700  -3.216
   40   1HG2  THR   5          1HG2      THR   5  -9.726  -2.649  -0.462
   41   2HG2  THR   5          2HG2      THR   5 -11.368  -3.172  -0.878
   42   3HG2  THR   5          3HG2      THR   5 -10.252  -4.301  -0.097
   43    H    VAL   6           H        VAL   6 -10.609  -0.792  -2.036
   44    HA   VAL   6           HA       VAL   6  -7.841  -0.080  -1.991
   45    HB   VAL   6           HB       VAL   6  -8.684   1.262  -3.749
   46   1HG1  VAL   6          1HG1      VAL   6 -11.050   2.077  -2.077
   47   2HG1  VAL   6          2HG1      VAL   6 -10.590   2.756  -3.662
   48   3HG1  VAL   6          3HG1      VAL   6 -11.036   1.056  -3.541
   49   1HG2  VAL   6          1HG2      VAL   6  -7.299   2.601  -2.122
   50   2HG2  VAL   6          2HG2      VAL   6  -8.484   3.611  -2.958
   51   3HG2  VAL   6          3HG2      VAL   6  -8.788   3.073  -1.294
   52    H    TYR   7           H        TYR   7  -7.124   1.142  -0.256
   53    HA   TYR   7           HA       TYR   7  -8.880   0.980   2.155
   54   1HB   TYR   7          2HB       TYR   7  -5.972   0.131   1.971
   55   2HB   TYR   7          3HB       TYR   7  -7.077  -0.001   3.347
   56    HD1  TYR   7           HD1      TYR   7  -6.569  -1.302  -0.159
   57    HD2  TYR   7           HD2      TYR   7  -7.812  -2.110   3.875
   58    HE1  TYR   7           HE1      TYR   7  -6.825  -3.685  -0.711
   59    HE2  TYR   7           HE2      TYR   7  -8.172  -4.482   3.291
   60    HH   TYR   7           HH       TYR   7  -7.675  -5.791   0.070
   61    H    ARG   8           H        ARG   8  -8.327   2.592   3.739
   62    HA   ARG   8           HA       ARG   8  -6.903   4.941   2.565
   63   1HB   ARG   8          2HB       ARG   8  -8.652   4.621   5.047
   64   2HB   ARG   8          3HB       ARG   8  -7.753   6.097   4.638
   65   1HG   ARG   8          2HG       ARG   8  -8.897   6.148   2.421
   66   2HG   ARG   8          3HG       ARG   8  -9.883   4.772   2.937
   67   1HD   ARG   8          2HD       ARG   8  -9.747   7.456   4.395
   68   2HD   ARG   8          3HD       ARG   8 -10.919   7.122   3.136
   69    HE   ARG   8           HE       ARG   8 -10.749   5.840   5.828
   70   1HH1  ARG   8          2HH2      ARG   8 -12.588   5.853   2.818
   71   2HH1  ARG   8          1HH2      ARG   8 -14.148   5.983   3.560
   72   1HH2  ARG   8          2HH1      ARG   8 -12.814   5.579   6.850
   73   2HH2  ARG   8          1HH1      ARG   8 -14.257   5.542   5.889
   74    H    VAL   9           H        VAL   9  -4.851   5.453   3.184
   75    HA   VAL   9           HA       VAL   9  -3.740   4.178   5.641
   76    HB   VAL   9           HB       VAL   9  -2.487   3.207   3.875
   77   1HG1  VAL   9          1HG1      VAL   9  -1.322   4.566   2.137
   78   2HG1  VAL   9          2HG1      VAL   9  -3.073   4.604   1.966
   79   3HG1  VAL   9          3HG1      VAL   9  -2.223   6.000   2.667
   80   1HG2  VAL   9          1HG2      VAL   9  -0.828   5.578   4.771
   81   2HG2  VAL   9          2HG2      VAL   9  -1.278   4.217   5.852
   82   3HG2  VAL   9          3HG2      VAL   9  -0.323   3.929   4.429
   83    H    ASP  10           H        ASP  10  -2.360   5.532   6.900
   84    HA   ASP  10           HA       ASP  10  -2.302   8.415   6.277
   85   1HB   ASP  10          2HB       ASP  10  -4.467   7.764   7.608
   86   2HB   ASP  10          3HB       ASP  10  -3.318   7.205   8.813
   87    H    GLY  11           H        GLY  11  -0.910   9.405   8.039
   88   1HA   GLY  11          1HA       GLY  11   0.575   9.141   9.868
   89   2HA   GLY  11          2HA       GLY  11   1.008   7.509   9.360
   90    H    LEU  12           H        LEU  12   2.008   7.535   6.954
   91    HA   LEU  12           HA       LEU  12   4.447   9.063   7.387
   92   1HB   LEU  12          2HB       LEU  12   5.496   7.852   5.755
   93   2HB   LEU  12          3HB       LEU  12   4.408   6.724   6.516
   94    HG   LEU  12           HG       LEU  12   2.813   7.138   4.480
   95   1HD1  LEU  12          1HD1      LEU  12   4.337   7.735   2.380
   96   2HD1  LEU  12          2HD1      LEU  12   3.752   9.076   3.330
   97   3HD1  LEU  12          3HD1      LEU  12   5.415   8.480   3.553
   98   1HD2  LEU  12          1HD2      LEU  12   3.833   5.080   4.587
   99   2HD2  LEU  12          2HD2      LEU  12   4.374   5.645   3.023
  100   3HD2  LEU  12          3HD2      LEU  12   5.473   5.723   4.424
  101    H    SER  13           H        SER  13   5.446  10.510   5.794
  102    HA   SER  13           HA       SER  13   3.717  11.693   3.729
  103   1HB   SER  13          2HB       SER  13   4.711  13.377   6.059
  104   2HB   SER  13          3HB       SER  13   3.871  13.958   4.611
  105    HG   SER  13           HG       SER  13   2.294  12.106   5.520
  106    H    CYS  14           H        CYS  14   5.565  10.432   2.701
  107    HA   CYS  14           HA       CYS  14   7.508  12.412   1.840
  108   1HB   CYS  14          2HB       CYS  14   8.717  11.535   3.805
  109   2HB   CYS  14          3HB       CYS  14   8.501   9.872   3.205
  110    HG   CYS  14           HG       CYS  14   9.994  12.440   1.756
  111    H    THR  15           H        THR  15   7.506  12.215  -0.343
  112    HA   THR  15           HA       THR  15   6.358  10.327  -1.868
  113    HB   THR  15           HB       THR  15   8.916  11.773  -2.660
  114    HG1  THR  15           1HG      THR  15   7.479  13.586  -2.931
  115   1HG2  THR  15          1HG2      THR  15   6.273  11.267  -4.115
  116   2HG2  THR  15          2HG2      THR  15   7.689  12.111  -4.781
  117   3HG2  THR  15          3HG2      THR  15   7.789  10.384  -4.397
  118    H    ASN  16           H        ASN  16   9.811  10.290  -0.779
  119    HA   ASN  16           HA       ASN  16  10.685   8.090  -2.195
  120   1HB   ASN  16          2HB       ASN  16  11.423   8.907   0.643
  121   2HB   ASN  16          3HB       ASN  16  12.305   7.737  -0.335
  122   1HD2  ASN  16          1HD2      ASN  16  14.039   8.551  -1.474
  123   2HD2  ASN  16          2HD2      ASN  16  14.187  10.229  -1.961
  124    H    CYS  17           H        CYS  17   8.814   8.178   0.867
  125    HA   CYS  17           HA       CYS  17   9.012   5.292   1.266
  126   1HB   CYS  17          2HB       CYS  17   7.547   7.528   2.657
  127   2HB   CYS  17          3HB       CYS  17   7.034   5.839   2.858
  128    HG   CYS  17           HG       CYS  17   8.560   6.425   4.886
  129    H    ALA  18           H        ALA  18   6.615   7.557  -0.160
  130    HA   ALA  18           HA       ALA  18   4.632   5.574  -0.718
  131   1HB   ALA  18          1HB       ALA  18   4.278   8.028  -1.007
  132   2HB   ALA  18          2HB       ALA  18   5.339   7.996  -2.431
  133   3HB   ALA  18          3HB       ALA  18   3.822   7.085  -2.441
  134    H    ALA  19           H        ALA  19   7.522   6.565  -2.545
  135    HA   ALA  19           HA       ALA  19   7.114   4.832  -4.791
  136   1HB   ALA  19          1HB       ALA  19   9.471   5.280  -5.299
  137   2HB   ALA  19          2HB       ALA  19   8.623   6.771  -4.845
  138   3HB   ALA  19          3HB       ALA  19   9.713   5.981  -3.687
  139    H    LYS  20           H        LYS  20   9.117   4.466  -1.840
  140    HA   LYS  20           HA       LYS  20  10.086   1.862  -2.195
  141   1HB   LYS  20          2HB       LYS  20  10.545   3.533  -0.305
  142   2HB   LYS  20          3HB       LYS  20   8.997   3.072   0.380
  143   1HG   LYS  20          2HG       LYS  20  10.100   1.598   1.563
  144   2HG   LYS  20          3HG       LYS  20  10.145   0.583   0.132
  145   1HD   LYS  20          2HD       LYS  20  12.364   1.300  -0.434
  146   2HD   LYS  20          3HD       LYS  20  12.324   2.669   0.681
  147   1HE   LYS  20          2HE       LYS  20  12.287  -0.263   1.535
  148   2HE   LYS  20          3HE       LYS  20  13.710   0.789   1.522
  149   1HZ   LYS  20          1HZ       LYS  20  11.301   1.176   3.189
  150   2HZ   LYS  20          2HZ       LYS  20  12.793   0.718   3.696
  151   3HZ   LYS  20          3HZ       LYS  20  12.561   2.231   3.103
  152    H    PHE  21           H        PHE  21   6.986   2.952  -0.789
  153    HA   PHE  21           HA       PHE  21   5.885   0.421  -0.275
  154   1HB   PHE  21          2HB       PHE  21   4.853   3.198  -0.474
  155   2HB   PHE  21          3HB       PHE  21   3.687   1.983  -0.911
  156    HD1  PHE  21           1HD      PHE  21   3.415  -0.086   0.653
  157    HD2  PHE  21           2HD      PHE  21   5.219   3.646   1.845
  158    HE1  PHE  21           1HE      PHE  21   2.771  -0.517   3.008
  159    HE2  PHE  21           2HE      PHE  21   4.826   3.061   4.211
  160    HZ   PHE  21           HZ       PHE  21   3.361   1.135   4.774
  161    H    GLU  22           H        GLU  22   5.143   2.503  -3.210
  162    HA   GLU  22           HA       GLU  22   3.481   0.481  -4.237
  163   1HB   GLU  22          2HB       GLU  22   3.567   1.515  -6.386
  164   2HB   GLU  22          3HB       GLU  22   3.346   2.685  -5.099
  165   1HG   GLU  22          2HG       GLU  22   4.884   3.938  -6.079
  166   2HG   GLU  22          3HG       GLU  22   6.074   2.781  -5.511
  167    H    ARG  23           H        ARG  23   6.971   0.992  -4.738
  168    HA   ARG  23           HA       ARG  23   7.395  -1.190  -6.507
  169   1HB   ARG  23          2HB       ARG  23   9.026   0.636  -5.860
  170   2HB   ARG  23          3HB       ARG  23   9.356  -0.255  -4.363
  171   1HG   ARG  23          2HG       ARG  23  10.084  -2.226  -5.693
  172   2HG   ARG  23          3HG       ARG  23   9.627  -1.384  -7.189
  173   1HD   ARG  23          2HD       ARG  23  11.271   0.415  -6.633
  174   2HD   ARG  23          3HD       ARG  23  11.826  -0.569  -5.250
  175    HE   ARG  23           HE       ARG  23  11.921  -2.266  -7.456
  176   1HH1  ARG  23          2HH2      ARG  23  13.455   0.743  -6.484
  177   2HH1  ARG  23          1HH2      ARG  23  14.843   0.583  -7.519
  178   1HH2  ARG  23          2HH1      ARG  23  13.735  -2.531  -8.870
  179   2HH2  ARG  23          1HH1      ARG  23  15.004  -1.350  -8.909
  180    H    ASN  24           H        ASN  24   7.581  -1.177  -2.880
  181    HA   ASN  24           HA       ASN  24   8.080  -3.939  -2.528
  182   1HB   ASN  24          2HB       ASN  24   6.809  -1.778  -0.854
  183   2HB   ASN  24          3HB       ASN  24   6.440  -3.446  -0.449
  184   1HD2  ASN  24          1HD2      ASN  24   7.554  -3.855   1.377
  185   2HD2  ASN  24          2HD2      ASN  24   9.271  -3.669   1.550
  186    H    VAL  25           H        VAL  25   4.954  -2.244  -2.973
  187    HA   VAL  25           HA       VAL  25   3.334  -4.607  -2.675
  188    HB   VAL  25           HB       VAL  25   2.742  -1.943  -4.024
  189   1HG1  VAL  25          1HG1      VAL  25   0.926  -4.248  -3.180
  190   2HG1  VAL  25          2HG1      VAL  25   0.356  -2.621  -3.593
  191   3HG1  VAL  25          3HG1      VAL  25   1.154  -3.620  -4.822
  192   1HG2  VAL  25          1HG2      VAL  25   3.270  -1.747  -1.581
  193   2HG2  VAL  25          2HG2      VAL  25   1.554  -1.483  -1.887
  194   3HG2  VAL  25          3HG2      VAL  25   2.141  -3.039  -1.247
  195    H    LYS  26           H        LYS  26   4.679  -2.949  -5.532
  196    HA   LYS  26           HA       LYS  26   3.660  -4.649  -7.564
  197   1HB   LYS  26          2HB       LYS  26   6.015  -2.823  -7.204
  198   2HB   LYS  26          3HB       LYS  26   5.982  -3.825  -8.633
  199   1HG   LYS  26          2HG       LYS  26   4.068  -2.798  -9.495
  200   2HG   LYS  26          3HG       LYS  26   3.553  -2.163  -7.918
  201   1HD   LYS  26          2HD       LYS  26   5.065  -0.430  -7.907
  202   2HD   LYS  26          3HD       LYS  26   6.227  -1.249  -8.954
  203   1HE   LYS  26          2HE       LYS  26   4.914  -0.816 -10.919
  204   2HE   LYS  26          3HE       LYS  26   3.557  -0.178  -9.968
  205   1HZ   LYS  26          1HZ       LYS  26   5.465   1.394 -10.997
  206   2HZ   LYS  26          2HZ       LYS  26   4.622   1.774  -9.629
  207   3HZ   LYS  26          3HZ       LYS  26   6.044   1.158  -9.442
  208    H    GLU  27           H        GLU  27   6.552  -5.005  -5.448
  209    HA   GLU  27           HA       GLU  27   7.420  -7.476  -6.626
  210   1HB   GLU  27          2HB       GLU  27   7.935  -6.205  -3.931
  211   2HB   GLU  27          3HB       GLU  27   8.719  -7.682  -4.467
  212   1HG   GLU  27          2HG       GLU  27   8.886  -5.322  -6.335
  213   2HG   GLU  27          3HG       GLU  27   9.803  -5.259  -4.826
  214    H    ILE  28           H        ILE  28   4.444  -7.081  -5.008
  215    HA   ILE  28           HA       ILE  28   4.613  -9.627  -3.513
  216    HB   ILE  28           HB       ILE  28   2.325  -7.791  -4.107
  217   1HG1  ILE  28          2HG1      ILE  28   3.990  -6.736  -2.614
  218   2HG1  ILE  28          3HG1      ILE  28   2.444  -6.996  -1.816
  219   1HG2  ILE  28          1HG2      ILE  28   1.318  -9.863  -3.755
  220   2HG2  ILE  28          2HG2      ILE  28   2.359 -10.235  -2.365
  221   3HG2  ILE  28          3HG2      ILE  28   1.116  -8.959  -2.269
  222   1HD1  ILE  28          1HD1      ILE  28   4.254  -7.523  -0.298
  223   2HD1  ILE  28          2HD1      ILE  28   3.442  -9.042  -0.704
  224   3HD1  ILE  28          3HD1      ILE  28   4.996  -8.629  -1.463
  225    H    GLU  29           H        GLU  29   4.079 -11.544  -4.342
  226    HA   GLU  29           HA       GLU  29   2.947 -12.001  -6.935
  227   1HB   GLU  29          2HB       GLU  29   3.626 -13.657  -4.461
  228   2HB   GLU  29          3HB       GLU  29   2.737 -14.332  -5.805
  229   1HG   GLU  29          2HG       GLU  29   5.073 -14.868  -6.103
  230   2HG   GLU  29          3HG       GLU  29   4.596 -13.722  -7.365
  231    H    GLY  30           H        GLY  30   0.871 -11.850  -7.406
  232   1HA   GLY  30          1HA       GLY  30  -1.266 -13.069  -6.967
  233   2HA   GLY  30          2HA       GLY  30  -1.259 -12.383  -5.337
  234    H    VAL  31           H        VAL  31  -0.269  -9.743  -6.086
  235    HA   VAL  31           HA       VAL  31  -2.753  -8.574  -7.024
  236    HB   VAL  31           HB       VAL  31  -1.287  -7.687  -5.190
  237   1HG1  VAL  31          1HG1      VAL  31   0.892  -7.990  -6.304
  238   2HG1  VAL  31          2HG1      VAL  31   0.479  -6.699  -7.456
  239   3HG1  VAL  31          3HG1      VAL  31   0.630  -6.338  -5.721
  240   1HG2  VAL  31          1HG2      VAL  31  -1.643  -5.375  -5.720
  241   2HG2  VAL  31          2HG2      VAL  31  -1.819  -5.744  -7.442
  242   3HG2  VAL  31          3HG2      VAL  31  -3.026  -6.346  -6.269
  243    H    THR  32           H        THR  32  -2.760  -7.091  -8.875
  244    HA   THR  32           HA       THR  32  -0.980  -7.891 -11.136
  245    HB   THR  32           HB       THR  32  -3.911  -7.056 -11.259
  246    HG1  THR  32           1HG      THR  32  -2.598  -9.557 -11.304
  247   1HG2  THR  32          1HG2      THR  32  -3.744  -7.834 -13.602
  248   2HG2  THR  32          2HG2      THR  32  -2.684  -6.451 -13.298
  249   3HG2  THR  32          3HG2      THR  32  -1.997  -8.085 -13.400
  250    H    GLU  33           H        GLU  33  -3.193  -5.312  -9.892
  251    HA   GLU  33           HA       GLU  33  -0.936  -3.383 -10.469
  252   1HB   GLU  33          2HB       GLU  33  -3.872  -2.795 -11.049
  253   2HB   GLU  33          3HB       GLU  33  -2.526  -1.652 -11.092
  254   1HG   GLU  33          2HG       GLU  33  -1.425  -3.181 -12.815
  255   2HG   GLU  33          3HG       GLU  33  -2.958  -4.061 -12.899
  256    H    ALA  34           H        ALA  34  -0.621  -1.747  -8.909
  257    HA   ALA  34           HA       ALA  34  -2.745  -1.453  -6.896
  258   1HB   ALA  34          1HB       ALA  34  -1.092  -1.374  -5.057
  259   2HB   ALA  34          2HB       ALA  34  -1.121  -2.981  -5.815
  260   3HB   ALA  34          3HB       ALA  34   0.198  -1.843  -6.189
  261    H    ILE  35           H        ILE  35  -2.938   0.701  -6.217
  262    HA   ILE  35           HA       ILE  35  -1.043   2.633  -7.569
  263    HB   ILE  35           HB       ILE  35  -4.063   2.920  -7.464
  264   1HG1  ILE  35          2HG1      ILE  35  -2.272   2.539  -9.905
  265   2HG1  ILE  35          3HG1      ILE  35  -3.199   1.228  -9.168
  266   1HG2  ILE  35          1HG2      ILE  35  -3.634   4.982  -8.770
  267   2HG2  ILE  35          2HG2      ILE  35  -2.819   5.059  -7.216
  268   3HG2  ILE  35          3HG2      ILE  35  -1.888   4.683  -8.678
  269   1HD1  ILE  35          1HD1      ILE  35  -4.438   2.052 -11.032
  270   2HD1  ILE  35          2HD1      ILE  35  -5.306   2.454  -9.539
  271   3HD1  ILE  35          3HD1      ILE  35  -4.406   3.711 -10.422
  272    H    VAL  36           H        VAL  36   0.052   3.520  -5.875
  273    HA   VAL  36           HA       VAL  36  -1.412   3.730  -3.308
  274    HB   VAL  36           HB       VAL  36   0.440   3.322  -2.232
  275   1HG1  VAL  36          1HG1      VAL  36   1.523   1.386  -3.107
  276   2HG1  VAL  36          2HG1      VAL  36  -0.114   1.375  -3.781
  277   3HG1  VAL  36          3HG1      VAL  36   1.237   1.885  -4.787
  278   1HG2  VAL  36          1HG2      VAL  36   2.129   4.341  -4.535
  279   2HG2  VAL  36          2HG2      VAL  36   1.917   5.094  -2.955
  280   3HG2  VAL  36          3HG2      VAL  36   2.792   3.567  -3.067
  281    H    ASN  37           H        ASN  37  -1.955   5.648  -2.472
  282    HA   ASN  37           HA       ASN  37  -0.334   8.059  -3.215
  283   1HB   ASN  37          2HB       ASN  37  -3.288   7.914  -2.501
  284   2HB   ASN  37          3HB       ASN  37  -2.339   9.386  -2.785
  285   1HD2  ASN  37          1HD2      ASN  37  -4.536   9.350  -4.227
  286   2HD2  ASN  37          2HD2      ASN  37  -4.215   8.852  -5.878
  287    H    PHE  38           H        PHE  38   0.809   6.567  -1.388
  288    HA   PHE  38           HA       PHE  38  -0.086   7.019   1.335
  289   1HB   PHE  38          2HB       PHE  38   2.681   6.513   0.172
  290   2HB   PHE  38          3HB       PHE  38   2.363   6.759   1.877
  291    HD1  PHE  38           1HD      PHE  38   1.592   5.026   3.321
  292    HD2  PHE  38           2HD      PHE  38   1.950   4.395  -0.892
  293    HE1  PHE  38           1HE      PHE  38   1.137   2.597   3.610
  294    HE2  PHE  38           2HE      PHE  38   1.246   2.017  -0.602
  295    HZ   PHE  38           HZ       PHE  38   0.704   1.170   1.655
  296    H    GLY  39           H        GLY  39   0.190   8.821   2.594
  297   1HA   GLY  39          1HA       GLY  39   1.952  10.735   2.794
  298   2HA   GLY  39          2HA       GLY  39   1.180  11.301   1.301
  299    H    ALA  40           H        ALA  40  -1.365  10.871   1.508
  300    HA   ALA  40           HA       ALA  40  -2.669  11.242   4.022
  301   1HB   ALA  40          1HB       ALA  40  -2.353  13.752   2.304
  302   2HB   ALA  40          2HB       ALA  40  -3.483  13.578   3.664
  303   3HB   ALA  40          3HB       ALA  40  -1.744  13.532   3.959
  304    H    SER  41           H        SER  41  -3.159   9.358   2.240
  305    HA   SER  41           HA       SER  41  -5.790   9.950   1.196
  306   1HB   SER  41          2HB       SER  41  -3.472   9.812  -0.720
  307   2HB   SER  41          3HB       SER  41  -5.076   9.234  -1.207
  308    HG   SER  41           HG       SER  41  -4.780  11.763  -0.037
  309    H    LYS  42           H        LYS  42  -4.120   7.484  -0.560
  310    HA   LYS  42           HA       LYS  42  -5.092   5.338   1.084
  311   1HB   LYS  42          2HB       LYS  42  -7.026   4.744  -0.395
  312   2HB   LYS  42          3HB       LYS  42  -7.250   6.211   0.542
  313   1HG   LYS  42          2HG       LYS  42  -6.307   7.322  -1.776
  314   2HG   LYS  42          3HG       LYS  42  -7.036   5.863  -2.431
  315   1HD   LYS  42          2HD       LYS  42  -8.401   7.852  -0.551
  316   2HD   LYS  42          3HD       LYS  42  -8.571   7.875  -2.310
  317   1HE   LYS  42          2HE       LYS  42  -9.935   5.993  -2.387
  318   2HE   LYS  42          3HE       LYS  42  -9.137   5.241  -1.013
  319   1HZ   LYS  42          1HZ       LYS  42 -11.233   7.272  -0.803
  320   2HZ   LYS  42          2HZ       LYS  42 -11.217   5.668  -0.393
  321   3HZ   LYS  42          3HZ       LYS  42 -10.337   6.679   0.468
  322    H    ILE  43           H        ILE  43  -5.265   3.294  -0.101
  323    HA   ILE  43           HA       ILE  43  -3.246   3.128  -2.276
  324    HB   ILE  43           HB       ILE  43  -2.135   2.889  -0.168
  325   1HG1  ILE  43          2HG1      ILE  43  -1.246   1.616  -2.007
  326   2HG1  ILE  43          3HG1      ILE  43  -0.903   0.901  -0.444
  327   1HG2  ILE  43          1HG2      ILE  43  -3.875   2.169   1.325
  328   2HG2  ILE  43          2HG2      ILE  43  -3.984   0.594   0.519
  329   3HG2  ILE  43          3HG2      ILE  43  -2.506   1.061   1.376
  330   1HD1  ILE  43          1HD1      ILE  43  -2.927  -0.131  -2.444
  331   2HD1  ILE  43          2HD1      ILE  43  -1.375  -0.840  -2.014
  332   3HD1  ILE  43          3HD1      ILE  43  -2.680  -0.796  -0.815
  333    H    THR  44           H        THR  44  -4.179   2.229  -3.961
  334    HA   THR  44           HA       THR  44  -6.479   0.383  -3.640
  335    HB   THR  44           HB       THR  44  -5.344   1.721  -6.113
  336    HG1  THR  44           1HG      THR  44  -6.725   2.595  -4.173
  337   1HG2  THR  44          1HG2      THR  44  -7.878   0.066  -5.739
  338   2HG2  THR  44          2HG2      THR  44  -7.489   1.044  -7.167
  339   3HG2  THR  44          3HG2      THR  44  -6.489  -0.357  -6.767
  340    H    VAL  45           H        VAL  45  -6.400  -1.670  -4.322
  341    HA   VAL  45           HA       VAL  45  -3.861  -2.872  -5.285
  342    HB   VAL  45           HB       VAL  45  -5.797  -3.745  -3.131
  343   1HG1  VAL  45          1HG1      VAL  45  -3.295  -5.203  -4.089
  344   2HG1  VAL  45          2HG1      VAL  45  -4.358  -5.726  -2.773
  345   3HG1  VAL  45          3HG1      VAL  45  -4.962  -5.725  -4.434
  346   1HG2  VAL  45          1HG2      VAL  45  -2.891  -2.910  -2.918
  347   2HG2  VAL  45          2HG2      VAL  45  -4.314  -2.118  -2.194
  348   3HG2  VAL  45          3HG2      VAL  45  -3.797  -3.701  -1.609
  349    H    THR  46           H        THR  46  -4.322  -4.264  -7.034
  350    HA   THR  46           HA       THR  46  -7.077  -5.180  -7.493
  351    HB   THR  46           HB       THR  46  -5.386  -3.521  -9.450
  352    HG1  THR  46           1HG      THR  46  -7.279  -3.163  -7.632
  353   1HG2  THR  46          1HG2      THR  46  -8.084  -4.922  -9.835
  354   2HG2  THR  46          2HG2      THR  46  -7.386  -3.722 -10.942
  355   3HG2  THR  46          3HG2      THR  46  -6.580  -5.282 -10.714
  356    H    GLY  47           H        GLY  47  -7.009  -7.180  -8.153
  357   1HA   GLY  47          1HA       GLY  47  -5.554  -8.332 -10.054
  358   2HA   GLY  47          2HA       GLY  47  -4.372  -8.381  -8.774
  359    H    GLU  48           H        GLU  48  -4.540  -9.656  -7.029
  360    HA   GLU  48           HA       GLU  48  -6.955 -10.813  -6.014
  361   1HB   GLU  48          2HB       GLU  48  -6.039 -12.259  -8.120
  362   2HB   GLU  48          3HB       GLU  48  -5.028 -12.979  -6.877
  363   1HG   GLU  48          2HG       GLU  48  -8.082 -12.738  -6.788
  364   2HG   GLU  48          3HG       GLU  48  -7.188 -14.165  -7.320
  365    H    ALA  49           H        ALA  49  -5.624  -9.149  -4.571
  366    HA   ALA  49           HA       ALA  49  -4.463 -10.820  -2.486
  367   1HB   ALA  49          1HB       ALA  49  -2.906  -8.483  -3.675
  368   2HB   ALA  49          2HB       ALA  49  -2.459  -9.386  -2.217
  369   3HB   ALA  49          3HB       ALA  49  -2.450 -10.201  -3.790
  370    H    SER  50           H        SER  50  -4.124  -9.481  -0.462
  371    HA   SER  50           HA       SER  50  -6.169  -7.331  -0.197
  372   1HB   SER  50          2HB       SER  50  -5.410  -9.597   1.709
  373   2HB   SER  50          3HB       SER  50  -6.440  -8.229   2.143
  374    HG   SER  50           HG       SER  50  -6.962  -9.981  -0.041
  375    H    ILE  51           H        ILE  51  -5.704  -5.793   1.641
  376    HA   ILE  51           HA       ILE  51  -3.238  -4.727   1.328
  377    HB   ILE  51           HB       ILE  51  -5.322  -3.604   2.395
  378   1HG1  ILE  51          2HG1      ILE  51  -4.023  -2.060   3.695
  379   2HG1  ILE  51          3HG1      ILE  51  -2.589  -3.042   3.378
  380   1HG2  ILE  51          1HG2      ILE  51  -5.510  -3.547   4.775
  381   2HG2  ILE  51          2HG2      ILE  51  -5.473  -5.265   4.345
  382   3HG2  ILE  51          3HG2      ILE  51  -4.016  -4.461   4.998
  383   1HD1  ILE  51          1HD1      ILE  51  -3.067  -2.673   0.858
  384   2HD1  ILE  51          2HD1      ILE  51  -4.384  -1.611   1.357
  385   3HD1  ILE  51          3HD1      ILE  51  -2.708  -1.207   1.759
  386    H    GLN  52           H        GLN  52  -4.056  -7.191   3.675
  387    HA   GLN  52           HA       GLN  52  -2.146  -7.261   5.579
  388   1HB   GLN  52          2HB       GLN  52  -2.918  -9.463   3.632
  389   2HB   GLN  52          3HB       GLN  52  -1.991  -9.771   5.106
  390   1HG   GLN  52          2HG       GLN  52  -3.777  -9.387   6.515
  391   2HG   GLN  52          3HG       GLN  52  -4.566  -8.245   5.430
  392   1HE2  GLN  52          1HE2      GLN  52  -6.569  -9.076   4.903
  393   2HE2  GLN  52          2HE2      GLN  52  -6.809 -10.723   4.349
  394    H    GLN  53           H        GLN  53  -1.502  -8.070   2.164
  395    HA   GLN  53           HA       GLN  53   1.289  -8.694   2.422
  396   1HB   GLN  53          2HB       GLN  53  -0.347  -7.583   0.102
  397   2HB   GLN  53          3HB       GLN  53   1.265  -8.276  -0.049
  398   1HG   GLN  53          2HG       GLN  53  -0.851 -10.015   1.248
  399   2HG   GLN  53          3HG       GLN  53  -1.028  -9.642  -0.462
  400   1HE2  GLN  53          1HE2      GLN  53  -0.479 -11.564  -1.474
  401   2HE2  GLN  53          2HE2      GLN  53   1.067 -12.335  -1.250
  402    H    VAL  54           H        VAL  54  -0.420  -5.689   1.589
  403    HA   VAL  54           HA       VAL  54   1.906  -4.073   1.044
  404    HB   VAL  54           HB       VAL  54  -0.954  -3.256   1.715
  405   1HG1  VAL  54          1HG1      VAL  54  -0.368  -1.207   0.424
  406   2HG1  VAL  54          2HG1      VAL  54   0.449  -1.369   1.978
  407   3HG1  VAL  54          3HG1      VAL  54   1.334  -1.710   0.487
  408   1HG2  VAL  54          1HG2      VAL  54  -1.224  -4.634  -0.158
  409   2HG2  VAL  54          2HG2      VAL  54  -1.067  -3.024  -0.866
  410   3HG2  VAL  54          3HG2      VAL  54   0.307  -4.147  -0.881
  411    H    GLU  55           H        GLU  55  -0.246  -4.588   3.847
  412    HA   GLU  55           HA       GLU  55   0.795  -2.615   5.551
  413   1HB   GLU  55          2HB       GLU  55  -1.388  -3.949   5.705
  414   2HB   GLU  55          3HB       GLU  55  -0.431  -5.271   6.397
  415   1HG   GLU  55          2HG       GLU  55   0.345  -3.696   8.180
  416   2HG   GLU  55          3HG       GLU  55  -0.648  -2.420   7.449
  417    H    GLN  56           H        GLN  56   1.473  -6.144   5.173
  418    HA   GLN  56           HA       GLN  56   3.520  -6.355   7.056
  419   1HB   GLN  56          2HB       GLN  56   2.348  -8.231   5.951
  420   2HB   GLN  56          3HB       GLN  56   3.236  -7.924   4.452
  421   1HG   GLN  56          2HG       GLN  56   5.342  -8.460   5.502
  422   2HG   GLN  56          3HG       GLN  56   4.618  -8.453   7.117
  423   1HE2  GLN  56          1HE2      GLN  56   2.967 -10.148   7.615
  424   2HE2  GLN  56          2HE2      GLN  56   3.141 -11.701   6.815
  425    H    ALA  57           H        ALA  57   3.882  -5.686   3.485
  426    HA   ALA  57           HA       ALA  57   6.612  -5.026   3.456
  427   1HB   ALA  57          1HB       ALA  57   4.171  -4.008   1.974
  428   2HB   ALA  57          2HB       ALA  57   5.735  -3.252   1.719
  429   3HB   ALA  57          3HB       ALA  57   5.509  -4.993   1.379
  430    H    GLY  58           H        GLY  58   3.823  -2.901   4.302
  431   1HA   GLY  58          1HA       GLY  58   5.224  -0.538   4.724
  432   2HA   GLY  58          2HA       GLY  58   3.625  -0.999   5.398
  433    H    ALA  59           H        ALA  59   5.037  -3.369   6.785
  434    HA   ALA  59           HA       ALA  59   5.605  -2.314   9.283
  435   1HB   ALA  59          1HB       ALA  59   7.000  -4.715   8.061
  436   2HB   ALA  59          2HB       ALA  59   6.745  -4.370   9.780
  437   3HB   ALA  59          3HB       ALA  59   5.350  -4.734   8.744
  438    H    PHE  60           H        PHE  60   7.703  -2.099   6.393
  439    HA   PHE  60           HA       PHE  60  10.108  -1.592   7.796
  440   1HB   PHE  60          2HB       PHE  60  10.974  -0.521   5.912
  441   2HB   PHE  60          3HB       PHE  60  10.049  -1.922   5.400
  442    HD1  PHE  60           1HD      PHE  60   9.826   1.845   5.718
  443    HD2  PHE  60           2HD      PHE  60   8.645  -1.669   3.505
  444    HE1  PHE  60           1HE      PHE  60   8.579   3.259   4.116
  445    HE2  PHE  60           2HE      PHE  60   7.355  -0.251   1.945
  446    HZ   PHE  60           HZ       PHE  60   7.323   2.212   2.237
  447    H    GLU  61           H        GLU  61   7.301   0.528   7.389
  448    HA   GLU  61           HA       GLU  61   8.675   2.664   8.989
  449   1HB   GLU  61          2HB       GLU  61   8.163   3.220   6.651
  450   2HB   GLU  61          3HB       GLU  61   6.486   2.808   6.918
  451   1HG   GLU  61          2HG       GLU  61   6.280   5.073   7.247
  452   2HG   GLU  61          3HG       GLU  61   6.914   4.779   8.862
  453    H    HIS  62           H        HIS  62   5.909   0.504   8.780
  454    HA   HIS  62           HA       HIS  62   4.494  -0.240  10.346
  455   1HB   HIS  62          2HB       HIS  62   5.142   2.005  12.267
  456   2HB   HIS  62          3HB       HIS  62   4.407   0.446  12.592
  457    HD1  HIS  62           1HD      HIS  62   7.042  -1.049  10.900
  458    HD2  HIS  62           2HD      HIS  62   6.967   1.637  14.144
  459    HE1  HIS  62           1HE      HIS  62   9.187  -1.403  12.180
  460    H    LEU  63           H        LEU  63   3.283   0.821   8.315
  461    HA   LEU  63           HA       LEU  63   1.822   3.274   9.031
  462   1HB   LEU  63          2HB       LEU  63   1.842   1.426   6.621
  463   2HB   LEU  63          3HB       LEU  63   0.615   2.678   6.787
  464    HG   LEU  63           HG       LEU  63   2.440   3.407   5.412
  465   1HD1  LEU  63          1HD1      LEU  63   1.023   4.913   6.897
  466   2HD1  LEU  63          2HD1      LEU  63   2.453   5.061   7.956
  467   3HD1  LEU  63          3HD1      LEU  63   2.516   5.595   6.275
  468   1HD2  LEU  63          1HD2      LEU  63   4.625   3.929   6.290
  469   2HD2  LEU  63          2HD2      LEU  63   4.187   3.441   7.918
  470   3HD2  LEU  63          3HD2      LEU  63   4.305   2.216   6.632
  471    H    LYS  64           H        LYS  64  -0.665   3.397   8.751
  472    HA   LYS  64           HA       LYS  64  -1.930   0.951   9.871
  473   1HB   LYS  64          2HB       LYS  64  -3.420   2.486  11.132
  474   2HB   LYS  64          3HB       LYS  64  -1.756   2.356  11.687
  475   1HG   LYS  64          2HG       LYS  64  -2.142   4.523  12.029
  476   2HG   LYS  64          3HG       LYS  64  -1.314   4.619  10.485
  477   1HD   LYS  64          2HD       LYS  64  -3.201   5.278   9.368
  478   2HD   LYS  64          3HD       LYS  64  -4.294   4.369  10.372
  479   1HE   LYS  64          2HE       LYS  64  -3.974   5.950  12.278
  480   2HE   LYS  64          3HE       LYS  64  -2.853   6.925  11.314
  481   1HZ   LYS  64          1HZ       LYS  64  -4.600   7.797  10.098
  482   2HZ   LYS  64          2HZ       LYS  64  -5.660   6.577  10.485
  483   3HZ   LYS  64          3HZ       LYS  64  -5.181   7.726  11.568
  484    H    ILE  65           H        ILE  65  -3.132   0.142   8.255
  485    HA   ILE  65           HA       ILE  65  -4.347   2.060   6.342
  486    HB   ILE  65           HB       ILE  65  -3.796  -0.791   5.605
  487   1HG1  ILE  65          2HG1      ILE  65  -1.744   1.397   5.771
  488   2HG1  ILE  65          3HG1      ILE  65  -1.673  -0.339   6.203
  489   1HG2  ILE  65          1HG2      ILE  65  -3.883   0.199   3.346
  490   2HG2  ILE  65          2HG2      ILE  65  -5.304   0.618   4.307
  491   3HG2  ILE  65          3HG2      ILE  65  -4.055   1.815   4.049
  492   1HD1  ILE  65          1HD1      ILE  65  -1.598   0.816   3.410
  493   2HD1  ILE  65          2HD1      ILE  65  -0.262   0.097   4.312
  494   3HD1  ILE  65          3HD1      ILE  65  -1.620  -0.923   3.821
  495    H    ILE  66           H        ILE  66  -6.506   2.049   6.206
  496    HA   ILE  66           HA       ILE  66  -7.991   0.115   7.889
  497    HB   ILE  66           HB       ILE  66  -8.746   2.922   7.047
  498   1HG1  ILE  66          2HG1      ILE  66  -6.781   3.126   8.436
  499   2HG1  ILE  66          3HG1      ILE  66  -8.209   3.641   9.318
  500   1HG2  ILE  66          1HG2      ILE  66 -10.401   2.723   8.896
  501   2HG2  ILE  66          2HG2      ILE  66 -10.692   1.569   7.589
  502   3HG2  ILE  66          3HG2      ILE  66  -9.949   1.020   9.101
  503   1HD1  ILE  66          1HD1      ILE  66  -8.237   1.491  10.567
  504   2HD1  ILE  66          2HD1      ILE  66  -6.788   0.963   9.681
  505   3HD1  ILE  66          3HD1      ILE  66  -6.709   2.363  10.757
  506    HA   PRO  67           HA       PRO  67  -9.837  -1.016   3.870
  507   1HB   PRO  67          2HB       PRO  67 -11.553  -2.966   4.716
  508   2HB   PRO  67          3HB       PRO  67  -9.792  -3.221   4.669
  509   1HG   PRO  67          2HG       PRO  67 -11.461  -2.453   7.064
  510   2HG   PRO  67          3HG       PRO  67 -10.219  -3.732   6.954
  511   1HD   PRO  67          2HD       PRO  67  -9.701  -1.262   7.964
  512   2HD   PRO  67          3HD       PRO  67  -8.464  -2.146   7.019
  513    H    GLU  68           H        GLU  68 -10.803   1.020   3.516
  514    HA   GLU  68           HA       GLU  68 -13.104   1.920   4.886
  515   1HB   GLU  68          2HB       GLU  68 -13.405   3.459   3.003
  516   2HB   GLU  68          3HB       GLU  68 -11.772   3.466   3.706
  517   1HG   GLU  68          2HG       GLU  68 -10.931   2.164   1.778
  518   2HG   GLU  68          3HG       GLU  68 -12.555   2.128   1.087
  519    H    LYS  69           H        LYS  69 -15.038   1.025   4.983
  520    HA   LYS  69           HA       LYS  69 -16.164  -0.502   2.670
  521   1HB   LYS  69          2HB       LYS  69 -16.964  -0.245   5.592
  522   2HB   LYS  69          3HB       LYS  69 -17.966  -1.011   4.344
  523   1HG   LYS  69          2HG       LYS  69 -16.189  -2.590   3.810
  524   2HG   LYS  69          3HG       LYS  69 -15.108  -1.857   5.010
  525   1HD   LYS  69          2HD       LYS  69 -16.514  -2.473   6.843
  526   2HD   LYS  69          3HD       LYS  69 -17.849  -2.956   5.796
  527   1HE   LYS  69          2HE       LYS  69 -15.120  -4.346   5.873
  528   2HE   LYS  69          3HE       LYS  69 -16.532  -4.871   6.802
  529   1HZ   LYS  69          1HZ       LYS  69 -16.393  -4.742   3.862
  530   2HZ   LYS  69          2HZ       LYS  69 -16.346  -6.104   4.779
  531   3HZ   LYS  69          3HZ       LYS  69 -17.713  -5.191   4.736
  532    H    GLU  70           H        GLU  70 -16.238   1.443   1.404
  533    HA   GLU  70           HA       GLU  70 -17.837   3.702   2.131
  534   1HB   GLU  70          2HB       GLU  70 -16.102   3.495   0.279
  535   2HB   GLU  70          3HB       GLU  70 -17.316   2.640  -0.686
  536   1HG   GLU  70          2HG       GLU  70 -18.684   4.608  -0.821
  537   2HG   GLU  70          3HG       GLU  70 -17.826   5.396   0.515
  538    H    ALA  71           H        ALA  71 -20.115   3.930   2.144
  539    HA   ALA  71           HA       ALA  71 -21.968   2.124   0.962
  540   1HB   ALA  71          1HB       ALA  71 -21.099   0.609   2.757
  541   2HB   ALA  71          2HB       ALA  71 -21.317   1.910   3.949
  542   3HB   ALA  71          3HB       ALA  71 -22.730   1.189   3.153
  Start of MODEL   16
    1   1H    MET   1           H1       MET   1 -14.357 -13.721  -4.941
    2   2H    MET   1           H2       MET   1 -15.338 -14.352  -6.140
    3   3H    MET   1           H3       MET   1 -13.684 -14.537  -6.179
    4    HA   MET   1           HA       MET   1 -14.027 -12.797  -7.653
    5   1HB   MET   1          2HB       MET   1 -16.035 -11.941  -5.546
    6   2HB   MET   1          3HB       MET   1 -15.322 -10.732  -6.618
    7   1HG   MET   1          2HG       MET   1 -16.127 -11.756  -8.579
    8   2HG   MET   1          3HG       MET   1 -16.636 -13.229  -7.751
    9   1HE   MET   1          1HE       MET   1 -18.337 -12.443  -5.303
   10   2HE   MET   1          2HE       MET   1 -19.940 -12.254  -6.047
   11   3HE   MET   1          3HE       MET   1 -18.877 -13.576  -6.572
   12    H    ALA   2           H        ALA   2 -12.731 -10.795  -7.550
   13    HA   ALA   2           HA       ALA   2 -11.127 -10.450  -5.060
   14   1HB   ALA   2          1HB       ALA   2 -10.025 -11.013  -7.861
   15   2HB   ALA   2          2HB       ALA   2  -9.081 -10.500  -6.451
   16   3HB   ALA   2          3HB       ALA   2  -9.914 -12.069  -6.443
   17    H    GLU   3           H        GLU   3 -11.152  -9.355  -8.469
   18    HA   GLU   3           HA       GLU   3 -11.485  -7.381  -9.442
   19   1HB   GLU   3          2HB       GLU   3 -13.670  -7.693  -8.000
   20   2HB   GLU   3          3HB       GLU   3 -13.052  -6.355  -7.057
   21   1HG   GLU   3          2HG       GLU   3 -12.758  -5.235  -9.498
   22   2HG   GLU   3          3HG       GLU   3 -13.864  -6.517  -9.983
   23    H    LYS   4           H        LYS   4 -11.844  -4.894  -7.581
   24    HA   LYS   4           HA       LYS   4  -8.964  -4.326  -7.105
   25   1HB   LYS   4          2HB       LYS   4  -9.369  -2.054  -7.994
   26   2HB   LYS   4          3HB       LYS   4  -9.625  -3.311  -9.212
   27   1HG   LYS   4          2HG       LYS   4 -12.146  -3.154  -8.637
   28   2HG   LYS   4          3HG       LYS   4 -11.749  -1.693  -7.735
   29   1HD   LYS   4          2HD       LYS   4 -10.857  -0.663  -9.794
   30   2HD   LYS   4          3HD       LYS   4 -11.072  -2.198 -10.670
   31   1HE   LYS   4          2HE       LYS   4 -13.543  -2.100 -10.199
   32   2HE   LYS   4          3HE       LYS   4 -13.319  -0.513  -9.452
   33   1HZ   LYS   4          1HZ       LYS   4 -12.529   0.275 -11.598
   34   2HZ   LYS   4          2HZ       LYS   4 -12.745  -1.224 -12.255
   35   3HZ   LYS   4          3HZ       LYS   4 -14.041  -0.368 -11.720
   36    H    THR   5           H        THR   5  -8.574  -2.913  -5.308
   37    HA   THR   5           HA       THR   5 -10.916  -1.970  -3.785
   38    HB   THR   5           HB       THR   5  -8.887  -3.933  -2.577
   39    HG1  THR   5           1HG      THR   5 -11.314  -3.991  -3.727
   40   1HG2  THR   5          1HG2      THR   5  -9.607  -2.261  -0.854
   41   2HG2  THR   5          2HG2      THR   5 -11.302  -2.506  -1.329
   42   3HG2  THR   5          3HG2      THR   5 -10.388  -3.823  -0.577
   43    H    VAL   6           H        VAL   6 -10.410  -0.298  -2.372
   44    HA   VAL   6           HA       VAL   6  -7.640   0.321  -2.238
   45    HB   VAL   6           HB       VAL   6  -8.345   1.619  -4.070
   46   1HG1  VAL   6          1HG1      VAL   6 -10.202   3.165  -4.162
   47   2HG1  VAL   6          2HG1      VAL   6 -10.721   1.494  -3.961
   48   3HG1  VAL   6          3HG1      VAL   6 -10.764   2.603  -2.565
   49   1HG2  VAL   6          1HG2      VAL   6  -8.066   3.960  -3.423
   50   2HG2  VAL   6          2HG2      VAL   6  -8.561   3.601  -1.753
   51   3HG2  VAL   6          3HG2      VAL   6  -7.024   2.985  -2.389
   52    H    TYR   7           H        TYR   7  -6.903   1.191  -0.409
   53    HA   TYR   7           HA       TYR   7  -8.795   1.060   1.902
   54   1HB   TYR   7          2HB       TYR   7  -5.832   0.401   1.816
   55   2HB   TYR   7          3HB       TYR   7  -6.978   0.121   3.121
   56    HD1  TYR   7           HD1      TYR   7  -7.602  -2.075   3.466
   57    HD2  TYR   7           HD2      TYR   7  -6.235  -0.943  -0.437
   58    HE1  TYR   7           HE1      TYR   7  -8.142  -4.347   2.623
   59    HE2  TYR   7           HE2      TYR   7  -6.687  -3.220  -1.259
   60    HH   TYR   7           HH       TYR   7  -7.580  -5.328  -0.750
   61    H    ARG   8           H        ARG   8  -8.200   2.475   3.731
   62    HA   ARG   8           HA       ARG   8  -6.924   5.012   2.776
   63   1HB   ARG   8          2HB       ARG   8  -8.748   4.247   5.098
   64   2HB   ARG   8          3HB       ARG   8  -7.826   5.752   5.128
   65   1HG   ARG   8          2HG       ARG   8  -8.942   6.657   3.257
   66   2HG   ARG   8          3HG       ARG   8  -9.710   5.106   2.835
   67   1HD   ARG   8          2HD       ARG   8 -11.088   5.110   4.759
   68   2HD   ARG   8          3HD       ARG   8 -10.173   6.419   5.541
   69    HE   ARG   8           HE       ARG   8 -11.103   7.663   3.314
   70   1HH1  ARG   8          2HH2      ARG   8 -12.667   5.826   5.922
   71   2HH1  ARG   8          1HH2      ARG   8 -14.115   6.784   5.933
   72   1HH2  ARG   8          2HH1      ARG   8 -13.063   8.975   3.352
   73   2HH2  ARG   8          1HH1      ARG   8 -14.329   8.545   4.469
   74    H    VAL   9           H        VAL   9  -4.786   5.147   3.197
   75    HA   VAL   9           HA       VAL   9  -3.578   3.738   5.532
   76    HB   VAL   9           HB       VAL   9  -2.447   3.092   3.600
   77   1HG1  VAL   9          1HG1      VAL   9  -1.497   4.672   1.930
   78   2HG1  VAL   9          2HG1      VAL   9  -3.256   4.693   1.931
   79   3HG1  VAL   9          3HG1      VAL   9  -2.351   6.015   2.712
   80   1HG2  VAL   9          1HG2      VAL   9  -0.213   3.922   3.896
   81   2HG2  VAL   9          2HG2      VAL   9  -0.788   5.445   4.587
   82   3HG2  VAL   9          3HG2      VAL   9  -0.975   3.923   5.492
   83    H    ASP  10           H        ASP  10  -2.451   4.897   7.122
   84    HA   ASP  10           HA       ASP  10  -2.344   7.842   6.816
   85   1HB   ASP  10          2HB       ASP  10  -4.520   7.407   7.839
   86   2HB   ASP  10          3HB       ASP  10  -3.795   6.349   9.028
   87    H    GLY  11           H        GLY  11  -1.118   8.767   8.630
   88   1HA   GLY  11          1HA       GLY  11   0.560   8.529  10.321
   89   2HA   GLY  11          2HA       GLY  11   1.126   7.017   9.603
   90    H    LEU  12           H        LEU  12   1.821   7.320   7.178
   91    HA   LEU  12           HA       LEU  12   4.028   9.231   7.386
   92   1HB   LEU  12          2HB       LEU  12   4.972   7.986   5.473
   93   2HB   LEU  12          3HB       LEU  12   4.675   7.076   6.940
   94    HG   LEU  12           HG       LEU  12   2.761   5.955   5.987
   95   1HD1  LEU  12          1HD1      LEU  12   2.119   6.230   3.629
   96   2HD1  LEU  12          2HD1      LEU  12   1.650   7.579   4.638
   97   3HD1  LEU  12          3HD1      LEU  12   3.066   7.735   3.558
   98   1HD2  LEU  12          1HD2      LEU  12   5.001   6.075   3.934
   99   2HD2  LEU  12          2HD2      LEU  12   5.158   5.246   5.482
  100   3HD2  LEU  12          3HD2      LEU  12   3.955   4.681   4.315
  101    H    SER  13           H        SER  13   4.891  10.191   5.288
  102    HA   SER  13           HA       SER  13   3.036  10.942   3.194
  103   1HB   SER  13          2HB       SER  13   3.079  13.389   3.730
  104   2HB   SER  13          3HB       SER  13   2.173  12.455   4.932
  105    HG   SER  13           HG       SER  13   4.893  13.229   5.155
  106    H    CYS  14           H        CYS  14   4.936   9.923   2.039
  107    HA   CYS  14           HA       CYS  14   6.663  12.056   1.186
  108   1HB   CYS  14          2HB       CYS  14   7.676  10.418   3.354
  109   2HB   CYS  14          3HB       CYS  14   8.587  10.009   1.889
  110    HG   CYS  14           HG       CYS  14   7.900  12.981   3.094
  111    H    THR  15           H        THR  15   7.226  11.826  -0.909
  112    HA   THR  15           HA       THR  15   6.198   9.861  -2.506
  113    HB   THR  15           HB       THR  15   8.728  11.445  -3.108
  114    HG1  THR  15           1HG      THR  15   6.055  12.377  -3.164
  115   1HG2  THR  15          1HG2      THR  15   7.935   9.941  -4.914
  116   2HG2  THR  15          2HG2      THR  15   6.317  10.668  -4.823
  117   3HG2  THR  15          3HG2      THR  15   7.704  11.644  -5.348
  118    H    ASN  16           H        ASN  16   9.593  10.013  -1.235
  119    HA   ASN  16           HA       ASN  16  10.515   7.751  -2.553
  120   1HB   ASN  16          2HB       ASN  16  11.904   9.424  -1.344
  121   2HB   ASN  16          3HB       ASN  16  11.353   8.744   0.198
  122   1HD2  ASN  16          1HD2      ASN  16  13.774   8.495   0.501
  123   2HD2  ASN  16          2HD2      ASN  16  14.534   7.073  -0.188
  124    H    CYS  17           H        CYS  17   8.582   8.044   0.395
  125    HA   CYS  17           HA       CYS  17   8.926   5.270   1.256
  126   1HB   CYS  17          2HB       CYS  17   6.865   7.363   2.082
  127   2HB   CYS  17          3HB       CYS  17   7.083   5.750   2.771
  128    HG   CYS  17           HG       CYS  17   9.392   8.087   2.511
  129    H    ALA  18           H        ALA  18   6.475   7.237  -0.476
  130    HA   ALA  18           HA       ALA  18   4.614   5.182  -1.065
  131   1HB   ALA  18          1HB       ALA  18   4.311   7.659  -1.507
  132   2HB   ALA  18          2HB       ALA  18   5.349   7.472  -2.932
  133   3HB   ALA  18          3HB       ALA  18   3.823   6.585  -2.832
  134    H    ALA  19           H        ALA  19   7.591   6.135  -2.749
  135    HA   ALA  19           HA       ALA  19   7.393   4.394  -4.966
  136   1HB   ALA  19          1HB       ALA  19   9.040   6.215  -4.809
  137   2HB   ALA  19          2HB       ALA  19   9.944   5.306  -3.581
  138   3HB   ALA  19          3HB       ALA  19   9.789   4.659  -5.219
  139    H    LYS  20           H        LYS  20   9.128   3.919  -1.844
  140    HA   LYS  20           HA       LYS  20   9.835   1.213  -2.264
  141   1HB   LYS  20          2HB       LYS  20  10.771   2.591  -0.535
  142   2HB   LYS  20          3HB       LYS  20   9.240   2.664   0.353
  143   1HG   LYS  20          2HG       LYS  20   9.293   0.376   0.920
  144   2HG   LYS  20          3HG       LYS  20  10.492  -0.031  -0.300
  145   1HD   LYS  20          2HD       LYS  20  11.023   1.616   2.231
  146   2HD   LYS  20          3HD       LYS  20  11.344  -0.099   2.006
  147   1HE   LYS  20          2HE       LYS  20  13.436   0.590   1.460
  148   2HE   LYS  20          3HE       LYS  20  12.720   0.737  -0.144
  149   1HZ   LYS  20          1HZ       LYS  20  12.358   3.114   0.390
  150   2HZ   LYS  20          2HZ       LYS  20  13.139   2.900   1.819
  151   3HZ   LYS  20          3HZ       LYS  20  13.941   2.682   0.401
  152    H    PHE  21           H        PHE  21   6.814   2.614  -0.955
  153    HA   PHE  21           HA       PHE  21   5.706   0.098  -0.245
  154   1HB   PHE  21          2HB       PHE  21   4.976   2.572   0.341
  155   2HB   PHE  21          3HB       PHE  21   3.937   2.409  -1.063
  156    HD1  PHE  21           1HD      PHE  21   1.686   1.906  -0.323
  157    HD2  PHE  21           2HD      PHE  21   5.009   0.130   1.782
  158    HE1  PHE  21           1HE      PHE  21   0.195   1.263   1.568
  159    HE2  PHE  21           2HE      PHE  21   3.463  -0.701   3.474
  160    HZ   PHE  21           HZ       PHE  21   1.130  -0.072   3.458
  161    H    GLU  22           H        GLU  22   4.998   2.121  -3.195
  162    HA   GLU  22           HA       GLU  22   3.251   0.228  -4.324
  163   1HB   GLU  22          2HB       GLU  22   3.415   1.383  -6.376
  164   2HB   GLU  22          3HB       GLU  22   3.485   2.611  -5.102
  165   1HG   GLU  22          2HG       GLU  22   5.839   2.926  -5.436
  166   2HG   GLU  22          3HG       GLU  22   5.935   1.585  -6.591
  167    H    ARG  23           H        ARG  23   6.756   0.621  -4.600
  168    HA   ARG  23           HA       ARG  23   7.314  -1.460  -6.457
  169   1HB   ARG  23          2HB       ARG  23   8.948   0.284  -5.603
  170   2HB   ARG  23          3HB       ARG  23   8.891  -0.476  -4.013
  171   1HG   ARG  23          2HG       ARG  23  10.823  -1.382  -4.803
  172   2HG   ARG  23          3HG       ARG  23   9.693  -2.647  -5.289
  173   1HD   ARG  23          2HD       ARG  23   9.585  -1.638  -7.572
  174   2HD   ARG  23          3HD       ARG  23  10.687  -0.355  -6.996
  175    HE   ARG  23           HE       ARG  23  11.545  -3.182  -6.690
  176   1HH1  ARG  23          2HH2      ARG  23  11.599  -0.335  -8.790
  177   2HH1  ARG  23          1HH2      ARG  23  13.191  -0.586  -9.424
  178   1HH2  ARG  23          2HH1      ARG  23  13.716  -3.539  -7.502
  179   2HH2  ARG  23          1HH1      ARG  23  14.415  -2.488  -8.706
  180    H    ASN  24           H        ASN  24   7.267  -1.594  -2.805
  181    HA   ASN  24           HA       ASN  24   7.676  -4.377  -2.588
  182   1HB   ASN  24          2HB       ASN  24   6.294  -2.307  -0.889
  183   2HB   ASN  24          3HB       ASN  24   5.856  -3.984  -0.614
  184   1HD2  ASN  24          1HD2      ASN  24   7.664  -1.782   0.735
  185   2HD2  ASN  24          2HD2      ASN  24   8.893  -2.845   1.423
  186    H    VAL  25           H        VAL  25   4.565  -2.605  -2.994
  187    HA   VAL  25           HA       VAL  25   2.949  -4.928  -3.005
  188    HB   VAL  25           HB       VAL  25   2.382  -2.327  -4.501
  189   1HG1  VAL  25          1HG1      VAL  25   0.849  -4.017  -5.201
  190   2HG1  VAL  25          2HG1      VAL  25   0.623  -4.617  -3.533
  191   3HG1  VAL  25          3HG1      VAL  25  -0.002  -3.035  -4.005
  192   1HG2  VAL  25          1HG2      VAL  25   0.936  -2.090  -2.249
  193   2HG2  VAL  25          2HG2      VAL  25   2.252  -3.095  -1.600
  194   3HG2  VAL  25          3HG2      VAL  25   2.584  -1.520  -2.339
  195    H    LYS  26           H        LYS  26   4.386  -3.202  -5.798
  196    HA   LYS  26           HA       LYS  26   3.621  -4.923  -7.870
  197   1HB   LYS  26          2HB       LYS  26   5.898  -3.019  -7.309
  198   2HB   LYS  26          3HB       LYS  26   5.917  -3.932  -8.798
  199   1HG   LYS  26          2HG       LYS  26   3.874  -3.015  -9.520
  200   2HG   LYS  26          3HG       LYS  26   3.461  -2.348  -7.930
  201   1HD   LYS  26          2HD       LYS  26   5.061  -0.627  -8.078
  202   2HD   LYS  26          3HD       LYS  26   5.969  -1.461  -9.348
  203   1HE   LYS  26          2HE       LYS  26   4.146  -1.065 -10.972
  204   2HE   LYS  26          3HE       LYS  26   3.119  -0.381  -9.699
  205   1HZ   LYS  26          1HZ       LYS  26   4.644   1.446  -9.490
  206   2HZ   LYS  26          2HZ       LYS  26   5.644   0.829 -10.626
  207   3HZ   LYS  26          3HZ       LYS  26   4.126   1.327 -11.027
  208    H    GLU  27           H        GLU  27   6.362  -5.269  -5.565
  209    HA   GLU  27           HA       GLU  27   7.371  -7.629  -6.893
  210   1HB   GLU  27          2HB       GLU  27   8.017  -6.386  -4.201
  211   2HB   GLU  27          3HB       GLU  27   8.816  -7.817  -4.857
  212   1HG   GLU  27          2HG       GLU  27   9.517  -6.581  -6.868
  213   2HG   GLU  27          3HG       GLU  27   8.696  -5.124  -6.307
  214    H    ILE  28           H        ILE  28   4.556  -7.275  -4.897
  215    HA   ILE  28           HA       ILE  28   4.650 -10.050  -3.910
  216    HB   ILE  28           HB       ILE  28   2.237  -8.288  -4.196
  217   1HG1  ILE  28          2HG1      ILE  28   3.832  -8.448  -1.623
  218   2HG1  ILE  28          3HG1      ILE  28   3.931  -7.110  -2.766
  219   1HG2  ILE  28          1HG2      ILE  28   1.060  -9.870  -3.129
  220   2HG2  ILE  28          2HG2      ILE  28   2.417 -10.975  -3.421
  221   3HG2  ILE  28          3HG2      ILE  28   2.304 -10.121  -1.894
  222   1HD1  ILE  28          1HD1      ILE  28   1.333  -8.000  -1.476
  223   2HD1  ILE  28          2HD1      ILE  28   2.307  -6.598  -0.987
  224   3HD1  ILE  28          3HD1      ILE  28   1.539  -6.656  -2.589
  225    H    GLU  29           H        GLU  29   4.015 -11.817  -5.176
  226    HA   GLU  29           HA       GLU  29   3.175 -11.488  -7.880
  227   1HB   GLU  29          2HB       GLU  29   3.545 -13.861  -5.982
  228   2HB   GLU  29          3HB       GLU  29   3.156 -14.001  -7.687
  229   1HG   GLU  29          2HG       GLU  29   5.222 -12.804  -8.308
  230   2HG   GLU  29          3HG       GLU  29   5.662 -12.644  -6.600
  231    H    GLY  30           H        GLY  30   1.369 -11.384  -5.056
  232   1HA   GLY  30          1HA       GLY  30  -0.998 -12.864  -5.930
  233   2HA   GLY  30          2HA       GLY  30  -0.843 -11.833  -4.502
  234    H    VAL  31           H        VAL  31   0.160  -9.497  -6.148
  235    HA   VAL  31           HA       VAL  31  -2.497  -8.558  -6.965
  236    HB   VAL  31           HB       VAL  31  -1.374  -7.444  -5.119
  237   1HG1  VAL  31          1HG1      VAL  31   0.712  -6.454  -7.100
  238   2HG1  VAL  31          2HG1      VAL  31   0.589  -6.181  -5.345
  239   3HG1  VAL  31          3HG1      VAL  31   0.995  -7.772  -5.954
  240   1HG2  VAL  31          1HG2      VAL  31  -1.737  -5.203  -5.865
  241   2HG2  VAL  31          2HG2      VAL  31  -1.471  -5.669  -7.555
  242   3HG2  VAL  31          3HG2      VAL  31  -2.915  -6.257  -6.693
  243    H    THR  32           H        THR  32  -2.514  -7.112  -8.925
  244    HA   THR  32           HA       THR  32  -0.491  -7.894 -10.974
  245    HB   THR  32           HB       THR  32  -3.394  -7.072 -11.389
  246    HG1  THR  32           1HG      THR  32  -2.608  -9.311 -10.591
  247   1HG2  THR  32          1HG2      THR  32  -1.963  -6.340 -13.253
  248   2HG2  THR  32          2HG2      THR  32  -1.244  -7.963 -13.353
  249   3HG2  THR  32          3HG2      THR  32  -2.964  -7.722 -13.730
  250    H    GLU  33           H        GLU  33  -2.754  -5.267  -9.889
  251    HA   GLU  33           HA       GLU  33  -0.549  -3.295 -10.510
  252   1HB   GLU  33          2HB       GLU  33  -3.477  -3.297 -11.300
  253   2HB   GLU  33          3HB       GLU  33  -2.571  -1.786 -11.138
  254   1HG   GLU  33          2HG       GLU  33  -1.202  -3.884 -12.772
  255   2HG   GLU  33          3HG       GLU  33  -2.724  -3.278 -13.418
  256    H    ALA  34           H        ALA  34  -0.551  -1.409  -9.194
  257    HA   ALA  34           HA       ALA  34  -2.585  -1.158  -7.119
  258   1HB   ALA  34          1HB       ALA  34  -0.864  -1.087  -5.282
  259   2HB   ALA  34          2HB       ALA  34  -1.032  -2.692  -6.027
  260   3HB   ALA  34          3HB       ALA  34   0.355  -1.655  -6.441
  261    H    ILE  35           H        ILE  35  -2.702   0.976  -6.342
  262    HA   ILE  35           HA       ILE  35  -0.774   2.931  -7.568
  263    HB   ILE  35           HB       ILE  35  -3.787   3.309  -7.522
  264   1HG1  ILE  35          2HG1      ILE  35  -1.954   2.877  -9.921
  265   2HG1  ILE  35          3HG1      ILE  35  -3.019   1.635  -9.251
  266   1HG2  ILE  35          1HG2      ILE  35  -2.442   5.382  -7.190
  267   2HG2  ILE  35          2HG2      ILE  35  -1.555   5.024  -8.684
  268   3HG2  ILE  35          3HG2      ILE  35  -3.292   5.386  -8.728
  269   1HD1  ILE  35          1HD1      ILE  35  -4.995   3.066  -9.669
  270   2HD1  ILE  35          2HD1      ILE  35  -3.945   4.230 -10.516
  271   3HD1  ILE  35          3HD1      ILE  35  -4.118   2.582 -11.132
  272    H    VAL  36           H        VAL  36   0.309   3.593  -5.792
  273    HA   VAL  36           HA       VAL  36  -1.109   3.912  -3.209
  274    HB   VAL  36           HB       VAL  36   1.838   4.256  -3.849
  275   1HG1  VAL  36          1HG1      VAL  36   2.132   3.914  -1.457
  276   2HG1  VAL  36          2HG1      VAL  36   1.053   5.273  -1.757
  277   3HG1  VAL  36          3HG1      VAL  36   0.373   3.711  -1.247
  278   1HG2  VAL  36          1HG2      VAL  36   2.196   1.991  -2.963
  279   2HG2  VAL  36          2HG2      VAL  36   0.464   1.682  -3.013
  280   3HG2  VAL  36          3HG2      VAL  36   1.336   1.987  -4.509
  281    H    ASN  37           H        ASN  37  -1.855   6.012  -2.628
  282    HA   ASN  37           HA       ASN  37  -0.696   8.343  -4.100
  283   1HB   ASN  37          2HB       ASN  37  -2.869   8.150  -1.992
  284   2HB   ASN  37          3HB       ASN  37  -2.222   9.662  -2.606
  285   1HD2  ASN  37          1HD2      ASN  37  -2.136   9.742  -5.194
  286   2HD2  ASN  37          2HD2      ASN  37  -3.630   9.218  -5.946
  287    H    PHE  38           H        PHE  38  -1.126   7.271  -0.723
  288    HA   PHE  38           HA       PHE  38  -0.190   7.999   1.237
  289   1HB   PHE  38          2HB       PHE  38   2.284   8.346  -0.521
  290   2HB   PHE  38          3HB       PHE  38   2.278   8.701   1.185
  291    HD1  PHE  38           1HD      PHE  38   0.162   5.839   0.735
  292    HD2  PHE  38           2HD      PHE  38   4.278   7.135   0.963
  293    HE1  PHE  38           1HE      PHE  38   0.786   3.702   1.749
  294    HE2  PHE  38           2HE      PHE  38   4.910   4.892   1.815
  295    HZ   PHE  38           HZ       PHE  38   3.154   3.232   2.341
  296    H    GLY  39           H        GLY  39   1.242  10.165   2.051
  297   1HA   GLY  39          1HA       GLY  39   1.103  12.432   2.335
  298   2HA   GLY  39          2HA       GLY  39   0.565  12.587   0.655
  299    H    ALA  40           H        ALA  40  -1.038  10.569   3.055
  300    HA   ALA  40           HA       ALA  40  -2.917  10.707   4.297
  301   1HB   ALA  40          1HB       ALA  40  -3.010  13.701   3.734
  302   2HB   ALA  40          2HB       ALA  40  -3.924  12.795   4.946
  303   3HB   ALA  40          3HB       ALA  40  -2.158  12.918   5.083
  304    H    SER  41           H        SER  41  -3.509   9.357   2.493
  305    HA   SER  41           HA       SER  41  -5.894  10.279   1.124
  306   1HB   SER  41          2HB       SER  41  -3.308   9.906  -0.388
  307   2HB   SER  41          3HB       SER  41  -4.878   9.625  -1.172
  308    HG   SER  41           HG       SER  41  -4.398  12.006   0.259
  309    H    LYS  42           H        LYS  42  -4.175   7.742  -0.478
  310    HA   LYS  42           HA       LYS  42  -5.401   5.629   1.062
  311   1HB   LYS  42          2HB       LYS  42  -7.091   5.021  -0.596
  312   2HB   LYS  42          3HB       LYS  42  -7.343   6.660   0.013
  313   1HG   LYS  42          2HG       LYS  42  -5.769   7.152  -2.179
  314   2HG   LYS  42          3HG       LYS  42  -6.618   5.737  -2.746
  315   1HD   LYS  42          2HD       LYS  42  -7.818   8.386  -1.762
  316   2HD   LYS  42          3HD       LYS  42  -7.639   7.856  -3.426
  317   1HE   LYS  42          2HE       LYS  42  -9.921   7.550  -2.916
  318   2HE   LYS  42          3HE       LYS  42  -9.213   5.935  -2.983
  319   1HZ   LYS  42          1HZ       LYS  42 -10.694   6.233  -1.112
  320   2HZ   LYS  42          2HZ       LYS  42  -9.166   5.940  -0.581
  321   3HZ   LYS  42          3HZ       LYS  42  -9.776   7.470  -0.529
  322    H    ILE  43           H        ILE  43  -5.222   3.553  -0.052
  323    HA   ILE  43           HA       ILE  43  -3.048   3.427  -2.102
  324    HB   ILE  43           HB       ILE  43  -2.028   3.017   0.013
  325   1HG1  ILE  43          2HG1      ILE  43  -1.312   1.688  -1.951
  326   2HG1  ILE  43          3HG1      ILE  43  -0.849   1.023  -0.381
  327   1HG2  ILE  43          1HG2      ILE  43  -4.015   0.785   0.520
  328   2HG2  ILE  43          2HG2      ILE  43  -2.571   1.158   1.465
  329   3HG2  ILE  43          3HG2      ILE  43  -3.899   2.321   1.404
  330   1HD1  ILE  43          1HD1      ILE  43  -1.448  -0.740  -1.876
  331   2HD1  ILE  43          2HD1      ILE  43  -2.595  -0.682  -0.533
  332   3HD1  ILE  43          3HD1      ILE  43  -3.055  -0.074  -2.134
  333    H    THR  44           H        THR  44  -3.790   2.471  -3.895
  334    HA   THR  44           HA       THR  44  -6.138   0.673  -3.750
  335    HB   THR  44           HB       THR  44  -4.775   2.035  -6.071
  336    HG1  THR  44           1HG      THR  44  -6.955   2.927  -6.052
  337   1HG2  THR  44          1HG2      THR  44  -7.287   0.313  -6.032
  338   2HG2  THR  44          2HG2      THR  44  -6.779   1.341  -7.386
  339   3HG2  THR  44          3HG2      THR  44  -5.787  -0.031  -6.924
  340    H    VAL  45           H        VAL  45  -6.149  -1.280  -4.591
  341    HA   VAL  45           HA       VAL  45  -3.677  -2.640  -5.527
  342    HB   VAL  45           HB       VAL  45  -5.485  -3.339  -3.199
  343   1HG1  VAL  45          1HG1      VAL  45  -3.882  -5.390  -4.762
  344   2HG1  VAL  45          2HG1      VAL  45  -4.555  -5.639  -3.143
  345   3HG1  VAL  45          3HG1      VAL  45  -5.644  -5.379  -4.507
  346   1HG2  VAL  45          1HG2      VAL  45  -2.471  -3.565  -3.589
  347   2HG2  VAL  45          2HG2      VAL  45  -3.314  -2.220  -2.798
  348   3HG2  VAL  45          3HG2      VAL  45  -3.360  -3.833  -2.074
  349    H    THR  46           H        THR  46  -4.124  -4.043  -7.234
  350    HA   THR  46           HA       THR  46  -6.907  -4.787  -7.912
  351    HB   THR  46           HB       THR  46  -5.043  -3.130  -9.684
  352    HG1  THR  46           1HG      THR  46  -6.897  -2.795  -7.908
  353   1HG2  THR  46          1HG2      THR  46  -7.758  -4.430 -10.278
  354   2HG2  THR  46          2HG2      THR  46  -6.998  -3.175 -11.278
  355   3HG2  THR  46          3HG2      THR  46  -6.235  -4.763 -11.126
  356    H    GLY  47           H        GLY  47  -6.367  -6.829  -7.448
  357   1HA   GLY  47          1HA       GLY  47  -5.161  -8.186  -9.672
  358   2HA   GLY  47          2HA       GLY  47  -4.060  -8.178  -8.331
  359    H    GLU  48           H        GLU  48  -4.257  -9.776  -6.795
  360    HA   GLU  48           HA       GLU  48  -6.868 -10.528  -5.791
  361   1HB   GLU  48          2HB       GLU  48  -6.236 -12.109  -7.755
  362   2HB   GLU  48          3HB       GLU  48  -5.027 -12.796  -6.675
  363   1HG   GLU  48          2HG       GLU  48  -7.797 -12.556  -5.529
  364   2HG   GLU  48          3HG       GLU  48  -7.661 -13.601  -6.948
  365    H    ALA  49           H        ALA  49  -5.548  -8.949  -4.387
  366    HA   ALA  49           HA       ALA  49  -4.295 -10.521  -2.235
  367   1HB   ALA  49          1HB       ALA  49  -2.369  -9.776  -3.562
  368   2HB   ALA  49          2HB       ALA  49  -3.008  -8.114  -3.594
  369   3HB   ALA  49          3HB       ALA  49  -2.458  -8.823  -2.067
  370    H    SER  50           H        SER  50  -4.083  -9.195  -0.279
  371    HA   SER  50           HA       SER  50  -6.169  -7.089  -0.001
  372   1HB   SER  50          2HB       SER  50  -5.402  -9.382   1.861
  373   2HB   SER  50          3HB       SER  50  -6.398  -8.003   2.347
  374    HG   SER  50           HG       SER  50  -7.667  -9.806   1.607
  375    H    ILE  51           H        ILE  51  -5.642  -5.513   1.822
  376    HA   ILE  51           HA       ILE  51  -3.138  -4.557   1.519
  377    HB   ILE  51           HB       ILE  51  -5.155  -3.341   2.577
  378   1HG1  ILE  51          2HG1      ILE  51  -3.710  -1.945   3.993
  379   2HG1  ILE  51          3HG1      ILE  51  -2.368  -3.001   3.561
  380   1HG2  ILE  51          1HG2      ILE  51  -5.399  -3.322   4.948
  381   2HG2  ILE  51          2HG2      ILE  51  -5.476  -5.025   4.465
  382   3HG2  ILE  51          3HG2      ILE  51  -3.987  -4.357   5.188
  383   1HD1  ILE  51          1HD1      ILE  51  -2.897  -2.477   1.097
  384   2HD1  ILE  51          2HD1      ILE  51  -4.118  -1.346   1.686
  385   3HD1  ILE  51          3HD1      ILE  51  -2.401  -1.082   2.053
  386    H    GLN  52           H        GLN  52  -4.095  -7.002   3.855
  387    HA   GLN  52           HA       GLN  52  -2.269  -7.247   5.774
  388   1HB   GLN  52          2HB       GLN  52  -3.057  -9.325   3.684
  389   2HB   GLN  52          3HB       GLN  52  -2.128  -9.757   5.114
  390   1HG   GLN  52          2HG       GLN  52  -4.853  -8.387   5.261
  391   2HG   GLN  52          3HG       GLN  52  -4.625 -10.141   5.254
  392   1HE2  GLN  52          1HE2      GLN  52  -5.946  -9.101   7.411
  393   2HE2  GLN  52          2HE2      GLN  52  -4.880  -9.141   8.805
  394    H    GLN  53           H        GLN  53  -1.445  -8.088   2.395
  395    HA   GLN  53           HA       GLN  53   1.321  -8.748   3.044
  396   1HB   GLN  53          2HB       GLN  53  -0.029  -8.185   0.386
  397   2HB   GLN  53          3HB       GLN  53   1.599  -8.877   0.612
  398   1HG   GLN  53          2HG       GLN  53   0.626 -10.792   1.832
  399   2HG   GLN  53          3HG       GLN  53  -1.005 -10.147   1.586
  400   1HE2  GLN  53          1HE2      GLN  53   0.766 -12.600   0.491
  401   2HE2  GLN  53          2HE2      GLN  53   0.270 -12.588  -1.192
  402    H    VAL  54           H        VAL  54  -0.337  -5.856   1.845
  403    HA   VAL  54           HA       VAL  54   2.063  -4.383   1.185
  404    HB   VAL  54           HB       VAL  54  -0.793  -3.335   1.570
  405   1HG1  VAL  54          1HG1      VAL  54   0.036  -1.570   0.011
  406   2HG1  VAL  54          2HG1      VAL  54   0.606  -1.585   1.675
  407   3HG1  VAL  54          3HG1      VAL  54   1.691  -2.130   0.383
  408   1HG2  VAL  54          1HG2      VAL  54  -0.891  -5.075  -0.123
  409   2HG2  VAL  54          2HG2      VAL  54  -0.903  -3.504  -0.924
  410   3HG2  VAL  54          3HG2      VAL  54   0.587  -4.473  -0.893
  411    H    GLU  55           H        GLU  55  -0.117  -4.707   3.983
  412    HA   GLU  55           HA       GLU  55   0.890  -2.682   5.664
  413   1HB   GLU  55          2HB       GLU  55  -1.288  -3.987   5.862
  414   2HB   GLU  55          3HB       GLU  55  -0.339  -5.372   6.426
  415   1HG   GLU  55          2HG       GLU  55   0.546  -3.953   8.279
  416   2HG   GLU  55          3HG       GLU  55  -0.502  -2.634   7.717
  417    H    GLN  56           H        GLN  56   1.565  -6.220   5.342
  418    HA   GLN  56           HA       GLN  56   3.666  -6.418   7.148
  419   1HB   GLN  56          2HB       GLN  56   2.515  -8.279   5.950
  420   2HB   GLN  56          3HB       GLN  56   3.465  -7.920   4.500
  421   1HG   GLN  56          2HG       GLN  56   5.549  -8.378   5.697
  422   2HG   GLN  56          3HG       GLN  56   4.663  -8.613   7.214
  423   1HE2  GLN  56          1HE2      GLN  56   2.775 -10.329   6.994
  424   2HE2  GLN  56          2HE2      GLN  56   3.255 -11.803   6.166
  425    H    ALA  57           H        ALA  57   3.959  -5.605   3.586
  426    HA   ALA  57           HA       ALA  57   6.691  -4.955   3.601
  427   1HB   ALA  57          1HB       ALA  57   4.321  -3.855   2.048
  428   2HB   ALA  57          2HB       ALA  57   5.966  -3.295   1.800
  429   3HB   ALA  57          3HB       ALA  57   5.559  -5.010   1.531
  430    H    GLY  58           H        GLY  58   3.870  -2.850   4.511
  431   1HA   GLY  58          1HA       GLY  58   5.286  -0.486   4.970
  432   2HA   GLY  58          2HA       GLY  58   3.741  -0.966   5.707
  433    H    ALA  59           H        ALA  59   5.503  -3.433   6.831
  434    HA   ALA  59           HA       ALA  59   5.961  -2.575   9.421
  435   1HB   ALA  59          1HB       ALA  59   6.075  -4.919   8.726
  436   2HB   ALA  59          2HB       ALA  59   7.584  -4.596   7.832
  437   3HB   ALA  59          3HB       ALA  59   7.541  -4.447   9.600
  438    H    PHE  60           H        PHE  60   7.947  -1.769   6.561
  439    HA   PHE  60           HA       PHE  60  10.290  -1.008   7.947
  440   1HB   PHE  60          2HB       PHE  60  10.748   0.542   6.121
  441   2HB   PHE  60          3HB       PHE  60  10.370  -1.094   5.611
  442    HD1  PHE  60           1HD      PHE  60   8.824  -1.433   3.866
  443    HD2  PHE  60           2HD      PHE  60   8.888   2.370   5.900
  444    HE1  PHE  60           1HE      PHE  60   7.138  -0.550   2.297
  445    HE2  PHE  60           2HE      PHE  60   7.273   3.265   4.271
  446    HZ   PHE  60           HZ       PHE  60   6.432   1.852   2.434
  447    H    GLU  61           H        GLU  61   7.206   0.752   7.715
  448    HA   GLU  61           HA       GLU  61   8.288   2.757   9.685
  449   1HB   GLU  61          2HB       GLU  61   6.697   3.138   7.173
  450   2HB   GLU  61          3HB       GLU  61   6.291   4.149   8.566
  451   1HG   GLU  61          2HG       GLU  61   8.519   5.021   8.724
  452   2HG   GLU  61          3HG       GLU  61   9.113   3.934   7.465
  453    H    HIS  62           H        HIS  62   6.065   0.232   9.260
  454    HA   HIS  62           HA       HIS  62   4.564  -0.665  10.688
  455   1HB   HIS  62          2HB       HIS  62   5.002   1.543  12.716
  456   2HB   HIS  62          3HB       HIS  62   4.474  -0.111  12.980
  457    HD1  HIS  62           1HD      HIS  62   7.288  -1.095  11.156
  458    HD2  HIS  62           2HD      HIS  62   6.851   1.287  14.601
  459    HE1  HIS  62           1HE      HIS  62   9.488  -1.201  12.390
  460    H    LEU  63           H        LEU  63   3.481   0.717   8.626
  461    HA   LEU  63           HA       LEU  63   1.875   2.965   9.552
  462   1HB   LEU  63          2HB       LEU  63   1.680   1.349   6.968
  463   2HB   LEU  63          3HB       LEU  63   0.815   2.839   7.325
  464    HG   LEU  63           HG       LEU  63   2.453   3.633   6.068
  465   1HD1  LEU  63          1HD1      LEU  63   3.791   3.801   8.826
  466   2HD1  LEU  63          2HD1      LEU  63   4.104   4.864   7.477
  467   3HD1  LEU  63          3HD1      LEU  63   2.498   4.874   8.233
  468   1HD2  LEU  63          1HD2      LEU  63   4.603   1.932   7.355
  469   2HD2  LEU  63          2HD2      LEU  63   3.754   1.531   5.840
  470   3HD2  LEU  63          3HD2      LEU  63   4.756   2.985   5.943
  471    H    LYS  64           H        LYS  64  -0.521   3.077   9.037
  472    HA   LYS  64           HA       LYS  64  -1.911   0.637   9.963
  473   1HB   LYS  64          2HB       LYS  64  -3.432   2.240  11.276
  474   2HB   LYS  64          3HB       LYS  64  -1.900   1.697  11.951
  475   1HG   LYS  64          2HG       LYS  64  -1.758   3.851  12.568
  476   2HG   LYS  64          3HG       LYS  64  -0.938   3.988  11.037
  477   1HD   LYS  64          2HD       LYS  64  -2.364   5.675  10.683
  478   2HD   LYS  64          3HD       LYS  64  -3.513   4.416  10.209
  479   1HE   LYS  64          2HE       LYS  64  -4.390   4.366  12.567
  480   2HE   LYS  64          3HE       LYS  64  -3.232   5.638  13.007
  481   1HZ   LYS  64          1HZ       LYS  64  -5.377   6.574  12.570
  482   2HZ   LYS  64          2HZ       LYS  64  -4.309   7.107  11.454
  483   3HZ   LYS  64          3HZ       LYS  64  -5.395   5.969  11.036
  484    H    ILE  65           H        ILE  65  -3.451   0.125   8.594
  485    HA   ILE  65           HA       ILE  65  -4.467   2.142   6.708
  486    HB   ILE  65           HB       ILE  65  -3.718  -0.666   5.845
  487   1HG1  ILE  65          2HG1      ILE  65  -1.983   1.802   5.837
  488   2HG1  ILE  65          3HG1      ILE  65  -1.618   0.148   6.403
  489   1HG2  ILE  65          1HG2      ILE  65  -4.047   0.244   3.597
  490   2HG2  ILE  65          2HG2      ILE  65  -5.453   0.603   4.588
  491   3HG2  ILE  65          3HG2      ILE  65  -4.267   1.867   4.253
  492   1HD1  ILE  65          1HD1      ILE  65  -0.443   0.867   4.442
  493   2HD1  ILE  65          2HD1      ILE  65  -1.355  -0.649   4.200
  494   3HD1  ILE  65          3HD1      ILE  65  -1.924   0.896   3.505
  495    H    ILE  66           H        ILE  66  -6.611   1.993   6.346
  496    HA   ILE  66           HA       ILE  66  -8.090  -0.028   7.947
  497    HB   ILE  66           HB       ILE  66  -8.561   2.890   7.373
  498   1HG1  ILE  66          2HG1      ILE  66  -8.427   1.338  10.003
  499   2HG1  ILE  66          3HG1      ILE  66  -6.997   2.046   9.251
  500   1HG2  ILE  66          1HG2      ILE  66 -10.724   1.839   7.128
  501   2HG2  ILE  66          2HG2      ILE  66 -10.484   0.855   8.590
  502   3HG2  ILE  66          3HG2      ILE  66 -10.687   2.613   8.705
  503   1HD1  ILE  66          1HD1      ILE  66  -8.011   4.292   9.347
  504   2HD1  ILE  66          2HD1      ILE  66  -9.405   3.617  10.226
  505   3HD1  ILE  66          3HD1      ILE  66  -7.788   3.541  10.939
  506    HA   PRO  67           HA       PRO  67  -9.575  -1.166   3.795
  507   1HB   PRO  67          2HB       PRO  67 -10.902  -3.444   4.425
  508   2HB   PRO  67          3HB       PRO  67  -9.132  -3.362   4.621
  509   1HG   PRO  67          2HG       PRO  67 -11.209  -2.928   6.774
  510   2HG   PRO  67          3HG       PRO  67  -9.793  -4.019   6.819
  511   1HD   PRO  67          2HD       PRO  67  -9.747  -1.512   7.882
  512   2HD   PRO  67          3HD       PRO  67  -8.299  -2.209   7.088
  513    H    GLU  68           H        GLU  68 -10.699   0.950   4.099
  514    HA   GLU  68           HA       GLU  68 -12.317   2.326   4.406
  515   1HB   GLU  68          2HB       GLU  68 -14.163   2.061   3.129
  516   2HB   GLU  68          3HB       GLU  68 -12.940   1.157   2.282
  517   1HG   GLU  68          2HG       GLU  68 -13.893  -0.939   2.783
  518   2HG   GLU  68          3HG       GLU  68 -14.880  -0.314   4.107
  519    H    LYS  69           H        LYS  69 -15.062   2.066   5.012
  520    HA   LYS  69           HA       LYS  69 -16.330   2.368   6.785
  521   1HB   LYS  69          2HB       LYS  69 -15.303  -0.307   7.105
  522   2HB   LYS  69          3HB       LYS  69 -15.405   0.407   8.703
  523   1HG   LYS  69          2HG       LYS  69 -17.616   0.383   6.613
  524   2HG   LYS  69          3HG       LYS  69 -17.486  -0.825   7.880
  525   1HD   LYS  69          2HD       LYS  69 -17.672   2.128   8.653
  526   2HD   LYS  69          3HD       LYS  69 -19.098   1.266   8.103
  527   1HE   LYS  69          2HE       LYS  69 -19.046   1.223  10.504
  528   2HE   LYS  69          3HE       LYS  69 -18.857  -0.420   9.879
  529   1HZ   LYS  69          1HZ       LYS  69 -17.345   0.074  11.698
  530   2HZ   LYS  69          2HZ       LYS  69 -16.488  -0.221  10.323
  531   3HZ   LYS  69          3HZ       LYS  69 -16.674   1.316  10.871
  532    H    GLU  70           H        GLU  70 -16.219   4.137   8.052
  533    HA   GLU  70           HA       GLU  70 -14.064   5.053   9.577
  534   1HB   GLU  70          2HB       GLU  70 -17.085   5.178   9.980
  535   2HB   GLU  70          3HB       GLU  70 -15.939   6.030  11.020
  536   1HG   GLU  70          2HG       GLU  70 -16.815   7.522   9.277
  537   2HG   GLU  70          3HG       GLU  70 -15.068   7.312   9.132
  538    H    ALA  71           H        ALA  71 -13.257   4.547  11.602
  539    HA   ALA  71           HA       ALA  71 -13.817   1.809  12.563
  540   1HB   ALA  71          1HB       ALA  71 -11.494   2.448  12.061
  541   2HB   ALA  71          2HB       ALA  71 -11.607   3.807  13.205
  542   3HB   ALA  71          3HB       ALA  71 -11.708   2.135  13.797
  Start of MODEL   17
    1   1H    MET   1           H1       MET   1 -14.343 -14.046  -3.651
    2   2H    MET   1           H2       MET   1 -15.861 -14.156  -4.343
    3   3H    MET   1           H3       MET   1 -14.481 -14.202  -5.270
    4    HA   MET   1           HA       MET   1 -15.210 -12.024  -5.525
    5   1HB   MET   1          2HB       MET   1 -15.939 -12.394  -2.632
    6   2HB   MET   1          3HB       MET   1 -15.303 -10.807  -3.062
    7   1HG   MET   1          2HG       MET   1 -16.976 -10.503  -4.783
    8   2HG   MET   1          3HG       MET   1 -17.661 -12.108  -4.466
    9   1HE   MET   1          1HE       MET   1 -20.015 -10.775  -4.365
   10   2HE   MET   1          2HE       MET   1 -20.340  -9.477  -3.190
   11   3HE   MET   1          3HE       MET   1 -19.192  -9.201  -4.518
   12    H    ALA   2           H        ALA   2 -13.683 -10.261  -5.457
   13    HA   ALA   2           HA       ALA   2 -11.499 -10.066  -3.682
   14   1HB   ALA   2          1HB       ALA   2 -10.493 -12.005  -4.743
   15   2HB   ALA   2          2HB       ALA   2 -10.854 -11.391  -6.365
   16   3HB   ALA   2          3HB       ALA   2  -9.659 -10.567  -5.342
   17    H    GLU   3           H        GLU   3 -11.677  -9.689  -7.241
   18    HA   GLU   3           HA       GLU   3 -11.756  -7.919  -8.594
   19   1HB   GLU   3          2HB       GLU   3 -13.938  -7.670  -7.061
   20   2HB   GLU   3          3HB       GLU   3 -13.131  -6.216  -6.494
   21   1HG   GLU   3          2HG       GLU   3 -14.547  -5.560  -8.310
   22   2HG   GLU   3          3HG       GLU   3 -12.952  -5.620  -9.078
   23    H    LYS   4           H        LYS   4 -11.743  -5.084  -7.646
   24    HA   LYS   4           HA       LYS   4  -8.897  -4.809  -6.801
   25   1HB   LYS   4          2HB       LYS   4  -8.899  -2.646  -7.789
   26   2HB   LYS   4          3HB       LYS   4  -9.548  -3.773  -8.994
   27   1HG   LYS   4          2HG       LYS   4 -11.897  -2.954  -8.135
   28   2HG   LYS   4          3HG       LYS   4 -10.970  -1.654  -7.360
   29   1HD   LYS   4          2HD       LYS   4  -9.865  -1.385  -9.746
   30   2HD   LYS   4          3HD       LYS   4 -11.264  -2.327 -10.301
   31   1HE   LYS   4          2HE       LYS   4 -12.747  -0.580  -9.128
   32   2HE   LYS   4          3HE       LYS   4 -11.272   0.357  -8.826
   33   1HZ   LYS   4          1HZ       LYS   4 -12.373  -0.357 -11.463
   34   2HZ   LYS   4          2HZ       LYS   4 -12.352   1.137 -10.777
   35   3HZ   LYS   4          3HZ       LYS   4 -10.941   0.424 -11.232
   36    H    THR   5           H        THR   5  -8.539  -3.115  -5.083
   37    HA   THR   5           HA       THR   5 -10.947  -2.235  -3.658
   38    HB   THR   5           HB       THR   5  -8.986  -4.180  -2.307
   39    HG1  THR   5           1HG      THR   5 -11.353  -4.243  -3.543
   40   1HG2  THR   5          1HG2      THR   5 -11.375  -2.618  -1.177
   41   2HG2  THR   5          2HG2      THR   5 -10.536  -3.940  -0.350
   42   3HG2  THR   5          3HG2      THR   5  -9.684  -2.424  -0.667
   43    H    VAL   6           H        VAL   6 -10.541  -0.515  -2.324
   44    HA   VAL   6           HA       VAL   6  -7.779   0.174  -2.113
   45    HB   VAL   6           HB       VAL   6  -8.562   1.606  -3.818
   46   1HG1  VAL   6          1HG1      VAL   6 -10.516   3.042  -3.744
   47   2HG1  VAL   6          2HG1      VAL   6 -10.908   1.326  -3.734
   48   3HG1  VAL   6          3HG1      VAL   6 -11.025   2.265  -2.219
   49   1HG2  VAL   6          1HG2      VAL   6  -8.844   3.355  -1.320
   50   2HG2  VAL   6          2HG2      VAL   6  -7.293   2.903  -2.049
   51   3HG2  VAL   6          3HG2      VAL   6  -8.428   3.906  -2.953
   52    H    TYR   7           H        TYR   7  -7.108   1.238  -0.296
   53    HA   TYR   7           HA       TYR   7  -8.910   1.032   2.074
   54   1HB   TYR   7          2HB       TYR   7  -5.979   0.232   1.937
   55   2HB   TYR   7          3HB       TYR   7  -7.115  -0.034   3.251
   56    HD1  TYR   7           HD1      TYR   7  -8.061  -2.171   3.485
   57    HD2  TYR   7           HD2      TYR   7  -6.287  -1.064  -0.272
   58    HE1  TYR   7           HE1      TYR   7  -8.494  -4.447   2.617
   59    HE2  TYR   7           HE2      TYR   7  -6.601  -3.373  -1.094
   60    HH   TYR   7           HH       TYR   7  -8.408  -5.835   0.699
   61    H    ARG   8           H        ARG   8  -8.153   2.542   3.808
   62    HA   ARG   8           HA       ARG   8  -6.581   4.799   2.657
   63   1HB   ARG   8          2HB       ARG   8  -8.417   4.700   5.026
   64   2HB   ARG   8          3HB       ARG   8  -7.332   6.050   4.692
   65   1HG   ARG   8          2HG       ARG   8  -8.342   6.347   2.438
   66   2HG   ARG   8          3HG       ARG   8  -9.535   5.088   2.815
   67   1HD   ARG   8          2HD       ARG   8 -10.285   6.429   4.774
   68   2HD   ARG   8          3HD       ARG   8  -9.078   7.670   4.387
   69    HE   ARG   8           HE       ARG   8 -10.789   7.161   2.133
   70   1HH1  ARG   8          2HH2      ARG   8 -11.067   8.446   5.377
   71   2HH1  ARG   8          1HH2      ARG   8 -11.948   9.882   4.950
   72   1HH2  ARG   8          2HH1      ARG   8 -12.245   8.873   1.530
   73   2HH2  ARG   8          1HH1      ARG   8 -12.774  10.029   2.708
   74    H    VAL   9           H        VAL   9  -4.765   5.653   3.812
   75    HA   VAL   9           HA       VAL   9  -3.672   3.893   5.962
   76    HB   VAL   9           HB       VAL   9  -2.726   2.894   4.034
   77   1HG1  VAL   9          1HG1      VAL   9  -3.150   4.462   2.277
   78   2HG1  VAL   9          2HG1      VAL   9  -2.029   5.643   2.962
   79   3HG1  VAL   9          3HG1      VAL   9  -1.421   4.106   2.326
   80   1HG2  VAL   9          1HG2      VAL   9  -0.675   4.804   5.196
   81   2HG2  VAL   9          2HG2      VAL   9  -1.245   3.311   5.940
   82   3HG2  VAL   9          3HG2      VAL   9  -0.357   3.254   4.401
   83    H    ASP  10           H        ASP  10  -3.011   5.073   7.630
   84    HA   ASP  10           HA       ASP  10  -2.540   7.988   7.173
   85   1HB   ASP  10          2HB       ASP  10  -4.345   6.845   8.781
   86   2HB   ASP  10          3HB       ASP  10  -2.982   6.815   9.906
   87    H    GLY  11           H        GLY  11  -1.167   8.768   9.291
   88   1HA   GLY  11          1HA       GLY  11   0.727   8.758  10.557
   89   2HA   GLY  11          2HA       GLY  11   1.012   7.065  10.136
   90    H    LEU  12           H        LEU  12   1.312   7.190   7.428
   91    HA   LEU  12           HA       LEU  12   3.978   7.795   6.989
   92   1HB   LEU  12          2HB       LEU  12   3.378   7.720   4.533
   93   2HB   LEU  12          3HB       LEU  12   2.878   6.360   5.514
   94    HG   LEU  12           HG       LEU  12   0.515   7.393   5.618
   95   1HD1  LEU  12          1HD1      LEU  12   0.881   9.687   4.781
   96   2HD1  LEU  12          2HD1      LEU  12   1.739   9.057   3.356
   97   3HD1  LEU  12          3HD1      LEU  12   0.000   8.786   3.565
   98   1HD2  LEU  12          1HD2      LEU  12   1.244   5.442   4.250
   99   2HD2  LEU  12          2HD2      LEU  12  -0.016   6.428   3.462
  100   3HD2  LEU  12          3HD2      LEU  12   1.676   6.600   2.999
  101    H    SER  13           H        SER  13   5.111   9.362   5.693
  102    HA   SER  13           HA       SER  13   3.820  11.719   4.717
  103   1HB   SER  13          2HB       SER  13   3.915  12.107   7.310
  104   2HB   SER  13          3HB       SER  13   5.649  12.321   7.071
  105    HG   SER  13           HG       SER  13   4.327  14.258   6.938
  106    H    CYS  14           H        CYS  14   5.433   9.927   3.316
  107    HA   CYS  14           HA       CYS  14   7.561  11.769   2.509
  108   1HB   CYS  14          2HB       CYS  14   8.709  10.597   4.346
  109   2HB   CYS  14          3HB       CYS  14   8.289   9.035   3.625
  110    HG   CYS  14           HG       CYS  14  10.094  11.522   2.441
  111    H    THR  15           H        THR  15   7.345  11.839   0.316
  112    HA   THR  15           HA       THR  15   6.156   9.990  -1.333
  113    HB   THR  15           HB       THR  15   8.514  11.775  -2.057
  114    HG1  THR  15           1HG      THR  15   5.792  12.496  -1.746
  115   1HG2  THR  15          1HG2      THR  15   7.237  12.098  -4.157
  116   2HG2  THR  15          2HG2      THR  15   7.669  10.397  -3.920
  117   3HG2  THR  15          3HG2      THR  15   6.010  10.940  -3.601
  118    H    ASN  16           H        ASN  16   9.607  10.130  -0.345
  119    HA   ASN  16           HA       ASN  16  10.582   8.202  -2.095
  120   1HB   ASN  16          2HB       ASN  16  11.794   9.814  -0.426
  121   2HB   ASN  16          3HB       ASN  16  11.659   8.477   0.723
  122   1HD2  ASN  16          1HD2      ASN  16  13.682   9.879  -1.525
  123   2HD2  ASN  16          2HD2      ASN  16  14.643   8.476  -1.940
  124    H    CYS  17           H        CYS  17   8.920   7.940   1.014
  125    HA   CYS  17           HA       CYS  17   9.243   5.058   1.303
  126   1HB   CYS  17          2HB       CYS  17   7.481   7.105   2.706
  127   2HB   CYS  17          3HB       CYS  17   7.356   5.381   2.982
  128    HG   CYS  17           HG       CYS  17  10.041   7.274   3.246
  129    H    ALA  18           H        ALA  18   6.689   7.302   0.149
  130    HA   ALA  18           HA       ALA  18   4.670   5.515  -0.484
  131   1HB   ALA  18          1HB       ALA  18   3.863   7.095  -2.023
  132   2HB   ALA  18          2HB       ALA  18   4.803   8.083  -0.868
  133   3HB   ALA  18          3HB       ALA  18   5.460   7.692  -2.459
  134    H    ALA  19           H        ALA  19   7.488   6.389  -2.458
  135    HA   ALA  19           HA       ALA  19   6.916   4.782  -4.743
  136   1HB   ALA  19          1HB       ALA  19   8.609   6.583  -4.721
  137   2HB   ALA  19          2HB       ALA  19   9.633   5.626  -3.630
  138   3HB   ALA  19          3HB       ALA  19   9.308   5.046  -5.276
  139    H    LYS  20           H        LYS  20   8.903   4.113  -1.839
  140    HA   LYS  20           HA       LYS  20   9.618   1.461  -2.540
  141   1HB   LYS  20          2HB       LYS  20  10.537   3.015  -0.729
  142   2HB   LYS  20          3HB       LYS  20   9.208   2.483   0.294
  143   1HG   LYS  20          2HG       LYS  20   9.998   0.278   0.435
  144   2HG   LYS  20          3HG       LYS  20  10.985   0.389  -1.027
  145   1HD   LYS  20          2HD       LYS  20  11.535   2.066   1.443
  146   2HD   LYS  20          3HD       LYS  20  12.239   0.459   1.227
  147   1HE   LYS  20          2HE       LYS  20  13.650   1.091  -0.492
  148   2HE   LYS  20          3HE       LYS  20  12.588   2.358  -1.093
  149   1HZ   LYS  20          1HZ       LYS  20  13.202   3.743   0.727
  150   2HZ   LYS  20          2HZ       LYS  20  14.184   2.579   1.362
  151   3HZ   LYS  20          3HZ       LYS  20  14.538   3.263  -0.092
  152    H    PHE  21           H        PHE  21   6.752   2.784  -0.892
  153    HA   PHE  21           HA       PHE  21   5.493   0.348  -0.196
  154   1HB   PHE  21          2HB       PHE  21   4.861   2.907   0.223
  155   2HB   PHE  21          3HB       PHE  21   3.812   2.664  -1.151
  156    HD1  PHE  21           1HD      PHE  21   1.600   1.647  -0.709
  157    HD2  PHE  21           2HD      PHE  21   4.819   1.061   2.051
  158    HE1  PHE  21           1HE      PHE  21  -0.025   1.639   1.199
  159    HE2  PHE  21           2HE      PHE  21   3.177   0.937   3.935
  160    HZ   PHE  21           HZ       PHE  21   0.790   1.378   3.511
  161    H    GLU  22           H        GLU  22   4.965   2.410  -3.168
  162    HA   GLU  22           HA       GLU  22   3.182   0.581  -4.348
  163   1HB   GLU  22          2HB       GLU  22   3.120   1.879  -6.185
  164   2HB   GLU  22          3HB       GLU  22   3.839   3.055  -5.073
  165   1HG   GLU  22          2HG       GLU  22   5.972   2.836  -6.029
  166   2HG   GLU  22          3HG       GLU  22   5.492   1.441  -7.024
  167    H    ARG  23           H        ARG  23   6.704   0.854  -4.683
  168    HA   ARG  23           HA       ARG  23   6.990  -1.225  -6.590
  169   1HB   ARG  23          2HB       ARG  23   8.632   0.583  -5.932
  170   2HB   ARG  23          3HB       ARG  23   9.061  -0.381  -4.506
  171   1HG   ARG  23          2HG       ARG  23   9.822  -2.225  -5.953
  172   2HG   ARG  23          3HG       ARG  23   9.165  -1.403  -7.384
  173   1HD   ARG  23          2HD       ARG  23  10.696   0.524  -6.933
  174   2HD   ARG  23          3HD       ARG  23  11.485  -0.447  -5.660
  175    HE   ARG  23           HE       ARG  23  11.546  -2.110  -7.835
  176   1HH1  ARG  23          2HH2      ARG  23  12.693   1.164  -7.233
  177   2HH1  ARG  23          1HH2      ARG  23  13.844   1.193  -8.534
  178   1HH2  ARG  23          2HH1      ARG  23  13.059  -2.124  -9.589
  179   2HH2  ARG  23          1HH1      ARG  23  14.073  -0.751  -9.892
  180    H    ASN  24           H        ASN  24   7.207  -1.299  -2.981
  181    HA   ASN  24           HA       ASN  24   7.675  -4.077  -2.663
  182   1HB   ASN  24          2HB       ASN  24   6.104  -2.078  -0.973
  183   2HB   ASN  24          3HB       ASN  24   6.249  -3.787  -0.574
  184   1HD2  ASN  24          1HD2      ASN  24   7.116  -1.662   1.120
  185   2HD2  ASN  24          2HD2      ASN  24   8.757  -2.129   1.466
  186    H    VAL  25           H        VAL  25   4.549  -2.291  -3.104
  187    HA   VAL  25           HA       VAL  25   3.008  -4.662  -2.921
  188    HB   VAL  25           HB       VAL  25   2.212  -2.209  -4.540
  189   1HG1  VAL  25          1HG1      VAL  25   0.752  -4.112  -4.909
  190   2HG1  VAL  25          2HG1      VAL  25   0.625  -4.422  -3.165
  191   3HG1  VAL  25          3HG1      VAL  25  -0.083  -2.969  -3.841
  192   1HG2  VAL  25          1HG2      VAL  25   0.912  -1.942  -2.131
  193   2HG2  VAL  25          2HG2      VAL  25   2.476  -2.580  -1.594
  194   3HG2  VAL  25          3HG2      VAL  25   2.374  -1.094  -2.569
  195    H    LYS  26           H        LYS  26   4.346  -3.004  -5.793
  196    HA   LYS  26           HA       LYS  26   3.568  -4.865  -7.770
  197   1HB   LYS  26          2HB       LYS  26   5.745  -2.834  -7.411
  198   2HB   LYS  26          3HB       LYS  26   5.895  -3.931  -8.769
  199   1HG   LYS  26          2HG       LYS  26   3.974  -3.174  -9.796
  200   2HG   LYS  26          3HG       LYS  26   3.229  -2.597  -8.289
  201   1HD   LYS  26          2HD       LYS  26   4.528  -0.656  -8.186
  202   2HD   LYS  26          3HD       LYS  26   5.699  -1.236  -9.378
  203   1HE   LYS  26          2HE       LYS  26   4.430  -0.611 -11.171
  204   2HE   LYS  26          3HE       LYS  26   2.916  -1.149 -10.438
  205   1HZ   LYS  26          1HZ       LYS  26   2.770   0.862  -9.218
  206   2HZ   LYS  26          2HZ       LYS  26   4.215   1.410  -9.696
  207   3HZ   LYS  26          3HZ       LYS  26   3.013   1.244 -10.791
  208    H    GLU  27           H        GLU  27   6.308  -5.120  -5.457
  209    HA   GLU  27           HA       GLU  27   7.444  -7.434  -6.673
  210   1HB   GLU  27          2HB       GLU  27   7.540  -6.542  -3.787
  211   2HB   GLU  27          3HB       GLU  27   8.554  -7.784  -4.506
  212   1HG   GLU  27          2HG       GLU  27   8.601  -5.186  -5.989
  213   2HG   GLU  27          3HG       GLU  27   9.215  -5.125  -4.336
  214    H    ILE  28           H        ILE  28   4.460  -7.139  -4.788
  215    HA   ILE  28           HA       ILE  28   4.504  -9.863  -3.761
  216    HB   ILE  28           HB       ILE  28   2.218  -7.984  -4.233
  217   1HG1  ILE  28          2HG1      ILE  28   3.364  -8.457  -1.485
  218   2HG1  ILE  28          3HG1      ILE  28   3.985  -7.181  -2.541
  219   1HG2  ILE  28          1HG2      ILE  28   2.325 -10.685  -2.954
  220   2HG2  ILE  28          2HG2      ILE  28   1.234  -9.498  -2.246
  221   3HG2  ILE  28          3HG2      ILE  28   1.052  -9.906  -3.940
  222   1HD1  ILE  28          1HD1      ILE  28   1.694  -6.297  -2.860
  223   2HD1  ILE  28          2HD1      ILE  28   1.047  -7.432  -1.733
  224   3HD1  ILE  28          3HD1      ILE  28   2.214  -6.224  -1.158
  225    H    GLU  29           H        GLU  29   3.876 -11.694  -4.835
  226    HA   GLU  29           HA       GLU  29   3.294 -11.631  -7.649
  227   1HB   GLU  29          2HB       GLU  29   3.794 -13.723  -5.501
  228   2HB   GLU  29          3HB       GLU  29   3.098 -14.196  -7.035
  229   1HG   GLU  29          2HG       GLU  29   4.989 -13.218  -8.265
  230   2HG   GLU  29          3HG       GLU  29   5.716 -12.667  -6.744
  231    H    GLY  30           H        GLY  30   1.341 -11.567  -4.901
  232   1HA   GLY  30          1HA       GLY  30  -0.992 -12.942  -6.009
  233   2HA   GLY  30          2HA       GLY  30  -0.887 -12.081  -4.474
  234    H    VAL  31           H        VAL  31   0.227  -9.696  -6.466
  235    HA   VAL  31           HA       VAL  31  -2.478  -8.688  -7.018
  236    HB   VAL  31           HB       VAL  31  -1.368  -7.664  -5.081
  237   1HG1  VAL  31          1HG1      VAL  31   0.648  -6.481  -7.036
  238   2HG1  VAL  31          2HG1      VAL  31   0.573  -6.337  -5.264
  239   3HG1  VAL  31          3HG1      VAL  31   0.994  -7.879  -6.012
  240   1HG2  VAL  31          1HG2      VAL  31  -1.606  -5.881  -7.497
  241   2HG2  VAL  31          2HG2      VAL  31  -2.964  -6.422  -6.474
  242   3HG2  VAL  31          3HG2      VAL  31  -1.693  -5.351  -5.811
  243    H    THR  32           H        THR  32  -2.597  -7.305  -8.965
  244    HA   THR  32           HA       THR  32  -0.546  -7.984 -11.009
  245    HB   THR  32           HB       THR  32  -3.448  -7.144 -11.392
  246    HG1  THR  32           1HG      THR  32  -3.620  -9.360 -12.026
  247   1HG2  THR  32          1HG2      THR  32  -1.316  -8.107 -13.343
  248   2HG2  THR  32          2HG2      THR  32  -3.035  -7.868 -13.729
  249   3HG2  THR  32          3HG2      THR  32  -2.031  -6.484 -13.278
  250    H    GLU  33           H        GLU  33  -2.744  -5.374  -9.789
  251    HA   GLU  33           HA       GLU  33  -0.502  -3.455 -10.330
  252   1HB   GLU  33          2HB       GLU  33  -3.408  -3.016 -11.178
  253   2HB   GLU  33          3HB       GLU  33  -2.176  -1.757 -11.041
  254   1HG   GLU  33          2HG       GLU  33  -0.777  -3.306 -12.634
  255   2HG   GLU  33          3HG       GLU  33  -2.350  -4.012 -13.032
  256    H    ALA  34           H        ALA  34  -0.673  -1.472  -9.106
  257    HA   ALA  34           HA       ALA  34  -2.605  -1.370  -6.955
  258   1HB   ALA  34          1HB       ALA  34  -0.916  -2.837  -5.960
  259   2HB   ALA  34          2HB       ALA  34   0.381  -1.692  -6.380
  260   3HB   ALA  34          3HB       ALA  34  -0.852  -1.232  -5.183
  261    H    ILE  35           H        ILE  35  -2.873   0.755  -6.301
  262    HA   ILE  35           HA       ILE  35  -1.069   2.801  -7.595
  263    HB   ILE  35           HB       ILE  35  -4.097   2.978  -7.529
  264   1HG1  ILE  35          2HG1      ILE  35  -3.436   1.232  -9.153
  265   2HG1  ILE  35          3HG1      ILE  35  -4.193   2.640  -9.877
  266   1HG2  ILE  35          1HG2      ILE  35  -1.974   4.761  -8.772
  267   2HG2  ILE  35          2HG2      ILE  35  -3.727   4.917  -9.025
  268   3HG2  ILE  35          3HG2      ILE  35  -3.040   5.147  -7.411
  269   1HD1  ILE  35          1HD1      ILE  35  -1.178   2.184  -9.866
  270   2HD1  ILE  35          2HD1      ILE  35  -2.276   1.775 -11.190
  271   3HD1  ILE  35          3HD1      ILE  35  -2.066   3.466 -10.715
  272    H    VAL  36           H        VAL  36  -0.032   3.522  -5.778
  273    HA   VAL  36           HA       VAL  36  -1.671   4.033  -3.351
  274    HB   VAL  36           HB       VAL  36   0.253   2.595  -3.034
  275   1HG1  VAL  36          1HG1      VAL  36   1.976   4.956  -3.895
  276   2HG1  VAL  36          2HG1      VAL  36   2.520   3.401  -3.238
  277   3HG1  VAL  36          3HG1      VAL  36   1.712   3.462  -4.819
  278   1HG2  VAL  36          1HG2      VAL  36   1.251   3.812  -1.161
  279   2HG2  VAL  36          2HG2      VAL  36   0.685   5.343  -1.822
  280   3HG2  VAL  36          3HG2      VAL  36  -0.490   4.151  -1.217
  281    H    ASN  37           H        ASN  37  -1.848   6.042  -2.406
  282    HA   ASN  37           HA       ASN  37  -0.348   8.300  -3.635
  283   1HB   ASN  37          2HB       ASN  37  -3.349   8.214  -3.259
  284   2HB   ASN  37          3HB       ASN  37  -2.420   9.691  -3.563
  285   1HD2  ASN  37          1HD2      ASN  37  -1.205   9.798  -5.696
  286   2HD2  ASN  37          2HD2      ASN  37  -1.901   8.911  -7.037
  287    H    PHE  38           H        PHE  38   0.812   7.557  -1.686
  288    HA   PHE  38           HA       PHE  38   0.248   8.097   0.996
  289   1HB   PHE  38          2HB       PHE  38   2.630   8.639  -0.799
  290   2HB   PHE  38          3HB       PHE  38   2.619   9.271   0.830
  291    HD1  PHE  38           1HD      PHE  38   1.118   5.927   0.251
  292    HD2  PHE  38           2HD      PHE  38   4.434   8.205   1.767
  293    HE1  PHE  38           1HE      PHE  38   1.965   3.950   1.356
  294    HE2  PHE  38           2HE      PHE  38   5.166   6.248   3.033
  295    HZ   PHE  38           HZ       PHE  38   4.015   4.048   2.746
  296    H    GLY  39           H        GLY  39   0.553  10.398  -1.686
  297   1HA   GLY  39          1HA       GLY  39   1.037  12.716  -0.271
  298   2HA   GLY  39          2HA       GLY  39   0.125  12.636  -1.796
  299    H    ALA  40           H        ALA  40  -1.936  10.813  -0.280
  300    HA   ALA  40           HA       ALA  40  -2.973  12.762   1.722
  301   1HB   ALA  40          1HB       ALA  40  -4.513  12.910  -0.135
  302   2HB   ALA  40          2HB       ALA  40  -4.650  11.143  -0.227
  303   3HB   ALA  40          3HB       ALA  40  -5.267  12.020   1.200
  304    H    SER  41           H        SER  41  -4.543   9.643   1.229
  305    HA   SER  41           HA       SER  41  -2.911   8.272   3.140
  306   1HB   SER  41          2HB       SER  41  -5.742   9.190   3.922
  307   2HB   SER  41          3HB       SER  41  -4.652   8.242   4.926
  308    HG   SER  41           HG       SER  41  -3.230  10.272   4.491
  309    H    LYS  42           H        LYS  42  -3.397   7.375   0.582
  310    HA   LYS  42           HA       LYS  42  -5.544   5.368   0.892
  311   1HB   LYS  42          2HB       LYS  42  -6.339   6.067  -1.476
  312   2HB   LYS  42          3HB       LYS  42  -6.956   6.904  -0.049
  313   1HG   LYS  42          2HG       LYS  42  -5.630   8.810  -0.393
  314   2HG   LYS  42          3HG       LYS  42  -4.555   7.978  -1.523
  315   1HD   LYS  42          2HD       LYS  42  -6.345   7.862  -3.198
  316   2HD   LYS  42          3HD       LYS  42  -7.510   8.545  -2.040
  317   1HE   LYS  42          2HE       LYS  42  -6.219  10.662  -1.952
  318   2HE   LYS  42          3HE       LYS  42  -5.009   9.995  -3.059
  319   1HZ   LYS  42          1HZ       LYS  42  -7.839  10.497  -3.707
  320   2HZ   LYS  42          2HZ       LYS  42  -6.556  11.404  -4.186
  321   3HZ   LYS  42          3HZ       LYS  42  -6.722   9.867  -4.743
  322    H    ILE  43           H        ILE  43  -5.338   3.525  -0.197
  323    HA   ILE  43           HA       ILE  43  -3.224   3.244  -2.219
  324    HB   ILE  43           HB       ILE  43  -2.121   2.873  -0.131
  325   1HG1  ILE  43          2HG1      ILE  43  -1.482   1.488  -2.090
  326   2HG1  ILE  43          3HG1      ILE  43  -1.035   0.837  -0.517
  327   1HG2  ILE  43          1HG2      ILE  43  -4.148   0.734   0.564
  328   2HG2  ILE  43          2HG2      ILE  43  -2.647   1.097   1.432
  329   3HG2  ILE  43          3HG2      ILE  43  -3.933   2.301   1.358
  330   1HD1  ILE  43          1HD1      ILE  43  -1.693  -0.965  -1.863
  331   2HD1  ILE  43          2HD1      ILE  43  -2.936  -0.757  -0.624
  332   3HD1  ILE  43          3HD1      ILE  43  -3.224  -0.212  -2.287
  333    H    THR  44           H        THR  44  -4.046   2.267  -3.940
  334    HA   THR  44           HA       THR  44  -6.341   0.409  -3.652
  335    HB   THR  44           HB       THR  44  -5.227   1.730  -6.133
  336    HG1  THR  44           1HG      THR  44  -6.579   2.688  -4.203
  337   1HG2  THR  44          1HG2      THR  44  -7.734   0.064  -5.671
  338   2HG2  THR  44          2HG2      THR  44  -7.448   1.074  -7.101
  339   3HG2  THR  44          3HG2      THR  44  -6.389  -0.304  -6.775
  340    H    VAL  45           H        VAL  45  -6.200  -1.646  -4.258
  341    HA   VAL  45           HA       VAL  45  -3.657  -2.830  -5.280
  342    HB   VAL  45           HB       VAL  45  -5.704  -3.755  -3.266
  343   1HG1  VAL  45          1HG1      VAL  45  -4.947  -5.717  -4.639
  344   2HG1  VAL  45          2HG1      VAL  45  -3.267  -5.329  -4.193
  345   3HG1  VAL  45          3HG1      VAL  45  -4.426  -5.833  -2.957
  346   1HG2  VAL  45          1HG2      VAL  45  -3.737  -3.930  -1.689
  347   2HG2  VAL  45          2HG2      VAL  45  -2.767  -3.091  -2.920
  348   3HG2  VAL  45          3HG2      VAL  45  -4.179  -2.295  -2.176
  349    H    THR  46           H        THR  46  -4.070  -4.212  -7.076
  350    HA   THR  46           HA       THR  46  -6.871  -4.826  -7.842
  351    HB   THR  46           HB       THR  46  -4.857  -3.213  -9.486
  352    HG1  THR  46           1HG      THR  46  -6.773  -2.843  -7.755
  353   1HG2  THR  46          1HG2      THR  46  -7.629  -4.294 -10.225
  354   2HG2  THR  46          2HG2      THR  46  -6.754  -3.042 -11.131
  355   3HG2  THR  46          3HG2      THR  46  -6.103  -4.683 -11.043
  356    H    GLY  47           H        GLY  47  -6.339  -6.903  -7.342
  357   1HA   GLY  47          1HA       GLY  47  -5.158  -8.264  -9.608
  358   2HA   GLY  47          2HA       GLY  47  -4.099  -8.322  -8.239
  359    H    GLU  48           H        GLU  48  -4.402  -9.957  -6.716
  360    HA   GLU  48           HA       GLU  48  -7.101 -10.699  -5.919
  361   1HB   GLU  48          2HB       GLU  48  -6.408 -12.266  -7.891
  362   2HB   GLU  48          3HB       GLU  48  -5.263 -12.974  -6.743
  363   1HG   GLU  48          2HG       GLU  48  -7.260 -13.354  -5.182
  364   2HG   GLU  48          3HG       GLU  48  -8.303 -12.795  -6.503
  365    H    ALA  49           H        ALA  49  -5.538  -9.174  -4.427
  366    HA   ALA  49           HA       ALA  49  -4.748 -10.978  -2.232
  367   1HB   ALA  49          1HB       ALA  49  -2.644 -10.610  -3.446
  368   2HB   ALA  49          2HB       ALA  49  -2.897  -8.848  -3.393
  369   3HB   ALA  49          3HB       ALA  49  -2.626  -9.761  -1.893
  370    H    SER  50           H        SER  50  -4.346  -9.732  -0.238
  371    HA   SER  50           HA       SER  50  -6.284  -7.474   0.029
  372   1HB   SER  50          2HB       SER  50  -5.432  -9.692   1.945
  373   2HB   SER  50          3HB       SER  50  -6.405  -8.297   2.420
  374    HG   SER  50           HG       SER  50  -7.124 -10.025   0.284
  375    H    ILE  51           H        ILE  51  -5.720  -5.863   1.662
  376    HA   ILE  51           HA       ILE  51  -3.222  -4.843   1.400
  377    HB   ILE  51           HB       ILE  51  -5.343  -3.690   2.422
  378   1HG1  ILE  51          2HG1      ILE  51  -3.979  -2.212   3.771
  379   2HG1  ILE  51          3HG1      ILE  51  -2.592  -3.223   3.377
  380   1HG2  ILE  51          1HG2      ILE  51  -4.109  -4.592   5.040
  381   2HG2  ILE  51          2HG2      ILE  51  -5.580  -3.644   4.785
  382   3HG2  ILE  51          3HG2      ILE  51  -5.563  -5.359   4.343
  383   1HD1  ILE  51          1HD1      ILE  51  -2.630  -1.397   1.771
  384   2HD1  ILE  51          2HD1      ILE  51  -3.190  -2.797   0.870
  385   3HD1  ILE  51          3HD1      ILE  51  -4.358  -1.622   1.476
  386    H    GLN  52           H        GLN  52  -4.067  -7.282   3.751
  387    HA   GLN  52           HA       GLN  52  -2.140  -7.415   5.630
  388   1HB   GLN  52          2HB       GLN  52  -2.876  -9.556   3.602
  389   2HB   GLN  52          3HB       GLN  52  -1.975  -9.901   5.082
  390   1HG   GLN  52          2HG       GLN  52  -3.799  -9.523   6.476
  391   2HG   GLN  52          3HG       GLN  52  -4.615  -8.451   5.339
  392   1HE2  GLN  52          1HE2      GLN  52  -6.604  -9.463   5.013
  393   2HE2  GLN  52          2HE2      GLN  52  -6.725 -11.094   4.384
  394    H    GLN  53           H        GLN  53  -1.482  -8.168   2.195
  395    HA   GLN  53           HA       GLN  53   1.318  -8.779   2.534
  396   1HB   GLN  53          2HB       GLN  53  -0.212  -7.772   0.121
  397   2HB   GLN  53          3HB       GLN  53   1.381  -8.560   0.102
  398   1HG   GLN  53          2HG       GLN  53  -0.848 -10.142   1.376
  399   2HG   GLN  53          3HG       GLN  53  -0.997  -9.795  -0.344
  400   1HE2  GLN  53          1HE2      GLN  53  -0.733 -11.958  -1.003
  401   2HE2  GLN  53          2HE2      GLN  53   0.822 -12.752  -0.868
  402    H    VAL  54           H        VAL  54  -0.444  -5.793   1.724
  403    HA   VAL  54           HA       VAL  54   1.919  -4.200   1.184
  404    HB   VAL  54           HB       VAL  54  -0.954  -3.312   1.676
  405   1HG1  VAL  54          1HG1      VAL  54   0.579  -1.452   1.899
  406   2HG1  VAL  54          2HG1      VAL  54   1.419  -1.902   0.406
  407   3HG1  VAL  54          3HG1      VAL  54  -0.260  -1.325   0.354
  408   1HG2  VAL  54          1HG2      VAL  54   0.480  -4.082  -0.887
  409   2HG2  VAL  54          2HG2      VAL  54  -0.961  -4.861  -0.204
  410   3HG2  VAL  54          3HG2      VAL  54  -1.072  -3.217  -0.833
  411    H    GLU  55           H        GLU  55  -0.184  -4.952   3.949
  412    HA   GLU  55           HA       GLU  55   0.748  -2.991   5.757
  413   1HB   GLU  55          2HB       GLU  55  -1.271  -4.601   5.882
  414   2HB   GLU  55          3HB       GLU  55  -0.135  -5.795   6.535
  415   1HG   GLU  55          2HG       GLU  55  -0.613  -3.004   7.661
  416   2HG   GLU  55          3HG       GLU  55  -1.394  -4.481   8.248
  417    H    GLN  56           H        GLN  56   1.780  -6.428   5.131
  418    HA   GLN  56           HA       GLN  56   4.011  -6.503   6.740
  419   1HB   GLN  56          2HB       GLN  56   2.946  -8.352   5.307
  420   2HB   GLN  56          3HB       GLN  56   3.875  -7.709   3.949
  421   1HG   GLN  56          2HG       GLN  56   5.111  -9.497   4.829
  422   2HG   GLN  56          3HG       GLN  56   5.961  -8.007   5.274
  423   1HE2  GLN  56          1HE2      GLN  56   6.948  -8.508   7.261
  424   2HE2  GLN  56          2HE2      GLN  56   6.079  -9.213   8.613
  425    H    ALA  57           H        ALA  57   3.929  -5.361   3.278
  426    HA   ALA  57           HA       ALA  57   6.550  -4.325   3.097
  427   1HB   ALA  57          1HB       ALA  57   3.947  -3.227   1.950
  428   2HB   ALA  57          2HB       ALA  57   5.556  -2.780   1.447
  429   3HB   ALA  57          3HB       ALA  57   4.989  -4.452   1.219
  430    H    GLY  58           H        GLY  58   3.613  -2.702   4.410
  431   1HA   GLY  58          1HA       GLY  58   4.731  -0.248   4.955
  432   2HA   GLY  58          2HA       GLY  58   3.298  -0.963   5.726
  433    H    ALA  59           H        ALA  59   5.033  -3.290   6.741
  434    HA   ALA  59           HA       ALA  59   5.772  -2.452   9.258
  435   1HB   ALA  59          1HB       ALA  59   7.183  -4.383   9.428
  436   2HB   ALA  59          2HB       ALA  59   5.749  -4.819   8.476
  437   3HB   ALA  59          3HB       ALA  59   7.315  -4.524   7.668
  438    H    PHE  60           H        PHE  60   7.671  -1.938   6.250
  439    HA   PHE  60           HA       PHE  60  10.106  -1.251   7.456
  440   1HB   PHE  60          2HB       PHE  60  10.768  -0.202   5.548
  441   2HB   PHE  60          3HB       PHE  60   9.662  -1.446   4.978
  442    HD1  PHE  60           1HD      PHE  60   7.018  -0.101   5.303
  443    HD2  PHE  60           2HD      PHE  60  10.741   1.647   4.093
  444    HE1  PHE  60           1HE      PHE  60   5.802   1.463   3.905
  445    HE2  PHE  60           2HE      PHE  60   9.513   3.231   2.656
  446    HZ   PHE  60           HZ       PHE  60   7.029   3.051   2.417
  447    H    GLU  61           H        GLU  61   7.148   0.701   7.300
  448    HA   GLU  61           HA       GLU  61   8.495   2.837   8.890
  449   1HB   GLU  61          2HB       GLU  61   7.878   3.088   6.215
  450   2HB   GLU  61          3HB       GLU  61   6.395   3.682   6.964
  451   1HG   GLU  61          2HG       GLU  61   7.811   5.560   6.612
  452   2HG   GLU  61          3HG       GLU  61   7.863   5.242   8.352
  453    H    HIS  62           H        HIS  62   6.155   0.513   9.019
  454    HA   HIS  62           HA       HIS  62   4.579   0.037  10.549
  455   1HB   HIS  62          2HB       HIS  62   5.692   2.425  12.070
  456   2HB   HIS  62          3HB       HIS  62   4.667   1.151  12.730
  457    HD1  HIS  62           1HD      HIS  62   6.647  -1.064  10.907
  458    HD2  HIS  62           2HD      HIS  62   7.543   1.677  13.973
  459    HE1  HIS  62           1HE      HIS  62   8.700  -1.948  12.082
  460    H    LEU  63           H        LEU  63   3.354   1.024   8.470
  461    HA   LEU  63           HA       LEU  63   1.762   3.386   9.250
  462   1HB   LEU  63          2HB       LEU  63   1.402   1.636   6.804
  463   2HB   LEU  63          3HB       LEU  63   0.704   3.219   7.138
  464    HG   LEU  63           HG       LEU  63   2.348   3.693   5.665
  465   1HD1  LEU  63          1HD1      LEU  63   2.422   5.217   7.621
  466   2HD1  LEU  63          2HD1      LEU  63   3.681   4.221   8.375
  467   3HD1  LEU  63          3HD1      LEU  63   4.029   5.050   6.868
  468   1HD2  LEU  63          1HD2      LEU  63   3.553   1.433   6.027
  469   2HD2  LEU  63          2HD2      LEU  63   4.522   2.831   5.510
  470   3HD2  LEU  63          3HD2      LEU  63   4.556   2.290   7.194
  471    H    LYS  64           H        LYS  64  -0.734   2.992   8.525
  472    HA   LYS  64           HA       LYS  64  -1.843   0.667   9.947
  473   1HB   LYS  64          2HB       LYS  64  -3.277   2.134  11.311
  474   2HB   LYS  64          3HB       LYS  64  -1.594   2.077  11.817
  475   1HG   LYS  64          2HG       LYS  64  -2.729   4.328  10.121
  476   2HG   LYS  64          3HG       LYS  64  -2.823   4.348  11.856
  477   1HD   LYS  64          2HD       LYS  64  -0.076   4.053  10.526
  478   2HD   LYS  64          3HD       LYS  64  -0.954   5.520  10.488
  479   1HE   LYS  64          2HE       LYS  64   0.374   5.786  12.390
  480   2HE   LYS  64          3HE       LYS  64  -1.117   5.205  13.129
  481   1HZ   LYS  64          1HZ       LYS  64  -0.114   2.976  13.100
  482   2HZ   LYS  64          2HZ       LYS  64   1.279   3.573  12.455
  483   3HZ   LYS  64          3HZ       LYS  64   0.799   4.040  13.958
  484    H    ILE  65           H        ILE  65  -2.435   0.078   8.004
  485    HA   ILE  65           HA       ILE  65  -4.138   1.748   6.317
  486    HB   ILE  65           HB       ILE  65  -3.536  -1.140   5.703
  487   1HG1  ILE  65          2HG1      ILE  65  -1.624   1.176   5.320
  488   2HG1  ILE  65          3HG1      ILE  65  -1.407  -0.355   6.214
  489   1HG2  ILE  65          1HG2      ILE  65  -5.163  -0.104   4.308
  490   2HG2  ILE  65          2HG2      ILE  65  -4.226   1.377   4.109
  491   3HG2  ILE  65          3HG2      ILE  65  -3.686  -0.091   3.339
  492   1HD1  ILE  65          1HD1      ILE  65  -1.473  -1.585   4.099
  493   2HD1  ILE  65          2HD1      ILE  65  -1.431  -0.021   3.231
  494   3HD1  ILE  65          3HD1      ILE  65  -0.107  -0.514   4.301
  495    H    ILE  66           H        ILE  66  -6.375   1.581   6.161
  496    HA   ILE  66           HA       ILE  66  -7.724  -0.654   7.599
  497    HB   ILE  66           HB       ILE  66  -8.508   2.283   7.658
  498   1HG1  ILE  66          2HG1      ILE  66  -8.162   1.464  10.292
  499   2HG1  ILE  66          3HG1      ILE  66  -6.859   0.598   9.491
  500   1HG2  ILE  66          1HG2      ILE  66 -10.239   1.634   9.235
  501   2HG2  ILE  66          2HG2      ILE  66 -10.485   0.780   7.715
  502   3HG2  ILE  66          3HG2      ILE  66  -9.774  -0.071   9.109
  503   1HD1  ILE  66          1HD1      ILE  66  -7.416   3.597   9.465
  504   2HD1  ILE  66          2HD1      ILE  66  -6.047   2.764  10.228
  505   3HD1  ILE  66          3HD1      ILE  66  -6.171   2.838   8.456
  506    HA   PRO  67           HA       PRO  67  -9.932  -0.754   3.619
  507   1HB   PRO  67          2HB       PRO  67 -11.819  -2.640   4.168
  508   2HB   PRO  67          3HB       PRO  67 -10.102  -3.062   4.032
  509   1HG   PRO  67          2HG       PRO  67 -11.634  -2.482   6.573
  510   2HG   PRO  67          3HG       PRO  67 -10.608  -3.904   6.216
  511   1HD   PRO  67          2HD       PRO  67  -9.659  -1.783   7.591
  512   2HD   PRO  67          3HD       PRO  67  -8.619  -2.614   6.400
  513    H    GLU  68           H        GLU  68 -10.369   1.560   4.605
  514    HA   GLU  68           HA       GLU  68 -12.986   2.194   5.545
  515   1HB   GLU  68          2HB       GLU  68 -10.858   3.651   3.970
  516   2HB   GLU  68          3HB       GLU  68 -12.407   4.425   4.326
  517   1HG   GLU  68          2HG       GLU  68 -11.109   3.146   6.699
  518   2HG   GLU  68          3HG       GLU  68 -10.244   4.517   6.035
  519    H    LYS  69           H        LYS  69 -14.893   2.776   4.385
  520    HA   LYS  69           HA       LYS  69 -14.942   2.702   1.515
  521   1HB   LYS  69          2HB       LYS  69 -15.520   0.237   2.927
  522   2HB   LYS  69          3HB       LYS  69 -17.072   0.936   2.473
  523   1HG   LYS  69          2HG       LYS  69 -15.799   1.285   0.133
  524   2HG   LYS  69          3HG       LYS  69 -14.790  -0.024   0.725
  525   1HD   LYS  69          2HD       LYS  69 -16.762  -1.492   0.904
  526   2HD   LYS  69          3HD       LYS  69 -17.844  -0.099   0.664
  527   1HE   LYS  69          2HE       LYS  69 -16.607   0.202  -1.632
  528   2HE   LYS  69          3HE       LYS  69 -16.128  -1.491  -1.412
  529   1HZ   LYS  69          1HZ       LYS  69 -18.789  -0.255  -1.584
  530   2HZ   LYS  69          2HZ       LYS  69 -18.152  -1.323  -2.637
  531   3HZ   LYS  69          3HZ       LYS  69 -18.620  -1.851  -1.137
  532    H    GLU  70           H        GLU  70 -17.223   3.305   0.766
  533    HA   GLU  70           HA       GLU  70 -18.851   4.796   2.720
  534   1HB   GLU  70          2HB       GLU  70 -16.932   6.122   0.768
  535   2HB   GLU  70          3HB       GLU  70 -18.508   6.867   1.071
  536   1HG   GLU  70          2HG       GLU  70 -16.663   6.186   3.385
  537   2HG   GLU  70          3HG       GLU  70 -16.522   7.685   2.467
  538    H    ALA  71           H        ALA  71 -18.022   4.906  -0.693
  539    HA   ALA  71           HA       ALA  71 -20.499   3.528  -1.563
  540   1HB   ALA  71          1HB       ALA  71 -19.557   5.365  -2.991
  541   2HB   ALA  71          2HB       ALA  71 -18.034   4.463  -3.113
  542   3HB   ALA  71          3HB       ALA  71 -19.530   3.788  -3.802
  Start of MODEL   18
    1   1H    MET   1           H1       MET   1 -11.302 -13.245  -8.953
    2   2H    MET   1           H2       MET   1 -12.551 -14.350  -9.017
    3   3H    MET   1           H3       MET   1 -12.841 -12.712  -8.844
    4    HA   MET   1           HA       MET   1 -13.047 -13.513  -6.675
    5   1HB   MET   1          2HB       MET   1 -10.799 -15.225  -7.634
    6   2HB   MET   1          3HB       MET   1 -10.673 -14.730  -5.953
    7   1HG   MET   1          2HG       MET   1 -13.311 -15.902  -6.816
    8   2HG   MET   1          3HG       MET   1 -11.896 -16.948  -6.825
    9   1HE   MET   1          1HE       MET   1 -13.600 -15.115  -2.964
   10   2HE   MET   1          2HE       MET   1 -12.933 -14.075  -4.234
   11   3HE   MET   1          3HE       MET   1 -14.416 -15.017  -4.541
   12    H    ALA   2           H        ALA   2 -11.771 -12.575  -4.811
   13    HA   ALA   2           HA       ALA   2 -11.142 -10.504  -4.032
   14   1HB   ALA   2          1HB       ALA   2  -9.424 -12.127  -3.488
   15   2HB   ALA   2          2HB       ALA   2  -8.589 -11.793  -5.012
   16   3HB   ALA   2          3HB       ALA   2  -8.695 -10.532  -3.770
   17    H    GLU   3           H        GLU   3 -12.342  -9.440  -5.860
   18    HA   GLU   3           HA       GLU   3 -11.003  -8.109  -7.972
   19   1HB   GLU   3          2HB       GLU   3 -13.576  -7.728  -6.420
   20   2HB   GLU   3          3HB       GLU   3 -13.082  -6.453  -7.521
   21   1HG   GLU   3          2HG       GLU   3 -13.027  -7.915  -9.412
   22   2HG   GLU   3          3HG       GLU   3 -13.249  -9.355  -8.399
   23    H    LYS   4           H        LYS   4 -11.156  -5.618  -7.979
   24    HA   LYS   4           HA       LYS   4  -8.838  -4.876  -6.500
   25   1HB   LYS   4          2HB       LYS   4  -9.110  -2.701  -7.700
   26   2HB   LYS   4          3HB       LYS   4  -9.184  -4.131  -8.746
   27   1HG   LYS   4          2HG       LYS   4 -11.794  -3.856  -8.542
   28   2HG   LYS   4          3HG       LYS   4 -11.427  -2.255  -7.906
   29   1HD   LYS   4          2HD       LYS   4 -10.212  -1.681  -9.962
   30   2HD   LYS   4          3HD       LYS   4 -10.324  -3.357 -10.533
   31   1HE   LYS   4          2HE       LYS   4 -12.867  -3.122 -10.490
   32   2HE   LYS   4          3HE       LYS   4 -12.633  -1.388 -10.206
   33   1HZ   LYS   4          1HZ       LYS   4 -12.946  -1.909 -12.525
   34   2HZ   LYS   4          2HZ       LYS   4 -11.429  -1.308 -12.305
   35   3HZ   LYS   4          3HZ       LYS   4 -11.656  -2.924 -12.532
   36    H    THR   5           H        THR   5  -8.525  -3.330  -4.877
   37    HA   THR   5           HA       THR   5 -10.903  -2.019  -3.696
   38    HB   THR   5           HB       THR   5  -9.182  -4.042  -2.162
   39    HG1  THR   5           1HG      THR   5 -11.486  -3.943  -3.486
   40   1HG2  THR   5          1HG2      THR   5 -10.691  -3.525  -0.246
   41   2HG2  THR   5          2HG2      THR   5  -9.722  -2.106  -0.659
   42   3HG2  THR   5          3HG2      THR   5 -11.422  -2.197  -1.164
   43    H    VAL   6           H        VAL   6 -10.435  -0.190  -2.630
   44    HA   VAL   6           HA       VAL   6  -7.639   0.288  -2.220
   45    HB   VAL   6           HB       VAL   6  -8.144   1.711  -3.974
   46   1HG1  VAL   6          1HG1      VAL   6 -10.749   2.541  -2.737
   47   2HG1  VAL   6          2HG1      VAL   6  -9.997   3.230  -4.205
   48   3HG1  VAL   6          3HG1      VAL   6 -10.477   1.537  -4.194
   49   1HG2  VAL   6          1HG2      VAL   6  -8.639   3.561  -1.595
   50   2HG2  VAL   6          2HG2      VAL   6  -7.041   2.970  -2.076
   51   3HG2  VAL   6          3HG2      VAL   6  -7.958   4.011  -3.170
   52    H    TYR   7           H        TYR   7  -6.953   1.072  -0.373
   53    HA   TYR   7           HA       TYR   7  -8.914   1.135   1.891
   54   1HB   TYR   7          2HB       TYR   7  -6.015   0.224   1.916
   55   2HB   TYR   7          3HB       TYR   7  -7.179   0.136   3.229
   56    HD1  TYR   7           HD1      TYR   7  -6.531  -1.200  -0.252
   57    HD2  TYR   7           HD2      TYR   7  -8.087  -1.944   3.691
   58    HE1  TYR   7           HE1      TYR   7  -6.879  -3.560  -0.838
   59    HE2  TYR   7           HE2      TYR   7  -8.457  -4.316   3.090
   60    HH   TYR   7           HH       TYR   7  -7.768  -5.651  -0.088
   61    H    ARG   8           H        ARG   8  -7.998   2.529   3.734
   62    HA   ARG   8           HA       ARG   8  -6.612   4.894   2.540
   63   1HB   ARG   8          2HB       ARG   8  -8.543   4.684   4.873
   64   2HB   ARG   8          3HB       ARG   8  -7.628   6.138   4.425
   65   1HG   ARG   8          2HG       ARG   8  -8.600   5.954   2.076
   66   2HG   ARG   8          3HG       ARG   8  -9.601   4.619   2.651
   67   1HD   ARG   8          2HD       ARG   8 -10.827   6.681   2.591
   68   2HD   ARG   8          3HD       ARG   8 -10.689   6.105   4.277
   69    HE   ARG   8           HE       ARG   8  -8.579   7.948   3.595
   70   1HH1  ARG   8          2HH2      ARG   8 -12.078   7.903   4.099
   71   2HH1  ARG   8          1HH2      ARG   8 -12.147   9.347   5.058
   72   1HH2  ARG   8          2HH1      ARG   8  -8.644  10.036   4.652
   73   2HH2  ARG   8          1HH1      ARG   8 -10.157  10.683   5.204
   74    H    VAL   9           H        VAL   9  -4.717   5.656   3.394
   75    HA   VAL   9           HA       VAL   9  -3.562   4.036   5.648
   76    HB   VAL   9           HB       VAL   9  -2.453   3.235   3.737
   77   1HG1  VAL   9          1HG1      VAL   9  -2.112   6.110   2.764
   78   2HG1  VAL   9          2HG1      VAL   9  -1.447   4.659   1.997
   79   3HG1  VAL   9          3HG1      VAL   9  -3.183   4.883   2.046
   80   1HG2  VAL   9          1HG2      VAL   9  -0.185   3.866   4.080
   81   2HG2  VAL   9          2HG2      VAL   9  -0.633   5.447   4.742
   82   3HG2  VAL   9          3HG2      VAL   9  -1.003   3.959   5.644
   83    H    ASP  10           H        ASP  10  -2.415   5.205   7.246
   84    HA   ASP  10           HA       ASP  10  -1.973   8.062   6.672
   85   1HB   ASP  10          2HB       ASP  10  -4.335   7.611   7.786
   86   2HB   ASP  10          3HB       ASP  10  -3.403   7.423   9.266
   87    H    GLY  11           H        GLY  11  -0.799   9.060   8.523
   88   1HA   GLY  11          1HA       GLY  11   1.167   9.213   9.707
   89   2HA   GLY  11          2HA       GLY  11   0.681   7.683  10.447
   90    H    LEU  12           H        LEU  12   2.137   8.922   7.384
   91    HA   LEU  12           HA       LEU  12   4.264   6.873   7.538
   92   1HB   LEU  12          2HB       LEU  12   4.123   6.481   5.177
   93   2HB   LEU  12          3HB       LEU  12   2.544   6.180   5.891
   94    HG   LEU  12           HG       LEU  12   2.184   7.110   3.858
   95   1HD1  LEU  12          1HD1      LEU  12   1.617   9.478   5.607
   96   2HD1  LEU  12          2HD1      LEU  12   0.773   8.919   4.159
   97   3HD1  LEU  12          3HD1      LEU  12   0.706   7.933   5.632
   98   1HD2  LEU  12          1HD2      LEU  12   4.439   8.179   3.531
   99   2HD2  LEU  12          2HD2      LEU  12   3.059   9.091   2.901
  100   3HD2  LEU  12          3HD2      LEU  12   3.810   9.610   4.399
  101    H    SER  13           H        SER  13   6.204   7.576   6.192
  102    HA   SER  13           HA       SER  13   6.950  10.218   6.888
  103   1HB   SER  13          2HB       SER  13   8.209   8.114   5.116
  104   2HB   SER  13          3HB       SER  13   8.898   9.745   5.255
  105    HG   SER  13           HG       SER  13   8.914   7.702   7.061
  106    H    CYS  14           H        CYS  14   6.987   9.199   3.385
  107    HA   CYS  14           HA       CYS  14   5.268  11.245   2.520
  108   1HB   CYS  14          2HB       CYS  14   7.556  12.474   3.460
  109   2HB   CYS  14          3HB       CYS  14   8.038  12.196   1.796
  110    HG   CYS  14           HG       CYS  14   6.134  13.523   0.691
  111    H    THR  15           H        THR  15   6.354  11.877   0.032
  112    HA   THR  15           HA       THR  15   5.667   9.807  -1.526
  113    HB   THR  15           HB       THR  15   5.929  12.162  -2.203
  114    HG1  THR  15           1HG      THR  15   6.981  10.138  -3.874
  115   1HG2  THR  15          1HG2      THR  15   8.843  11.462  -2.781
  116   2HG2  THR  15          2HG2      THR  15   7.997  12.970  -3.146
  117   3HG2  THR  15          3HG2      THR  15   8.304  12.525  -1.458
  118    H    ASN  16           H        ASN  16   8.974  10.383  -0.324
  119    HA   ASN  16           HA       ASN  16  10.396   8.520  -1.780
  120   1HB   ASN  16          2HB       ASN  16  10.682   9.142   1.195
  121   2HB   ASN  16          3HB       ASN  16  11.903   8.375   0.175
  122   1HD2  ASN  16          1HD2      ASN  16  10.588  11.427   1.231
  123   2HD2  ASN  16          2HD2      ASN  16  11.522  12.417   0.129
  124    H    CYS  17           H        CYS  17   8.439   8.011   1.161
  125    HA   CYS  17           HA       CYS  17   8.895   5.105   1.223
  126   1HB   CYS  17          2HB       CYS  17   7.266   7.063   2.838
  127   2HB   CYS  17          3HB       CYS  17   6.937   5.322   2.918
  128    HG   CYS  17           HG       CYS  17   9.958   6.578   3.164
  129    H    ALA  18           H        ALA  18   6.460   7.417  -0.001
  130    HA   ALA  18           HA       ALA  18   4.421   5.571  -0.580
  131   1HB   ALA  18          1HB       ALA  18   4.387   8.101  -0.978
  132   2HB   ALA  18          2HB       ALA  18   5.170   7.773  -2.537
  133   3HB   ALA  18          3HB       ALA  18   3.589   7.075  -2.194
  134    H    ALA  19           H        ALA  19   7.291   6.479  -2.445
  135    HA   ALA  19           HA       ALA  19   6.861   4.822  -4.733
  136   1HB   ALA  19          1HB       ALA  19   8.497   6.672  -4.690
  137   2HB   ALA  19          2HB       ALA  19   9.500   5.778  -3.529
  138   3HB   ALA  19          3HB       ALA  19   9.259   5.140  -5.165
  139    H    LYS  20           H        LYS  20   8.785   4.313  -1.735
  140    HA   LYS  20           HA       LYS  20   9.562   1.667  -2.254
  141   1HB   LYS  20          2HB       LYS  20  10.377   3.122  -0.416
  142   2HB   LYS  20          3HB       LYS  20   8.879   2.828   0.482
  143   1HG   LYS  20          2HG       LYS  20   9.414   0.624   0.959
  144   2HG   LYS  20          3HG       LYS  20  10.386   0.405  -0.495
  145   1HD   LYS  20          2HD       LYS  20  12.167   1.811   0.397
  146   2HD   LYS  20          3HD       LYS  20  11.209   2.172   1.854
  147   1HE   LYS  20          2HE       LYS  20  11.302  -0.138   2.584
  148   2HE   LYS  20          3HE       LYS  20  12.005  -0.669   1.048
  149   1HZ   LYS  20          1HZ       LYS  20  13.343   1.124   2.967
  150   2HZ   LYS  20          2HZ       LYS  20  13.653  -0.482   2.781
  151   3HZ   LYS  20          3HZ       LYS  20  13.977   0.562   1.555
  152    H    PHE  21           H        PHE  21   6.504   2.892  -0.867
  153    HA   PHE  21           HA       PHE  21   5.421   0.341  -0.277
  154   1HB   PHE  21          2HB       PHE  21   4.660   2.786   0.418
  155   2HB   PHE  21          3HB       PHE  21   3.659   2.687  -1.015
  156    HD1  PHE  21           1HD      PHE  21   4.572   0.221   1.759
  157    HD2  PHE  21           2HD      PHE  21   1.393   2.213  -0.364
  158    HE1  PHE  21           1HE      PHE  21   3.001  -0.298   3.570
  159    HE2  PHE  21           2HE      PHE  21  -0.058   1.981   1.643
  160    HZ   PHE  21           HZ       PHE  21   0.902   1.027   3.727
  161    H    GLU  22           H        GLU  22   4.808   2.490  -3.150
  162    HA   GLU  22           HA       GLU  22   3.077   0.651  -4.395
  163   1HB   GLU  22          2HB       GLU  22   3.098   1.963  -6.258
  164   2HB   GLU  22          3HB       GLU  22   3.668   3.128  -5.056
  165   1HG   GLU  22          2HG       GLU  22   5.923   2.946  -5.812
  166   2HG   GLU  22          3HG       GLU  22   5.498   1.666  -6.971
  167    H    ARG  23           H        ARG  23   6.608   1.010  -4.610
  168    HA   ARG  23           HA       ARG  23   7.076  -1.037  -6.514
  169   1HB   ARG  23          2HB       ARG  23   8.684   0.803  -5.556
  170   2HB   ARG  23          3HB       ARG  23   8.944  -0.303  -4.206
  171   1HG   ARG  23          2HG       ARG  23  10.677  -0.950  -5.570
  172   2HG   ARG  23          3HG       ARG  23   9.432  -2.051  -6.175
  173   1HD   ARG  23          2HD       ARG  23   8.884  -0.360  -7.966
  174   2HD   ARG  23          3HD       ARG  23  10.213   0.652  -7.337
  175    HE   ARG  23           HE       ARG  23  11.065  -2.047  -7.922
  176   1HH1  ARG  23          2HH2      ARG  23  10.346   1.053  -9.430
  177   2HH1  ARG  23          1HH2      ARG  23  11.401   0.843 -10.793
  178   1HH2  ARG  23          2HH1      ARG  23  12.461  -2.399  -9.740
  179   2HH2  ARG  23          1HH1      ARG  23  12.627  -1.196 -10.977
  180    H    ASN  24           H        ASN  24   7.187  -1.150  -2.902
  181    HA   ASN  24           HA       ASN  24   7.692  -3.871  -2.539
  182   1HB   ASN  24          2HB       ASN  24   6.270  -1.754  -0.945
  183   2HB   ASN  24          3HB       ASN  24   5.825  -3.403  -0.592
  184   1HD2  ASN  24          1HD2      ASN  24   7.756  -4.994  -0.358
  185   2HD2  ASN  24          2HD2      ASN  24   8.950  -4.410   0.778
  186    H    VAL  25           H        VAL  25   4.487  -2.271  -3.050
  187    HA   VAL  25           HA       VAL  25   3.101  -4.756  -2.950
  188    HB   VAL  25           HB       VAL  25   2.196  -2.199  -4.325
  189   1HG1  VAL  25          1HG1      VAL  25   0.901  -4.193  -5.021
  190   2HG1  VAL  25          2HG1      VAL  25   0.675  -4.662  -3.324
  191   3HG1  VAL  25          3HG1      VAL  25  -0.070  -3.182  -3.940
  192   1HG2  VAL  25          1HG2      VAL  25   0.858  -1.994  -2.153
  193   2HG2  VAL  25          2HG2      VAL  25   1.878  -3.299  -1.500
  194   3HG2  VAL  25          3HG2      VAL  25   2.586  -1.754  -1.941
  195    H    LYS  26           H        LYS  26   4.320  -2.890  -5.781
  196    HA   LYS  26           HA       LYS  26   3.648  -4.699  -7.825
  197   1HB   LYS  26          2HB       LYS  26   5.772  -2.615  -7.364
  198   2HB   LYS  26          3HB       LYS  26   5.887  -3.609  -8.804
  199   1HG   LYS  26          2HG       LYS  26   3.886  -2.842  -9.673
  200   2HG   LYS  26          3HG       LYS  26   3.240  -2.323  -8.101
  201   1HD   LYS  26          2HD       LYS  26   4.580  -0.388  -8.024
  202   2HD   LYS  26          3HD       LYS  26   5.637  -0.954  -9.327
  203   1HE   LYS  26          2HE       LYS  26   3.785  -0.741 -10.958
  204   2HE   LYS  26          3HE       LYS  26   2.645  -0.342  -9.660
  205   1HZ   LYS  26          1HZ       LYS  26   3.342   1.615 -10.830
  206   2HZ   LYS  26          2HZ       LYS  26   3.864   1.724  -9.298
  207   3HZ   LYS  26          3HZ       LYS  26   4.922   1.356 -10.467
  208    H    GLU  27           H        GLU  27   6.355  -4.928  -5.496
  209    HA   GLU  27           HA       GLU  27   7.645  -7.123  -6.820
  210   1HB   GLU  27          2HB       GLU  27   7.726  -6.134  -3.954
  211   2HB   GLU  27          3HB       GLU  27   8.761  -7.413  -4.570
  212   1HG   GLU  27          2HG       GLU  27   9.959  -5.987  -5.995
  213   2HG   GLU  27          3HG       GLU  27   8.711  -4.746  -6.008
  214    H    ILE  28           H        ILE  28   4.691  -7.060  -4.886
  215    HA   ILE  28           HA       ILE  28   4.970  -9.844  -4.015
  216    HB   ILE  28           HB       ILE  28   2.491  -8.123  -4.090
  217   1HG1  ILE  28          2HG1      ILE  28   4.159  -8.527  -1.589
  218   2HG1  ILE  28          3HG1      ILE  28   4.392  -7.146  -2.658
  219   1HG2  ILE  28          1HG2      ILE  28   3.091 -10.850  -3.055
  220   2HG2  ILE  28          2HG2      ILE  28   2.167  -9.830  -1.969
  221   3HG2  ILE  28          3HG2      ILE  28   1.558 -10.121  -3.600
  222   1HD1  ILE  28          1HD1      ILE  28   2.867  -6.469  -0.913
  223   2HD1  ILE  28          2HD1      ILE  28   1.981  -6.546  -2.453
  224   3HD1  ILE  28          3HD1      ILE  28   1.775  -7.817  -1.270
  225    H    GLU  29           H        GLU  29   4.153 -11.662  -5.127
  226    HA   GLU  29           HA       GLU  29   3.284 -11.355  -7.852
  227   1HB   GLU  29          2HB       GLU  29   3.915 -13.651  -5.945
  228   2HB   GLU  29          3HB       GLU  29   3.220 -13.922  -7.530
  229   1HG   GLU  29          2HG       GLU  29   5.099 -12.764  -8.619
  230   2HG   GLU  29          3HG       GLU  29   5.835 -12.437  -7.039
  231    H    GLY  30           H        GLY  30   1.687 -11.670  -4.873
  232   1HA   GLY  30          1HA       GLY  30  -0.716 -13.036  -5.700
  233   2HA   GLY  30          2HA       GLY  30  -0.524 -12.039  -4.250
  234    H    VAL  31           H        VAL  31   0.299  -9.643  -5.808
  235    HA   VAL  31           HA       VAL  31  -2.378  -8.702  -6.586
  236    HB   VAL  31           HB       VAL  31  -1.010  -7.725  -4.733
  237   1HG1  VAL  31          1HG1      VAL  31   1.205  -7.903  -5.962
  238   2HG1  VAL  31          2HG1      VAL  31   0.724  -6.473  -6.889
  239   3HG1  VAL  31          3HG1      VAL  31   0.869  -6.400  -5.113
  240   1HG2  VAL  31          1HG2      VAL  31  -1.502  -5.670  -6.875
  241   2HG2  VAL  31          2HG2      VAL  31  -2.790  -6.479  -5.934
  242   3HG2  VAL  31          3HG2      VAL  31  -1.557  -5.490  -5.119
  243    H    THR  32           H        THR  32  -2.022  -6.824  -8.368
  244    HA   THR  32           HA       THR  32  -0.159  -7.683 -10.512
  245    HB   THR  32           HB       THR  32  -3.166  -7.327 -10.857
  246    HG1  THR  32           1HG      THR  32  -1.520  -9.482 -10.368
  247   1HG2  THR  32          1HG2      THR  32  -0.991  -8.013 -12.874
  248   2HG2  THR  32          2HG2      THR  32  -2.742  -8.115 -13.167
  249   3HG2  THR  32          3HG2      THR  32  -1.993  -6.544 -12.843
  250    H    GLU  33           H        GLU  33  -2.777  -5.338  -9.646
  251    HA   GLU  33           HA       GLU  33  -0.845  -3.174 -10.485
  252   1HB   GLU  33          2HB       GLU  33  -3.842  -3.277 -10.973
  253   2HB   GLU  33          3HB       GLU  33  -2.930  -1.773 -10.820
  254   1HG   GLU  33          2HG       GLU  33  -1.354  -3.081 -12.634
  255   2HG   GLU  33          3HG       GLU  33  -2.926  -3.792 -13.017
  256    H    ALA  34           H        ALA  34  -0.698  -1.374  -9.206
  257    HA   ALA  34           HA       ALA  34  -2.151  -1.359  -6.652
  258   1HB   ALA  34          1HB       ALA  34  -0.149  -2.743  -6.283
  259   2HB   ALA  34          2HB       ALA  34   0.898  -1.433  -6.864
  260   3HB   ALA  34          3HB       ALA  34  -0.051  -1.211  -5.374
  261    H    ILE  35           H        ILE  35  -2.750   0.781  -6.293
  262    HA   ILE  35           HA       ILE  35  -1.034   2.896  -7.596
  263    HB   ILE  35           HB       ILE  35  -4.064   2.874  -7.754
  264   1HG1  ILE  35          2HG1      ILE  35  -2.028   2.447  -9.987
  265   2HG1  ILE  35          3HG1      ILE  35  -2.964   1.142  -9.250
  266   1HG2  ILE  35          1HG2      ILE  35  -3.736   4.858  -9.142
  267   2HG2  ILE  35          2HG2      ILE  35  -2.999   5.115  -7.565
  268   3HG2  ILE  35          3HG2      ILE  35  -1.974   4.726  -8.962
  269   1HD1  ILE  35          1HD1      ILE  35  -4.021   1.745 -11.287
  270   2HD1  ILE  35          2HD1      ILE  35  -5.074   2.195  -9.932
  271   3HD1  ILE  35          3HD1      ILE  35  -4.156   3.443 -10.813
  272    H    VAL  36           H        VAL  36  -0.072   3.634  -5.772
  273    HA   VAL  36           HA       VAL  36  -1.782   4.220  -3.417
  274    HB   VAL  36           HB       VAL  36   0.209   2.854  -3.053
  275   1HG1  VAL  36          1HG1      VAL  36   1.656   3.864  -4.825
  276   2HG1  VAL  36          2HG1      VAL  36   1.870   5.295  -3.800
  277   3HG1  VAL  36          3HG1      VAL  36   2.432   3.714  -3.233
  278   1HG2  VAL  36          1HG2      VAL  36   0.378   5.631  -1.820
  279   2HG2  VAL  36          2HG2      VAL  36  -0.616   4.287  -1.223
  280   3HG2  VAL  36          3HG2      VAL  36   1.159   4.194  -1.193
  281    H    ASN  37           H        ASN  37  -2.181   6.239  -2.681
  282    HA   ASN  37           HA       ASN  37  -0.538   8.479  -3.718
  283   1HB   ASN  37          2HB       ASN  37  -3.555   8.367  -3.846
  284   2HB   ASN  37          3HB       ASN  37  -2.718   9.899  -3.573
  285   1HD2  ASN  37          1HD2      ASN  37  -4.385   9.372  -5.862
  286   2HD2  ASN  37          2HD2      ASN  37  -3.307   9.487  -7.239
  287    H    PHE  38           H        PHE  38   0.447   7.671  -1.802
  288    HA   PHE  38           HA       PHE  38  -0.297   8.247   0.880
  289   1HB   PHE  38          2HB       PHE  38   2.233   8.454  -0.789
  290   2HB   PHE  38          3HB       PHE  38   2.221   9.107   0.832
  291    HD1  PHE  38           1HD      PHE  38   0.175   6.102   0.598
  292    HD2  PHE  38           2HD      PHE  38   4.152   7.650   1.261
  293    HE1  PHE  38           1HE      PHE  38   0.727   4.162   1.935
  294    HE2  PHE  38           2HE      PHE  38   4.703   5.663   2.560
  295    HZ   PHE  38           HZ       PHE  38   3.024   3.822   2.848
  296    H    GLY  39           H        GLY  39   0.264  10.437  -1.827
  297   1HA   GLY  39          1HA       GLY  39   0.820  12.717  -0.339
  298   2HA   GLY  39          2HA       GLY  39  -0.006  12.698  -1.921
  299    H    ALA  40           H        ALA  40  -2.164  10.868  -0.511
  300    HA   ALA  40           HA       ALA  40  -3.285  12.782   1.468
  301   1HB   ALA  40          1HB       ALA  40  -4.711  12.982  -0.474
  302   2HB   ALA  40          2HB       ALA  40  -4.854  11.221  -0.621
  303   3HB   ALA  40          3HB       ALA  40  -5.557  12.067   0.787
  304    H    SER  41           H        SER  41  -4.864   9.699   0.820
  305    HA   SER  41           HA       SER  41  -3.505   8.273   2.867
  306   1HB   SER  41          2HB       SER  41  -6.314   9.417   3.377
  307   2HB   SER  41          3HB       SER  41  -5.459   8.312   4.457
  308    HG   SER  41           HG       SER  41  -3.816  10.078   4.500
  309    H    LYS  42           H        LYS  42  -3.678   7.308   0.432
  310    HA   LYS  42           HA       LYS  42  -5.862   5.388   0.524
  311   1HB   LYS  42          2HB       LYS  42  -6.719   5.872  -1.715
  312   2HB   LYS  42          3HB       LYS  42  -7.017   7.136  -0.536
  313   1HG   LYS  42          2HG       LYS  42  -4.837   8.263  -1.525
  314   2HG   LYS  42          3HG       LYS  42  -4.984   7.042  -2.792
  315   1HD   LYS  42          2HD       LYS  42  -5.911   9.148  -3.523
  316   2HD   LYS  42          3HD       LYS  42  -7.198   7.937  -3.430
  317   1HE   LYS  42          2HE       LYS  42  -8.231   8.957  -1.595
  318   2HE   LYS  42          3HE       LYS  42  -6.728   9.663  -0.992
  319   1HZ   LYS  42          1HZ       LYS  42  -6.808  11.281  -2.729
  320   2HZ   LYS  42          2HZ       LYS  42  -8.177  10.623  -3.367
  321   3HZ   LYS  42          3HZ       LYS  42  -8.209  11.316  -1.878
  322    H    ILE  43           H        ILE  43  -5.477   3.572  -0.450
  323    HA   ILE  43           HA       ILE  43  -3.134   3.202  -2.212
  324    HB   ILE  43           HB       ILE  43  -2.253   3.057  -0.013
  325   1HG1  ILE  43          2HG1      ILE  43  -1.161   1.665  -1.626
  326   2HG1  ILE  43          3HG1      ILE  43  -1.139   0.931  -0.026
  327   1HG2  ILE  43          1HG2      ILE  43  -4.208   0.847   0.643
  328   2HG2  ILE  43          2HG2      ILE  43  -2.817   1.354   1.610
  329   3HG2  ILE  43          3HG2      ILE  43  -4.146   2.477   1.342
  330   1HD1  ILE  43          1HD1      ILE  43  -2.742   0.045  -2.402
  331   2HD1  ILE  43          2HD1      ILE  43  -1.482  -0.813  -1.527
  332   3HD1  ILE  43          3HD1      ILE  43  -3.059  -0.556  -0.757
  333    H    THR  44           H        THR  44  -4.089   2.456  -3.983
  334    HA   THR  44           HA       THR  44  -6.289   0.527  -3.896
  335    HB   THR  44           HB       THR  44  -4.657   1.502  -6.236
  336    HG1  THR  44           1HG      THR  44  -7.057   2.559  -5.384
  337   1HG2  THR  44          1HG2      THR  44  -6.700   1.016  -7.548
  338   2HG2  THR  44          2HG2      THR  44  -5.998  -0.436  -6.829
  339   3HG2  THR  44          3HG2      THR  44  -7.441   0.299  -6.100
  340    H    VAL  45           H        VAL  45  -6.095  -1.586  -4.140
  341    HA   VAL  45           HA       VAL  45  -3.562  -2.801  -5.104
  342    HB   VAL  45           HB       VAL  45  -5.284  -3.358  -2.693
  343   1HG1  VAL  45          1HG1      VAL  45  -4.460  -5.684  -2.489
  344   2HG1  VAL  45          2HG1      VAL  45  -5.577  -5.501  -3.844
  345   3HG1  VAL  45          3HG1      VAL  45  -3.827  -5.602  -4.138
  346   1HG2  VAL  45          1HG2      VAL  45  -2.320  -3.848  -3.159
  347   2HG2  VAL  45          2HG2      VAL  45  -3.004  -2.314  -2.593
  348   3HG2  VAL  45          3HG2      VAL  45  -3.188  -3.778  -1.607
  349    H    THR  46           H        THR  46  -3.917  -4.247  -6.799
  350    HA   THR  46           HA       THR  46  -6.632  -5.286  -7.286
  351    HB   THR  46           HB       THR  46  -4.936  -3.538  -9.134
  352    HG1  THR  46           1HG      THR  46  -6.949  -3.303  -7.496
  353   1HG2  THR  46          1HG2      THR  46  -6.746  -3.910 -10.837
  354   2HG2  THR  46          2HG2      THR  46  -5.788  -5.368 -10.551
  355   3HG2  THR  46          3HG2      THR  46  -7.404  -5.215  -9.827
  356    H    GLY  47           H        GLY  47  -6.489  -7.294  -8.016
  357   1HA   GLY  47          1HA       GLY  47  -4.915  -8.413  -9.848
  358   2HA   GLY  47          2HA       GLY  47  -3.810  -8.476  -8.482
  359    H    GLU  48           H        GLU  48  -4.236  -9.882  -6.723
  360    HA   GLU  48           HA       GLU  48  -6.894 -10.805  -6.201
  361   1HB   GLU  48          2HB       GLU  48  -5.726 -12.376  -8.064
  362   2HB   GLU  48          3HB       GLU  48  -5.020 -13.142  -6.651
  363   1HG   GLU  48          2HG       GLU  48  -7.279 -13.615  -5.783
  364   2HG   GLU  48          3HG       GLU  48  -8.000 -12.613  -7.070
  365    H    ALA  49           H        ALA  49  -5.419  -9.178  -4.635
  366    HA   ALA  49           HA       ALA  49  -4.846 -10.865  -2.279
  367   1HB   ALA  49          1HB       ALA  49  -2.863  -8.856  -3.432
  368   2HB   ALA  49          2HB       ALA  49  -2.725  -9.676  -1.864
  369   3HB   ALA  49          3HB       ALA  49  -2.652 -10.623  -3.360
  370    H    SER  50           H        SER  50  -4.287  -9.378  -0.371
  371    HA   SER  50           HA       SER  50  -6.176  -7.081  -0.289
  372   1HB   SER  50          2HB       SER  50  -5.761  -9.357   1.705
  373   2HB   SER  50          3HB       SER  50  -6.712  -7.903   2.030
  374    HG   SER  50           HG       SER  50  -8.046  -9.608   1.249
  375    H    ILE  51           H        ILE  51  -5.801  -5.619   1.606
  376    HA   ILE  51           HA       ILE  51  -3.256  -4.686   1.546
  377    HB   ILE  51           HB       ILE  51  -5.457  -3.534   2.457
  378   1HG1  ILE  51          2HG1      ILE  51  -4.124  -1.934   3.706
  379   2HG1  ILE  51          3HG1      ILE  51  -2.716  -2.969   3.399
  380   1HG2  ILE  51          1HG2      ILE  51  -4.184  -4.264   5.111
  381   2HG2  ILE  51          2HG2      ILE  51  -5.667  -3.348   4.820
  382   3HG2  ILE  51          3HG2      ILE  51  -5.639  -5.085   4.478
  383   1HD1  ILE  51          1HD1      ILE  51  -3.222  -2.668   0.877
  384   2HD1  ILE  51          2HD1      ILE  51  -4.494  -1.543   1.361
  385   3HD1  ILE  51          3HD1      ILE  51  -2.804  -1.176   1.715
  386    H    GLN  52           H        GLN  52  -4.360  -7.198   3.690
  387    HA   GLN  52           HA       GLN  52  -2.573  -7.442   5.731
  388   1HB   GLN  52          2HB       GLN  52  -3.301  -9.501   3.597
  389   2HB   GLN  52          3HB       GLN  52  -2.447  -9.916   5.083
  390   1HG   GLN  52          2HG       GLN  52  -5.205  -8.602   5.052
  391   2HG   GLN  52          3HG       GLN  52  -4.922 -10.342   5.113
  392   1HE2  GLN  52          1HE2      GLN  52  -5.481  -7.666   7.103
  393   2HE2  GLN  52          2HE2      GLN  52  -4.813  -8.355   8.570
  394    H    GLN  53           H        GLN  53  -1.765  -8.110   2.292
  395    HA   GLN  53           HA       GLN  53   0.984  -8.836   2.946
  396   1HB   GLN  53          2HB       GLN  53  -0.145  -8.011   0.245
  397   2HB   GLN  53          3HB       GLN  53   1.360  -8.899   0.595
  398   1HG   GLN  53          2HG       GLN  53  -0.024 -10.721   1.632
  399   2HG   GLN  53          3HG       GLN  53  -1.480  -9.901   1.035
  400   1HE2  GLN  53          1HE2      GLN  53  -0.009 -12.576   0.312
  401   2HE2  GLN  53          2HE2      GLN  53   0.048 -12.484  -1.438
  402    H    VAL  54           H        VAL  54  -0.628  -5.853   1.923
  403    HA   VAL  54           HA       VAL  54   1.790  -4.400   1.307
  404    HB   VAL  54           HB       VAL  54  -1.004  -3.331   1.906
  405   1HG1  VAL  54          1HG1      VAL  54   1.390  -2.094   0.504
  406   2HG1  VAL  54          2HG1      VAL  54  -0.253  -1.418   0.503
  407   3HG1  VAL  54          3HG1      VAL  54   0.631  -1.576   2.018
  408   1HG2  VAL  54          1HG2      VAL  54  -1.110  -3.263  -0.662
  409   2HG2  VAL  54          2HG2      VAL  54   0.218  -4.438  -0.640
  410   3HG2  VAL  54          3HG2      VAL  54  -1.329  -4.842   0.107
  411    H    GLU  55           H        GLU  55  -0.330  -4.815   4.138
  412    HA   GLU  55           HA       GLU  55   0.735  -2.904   5.882
  413   1HB   GLU  55          2HB       GLU  55  -1.379  -4.271   6.077
  414   2HB   GLU  55          3HB       GLU  55  -0.401  -5.658   6.565
  415   1HG   GLU  55          2HG       GLU  55  -0.401  -2.960   7.973
  416   2HG   GLU  55          3HG       GLU  55  -1.443  -4.320   8.423
  417    H    GLN  56           H        GLN  56   1.453  -6.423   5.481
  418    HA   GLN  56           HA       GLN  56   3.632  -6.557   7.173
  419   1HB   GLN  56          2HB       GLN  56   2.448  -8.442   6.072
  420   2HB   GLN  56          3HB       GLN  56   3.348  -8.155   4.581
  421   1HG   GLN  56          2HG       GLN  56   4.884  -8.520   7.174
  422   2HG   GLN  56          3HG       GLN  56   4.081  -9.918   6.462
  423   1HE2  GLN  56          1HE2      GLN  56   5.818 -11.130   5.730
  424   2HE2  GLN  56          2HE2      GLN  56   6.967 -10.513   4.554
  425    H    ALA  57           H        ALA  57   3.818  -5.923   3.593
  426    HA   ALA  57           HA       ALA  57   6.547  -5.299   3.450
  427   1HB   ALA  57          1HB       ALA  57   4.179  -4.037   2.000
  428   2HB   ALA  57          2HB       ALA  57   5.881  -3.795   1.589
  429   3HB   ALA  57          3HB       ALA  57   5.162  -5.418   1.462
  430    H    GLY  58           H        GLY  58   3.821  -3.157   4.363
  431   1HA   GLY  58          1HA       GLY  58   5.080  -0.709   4.675
  432   2HA   GLY  58          2HA       GLY  58   3.639  -1.300   5.541
  433    H    ALA  59           H        ALA  59   5.424  -3.601   6.698
  434    HA   ALA  59           HA       ALA  59   6.133  -2.537   9.148
  435   1HB   ALA  59          1HB       ALA  59   7.568  -4.763   7.657
  436   2HB   ALA  59          2HB       ALA  59   7.623  -4.455   9.404
  437   3HB   ALA  59          3HB       ALA  59   6.094  -4.941   8.648
  438    H    PHE  60           H        PHE  60   7.901  -2.057   6.083
  439    HA   PHE  60           HA       PHE  60  10.377  -1.294   7.213
  440   1HB   PHE  60          2HB       PHE  60  10.819  -0.028   5.253
  441   2HB   PHE  60          3HB       PHE  60  10.109  -1.585   4.846
  442    HD1  PHE  60           1HD      PHE  60   8.423  -1.618   3.170
  443    HD2  PHE  60           2HD      PHE  60   9.332   2.080   5.181
  444    HE1  PHE  60           1HE      PHE  60   6.808  -0.447   1.743
  445    HE2  PHE  60           2HE      PHE  60   7.608   3.230   3.836
  446    HZ   PHE  60           HZ       PHE  60   6.351   1.990   2.091
  447    H    GLU  61           H        GLU  61   7.354   0.535   7.121
  448    HA   GLU  61           HA       GLU  61   8.635   2.719   8.740
  449   1HB   GLU  61          2HB       GLU  61   7.982   3.368   6.431
  450   2HB   GLU  61          3HB       GLU  61   6.317   2.909   6.786
  451   1HG   GLU  61          2HG       GLU  61   6.522   5.291   6.923
  452   2HG   GLU  61          3HG       GLU  61   6.369   4.749   8.596
  453    H    HIS  62           H        HIS  62   6.138   0.308   8.647
  454    HA   HIS  62           HA       HIS  62   4.699  -0.459  10.169
  455   1HB   HIS  62          2HB       HIS  62   5.353   1.736  12.144
  456   2HB   HIS  62          3HB       HIS  62   4.741   0.117  12.444
  457    HD1  HIS  62           1HD      HIS  62   7.296  -1.266  10.658
  458    HD2  HIS  62           2HD      HIS  62   7.402   1.612  13.731
  459    HE1  HIS  62           1HE      HIS  62   9.562  -1.457  11.746
  460    H    LEU  63           H        LEU  63   3.496   0.779   8.163
  461    HA   LEU  63           HA       LEU  63   2.102   3.205   9.028
  462   1HB   LEU  63          2HB       LEU  63   1.440   1.435   6.638
  463   2HB   LEU  63          3HB       LEU  63   0.882   3.071   6.965
  464    HG   LEU  63           HG       LEU  63   2.434   3.528   5.434
  465   1HD1  LEU  63          1HD1      LEU  63   4.247   3.551   7.895
  466   2HD1  LEU  63          2HD1      LEU  63   4.390   4.530   6.432
  467   3HD1  LEU  63          3HD1      LEU  63   3.007   4.755   7.526
  468   1HD2  LEU  63          1HD2      LEU  63   4.449   1.535   6.542
  469   2HD2  LEU  63          2HD2      LEU  63   3.269   1.141   5.287
  470   3HD2  LEU  63          3HD2      LEU  63   4.499   2.382   4.987
  471    H    LYS  64           H        LYS  64  -0.329   3.361   8.887
  472    HA   LYS  64           HA       LYS  64  -1.694   0.882   9.806
  473   1HB   LYS  64          2HB       LYS  64  -3.228   2.372  11.154
  474   2HB   LYS  64          3HB       LYS  64  -1.622   1.998  11.771
  475   1HG   LYS  64          2HG       LYS  64  -1.670   4.166  12.342
  476   2HG   LYS  64          3HG       LYS  64  -0.909   4.316  10.786
  477   1HD   LYS  64          2HD       LYS  64  -2.412   5.809  10.282
  478   2HD   LYS  64          3HD       LYS  64  -3.625   4.555  10.100
  479   1HE   LYS  64          2HE       LYS  64  -2.988   6.022  12.727
  480   2HE   LYS  64          3HE       LYS  64  -4.219   6.566  11.588
  481   1HZ   LYS  64          1HZ       LYS  64  -5.430   4.585  11.922
  482   2HZ   LYS  64          2HZ       LYS  64  -4.258   3.921  12.872
  483   3HZ   LYS  64          3HZ       LYS  64  -5.105   5.234  13.393
  484    H    ILE  65           H        ILE  65  -3.113   0.259   8.374
  485    HA   ILE  65           HA       ILE  65  -4.316   2.239   6.552
  486    HB   ILE  65           HB       ILE  65  -3.935  -0.615   5.701
  487   1HG1  ILE  65          2HG1      ILE  65  -1.693   1.402   5.740
  488   2HG1  ILE  65          3HG1      ILE  65  -1.786  -0.303   6.286
  489   1HG2  ILE  65          1HG2      ILE  65  -5.402   0.847   4.435
  490   2HG2  ILE  65          2HG2      ILE  65  -4.085   1.979   4.157
  491   3HG2  ILE  65          3HG2      ILE  65  -4.019   0.358   3.460
  492   1HD1  ILE  65          1HD1      ILE  65  -2.071  -0.948   3.884
  493   2HD1  ILE  65          2HD1      ILE  65  -1.542   0.696   3.467
  494   3HD1  ILE  65          3HD1      ILE  65  -0.498  -0.415   4.404
  495    H    ILE  66           H        ILE  66  -6.536   2.022   6.233
  496    HA   ILE  66           HA       ILE  66  -7.904  -0.092   7.817
  497    HB   ILE  66           HB       ILE  66  -8.721   2.827   7.587
  498   1HG1  ILE  66          2HG1      ILE  66  -8.398   2.391  10.249
  499   2HG1  ILE  66          3HG1      ILE  66  -7.167   1.281   9.660
  500   1HG2  ILE  66          1HG2      ILE  66  -9.933   0.540   9.196
  501   2HG2  ILE  66          2HG2      ILE  66 -10.458   2.233   9.216
  502   3HG2  ILE  66          3HG2      ILE  66 -10.657   1.278   7.749
  503   1HD1  ILE  66          1HD1      ILE  66  -7.401   4.273   9.083
  504   2HD1  ILE  66          2HD1      ILE  66  -6.228   3.485  10.155
  505   3HD1  ILE  66          3HD1      ILE  66  -6.128   3.237   8.406
  506    HA   PRO  67           HA       PRO  67 -10.043  -0.529   3.800
  507   1HB   PRO  67          2HB       PRO  67 -11.881  -2.419   4.528
  508   2HB   PRO  67          3HB       PRO  67 -10.170  -2.822   4.257
  509   1HG   PRO  67          2HG       PRO  67 -11.551  -2.324   6.892
  510   2HG   PRO  67          3HG       PRO  67 -10.417  -3.637   6.473
  511   1HD   PRO  67          2HD       PRO  67  -9.668  -1.381   7.800
  512   2HD   PRO  67          3HD       PRO  67  -8.556  -2.199   6.662
  513    H    GLU  68           H        GLU  68 -10.928   1.638   3.818
  514    HA   GLU  68           HA       GLU  68 -12.829   2.700   5.404
  515   1HB   GLU  68          2HB       GLU  68 -11.586   3.638   3.293
  516   2HB   GLU  68          3HB       GLU  68 -12.972   3.028   2.369
  517   1HG   GLU  68          2HG       GLU  68 -14.473   4.308   3.888
  518   2HG   GLU  68          3HG       GLU  68 -13.045   4.907   4.755
  519    H    LYS  69           H        LYS  69 -13.404   0.637   2.582
  520    HA   LYS  69           HA       LYS  69 -14.965  -0.833   2.026
  521   1HB   LYS  69          2HB       LYS  69 -14.644  -1.470   4.432
  522   2HB   LYS  69          3HB       LYS  69 -16.137  -0.632   4.838
  523   1HG   LYS  69          2HG       LYS  69 -16.062  -2.771   2.671
  524   2HG   LYS  69          3HG       LYS  69 -16.062  -3.185   4.392
  525   1HD   LYS  69          2HD       LYS  69 -18.182  -1.867   4.705
  526   2HD   LYS  69          3HD       LYS  69 -18.199  -1.513   2.977
  527   1HE   LYS  69          2HE       LYS  69 -19.721  -3.346   3.446
  528   2HE   LYS  69          3HE       LYS  69 -18.390  -3.906   2.424
  529   1HZ   LYS  69          1HZ       LYS  69 -18.911  -5.440   4.207
  530   2HZ   LYS  69          2HZ       LYS  69 -17.379  -4.874   4.371
  531   3HZ   LYS  69          3HZ       LYS  69 -18.577  -4.299   5.345
  532    H    GLU  70           H        GLU  70 -16.731   1.504   4.101
  533    HA   GLU  70           HA       GLU  70 -17.932   2.872   1.954
  534   1HB   GLU  70          2HB       GLU  70 -19.301   0.745   1.758
  535   2HB   GLU  70          3HB       GLU  70 -19.918   1.037   3.390
  536   1HG   GLU  70          2HG       GLU  70 -20.869   3.209   2.596
  537   2HG   GLU  70          3HG       GLU  70 -20.228   2.881   0.977
  538    H    ALA  71           H        ALA  71 -18.598   1.710   5.332
  539    HA   ALA  71           HA       ALA  71 -18.202   4.242   6.547
  540   1HB   ALA  71          1HB       ALA  71 -21.019   3.044   6.413
  541   2HB   ALA  71          2HB       ALA  71 -20.513   4.378   7.472
  542   3HB   ALA  71          3HB       ALA  71 -20.536   4.605   5.710
  Start of MODEL   19
    1   1H    MET   1           H1       MET   1  -9.080  -8.604 -14.342
    2   2H    MET   1           H2       MET   1  -9.603  -7.036 -14.381
    3   3H    MET   1           H3       MET   1  -8.990  -7.686 -12.987
    4    HA   MET   1           HA       MET   1 -11.376  -7.621 -12.817
    5   1HB   MET   1          2HB       MET   1 -11.139  -9.165 -15.417
    6   2HB   MET   1          3HB       MET   1 -12.586  -9.252 -14.406
    7   1HG   MET   1          2HG       MET   1 -13.113  -6.977 -14.698
    8   2HG   MET   1          3HG       MET   1 -11.503  -6.566 -15.307
    9   1HE   MET   1          1HE       MET   1 -12.599  -5.122 -17.176
   10   2HE   MET   1          2HE       MET   1 -13.756  -5.761 -18.366
   11   3HE   MET   1          3HE       MET   1 -14.243  -5.588 -16.665
   12    H    ALA   2           H        ALA   2 -10.994  -8.607 -10.886
   13    HA   ALA   2           HA       ALA   2 -11.084 -11.394 -10.495
   14   1HB   ALA   2          1HB       ALA   2  -8.728 -11.618  -9.524
   15   2HB   ALA   2          2HB       ALA   2  -8.826 -11.591 -11.288
   16   3HB   ALA   2          3HB       ALA   2  -8.313 -10.134 -10.427
   17    H    GLU   3           H        GLU   3  -8.894  -9.542  -8.392
   18    HA   GLU   3           HA       GLU   3 -11.257  -8.487  -6.888
   19   1HB   GLU   3          2HB       GLU   3  -9.864 -10.346  -5.747
   20   2HB   GLU   3          3HB       GLU   3  -8.590  -9.125  -5.604
   21   1HG   GLU   3          2HG       GLU   3 -10.214  -7.652  -4.355
   22   2HG   GLU   3          3HG       GLU   3 -11.452  -8.909  -4.544
   23    H    LYS   4           H        LYS   4 -10.995  -6.375  -6.035
   24    HA   LYS   4           HA       LYS   4  -8.625  -4.863  -6.495
   25   1HB   LYS   4          2HB       LYS   4  -9.594  -3.137  -7.967
   26   2HB   LYS   4          3HB       LYS   4  -9.529  -4.711  -8.766
   27   1HG   LYS   4          2HG       LYS   4 -12.027  -4.967  -7.998
   28   2HG   LYS   4          3HG       LYS   4 -11.937  -3.223  -7.691
   29   1HD   LYS   4          2HD       LYS   4 -11.123  -2.912 -10.055
   30   2HD   LYS   4          3HD       LYS   4 -11.357  -4.652 -10.330
   31   1HE   LYS   4          2HE       LYS   4 -13.756  -4.479  -9.960
   32   2HE   LYS   4          3HE       LYS   4 -13.608  -2.805  -9.400
   33   1HZ   LYS   4          1HZ       LYS   4 -13.046  -3.713 -12.145
   34   2HZ   LYS   4          2HZ       LYS   4 -14.389  -2.906 -11.646
   35   3HZ   LYS   4          3HZ       LYS   4 -12.924  -2.166 -11.595
   36    H    THR   5           H        THR   5  -8.501  -3.178  -4.970
   37    HA   THR   5           HA       THR   5 -10.913  -2.344  -3.564
   38    HB   THR   5           HB       THR   5  -8.865  -4.199  -2.206
   39    HG1  THR   5           1HG      THR   5 -11.278  -4.344  -3.321
   40   1HG2  THR   5          1HG2      THR   5 -11.180  -2.598  -0.991
   41   2HG2  THR   5          2HG2      THR   5 -10.336  -3.930  -0.189
   42   3HG2  THR   5          3HG2      THR   5  -9.459  -2.441  -0.563
   43    H    VAL   6           H        VAL   6 -10.470  -0.617  -2.144
   44    HA   VAL   6           HA       VAL   6  -7.718   0.111  -2.031
   45    HB   VAL   6           HB       VAL   6  -8.556   1.493  -3.771
   46   1HG1  VAL   6          1HG1      VAL   6 -10.511   2.934  -3.672
   47   2HG1  VAL   6          2HG1      VAL   6 -10.908   1.220  -3.600
   48   3HG1  VAL   6          3HG1      VAL   6 -10.970   2.203  -2.111
   49   1HG2  VAL   6          1HG2      VAL   6  -8.402   3.812  -2.960
   50   2HG2  VAL   6          2HG2      VAL   6  -8.776   3.288  -1.307
   51   3HG2  VAL   6          3HG2      VAL   6  -7.241   2.826  -2.063
   52    H    TYR   7           H        TYR   7  -7.000   1.171  -0.229
   53    HA   TYR   7           HA       TYR   7  -8.843   1.101   2.129
   54   1HB   TYR   7          2HB       TYR   7  -5.927   0.292   2.120
   55   2HB   TYR   7          3HB       TYR   7  -7.135   0.015   3.374
   56    HD1  TYR   7           HD1      TYR   7  -8.780  -1.810   3.126
   57    HD2  TYR   7           HD2      TYR   7  -5.625  -1.221   0.260
   58    HE1  TYR   7           HE1      TYR   7  -8.996  -4.167   2.418
   59    HE2  TYR   7           HE2      TYR   7  -5.780  -3.609  -0.390
   60    HH   TYR   7           HH       TYR   7  -8.179  -5.830   0.924
   61    H    ARG   8           H        ARG   8  -8.252   2.704   3.775
   62    HA   ARG   8           HA       ARG   8  -6.702   5.003   2.645
   63   1HB   ARG   8          2HB       ARG   8  -8.666   4.753   4.942
   64   2HB   ARG   8          3HB       ARG   8  -7.479   6.049   4.865
   65   1HG   ARG   8          2HG       ARG   8  -8.497   6.181   2.293
   66   2HG   ARG   8          3HG       ARG   8  -9.872   5.604   3.185
   67   1HD   ARG   8          2HD       ARG   8  -9.906   8.050   3.141
   68   2HD   ARG   8          3HD       ARG   8  -9.570   7.504   4.791
   69    HE   ARG   8           HE       ARG   8  -7.224   7.967   3.027
   70   1HH1  ARG   8          2HH2      ARG   8  -9.248   9.521   5.487
   71   2HH1  ARG   8          1HH2      ARG   8  -7.875  10.276   6.273
   72   1HH2  ARG   8          2HH1      ARG   8  -5.520   8.938   4.000
   73   2HH2  ARG   8          1HH1      ARG   8  -5.725   9.715   5.546
   74    H    VAL   9           H        VAL   9  -4.776   5.568   3.421
   75    HA   VAL   9           HA       VAL   9  -3.648   4.146   5.785
   76    HB   VAL   9           HB       VAL   9  -2.356   3.444   3.943
   77   1HG1  VAL   9          1HG1      VAL   9  -1.368   4.921   2.249
   78   2HG1  VAL   9          2HG1      VAL   9  -3.106   5.039   2.202
   79   3HG1  VAL   9          3HG1      VAL   9  -2.158   6.331   2.974
   80   1HG2  VAL   9          1HG2      VAL   9  -0.169   4.290   4.506
   81   2HG2  VAL   9          2HG2      VAL   9  -0.822   5.821   5.068
   82   3HG2  VAL   9          3HG2      VAL   9  -1.131   4.316   5.971
   83    H    ASP  10           H        ASP  10  -2.541   5.470   7.289
   84    HA   ASP  10           HA       ASP  10  -2.173   8.249   6.604
   85   1HB   ASP  10          2HB       ASP  10  -4.475   7.470   8.289
   86   2HB   ASP  10          3HB       ASP  10  -3.342   8.479   9.188
   87    H    GLY  11           H        GLY  11  -0.892   9.334   8.239
   88   1HA   GLY  11          1HA       GLY  11   0.659   9.365   9.988
   89   2HA   GLY  11          2HA       GLY  11   0.612   7.608  10.114
   90    H    LEU  12           H        LEU  12   1.228   9.408   7.035
   91    HA   LEU  12           HA       LEU  12   4.080   9.435   7.391
   92   1HB   LEU  12          2HB       LEU  12   4.457   8.119   5.230
   93   2HB   LEU  12          3HB       LEU  12   4.159   7.256   6.727
   94    HG   LEU  12           HG       LEU  12   1.936   6.650   6.096
   95   1HD1  LEU  12          1HD1      LEU  12   1.017   8.581   4.955
   96   2HD1  LEU  12          2HD1      LEU  12   2.281   8.500   3.702
   97   3HD1  LEU  12          3HD1      LEU  12   1.025   7.248   3.809
   98   1HD2  LEU  12          1HD2      LEU  12   2.458   5.223   4.300
   99   2HD2  LEU  12          2HD2      LEU  12   3.625   6.371   3.592
  100   3HD2  LEU  12          3HD2      LEU  12   4.006   5.510   5.092
  101    H    SER  13           H        SER  13   5.090  10.296   5.262
  102    HA   SER  13           HA       SER  13   3.449  11.728   3.387
  103   1HB   SER  13          2HB       SER  13   2.918  13.155   5.336
  104   2HB   SER  13          3HB       SER  13   4.646  13.322   5.701
  105    HG   SER  13           HG       SER  13   4.888  14.350   3.698
  106    H    CYS  14           H        CYS  14   5.370  10.111   2.590
  107    HA   CYS  14           HA       CYS  14   7.573  11.918   1.755
  108   1HB   CYS  14          2HB       CYS  14   7.903   9.606   3.600
  109   2HB   CYS  14          3HB       CYS  14   8.943   9.545   2.170
  110    HG   CYS  14           HG       CYS  14   9.841  11.984   2.350
  111    H    THR  15           H        THR  15   7.645  11.877  -0.414
  112    HA   THR  15           HA       THR  15   6.379  10.135  -2.100
  113    HB   THR  15           HB       THR  15   9.042  11.520  -2.653
  114    HG1  THR  15           1HG      THR  15   6.432  12.624  -2.611
  115   1HG2  THR  15          1HG2      THR  15   6.596  10.978  -4.405
  116   2HG2  THR  15          2HG2      THR  15   8.031  11.909  -4.882
  117   3HG2  THR  15          3HG2      THR  15   8.175  10.176  -4.534
  118    H    ASN  16           H        ASN  16   9.861   9.933  -1.078
  119    HA   ASN  16           HA       ASN  16  10.538   7.640  -2.436
  120   1HB   ASN  16          2HB       ASN  16  11.442   8.510   0.338
  121   2HB   ASN  16          3HB       ASN  16  12.245   7.282  -0.651
  122   1HD2  ASN  16          1HD2      ASN  16  13.782   7.984  -2.166
  123   2HD2  ASN  16          2HD2      ASN  16  13.992   9.671  -2.595
  124    H    CYS  17           H        CYS  17   8.890   7.901   0.740
  125    HA   CYS  17           HA       CYS  17   8.901   5.075   1.287
  126   1HB   CYS  17          2HB       CYS  17   7.154   7.312   2.417
  127   2HB   CYS  17          3HB       CYS  17   7.100   5.607   2.885
  128    HG   CYS  17           HG       CYS  17   8.511   6.576   4.752
  129    H    ALA  18           H        ALA  18   6.478   7.316  -0.143
  130    HA   ALA  18           HA       ALA  18   4.454   5.422  -0.629
  131   1HB   ALA  18          1HB       ALA  18   5.225   7.824  -2.357
  132   2HB   ALA  18          2HB       ALA  18   3.669   6.987  -2.367
  133   3HB   ALA  18          3HB       ALA  18   4.187   7.883  -0.920
  134    H    ALA  19           H        ALA  19   7.240   6.314  -2.631
  135    HA   ALA  19           HA       ALA  19   6.554   4.669  -4.886
  136   1HB   ALA  19          1HB       ALA  19   8.862   5.114  -5.623
  137   2HB   ALA  19          2HB       ALA  19   8.066   6.596  -5.056
  138   3HB   ALA  19          3HB       ALA  19   9.260   5.781  -4.024
  139    H    LYS  20           H        LYS  20   8.864   4.214  -2.171
  140    HA   LYS  20           HA       LYS  20   9.710   1.584  -2.772
  141   1HB   LYS  20          2HB       LYS  20  10.799   2.874  -1.096
  142   2HB   LYS  20          3HB       LYS  20   9.317   3.060  -0.144
  143   1HG   LYS  20          2HG       LYS  20   9.314   0.797   0.555
  144   2HG   LYS  20          3HG       LYS  20  10.514   0.299  -0.645
  145   1HD   LYS  20          2HD       LYS  20  12.263   1.575   0.438
  146   2HD   LYS  20          3HD       LYS  20  11.088   2.417   1.474
  147   1HE   LYS  20          2HE       LYS  20  10.517   0.311   2.599
  148   2HE   LYS  20          3HE       LYS  20  11.670  -0.583   1.600
  149   1HZ   LYS  20          1HZ       LYS  20  12.543  -0.002   3.771
  150   2HZ   LYS  20          2HZ       LYS  20  13.425   0.730   2.592
  151   3HZ   LYS  20          3HZ       LYS  20  12.337   1.601   3.474
  152    H    PHE  21           H        PHE  21   6.873   2.720  -0.876
  153    HA   PHE  21           HA       PHE  21   5.747   0.224  -0.296
  154   1HB   PHE  21          2HB       PHE  21   4.786   3.011  -0.352
  155   2HB   PHE  21          3HB       PHE  21   3.572   1.889  -0.862
  156    HD1  PHE  21           1HD      PHE  21   4.511   3.593   1.886
  157    HD2  PHE  21           2HD      PHE  21   3.551  -0.422   0.631
  158    HE1  PHE  21           1HE      PHE  21   3.569   3.122   4.100
  159    HE2  PHE  21           2HE      PHE  21   2.637  -0.897   2.883
  160    HZ   PHE  21           HZ       PHE  21   2.498   0.917   4.566
  161    H    GLU  22           H        GLU  22   5.017   2.319  -3.207
  162    HA   GLU  22           HA       GLU  22   3.186   0.487  -4.266
  163   1HB   GLU  22          2HB       GLU  22   2.996   1.803  -6.081
  164   2HB   GLU  22          3HB       GLU  22   3.835   2.960  -5.025
  165   1HG   GLU  22          2HG       GLU  22   5.853   2.720  -6.145
  166   2HG   GLU  22          3HG       GLU  22   5.288   1.355  -7.135
  167    H    ARG  23           H        ARG  23   6.711   0.740  -4.809
  168    HA   ARG  23           HA       ARG  23   6.916  -1.404  -6.683
  169   1HB   ARG  23          2HB       ARG  23   8.745   0.317  -5.946
  170   2HB   ARG  23          3HB       ARG  23   9.062  -0.794  -4.604
  171   1HG   ARG  23          2HG       ARG  23   9.202  -2.637  -6.519
  172   2HG   ARG  23          3HG       ARG  23   9.323  -1.240  -7.593
  173   1HD   ARG  23          2HD       ARG  23  11.554  -1.755  -7.180
  174   2HD   ARG  23          3HD       ARG  23  11.237  -0.453  -6.012
  175    HE   ARG  23           HE       ARG  23  10.840  -3.267  -5.058
  176   1HH1  ARG  23          2HH2      ARG  23  13.223  -0.679  -5.353
  177   2HH1  ARG  23          1HH2      ARG  23  14.301  -1.376  -4.178
  178   1HH2  ARG  23          2HH1      ARG  23  12.147  -4.179  -3.694
  179   2HH2  ARG  23          1HH1      ARG  23  13.672  -3.489  -3.137
  180    H    ASN  24           H        ASN  24   7.317  -1.385  -3.098
  181    HA   ASN  24           HA       ASN  24   7.734  -4.089  -2.597
  182   1HB   ASN  24          2HB       ASN  24   6.519  -1.815  -1.073
  183   2HB   ASN  24          3HB       ASN  24   6.022  -3.409  -0.558
  184   1HD2  ASN  24          1HD2      ASN  24   7.670  -4.966   0.088
  185   2HD2  ASN  24          2HD2      ASN  24   9.107  -4.345   0.865
  186    H    VAL  25           H        VAL  25   4.567  -2.435  -3.042
  187    HA   VAL  25           HA       VAL  25   3.007  -4.858  -2.845
  188    HB   VAL  25           HB       VAL  25   2.358  -2.248  -4.306
  189   1HG1  VAL  25          1HG1      VAL  25   0.894  -4.029  -5.085
  190   2HG1  VAL  25          2HG1      VAL  25   0.609  -4.587  -3.419
  191   3HG1  VAL  25          3HG1      VAL  25  -0.001  -3.011  -3.949
  192   1HG2  VAL  25          1HG2      VAL  25   1.804  -3.237  -1.493
  193   2HG2  VAL  25          2HG2      VAL  25   2.712  -1.796  -1.923
  194   3HG2  VAL  25          3HG2      VAL  25   0.976  -1.838  -2.217
  195    H    LYS  26           H        LYS  26   4.304  -3.127  -5.743
  196    HA   LYS  26           HA       LYS  26   3.405  -4.999  -7.648
  197   1HB   LYS  26          2HB       LYS  26   5.619  -2.965  -7.470
  198   2HB   LYS  26          3HB       LYS  26   5.517  -3.978  -8.889
  199   1HG   LYS  26          2HG       LYS  26   3.372  -3.211  -9.444
  200   2HG   LYS  26          3HG       LYS  26   3.039  -2.552  -7.831
  201   1HD   LYS  26          2HD       LYS  26   4.474  -0.706  -8.129
  202   2HD   LYS  26          3HD       LYS  26   5.264  -1.438  -9.535
  203   1HE   LYS  26          2HE       LYS  26   3.165  -1.231 -10.852
  204   2HE   LYS  26          3HE       LYS  26   2.304  -0.623  -9.424
  205   1HZ   LYS  26          1HZ       LYS  26   3.666   1.338  -9.470
  206   2HZ   LYS  26          2HZ       LYS  26   4.533   0.793 -10.740
  207   3HZ   LYS  26          3HZ       LYS  26   2.935   1.149 -10.904
  208    H    GLU  27           H        GLU  27   6.252  -5.257  -5.485
  209    HA   GLU  27           HA       GLU  27   7.302  -7.569  -6.843
  210   1HB   GLU  27          2HB       GLU  27   7.744  -6.804  -3.934
  211   2HB   GLU  27          3HB       GLU  27   8.706  -7.893  -4.944
  212   1HG   GLU  27          2HG       GLU  27   8.925  -5.761  -6.530
  213   2HG   GLU  27          3HG       GLU  27   8.509  -4.899  -5.039
  214    H    ILE  28           H        ILE  28   4.439  -7.279  -4.899
  215    HA   ILE  28           HA       ILE  28   4.559  -9.931  -3.738
  216    HB   ILE  28           HB       ILE  28   2.228  -8.157  -4.263
  217   1HG1  ILE  28          2HG1      ILE  28   3.713  -8.590  -1.626
  218   2HG1  ILE  28          3HG1      ILE  28   3.962  -7.202  -2.684
  219   1HG2  ILE  28          1HG2      ILE  28   0.978  -9.516  -2.636
  220   2HG2  ILE  28          2HG2      ILE  28   1.522 -10.522  -3.957
  221   3HG2  ILE  28          3HG2      ILE  28   2.395 -10.565  -2.413
  222   1HD1  ILE  28          1HD1      ILE  28   1.381  -7.877  -1.238
  223   2HD1  ILE  28          2HD1      ILE  28   2.464  -6.512  -0.952
  224   3HD1  ILE  28          3HD1      ILE  28   1.536  -6.615  -2.465
  225    H    GLU  29           H        GLU  29   4.470 -11.655  -4.876
  226    HA   GLU  29           HA       GLU  29   3.499 -12.043  -7.552
  227   1HB   GLU  29          2HB       GLU  29   4.339 -13.784  -5.193
  228   2HB   GLU  29          3HB       GLU  29   3.751 -14.485  -6.680
  229   1HG   GLU  29          2HG       GLU  29   6.025 -12.498  -6.859
  230   2HG   GLU  29          3HG       GLU  29   6.343 -14.153  -6.321
  231    H    GLY  30           H        GLY  30   1.410 -11.345  -7.648
  232   1HA   GLY  30          1HA       GLY  30  -0.723 -13.012  -7.434
  233   2HA   GLY  30          2HA       GLY  30  -0.665 -12.329  -5.797
  234    H    VAL  31           H        VAL  31   0.361  -9.656  -6.659
  235    HA   VAL  31           HA       VAL  31  -2.271  -8.605  -7.335
  236    HB   VAL  31           HB       VAL  31  -0.799  -7.719  -5.517
  237   1HG1  VAL  31          1HG1      VAL  31   0.894  -6.093  -6.080
  238   2HG1  VAL  31          2HG1      VAL  31   1.370  -7.673  -6.710
  239   3HG1  VAL  31          3HG1      VAL  31   0.745  -6.432  -7.815
  240   1HG2  VAL  31          1HG2      VAL  31  -1.463  -5.449  -5.872
  241   2HG2  VAL  31          2HG2      VAL  31  -1.565  -5.705  -7.626
  242   3HG2  VAL  31          3HG2      VAL  31  -2.714  -6.528  -6.537
  243    H    THR  32           H        THR  32  -2.552  -7.038  -9.104
  244    HA   THR  32           HA       THR  32  -0.862  -7.649 -11.499
  245    HB   THR  32           HB       THR  32  -3.802  -6.858 -11.413
  246    HG1  THR  32           1HG      THR  32  -2.622  -9.209 -11.019
  247   1HG2  THR  32          1HG2      THR  32  -2.671  -6.126 -13.481
  248   2HG2  THR  32          2HG2      THR  32  -1.977  -7.746 -13.695
  249   3HG2  THR  32          3HG2      THR  32  -3.732  -7.506 -13.811
  250    H    GLU  33           H        GLU  33  -3.065  -5.172 -10.055
  251    HA   GLU  33           HA       GLU  33  -0.916  -3.146 -10.722
  252   1HB   GLU  33          2HB       GLU  33  -3.902  -2.640 -11.033
  253   2HB   GLU  33          3HB       GLU  33  -2.601  -1.458 -11.181
  254   1HG   GLU  33          2HG       GLU  33  -1.641  -2.880 -13.043
  255   2HG   GLU  33          3HG       GLU  33  -3.125  -3.848 -12.979
  256    H    ALA  34           H        ALA  34  -0.810  -1.300  -9.327
  257    HA   ALA  34           HA       ALA  34  -2.598  -1.245  -7.052
  258   1HB   ALA  34          1HB       ALA  34  -0.772  -1.087  -5.376
  259   2HB   ALA  34          2HB       ALA  34  -0.801  -2.679  -6.166
  260   3HB   ALA  34          3HB       ALA  34   0.425  -1.477  -6.633
  261    H    ILE  35           H        ILE  35  -2.943   0.900  -6.469
  262    HA   ILE  35           HA       ILE  35  -1.275   2.965  -7.887
  263    HB   ILE  35           HB       ILE  35  -4.309   2.954  -7.658
  264   1HG1  ILE  35          2HG1      ILE  35  -2.768   2.922 -10.263
  265   2HG1  ILE  35          3HG1      ILE  35  -3.193   1.403  -9.472
  266   1HG2  ILE  35          1HG2      ILE  35  -2.366   4.941  -8.906
  267   2HG2  ILE  35          2HG2      ILE  35  -4.134   5.039  -9.009
  268   3HG2  ILE  35          3HG2      ILE  35  -3.338   5.202  -7.444
  269   1HD1  ILE  35          1HD1      ILE  35  -5.560   1.959  -9.466
  270   2HD1  ILE  35          2HD1      ILE  35  -5.229   3.507 -10.274
  271   3HD1  ILE  35          3HD1      ILE  35  -4.888   1.978 -11.106
  272    H    VAL  36           H        VAL  36  -0.154   3.686  -6.081
  273    HA   VAL  36           HA       VAL  36  -1.735   3.921  -3.572
  274    HB   VAL  36           HB       VAL  36   0.044   3.155  -2.416
  275   1HG1  VAL  36          1HG1      VAL  36   0.456   1.550  -4.972
  276   2HG1  VAL  36          2HG1      VAL  36   0.545   0.991  -3.297
  277   3HG1  VAL  36          3HG1      VAL  36  -1.024   1.412  -4.020
  278   1HG2  VAL  36          1HG2      VAL  36   2.329   2.802  -3.365
  279   2HG2  VAL  36          2HG2      VAL  36   1.773   3.590  -4.874
  280   3HG2  VAL  36          3HG2      VAL  36   1.894   4.515  -3.375
  281    H    ASN  37           H        ASN  37  -1.881   5.833  -2.529
  282    HA   ASN  37           HA       ASN  37  -0.403   8.135  -3.707
  283   1HB   ASN  37          2HB       ASN  37  -2.510   8.008  -1.532
  284   2HB   ASN  37          3HB       ASN  37  -1.798   9.471  -2.220
  285   1HD2  ASN  37          1HD2      ASN  37  -3.816   6.605  -3.021
  286   2HD2  ASN  37          2HD2      ASN  37  -4.570   7.352  -4.427
  287    H    PHE  38           H        PHE  38  -0.914   6.564  -0.526
  288    HA   PHE  38           HA       PHE  38   0.130   6.840   1.476
  289   1HB   PHE  38          2HB       PHE  38   2.380   6.334  -0.465
  290   2HB   PHE  38          3HB       PHE  38   2.686   6.431   1.266
  291    HD1  PHE  38           1HD      PHE  38   2.098   4.088  -1.246
  292    HD2  PHE  38           2HD      PHE  38   1.003   5.063   2.768
  293    HE1  PHE  38           1HE      PHE  38   1.242   1.770  -0.915
  294    HE2  PHE  38           2HE      PHE  38   0.411   2.695   3.183
  295    HZ   PHE  38           HZ       PHE  38   0.468   1.056   1.332
  296    H    GLY  39           H        GLY  39  -0.747   9.154   1.052
  297   1HA   GLY  39          1HA       GLY  39   1.071  10.756   2.565
  298   2HA   GLY  39          2HA       GLY  39   0.942  11.367   0.896
  299    H    ALA  40           H        ALA  40  -1.082  10.212   3.604
  300    HA   ALA  40           HA       ALA  40  -3.002  10.937   4.566
  301   1HB   ALA  40          1HB       ALA  40  -1.829  13.134   4.720
  302   2HB   ALA  40          2HB       ALA  40  -2.529  13.605   3.156
  303   3HB   ALA  40          3HB       ALA  40  -3.586  13.287   4.538
  304    H    SER  41           H        SER  41  -3.335   9.276   2.587
  305    HA   SER  41           HA       SER  41  -5.763  10.099   1.212
  306   1HB   SER  41          2HB       SER  41  -3.151   9.779  -0.274
  307   2HB   SER  41          3HB       SER  41  -4.723   9.552  -1.094
  308    HG   SER  41           HG       SER  41  -4.249  11.876   0.403
  309    H    LYS  42           H        LYS  42  -4.290   7.618  -0.607
  310    HA   LYS  42           HA       LYS  42  -5.172   5.448   1.082
  311   1HB   LYS  42          2HB       LYS  42  -7.049   4.800  -0.421
  312   2HB   LYS  42          3HB       LYS  42  -7.289   6.287   0.480
  313   1HG   LYS  42          2HG       LYS  42  -6.344   7.333  -1.868
  314   2HG   LYS  42          3HG       LYS  42  -7.135   5.879  -2.464
  315   1HD   LYS  42          2HD       LYS  42  -8.343   8.006  -0.637
  316   2HD   LYS  42          3HD       LYS  42  -8.620   7.881  -2.377
  317   1HE   LYS  42          2HE       LYS  42  -9.935   5.931  -2.197
  318   2HE   LYS  42          3HE       LYS  42  -9.324   5.504  -0.596
  319   1HZ   LYS  42          1HZ       LYS  42 -11.098   7.817  -0.993
  320   2HZ   LYS  42          2HZ       LYS  42 -11.595   6.303  -0.582
  321   3HZ   LYS  42          3HZ       LYS  42 -10.713   7.054   0.445
  322    H    ILE  43           H        ILE  43  -5.192   3.379  -0.068
  323    HA   ILE  43           HA       ILE  43  -3.128   3.186  -2.192
  324    HB   ILE  43           HB       ILE  43  -1.947   2.774  -0.252
  325   1HG1  ILE  43          2HG1      ILE  43  -1.684   0.972  -2.022
  326   2HG1  ILE  43          3HG1      ILE  43  -1.071   0.648  -0.417
  327   1HG2  ILE  43          1HG2      ILE  43  -4.236   1.121   0.819
  328   2HG2  ILE  43          2HG2      ILE  43  -2.605   1.153   1.512
  329   3HG2  ILE  43          3HG2      ILE  43  -3.569   2.632   1.469
  330   1HD1  ILE  43          1HD1      ILE  43  -3.589  -0.564  -1.580
  331   2HD1  ILE  43          2HD1      ILE  43  -2.039  -1.330  -1.212
  332   3HD1  ILE  43          3HD1      ILE  43  -3.052  -0.757   0.105
  333    H    THR  44           H        THR  44  -4.043   2.303  -3.949
  334    HA   THR  44           HA       THR  44  -6.315   0.420  -3.632
  335    HB   THR  44           HB       THR  44  -5.252   1.764  -6.121
  336    HG1  THR  44           1HG      THR  44  -6.614   2.659  -4.135
  337   1HG2  THR  44          1HG2      THR  44  -7.811   0.182  -5.647
  338   2HG2  THR  44          2HG2      THR  44  -7.423   1.110  -7.106
  339   3HG2  THR  44          3HG2      THR  44  -6.456  -0.309  -6.684
  340    H    VAL  45           H        VAL  45  -6.127  -1.640  -4.201
  341    HA   VAL  45           HA       VAL  45  -3.647  -2.690  -5.469
  342    HB   VAL  45           HB       VAL  45  -5.149  -3.527  -2.998
  343   1HG1  VAL  45          1HG1      VAL  45  -4.115  -5.798  -3.144
  344   2HG1  VAL  45          2HG1      VAL  45  -5.417  -5.559  -4.320
  345   3HG1  VAL  45          3HG1      VAL  45  -3.718  -5.480  -4.838
  346   1HG2  VAL  45          1HG2      VAL  45  -2.217  -3.798  -3.758
  347   2HG2  VAL  45          2HG2      VAL  45  -2.903  -2.342  -3.022
  348   3HG2  VAL  45          3HG2      VAL  45  -2.929  -3.881  -2.131
  349    H    THR  46           H        THR  46  -4.088  -4.129  -7.148
  350    HA   THR  46           HA       THR  46  -6.831  -5.053  -7.594
  351    HB   THR  46           HB       THR  46  -5.219  -3.234  -9.423
  352    HG1  THR  46           1HG      THR  46  -7.125  -3.073  -7.713
  353   1HG2  THR  46          1HG2      THR  46  -7.632  -4.970 -10.151
  354   2HG2  THR  46          2HG2      THR  46  -7.023  -3.609 -11.122
  355   3HG2  THR  46          3HG2      THR  46  -6.015  -5.045 -10.893
  356    H    GLY  47           H        GLY  47  -6.759  -7.070  -8.171
  357   1HA   GLY  47          1HA       GLY  47  -5.290  -8.303 -10.015
  358   2HA   GLY  47          2HA       GLY  47  -4.110  -8.245  -8.738
  359    H    GLU  48           H        GLU  48  -4.208  -9.451  -6.975
  360    HA   GLU  48           HA       GLU  48  -6.554 -10.714  -5.882
  361   1HB   GLU  48          2HB       GLU  48  -5.789 -12.138  -7.965
  362   2HB   GLU  48          3HB       GLU  48  -4.467 -12.668  -6.927
  363   1HG   GLU  48          2HG       GLU  48  -6.161 -13.510  -5.290
  364   2HG   GLU  48          3HG       GLU  48  -7.460 -12.901  -6.337
  365    H    ALA  49           H        ALA  49  -5.130  -8.921  -4.573
  366    HA   ALA  49           HA       ALA  49  -3.842 -10.494  -2.460
  367   1HB   ALA  49          1HB       ALA  49  -2.535  -8.084  -3.809
  368   2HB   ALA  49          2HB       ALA  49  -1.984  -8.806  -2.287
  369   3HB   ALA  49          3HB       ALA  49  -1.909  -9.750  -3.788
  370    H    SER  50           H        SER  50  -3.674  -9.132  -0.459
  371    HA   SER  50           HA       SER  50  -5.793  -7.024  -0.326
  372   1HB   SER  50          2HB       SER  50  -5.319  -9.349   1.591
  373   2HB   SER  50          3HB       SER  50  -6.513  -8.068   1.801
  374    HG   SER  50           HG       SER  50  -7.302  -8.877  -0.396
  375    H    ILE  51           H        ILE  51  -5.646  -5.669   1.635
  376    HA   ILE  51           HA       ILE  51  -3.255  -4.431   1.834
  377    HB   ILE  51           HB       ILE  51  -5.449  -3.600   2.878
  378   1HG1  ILE  51          2HG1      ILE  51  -3.569  -2.199   2.711
  379   2HG1  ILE  51          3HG1      ILE  51  -4.462  -2.003   4.212
  380   1HG2  ILE  51          1HG2      ILE  51  -4.281  -4.783   5.430
  381   2HG2  ILE  51          2HG2      ILE  51  -5.704  -3.757   5.262
  382   3HG2  ILE  51          3HG2      ILE  51  -5.726  -5.397   4.589
  383   1HD1  ILE  51          1HD1      ILE  51  -2.593  -3.555   5.256
  384   2HD1  ILE  51          2HD1      ILE  51  -1.683  -3.096   3.795
  385   3HD1  ILE  51          3HD1      ILE  51  -2.214  -1.898   4.934
  386    H    GLN  52           H        GLN  52  -4.191  -7.048   4.114
  387    HA   GLN  52           HA       GLN  52  -2.279  -7.180   5.965
  388   1HB   GLN  52          2HB       GLN  52  -3.203  -9.406   4.104
  389   2HB   GLN  52          3HB       GLN  52  -2.224  -9.724   5.534
  390   1HG   GLN  52          2HG       GLN  52  -4.931  -8.315   5.627
  391   2HG   GLN  52          3HG       GLN  52  -4.693 -10.052   5.846
  392   1HE2  GLN  52          1HE2      GLN  52  -5.934  -8.717   7.893
  393   2HE2  GLN  52          2HE2      GLN  52  -4.819  -8.582   9.242
  394    H    GLN  53           H        GLN  53  -1.626  -8.169   2.602
  395    HA   GLN  53           HA       GLN  53   1.104  -9.024   3.089
  396   1HB   GLN  53          2HB       GLN  53  -0.342  -8.249   0.546
  397   2HB   GLN  53          3HB       GLN  53   1.212  -9.109   0.643
  398   1HG   GLN  53          2HG       GLN  53   0.223 -11.061   1.564
  399   2HG   GLN  53          3HG       GLN  53  -1.267 -10.240   2.019
  400   1HE2  GLN  53          1HE2      GLN  53   0.571 -11.405  -0.812
  401   2HE2  GLN  53          2HE2      GLN  53  -0.839 -11.470  -1.848
  402    H    VAL  54           H        VAL  54  -0.437  -6.045   1.945
  403    HA   VAL  54           HA       VAL  54   2.001  -4.577   1.388
  404    HB   VAL  54           HB       VAL  54  -0.850  -3.535   1.769
  405   1HG1  VAL  54          1HG1      VAL  54   0.649  -1.730   1.916
  406   2HG1  VAL  54          2HG1      VAL  54   1.654  -2.325   0.583
  407   3HG1  VAL  54          3HG1      VAL  54   0.013  -1.710   0.272
  408   1HG2  VAL  54          1HG2      VAL  54   0.510  -4.759  -0.638
  409   2HG2  VAL  54          2HG2      VAL  54  -1.064  -5.140   0.064
  410   3HG2  VAL  54          3HG2      VAL  54  -0.840  -3.608  -0.783
  411    H    GLU  55           H        GLU  55  -0.156  -5.095   4.155
  412    HA   GLU  55           HA       GLU  55   0.669  -3.035   5.844
  413   1HB   GLU  55          2HB       GLU  55  -1.174  -4.943   6.120
  414   2HB   GLU  55          3HB       GLU  55   0.098  -5.730   7.048
  415   1HG   GLU  55          2HG       GLU  55  -0.985  -2.923   7.538
  416   2HG   GLU  55          3HG       GLU  55  -1.315  -4.370   8.504
  417    H    GLN  56           H        GLN  56   1.694  -6.451   5.566
  418    HA   GLN  56           HA       GLN  56   3.896  -6.461   7.239
  419   1HB   GLN  56          2HB       GLN  56   2.796  -8.407   6.189
  420   2HB   GLN  56          3HB       GLN  56   3.612  -8.075   4.660
  421   1HG   GLN  56          2HG       GLN  56   5.277  -8.358   7.181
  422   2HG   GLN  56          3HG       GLN  56   4.527  -9.796   6.484
  423   1HE2  GLN  56          1HE2      GLN  56   6.582 -10.738   6.000
  424   2HE2  GLN  56          2HE2      GLN  56   7.520 -10.134   4.643
  425    H    ALA  57           H        ALA  57   3.929  -5.611   3.701
  426    HA   ALA  57           HA       ALA  57   6.661  -4.868   3.623
  427   1HB   ALA  57          1HB       ALA  57   6.037  -3.390   1.768
  428   2HB   ALA  57          2HB       ALA  57   5.311  -5.007   1.600
  429   3HB   ALA  57          3HB       ALA  57   4.320  -3.626   2.119
  430    H    GLY  58           H        GLY  58   3.784  -2.833   4.519
  431   1HA   GLY  58          1HA       GLY  58   5.089  -0.384   4.852
  432   2HA   GLY  58          2HA       GLY  58   3.561  -0.920   5.598
  433    H    ALA  59           H        ALA  59   4.984  -3.241   6.944
  434    HA   ALA  59           HA       ALA  59   5.729  -2.260   9.401
  435   1HB   ALA  59          1HB       ALA  59   7.147  -4.595   8.086
  436   2HB   ALA  59          2HB       ALA  59   6.892  -4.306   9.810
  437   3HB   ALA  59          3HB       ALA  59   5.501  -4.685   8.775
  438    H    PHE  60           H        PHE  60   7.688  -1.921   6.437
  439    HA   PHE  60           HA       PHE  60  10.169  -1.403   7.687
  440   1HB   PHE  60          2HB       PHE  60  10.827  -0.179   5.803
  441   2HB   PHE  60          3HB       PHE  60   9.915  -1.586   5.277
  442    HD1  PHE  60           1HD      PHE  60   9.747   2.140   5.742
  443    HD2  PHE  60           2HD      PHE  60   8.267  -1.273   3.575
  444    HE1  PHE  60           1HE      PHE  60   8.354   3.630   4.340
  445    HE2  PHE  60           2HE      PHE  60   6.850   0.210   2.197
  446    HZ   PHE  60           HZ       PHE  60   6.912   2.660   2.538
  447    H    GLU  61           H        GLU  61   7.302   0.618   7.565
  448    HA   GLU  61           HA       GLU  61   8.628   2.655   9.320
  449   1HB   GLU  61          2HB       GLU  61   8.491   3.406   7.068
  450   2HB   GLU  61          3HB       GLU  61   6.779   3.031   6.943
  451   1HG   GLU  61          2HG       GLU  61   6.282   4.912   8.451
  452   2HG   GLU  61          3HG       GLU  61   8.016   5.149   8.750
  453    H    HIS  62           H        HIS  62   6.006   0.441   9.023
  454    HA   HIS  62           HA       HIS  62   4.598  -0.308  10.587
  455   1HB   HIS  62          2HB       HIS  62   5.305   1.915  12.514
  456   2HB   HIS  62          3HB       HIS  62   4.681   0.307  12.852
  457    HD1  HIS  62           1HD      HIS  62   7.187  -1.136  11.047
  458    HD2  HIS  62           2HD      HIS  62   7.365   1.783  14.081
  459    HE1  HIS  62           1HE      HIS  62   9.471  -1.326  12.099
  460    H    LEU  63           H        LEU  63   3.226   0.764   8.671
  461    HA   LEU  63           HA       LEU  63   1.846   3.231   9.573
  462   1HB   LEU  63          2HB       LEU  63   1.566   1.571   7.037
  463   2HB   LEU  63          3HB       LEU  63   0.746   3.095   7.362
  464    HG   LEU  63           HG       LEU  63   2.471   3.686   6.028
  465   1HD1  LEU  63          1HD1      LEU  63   3.913   5.159   7.337
  466   2HD1  LEU  63          2HD1      LEU  63   2.272   5.179   8.020
  467   3HD1  LEU  63          3HD1      LEU  63   3.592   4.277   8.810
  468   1HD2  LEU  63          1HD2      LEU  63   4.740   3.090   6.102
  469   2HD2  LEU  63          2HD2      LEU  63   4.614   2.376   7.711
  470   3HD2  LEU  63          3HD2      LEU  63   3.858   1.566   6.328
  471    H    LYS  64           H        LYS  64  -0.667   3.249   8.871
  472    HA   LYS  64           HA       LYS  64  -1.982   0.852   9.979
  473   1HB   LYS  64          2HB       LYS  64  -3.462   2.377  11.311
  474   2HB   LYS  64          3HB       LYS  64  -1.824   2.123  11.906
  475   1HG   LYS  64          2HG       LYS  64  -1.758   4.349  12.214
  476   2HG   LYS  64          3HG       LYS  64  -1.366   4.419  10.524
  477   1HD   LYS  64          2HD       LYS  64  -3.057   5.840  10.382
  478   2HD   LYS  64          3HD       LYS  64  -4.071   4.418  10.262
  479   1HE   LYS  64          2HE       LYS  64  -3.428   6.017  12.803
  480   2HE   LYS  64          3HE       LYS  64  -4.973   6.008  11.943
  481   1HZ   LYS  64          1HZ       LYS  64  -5.223   3.697  12.514
  482   2HZ   LYS  64          2HZ       LYS  64  -3.760   3.668  13.263
  483   3HZ   LYS  64          3HZ       LYS  64  -4.983   4.578  13.882
  484    H    ILE  65           H        ILE  65  -3.123   0.201   8.292
  485    HA   ILE  65           HA       ILE  65  -4.389   2.222   6.547
  486    HB   ILE  65           HB       ILE  65  -3.732  -0.536   5.640
  487   1HG1  ILE  65          2HG1      ILE  65  -1.761   1.697   5.877
  488   2HG1  ILE  65          3HG1      ILE  65  -1.602  -0.060   6.120
  489   1HG2  ILE  65          1HG2      ILE  65  -3.939   0.374   3.421
  490   2HG2  ILE  65          2HG2      ILE  65  -5.327   0.891   4.382
  491   3HG2  ILE  65          3HG2      ILE  65  -4.022   2.030   4.053
  492   1HD1  ILE  65          1HD1      ILE  65  -1.611   1.448   3.492
  493   2HD1  ILE  65          2HD1      ILE  65  -0.287   0.547   4.231
  494   3HD1  ILE  65          3HD1      ILE  65  -1.686  -0.312   3.578
  495    H    ILE  66           H        ILE  66  -6.594   1.949   6.200
  496    HA   ILE  66           HA       ILE  66  -7.937  -0.258   7.684
  497    HB   ILE  66           HB       ILE  66  -8.424   2.732   7.772
  498   1HG1  ILE  66          2HG1      ILE  66  -7.935   0.870  10.133
  499   2HG1  ILE  66          3HG1      ILE  66  -6.584   1.592   9.266
  500   1HG2  ILE  66          1HG2      ILE  66 -10.086   0.523   9.069
  501   2HG2  ILE  66          2HG2      ILE  66 -10.301   2.258   9.321
  502   3HG2  ILE  66          3HG2      ILE  66 -10.618   1.571   7.736
  503   1HD1  ILE  66          1HD1      ILE  66  -8.755   3.199  10.636
  504   2HD1  ILE  66          2HD1      ILE  66  -7.095   2.932  11.191
  505   3HD1  ILE  66          3HD1      ILE  66  -7.388   3.847   9.700
  506    HA   PRO  67           HA       PRO  67 -10.324  -0.343   3.822
  507   1HB   PRO  67          2HB       PRO  67 -12.312  -2.078   4.538
  508   2HB   PRO  67          3HB       PRO  67 -10.638  -2.602   4.231
  509   1HG   PRO  67          2HG       PRO  67 -11.913  -2.014   6.905
  510   2HG   PRO  67          3HG       PRO  67 -10.944  -3.443   6.438
  511   1HD   PRO  67          2HD       PRO  67  -9.864  -1.354   7.770
  512   2HD   PRO  67          3HD       PRO  67  -8.928  -2.201   6.507
  513    H    GLU  68           H        GLU  68 -10.814   1.900   4.014
  514    HA   GLU  68           HA       GLU  68 -12.937   3.110   5.310
  515   1HB   GLU  68          2HB       GLU  68 -10.986   3.984   3.902
  516   2HB   GLU  68          3HB       GLU  68 -11.975   3.684   2.463
  517   1HG   GLU  68          2HG       GLU  68 -13.753   5.151   3.677
  518   2HG   GLU  68          3HG       GLU  68 -12.431   5.559   4.775
  519    H    LYS  69           H        LYS  69 -14.664   1.437   5.295
  520    HA   LYS  69           HA       LYS  69 -16.487   1.790   2.981
  521   1HB   LYS  69          2HB       LYS  69 -15.117  -0.116   2.427
  522   2HB   LYS  69          3HB       LYS  69 -15.434  -0.893   3.972
  523   1HG   LYS  69          2HG       LYS  69 -17.674  -0.220   2.001
  524   2HG   LYS  69          3HG       LYS  69 -16.647  -1.652   1.823
  525   1HD   LYS  69          2HD       LYS  69 -17.309  -2.082   4.372
  526   2HD   LYS  69          3HD       LYS  69 -18.701  -1.081   3.968
  527   1HE   LYS  69          2HE       LYS  69 -17.827  -3.623   2.496
  528   2HE   LYS  69          3HE       LYS  69 -19.113  -3.519   3.708
  529   1HZ   LYS  69          1HZ       LYS  69 -20.016  -3.437   1.492
  530   2HZ   LYS  69          2HZ       LYS  69 -20.308  -2.045   2.299
  531   3HZ   LYS  69          3HZ       LYS  69 -19.160  -2.066   1.147
  532    H    GLU  70           H        GLU  70 -18.039   2.818   4.102
  533    HA   GLU  70           HA       GLU  70 -19.777   3.197   5.477
  534   1HB   GLU  70          2HB       GLU  70 -19.916   0.163   5.566
  535   2HB   GLU  70          3HB       GLU  70 -21.218   1.283   5.971
  536   1HG   GLU  70          2HG       GLU  70 -21.259   2.179   3.693
  537   2HG   GLU  70          3HG       GLU  70 -19.886   1.170   3.216
  538    H    ALA  71           H        ALA  71 -18.242   4.194   6.996
  539    HA   ALA  71           HA       ALA  71 -18.545   3.194   9.667
  540   1HB   ALA  71          1HB       ALA  71 -16.120   3.477  10.161
  541   2HB   ALA  71          2HB       ALA  71 -16.372   2.132   9.023
  542   3HB   ALA  71          3HB       ALA  71 -15.789   3.706   8.431
  Start of MODEL   20
    1   1H    MET   1           H1       MET   1 -11.271 -13.281  -8.931
    2   2H    MET   1           H2       MET   1 -12.532 -14.372  -8.993
    3   3H    MET   1           H3       MET   1 -12.805 -12.730  -8.838
    4    HA   MET   1           HA       MET   1 -13.039 -13.514  -6.665
    5   1HB   MET   1          2HB       MET   1 -10.769 -15.232  -7.577
    6   2HB   MET   1          3HB       MET   1 -10.692 -14.734  -5.895
    7   1HG   MET   1          2HG       MET   1 -13.308 -15.900  -6.820
    8   2HG   MET   1          3HG       MET   1 -11.897 -16.953  -6.811
    9   1HE   MET   1          1HE       MET   1 -13.644 -15.119  -2.967
   10   2HE   MET   1          2HE       MET   1 -12.936 -14.085  -4.220
   11   3HE   MET   1          3HE       MET   1 -14.432 -14.995  -4.558
   12    H    ALA   2           H        ALA   2 -11.743 -12.592  -4.791
   13    HA   ALA   2           HA       ALA   2 -11.134 -10.508  -4.017
   14   1HB   ALA   2          1HB       ALA   2  -9.412 -12.122  -3.462
   15   2HB   ALA   2          2HB       ALA   2  -8.573 -11.793  -4.986
   16   3HB   ALA   2          3HB       ALA   2  -8.688 -10.525  -3.750
   17    H    GLU   3           H        GLU   3 -12.331  -9.443  -5.846
   18    HA   GLU   3           HA       GLU   3 -10.983  -8.124  -7.962
   19   1HB   GLU   3          2HB       GLU   3 -13.560  -7.706  -6.415
   20   2HB   GLU   3          3HB       GLU   3 -13.062  -6.479  -7.569
   21   1HG   GLU   3          2HG       GLU   3 -13.001  -8.030  -9.396
   22   2HG   GLU   3          3HG       GLU   3 -13.268  -9.414  -8.321
   23    H    LYS   4           H        LYS   4 -11.152  -5.626  -7.977
   24    HA   LYS   4           HA       LYS   4  -8.838  -4.876  -6.499
   25   1HB   LYS   4          2HB       LYS   4  -9.114  -2.705  -7.706
   26   2HB   LYS   4          3HB       LYS   4  -9.186  -4.138  -8.748
   27   1HG   LYS   4          2HG       LYS   4 -11.799  -3.864  -8.540
   28   2HG   LYS   4          3HG       LYS   4 -11.428  -2.259  -7.913
   29   1HD   LYS   4          2HD       LYS   4 -10.207  -1.704  -9.974
   30   2HD   LYS   4          3HD       LYS   4 -10.343  -3.382 -10.538
   31   1HE   LYS   4          2HE       LYS   4 -12.875  -3.124 -10.500
   32   2HE   LYS   4          3HE       LYS   4 -12.635  -1.396 -10.190
   33   1HZ   LYS   4          1HZ       LYS   4 -12.954  -1.878 -12.517
   34   2HZ   LYS   4          2HZ       LYS   4 -11.435  -1.286 -12.289
   35   3HZ   LYS   4          3HZ       LYS   4 -11.668  -2.897 -12.542
   36    H    THR   5           H        THR   5  -8.527  -3.314  -4.883
   37    HA   THR   5           HA       THR   5 -10.908  -2.018  -3.698
   38    HB   THR   5           HB       THR   5  -9.186  -4.043  -2.170
   39    HG1  THR   5           1HG      THR   5 -11.491  -3.941  -3.487
   40   1HG2  THR   5          1HG2      THR   5 -10.686  -3.526  -0.246
   41   2HG2  THR   5          2HG2      THR   5  -9.712  -2.110  -0.661
   42   3HG2  THR   5          3HG2      THR   5 -11.415  -2.193  -1.159
   43    H    VAL   6           H        VAL   6 -10.443  -0.190  -2.630
   44    HA   VAL   6           HA       VAL   6  -7.647   0.291  -2.220
   45    HB   VAL   6           HB       VAL   6  -8.153   1.709  -3.973
   46   1HG1  VAL   6          1HG1      VAL   6 -10.758   2.542  -2.744
   47   2HG1  VAL   6          2HG1      VAL   6 -10.001   3.231  -4.208
   48   3HG1  VAL   6          3HG1      VAL   6 -10.481   1.539  -4.199
   49   1HG2  VAL   6          1HG2      VAL   6  -8.647   3.563  -1.594
   50   2HG2  VAL   6          2HG2      VAL   6  -7.048   2.971  -2.075
   51   3HG2  VAL   6          3HG2      VAL   6  -7.965   4.012  -3.170
   52    H    TYR   7           H        TYR   7  -6.958   1.079  -0.378
   53    HA   TYR   7           HA       TYR   7  -8.913   1.137   1.893
   54   1HB   TYR   7          2HB       TYR   7  -6.012   0.230   1.909
   55   2HB   TYR   7          3HB       TYR   7  -7.176   0.135   3.222
   56    HD1  TYR   7           HD1      TYR   7  -6.519  -1.190  -0.260
   57    HD2  TYR   7           HD2      TYR   7  -8.090  -1.945   3.675
   58    HE1  TYR   7           HE1      TYR   7  -6.855  -3.550  -0.851
   59    HE2  TYR   7           HE2      TYR   7  -8.449  -4.317   3.068
   60    HH   TYR   7           HH       TYR   7  -7.728  -5.645  -0.106
   61    H    ARG   8           H        ARG   8  -7.998   2.531   3.731
   62    HA   ARG   8           HA       ARG   8  -6.607   4.891   2.535
   63   1HB   ARG   8          2HB       ARG   8  -8.571   4.696   4.841
   64   2HB   ARG   8          3HB       ARG   8  -7.643   6.145   4.406
   65   1HG   ARG   8          2HG       ARG   8  -8.590   5.974   2.048
   66   2HG   ARG   8          3HG       ARG   8  -9.600   4.638   2.602
   67   1HD   ARG   8          2HD       ARG   8 -10.831   6.719   2.540
   68   2HD   ARG   8          3HD       ARG   8 -10.720   6.107   4.211
   69    HE   ARG   8           HE       ARG   8  -8.586   7.946   3.614
   70   1HH1  ARG   8          2HH2      ARG   8 -12.098   7.923   4.098
   71   2HH1  ARG   8          1HH2      ARG   8 -12.157   9.398   5.003
   72   1HH2  ARG   8          2HH1      ARG   8  -8.640  10.013   4.715
   73   2HH2  ARG   8          1HH1      ARG   8 -10.156  10.675   5.232
   74    H    VAL   9           H        VAL   9  -4.717   5.658   3.397
   75    HA   VAL   9           HA       VAL   9  -3.565   4.033   5.649
   76    HB   VAL   9           HB       VAL   9  -2.463   3.226   3.732
   77   1HG1  VAL   9          1HG1      VAL   9  -2.103   6.101   2.766
   78   2HG1  VAL   9          2HG1      VAL   9  -1.449   4.646   1.994
   79   3HG1  VAL   9          3HG1      VAL   9  -3.185   4.885   2.046
   80   1HG2  VAL   9          1HG2      VAL   9  -0.192   3.842   4.074
   81   2HG2  VAL   9          2HG2      VAL   9  -0.628   5.423   4.740
   82   3HG2  VAL   9          3HG2      VAL   9  -1.006   3.936   5.639
   83    H    ASP  10           H        ASP  10  -2.404   5.201   7.239
   84    HA   ASP  10           HA       ASP  10  -1.960   8.059   6.668
   85   1HB   ASP  10          2HB       ASP  10  -4.321   7.621   7.762
   86   2HB   ASP  10          3HB       ASP  10  -3.411   7.392   9.247
   87    H    GLY  11           H        GLY  11  -0.787   9.050   8.528
   88   1HA   GLY  11          1HA       GLY  11   1.172   9.193   9.727
   89   2HA   GLY  11          2HA       GLY  11   0.685   7.653  10.450
   90    H    LEU  12           H        LEU  12   2.124   8.909   7.384
   91    HA   LEU  12           HA       LEU  12   4.268   6.876   7.529
   92   1HB   LEU  12          2HB       LEU  12   4.123   6.487   5.169
   93   2HB   LEU  12          3HB       LEU  12   2.545   6.178   5.884
   94    HG   LEU  12           HG       LEU  12   2.179   7.111   3.853
   95   1HD1  LEU  12          1HD1      LEU  12   1.608   9.473   5.609
   96   2HD1  LEU  12          2HD1      LEU  12   0.762   8.917   4.162
   97   3HD1  LEU  12          3HD1      LEU  12   0.702   7.926   5.632
   98   1HD2  LEU  12          1HD2      LEU  12   4.430   8.188   3.526
   99   2HD2  LEU  12          2HD2      LEU  12   3.047   9.095   2.898
  100   3HD2  LEU  12          3HD2      LEU  12   3.798   9.615   4.396
  101    H    SER  13           H        SER  13   6.206   7.594   6.192
  102    HA   SER  13           HA       SER  13   6.923  10.244   6.889
  103   1HB   SER  13          2HB       SER  13   8.216   8.159   5.119
  104   2HB   SER  13          3HB       SER  13   8.894   9.791   5.296
  105    HG   SER  13           HG       SER  13   8.888   7.720   7.069
  106    H    CYS  14           H        CYS  14   6.987   9.209   3.389
  107    HA   CYS  14           HA       CYS  14   5.275  11.261   2.509
  108   1HB   CYS  14          2HB       CYS  14   7.570  12.473   3.456
  109   2HB   CYS  14          3HB       CYS  14   8.052  12.194   1.791
  110    HG   CYS  14           HG       CYS  14   6.142  13.523   0.687
  111    H    THR  15           H        THR  15   6.368  11.883   0.026
  112    HA   THR  15           HA       THR  15   5.670   9.812  -1.529
  113    HB   THR  15           HB       THR  15   5.931  12.161  -2.212
  114    HG1  THR  15           1HG      THR  15   6.999  10.140  -3.875
  115   1HG2  THR  15          1HG2      THR  15   8.852  11.473  -2.771
  116   2HG2  THR  15          2HG2      THR  15   8.002  12.976  -3.145
  117   3HG2  THR  15          3HG2      THR  15   8.300  12.536  -1.454
  118    H    ASN  16           H        ASN  16   8.982  10.377  -0.331
  119    HA   ASN  16           HA       ASN  16  10.393   8.510  -1.793
  120   1HB   ASN  16          2HB       ASN  16  10.691   9.125   1.184
  121   2HB   ASN  16          3HB       ASN  16  11.906   8.356   0.156
  122   1HD2  ASN  16          1HD2      ASN  16  10.613  11.407   1.232
  123   2HD2  ASN  16          2HD2      ASN  16  11.544  12.399   0.128
  124    H    CYS  17           H        CYS  17   8.440   8.012   1.151
  125    HA   CYS  17           HA       CYS  17   8.890   5.107   1.228
  126   1HB   CYS  17          2HB       CYS  17   7.250   7.073   2.824
  127   2HB   CYS  17          3HB       CYS  17   6.937   5.330   2.921
  128    HG   CYS  17           HG       CYS  17   9.952   6.600   3.137
  129    H    ALA  18           H        ALA  18   6.453   7.417  -0.002
  130    HA   ALA  18           HA       ALA  18   4.416   5.573  -0.582
  131   1HB   ALA  18          1HB       ALA  18   4.385   8.104  -0.980
  132   2HB   ALA  18          2HB       ALA  18   5.166   7.773  -2.538
  133   3HB   ALA  18          3HB       ALA  18   3.584   7.079  -2.196
  134    H    ALA  19           H        ALA  19   7.284   6.481  -2.449
  135    HA   ALA  19           HA       ALA  19   6.849   4.825  -4.737
  136   1HB   ALA  19          1HB       ALA  19   8.474   6.682  -4.704
  137   2HB   ALA  19          2HB       ALA  19   9.488   5.796  -3.547
  138   3HB   ALA  19          3HB       ALA  19   9.243   5.155  -5.181
  139    H    LYS  20           H        LYS  20   8.794   4.321  -1.751
  140    HA   LYS  20           HA       LYS  20   9.573   1.675  -2.276
  141   1HB   LYS  20          2HB       LYS  20  10.405   3.116  -0.442
  142   2HB   LYS  20          3HB       LYS  20   8.905   2.845   0.460
  143   1HG   LYS  20          2HG       LYS  20   9.405   0.627   0.930
  144   2HG   LYS  20          3HG       LYS  20  10.401   0.408  -0.508
  145   1HD   LYS  20          2HD       LYS  20  12.167   1.820   0.427
  146   2HD   LYS  20          3HD       LYS  20  11.182   2.151   1.873
  147   1HE   LYS  20          2HE       LYS  20  11.273  -0.174   2.562
  148   2HE   LYS  20          3HE       LYS  20  12.007  -0.671   1.030
  149   1HZ   LYS  20          1HZ       LYS  20  13.298   1.090   3.008
  150   2HZ   LYS  20          2HZ       LYS  20  13.621  -0.510   2.796
  151   3HZ   LYS  20          3HZ       LYS  20  13.963   0.560   1.597
  152    H    PHE  21           H        PHE  21   6.519   2.895  -0.877
  153    HA   PHE  21           HA       PHE  21   5.443   0.343  -0.278
  154   1HB   PHE  21          2HB       PHE  21   4.681   2.780   0.423
  155   2HB   PHE  21          3HB       PHE  21   3.683   2.692  -1.013
  156    HD1  PHE  21           1HD      PHE  21   4.584   0.218   1.756
  157    HD2  PHE  21           2HD      PHE  21   1.416   2.223  -0.371
  158    HE1  PHE  21           1HE      PHE  21   3.004  -0.313   3.557
  159    HE2  PHE  21           2HE      PHE  21  -0.044   1.978   1.627
  160    HZ   PHE  21           HZ       PHE  21   0.901   1.005   3.708
  161    H    GLU  22           H        GLU  22   4.817   2.486  -3.153
  162    HA   GLU  22           HA       GLU  22   3.084   0.642  -4.388
  163   1HB   GLU  22          2HB       GLU  22   3.098   1.949  -6.257
  164   2HB   GLU  22          3HB       GLU  22   3.659   3.118  -5.053
  165   1HG   GLU  22          2HG       GLU  22   5.920   2.945  -5.809
  166   2HG   GLU  22          3HG       GLU  22   5.497   1.667  -6.971
  167    H    ARG  23           H        ARG  23   6.613   1.003  -4.615
  168    HA   ARG  23           HA       ARG  23   7.081  -1.049  -6.515
  169   1HB   ARG  23          2HB       ARG  23   8.690   0.794  -5.561
  170   2HB   ARG  23          3HB       ARG  23   8.947  -0.309  -4.208
  171   1HG   ARG  23          2HG       ARG  23  10.681  -0.960  -5.569
  172   2HG   ARG  23          3HG       ARG  23   9.435  -2.062  -6.172
  173   1HD   ARG  23          2HD       ARG  23   8.891  -0.378  -7.970
  174   2HD   ARG  23          3HD       ARG  23  10.220   0.636  -7.342
  175    HE   ARG  23           HE       ARG  23  11.076  -2.063  -7.914
  176   1HH1  ARG  23          2HH2      ARG  23  10.345   1.025  -9.443
  177   2HH1  ARG  23          1HH2      ARG  23  11.399   0.809 -10.805
  178   1HH2  ARG  23          2HH1      ARG  23  12.471  -2.423  -9.730
  179   2HH2  ARG  23          1HH1      ARG  23  12.632  -1.227 -10.977
  180    H    ASN  24           H        ASN  24   7.192  -1.150  -2.903
  181    HA   ASN  24           HA       ASN  24   7.698  -3.870  -2.535
  182   1HB   ASN  24          2HB       ASN  24   6.290  -1.745  -0.940
  183   2HB   ASN  24          3HB       ASN  24   5.831  -3.390  -0.583
  184   1HD2  ASN  24          1HD2      ASN  24   7.759  -4.996  -0.367
  185   2HD2  ASN  24          2HD2      ASN  24   8.950  -4.424   0.777
  186    H    VAL  25           H        VAL  25   4.492  -2.276  -3.046
  187    HA   VAL  25           HA       VAL  25   3.104  -4.762  -2.942
  188    HB   VAL  25           HB       VAL  25   2.202  -2.207  -4.325
  189   1HG1  VAL  25          1HG1      VAL  25   0.906  -4.196  -5.019
  190   2HG1  VAL  25          2HG1      VAL  25   0.682  -4.670  -3.322
  191   3HG1  VAL  25          3HG1      VAL  25  -0.067  -3.188  -3.934
  192   1HG2  VAL  25          1HG2      VAL  25   0.862  -1.996  -2.153
  193   2HG2  VAL  25          2HG2      VAL  25   1.887  -3.293  -1.495
  194   3HG2  VAL  25          3HG2      VAL  25   2.588  -1.748  -1.947
  195    H    LYS  26           H        LYS  26   4.322  -2.896  -5.774
  196    HA   LYS  26           HA       LYS  26   3.639  -4.704  -7.814
  197   1HB   LYS  26          2HB       LYS  26   5.772  -2.624  -7.363
  198   2HB   LYS  26          3HB       LYS  26   5.856  -3.603  -8.814
  199   1HG   LYS  26          2HG       LYS  26   3.822  -2.839  -9.624
  200   2HG   LYS  26          3HG       LYS  26   3.230  -2.300  -8.038
  201   1HD   LYS  26          2HD       LYS  26   4.596  -0.379  -8.021
  202   2HD   LYS  26          3HD       LYS  26   5.610  -0.977  -9.345
  203   1HE   LYS  26          2HE       LYS  26   3.721  -0.752 -10.932
  204   2HE   LYS  26          3HE       LYS  26   2.620  -0.327  -9.609
  205   1HZ   LYS  26          1HZ       LYS  26   3.316   1.609 -10.818
  206   2HZ   LYS  26          2HZ       LYS  26   3.865   1.726  -9.298
  207   3HZ   LYS  26          3HZ       LYS  26   4.899   1.335 -10.484
  208    H    GLU  27           H        GLU  27   6.354  -4.934  -5.496
  209    HA   GLU  27           HA       GLU  27   7.644  -7.125  -6.828
  210   1HB   GLU  27          2HB       GLU  27   7.728  -6.133  -3.964
  211   2HB   GLU  27          3HB       GLU  27   8.761  -7.416  -4.576
  212   1HG   GLU  27          2HG       GLU  27   9.955  -5.996  -6.013
  213   2HG   GLU  27          3HG       GLU  27   8.710  -4.752  -6.020
  214    H    ILE  28           H        ILE  28   4.692  -7.069  -4.894
  215    HA   ILE  28           HA       ILE  28   4.976  -9.854  -4.029
  216    HB   ILE  28           HB       ILE  28   2.497  -8.131  -4.085
  217   1HG1  ILE  28          2HG1      ILE  28   4.181  -8.538  -1.597
  218   2HG1  ILE  28          3HG1      ILE  28   4.405  -7.157  -2.667
  219   1HG2  ILE  28          1HG2      ILE  28   3.112 -10.859  -3.048
  220   2HG2  ILE  28          2HG2      ILE  28   2.180  -9.838  -1.968
  221   3HG2  ILE  28          3HG2      ILE  28   1.576 -10.141  -3.596
  222   1HD1  ILE  28          1HD1      ILE  28   2.891  -6.482  -0.912
  223   2HD1  ILE  28          2HD1      ILE  28   1.996  -6.559  -2.445
  224   3HD1  ILE  28          3HD1      ILE  28   1.800  -7.830  -1.259
  225    H    GLU  29           H        GLU  29   4.146 -11.673  -5.139
  226    HA   GLU  29           HA       GLU  29   3.275 -11.358  -7.859
  227   1HB   GLU  29          2HB       GLU  29   3.872 -13.670  -5.956
  228   2HB   GLU  29          3HB       GLU  29   3.223 -13.915  -7.565
  229   1HG   GLU  29          2HG       GLU  29   5.138 -12.750  -8.581
  230   2HG   GLU  29          3HG       GLU  29   5.828 -12.447  -6.975
  231    H    GLY  30           H        GLY  30   1.678 -11.681  -4.881
  232   1HA   GLY  30          1HA       GLY  30  -0.727 -13.040  -5.712
  233   2HA   GLY  30          2HA       GLY  30  -0.534 -12.048  -4.258
  234    H    VAL  31           H        VAL  31   0.292  -9.649  -5.806
  235    HA   VAL  31           HA       VAL  31  -2.385  -8.698  -6.569
  236    HB   VAL  31           HB       VAL  31  -0.999  -7.728  -4.727
  237   1HG1  VAL  31          1HG1      VAL  31   1.205  -7.912  -5.963
  238   2HG1  VAL  31          2HG1      VAL  31   0.725  -6.486  -6.897
  239   3HG1  VAL  31          3HG1      VAL  31   0.879  -6.402  -5.124
  240   1HG2  VAL  31          1HG2      VAL  31  -1.497  -5.660  -6.854
  241   2HG2  VAL  31          2HG2      VAL  31  -2.786  -6.477  -5.921
  242   3HG2  VAL  31          3HG2      VAL  31  -1.551  -5.497  -5.096
  243    H    THR  32           H        THR  32  -2.001  -6.799  -8.353
  244    HA   THR  32           HA       THR  32  -0.157  -7.677 -10.499
  245    HB   THR  32           HB       THR  32  -3.161  -7.330 -10.861
  246    HG1  THR  32           1HG      THR  32  -1.524  -9.485 -10.325
  247   1HG2  THR  32          1HG2      THR  32  -0.979  -8.082 -12.847
  248   2HG2  THR  32          2HG2      THR  32  -2.728  -8.160 -13.151
  249   3HG2  THR  32          3HG2      THR  32  -1.955  -6.595 -12.852
  250    H    GLU  33           H        GLU  33  -2.779  -5.334  -9.641
  251    HA   GLU  33           HA       GLU  33  -0.843  -3.174 -10.477
  252   1HB   GLU  33          2HB       GLU  33  -3.843  -3.250 -10.964
  253   2HB   GLU  33          3HB       GLU  33  -2.908  -1.759 -10.827
  254   1HG   GLU  33          2HG       GLU  33  -1.353  -3.074 -12.632
  255   2HG   GLU  33          3HG       GLU  33  -2.916  -3.816 -12.997
  256    H    ALA  34           H        ALA  34  -0.709  -1.367  -9.203
  257    HA   ALA  34           HA       ALA  34  -2.159  -1.354  -6.650
  258   1HB   ALA  34          1HB       ALA  34  -0.159  -2.743  -6.275
  259   2HB   ALA  34          2HB       ALA  34   0.890  -1.433  -6.853
  260   3HB   ALA  34          3HB       ALA  34  -0.063  -1.209  -5.365
  261    H    ILE  35           H        ILE  35  -2.743   0.785  -6.279
  262    HA   ILE  35           HA       ILE  35  -1.033   2.898  -7.590
  263    HB   ILE  35           HB       ILE  35  -4.063   2.882  -7.740
  264   1HG1  ILE  35          2HG1      ILE  35  -2.028   2.435  -9.970
  265   2HG1  ILE  35          3HG1      ILE  35  -2.987   1.145  -9.235
  266   1HG2  ILE  35          1HG2      ILE  35  -3.736   4.864  -9.129
  267   2HG2  ILE  35          2HG2      ILE  35  -2.990   5.120  -7.557
  268   3HG2  ILE  35          3HG2      ILE  35  -1.973   4.728  -8.958
  269   1HD1  ILE  35          1HD1      ILE  35  -4.029   1.755 -11.276
  270   2HD1  ILE  35          2HD1      ILE  35  -5.078   2.238  -9.930
  271   3HD1  ILE  35          3HD1      ILE  35  -4.130   3.459 -10.816
  272    H    VAL  36           H        VAL  36  -0.071   3.641  -5.769
  273    HA   VAL  36           HA       VAL  36  -1.776   4.225  -3.412
  274    HB   VAL  36           HB       VAL  36   0.227   2.870  -3.058
  275   1HG1  VAL  36          1HG1      VAL  36   1.663   3.904  -4.829
  276   2HG1  VAL  36          2HG1      VAL  36   1.862   5.332  -3.799
  277   3HG1  VAL  36          3HG1      VAL  36   2.442   3.756  -3.238
  278   1HG2  VAL  36          1HG2      VAL  36   0.374   5.644  -1.814
  279   2HG2  VAL  36          2HG2      VAL  36  -0.612   4.289  -1.223
  280   3HG2  VAL  36          3HG2      VAL  36   1.165   4.207  -1.194
  281    H    ASN  37           H        ASN  37  -2.174   6.242  -2.671
  282    HA   ASN  37           HA       ASN  37  -0.542   8.486  -3.712
  283   1HB   ASN  37          2HB       ASN  37  -3.560   8.369  -3.845
  284   2HB   ASN  37          3HB       ASN  37  -2.728   9.904  -3.561
  285   1HD2  ASN  37          1HD2      ASN  37  -4.390   9.281  -5.878
  286   2HD2  ASN  37          2HD2      ASN  37  -3.303   9.453  -7.242
  287    H    PHE  38           H        PHE  38   0.442   7.678  -1.797
  288    HA   PHE  38           HA       PHE  38  -0.301   8.247   0.885
  289   1HB   PHE  38          2HB       PHE  38   2.228   8.458  -0.785
  290   2HB   PHE  38          3HB       PHE  38   2.216   9.112   0.835
  291    HD1  PHE  38           1HD      PHE  38   0.171   6.105   0.604
  292    HD2  PHE  38           2HD      PHE  38   4.149   7.653   1.260
  293    HE1  PHE  38           1HE      PHE  38   0.728   4.161   1.936
  294    HE2  PHE  38           2HE      PHE  38   4.704   5.665   2.556
  295    HZ   PHE  38           HZ       PHE  38   3.026   3.822   2.843
  296    H    GLY  39           H        GLY  39   0.272  10.442  -1.816
  297   1HA   GLY  39          1HA       GLY  39   0.818  12.720  -0.325
  298   2HA   GLY  39          2HA       GLY  39  -0.001  12.701  -1.912
  299    H    ALA  40           H        ALA  40  -2.165  10.875  -0.510
  300    HA   ALA  40           HA       ALA  40  -3.305  12.799   1.451
  301   1HB   ALA  40          1HB       ALA  40  -4.718  12.978  -0.501
  302   2HB   ALA  40          2HB       ALA  40  -4.849  11.216  -0.638
  303   3HB   ALA  40          3HB       ALA  40  -5.569  12.066   0.759
  304    H    SER  41           H        SER  41  -4.859   9.692   0.811
  305    HA   SER  41           HA       SER  41  -3.500   8.295   2.871
  306   1HB   SER  41          2HB       SER  41  -6.321   9.405   3.388
  307   2HB   SER  41          3HB       SER  41  -5.432   8.334   4.474
  308    HG   SER  41           HG       SER  41  -3.810  10.181   4.374
  309    H    LYS  42           H        LYS  42  -3.675   7.324   0.430
  310    HA   LYS  42           HA       LYS  42  -5.854   5.392   0.531
  311   1HB   LYS  42          2HB       LYS  42  -6.716   5.872  -1.704
  312   2HB   LYS  42          3HB       LYS  42  -7.009   7.141  -0.527
  313   1HG   LYS  42          2HG       LYS  42  -4.832   8.263  -1.527
  314   2HG   LYS  42          3HG       LYS  42  -4.984   7.039  -2.791
  315   1HD   LYS  42          2HD       LYS  42  -5.912   9.148  -3.521
  316   2HD   LYS  42          3HD       LYS  42  -7.197   7.933  -3.429
  317   1HE   LYS  42          2HE       LYS  42  -8.215   8.939  -1.567
  318   2HE   LYS  42          3HE       LYS  42  -6.715   9.686  -1.006
  319   1HZ   LYS  42          1HZ       LYS  42  -6.865  11.271  -2.771
  320   2HZ   LYS  42          2HZ       LYS  42  -8.235  10.575  -3.365
  321   3HZ   LYS  42          3HZ       LYS  42  -8.246  11.293  -1.887
  322    H    ILE  43           H        ILE  43  -5.473   3.576  -0.449
  323    HA   ILE  43           HA       ILE  43  -3.133   3.205  -2.214
  324    HB   ILE  43           HB       ILE  43  -2.253   3.057  -0.015
  325   1HG1  ILE  43          2HG1      ILE  43  -1.157   1.668  -1.629
  326   2HG1  ILE  43          3HG1      ILE  43  -1.138   0.928  -0.029
  327   1HG2  ILE  43          1HG2      ILE  43  -4.201   0.841   0.638
  328   2HG2  ILE  43          2HG2      ILE  43  -2.814   1.354   1.608
  329   3HG2  ILE  43          3HG2      ILE  43  -4.148   2.471   1.338
  330   1HD1  ILE  43          1HD1      ILE  43  -2.744   0.049  -2.405
  331   2HD1  ILE  43          2HD1      ILE  43  -1.477  -0.809  -1.540
  332   3HD1  ILE  43          3HD1      ILE  43  -3.050  -0.559  -0.760
  333    H    THR  44           H        THR  44  -4.091   2.459  -3.984
  334    HA   THR  44           HA       THR  44  -6.293   0.532  -3.892
  335    HB   THR  44           HB       THR  44  -4.667   1.480  -6.249
  336    HG1  THR  44           1HG      THR  44  -7.018   2.591  -5.310
  337   1HG2  THR  44          1HG2      THR  44  -6.725   1.018  -7.538
  338   2HG2  THR  44          2HG2      THR  44  -6.045  -0.439  -6.809
  339   3HG2  THR  44          3HG2      THR  44  -7.470   0.328  -6.078
  340    H    VAL  45           H        VAL  45  -6.100  -1.583  -4.137
  341    HA   VAL  45           HA       VAL  45  -3.568  -2.798  -5.100
  342    HB   VAL  45           HB       VAL  45  -5.293  -3.356  -2.691
  343   1HG1  VAL  45          1HG1      VAL  45  -4.478  -5.686  -2.492
  344   2HG1  VAL  45          2HG1      VAL  45  -5.595  -5.494  -3.846
  345   3HG1  VAL  45          3HG1      VAL  45  -3.844  -5.603  -4.140
  346   1HG2  VAL  45          1HG2      VAL  45  -2.329  -3.840  -3.164
  347   2HG2  VAL  45          2HG2      VAL  45  -3.019  -2.319  -2.572
  348   3HG2  VAL  45          3HG2      VAL  45  -3.193  -3.800  -1.610
  349    H    THR  46           H        THR  46  -3.919  -4.244  -6.795
  350    HA   THR  46           HA       THR  46  -6.631  -5.288  -7.281
  351    HB   THR  46           HB       THR  46  -4.939  -3.541  -9.132
  352    HG1  THR  46           1HG      THR  46  -6.955  -3.306  -7.498
  353   1HG2  THR  46          1HG2      THR  46  -6.752  -3.921 -10.835
  354   2HG2  THR  46          2HG2      THR  46  -5.783  -5.373 -10.548
  355   3HG2  THR  46          3HG2      THR  46  -7.399  -5.230  -9.822
  356    H    GLY  47           H        GLY  47  -6.485  -7.297  -8.015
  357   1HA   GLY  47          1HA       GLY  47  -4.911  -8.411  -9.848
  358   2HA   GLY  47          2HA       GLY  47  -3.806  -8.476  -8.480
  359    H    GLU  48           H        GLU  48  -4.232  -9.892  -6.730
  360    HA   GLU  48           HA       GLU  48  -6.892 -10.805  -6.205
  361   1HB   GLU  48          2HB       GLU  48  -5.749 -12.377  -8.076
  362   2HB   GLU  48          3HB       GLU  48  -5.027 -13.148  -6.674
  363   1HG   GLU  48          2HG       GLU  48  -7.273 -13.631  -5.784
  364   2HG   GLU  48          3HG       GLU  48  -8.013 -12.610  -7.047
  365    H    ALA  49           H        ALA  49  -5.412  -9.189  -4.640
  366    HA   ALA  49           HA       ALA  49  -4.832 -10.880  -2.288
  367   1HB   ALA  49          1HB       ALA  49  -2.848  -8.876  -3.451
  368   2HB   ALA  49          2HB       ALA  49  -2.708  -9.692  -1.880
  369   3HB   ALA  49          3HB       ALA  49  -2.642 -10.644  -3.375
  370    H    SER  50           H        SER  50  -4.262  -9.384  -0.382
  371    HA   SER  50           HA       SER  50  -6.160  -7.094  -0.299
  372   1HB   SER  50          2HB       SER  50  -5.747  -9.373   1.690
  373   2HB   SER  50          3HB       SER  50  -6.705  -7.926   2.014
  374    HG   SER  50           HG       SER  50  -8.024  -9.638   1.220
  375    H    ILE  51           H        ILE  51  -5.792  -5.631   1.594
  376    HA   ILE  51           HA       ILE  51  -3.252  -4.693   1.542
  377    HB   ILE  51           HB       ILE  51  -5.451  -3.542   2.453
  378   1HG1  ILE  51          2HG1      ILE  51  -4.123  -1.948   3.712
  379   2HG1  ILE  51          3HG1      ILE  51  -2.714  -2.983   3.404
  380   1HG2  ILE  51          1HG2      ILE  51  -4.186  -4.280   5.108
  381   2HG2  ILE  51          2HG2      ILE  51  -5.670  -3.365   4.815
  382   3HG2  ILE  51          3HG2      ILE  51  -5.638  -5.102   4.469
  383   1HD1  ILE  51          1HD1      ILE  51  -3.204  -2.669   0.886
  384   2HD1  ILE  51          2HD1      ILE  51  -4.486  -1.554   1.363
  385   3HD1  ILE  51          3HD1      ILE  51  -2.801  -1.178   1.731
  386    H    GLN  52           H        GLN  52  -4.356  -7.206   3.688
  387    HA   GLN  52           HA       GLN  52  -2.571  -7.441   5.733
  388   1HB   GLN  52          2HB       GLN  52  -3.298  -9.509   3.609
  389   2HB   GLN  52          3HB       GLN  52  -2.444  -9.918   5.097
  390   1HG   GLN  52          2HG       GLN  52  -5.204  -8.604   5.056
  391   2HG   GLN  52          3HG       GLN  52  -4.919 -10.344   5.132
  392   1HE2  GLN  52          1HE2      GLN  52  -5.452  -7.634   7.097
  393   2HE2  GLN  52          2HE2      GLN  52  -4.794  -8.318   8.571
  394    H    GLN  53           H        GLN  53  -1.758  -8.118   2.298
  395    HA   GLN  53           HA       GLN  53   0.991  -8.841   2.955
  396   1HB   GLN  53          2HB       GLN  53  -0.141  -8.025   0.253
  397   2HB   GLN  53          3HB       GLN  53   1.368  -8.906   0.603
  398   1HG   GLN  53          2HG       GLN  53   0.000 -10.735   1.642
  399   2HG   GLN  53          3HG       GLN  53  -1.465  -9.922   1.057
  400   1HE2  GLN  53          1HE2      GLN  53  -0.029 -12.595   0.320
  401   2HE2  GLN  53          2HE2      GLN  53   0.031 -12.499  -1.430
  402    H    VAL  54           H        VAL  54  -0.625  -5.860   1.935
  403    HA   VAL  54           HA       VAL  54   1.793  -4.410   1.311
  404    HB   VAL  54           HB       VAL  54  -1.000  -3.335   1.904
  405   1HG1  VAL  54          1HG1      VAL  54   1.398  -2.104   0.507
  406   2HG1  VAL  54          2HG1      VAL  54  -0.245  -1.427   0.496
  407   3HG1  VAL  54          3HG1      VAL  54   0.631  -1.582   2.015
  408   1HG2  VAL  54          1HG2      VAL  54  -1.114  -3.274  -0.660
  409   2HG2  VAL  54          2HG2      VAL  54   0.226  -4.440  -0.642
  410   3HG2  VAL  54          3HG2      VAL  54  -1.316  -4.858   0.108
  411    H    GLU  55           H        GLU  55  -0.332  -4.817   4.140
  412    HA   GLU  55           HA       GLU  55   0.729  -2.903   5.884
  413   1HB   GLU  55          2HB       GLU  55  -1.385  -4.267   6.077
  414   2HB   GLU  55          3HB       GLU  55  -0.410  -5.657   6.565
  415   1HG   GLU  55          2HG       GLU  55  -0.407  -2.961   7.977
  416   2HG   GLU  55          3HG       GLU  55  -1.454  -4.319   8.422
  417    H    GLN  56           H        GLN  56   1.446  -6.422   5.490
  418    HA   GLN  56           HA       GLN  56   3.628  -6.562   7.178
  419   1HB   GLN  56          2HB       GLN  56   2.437  -8.441   6.076
  420   2HB   GLN  56          3HB       GLN  56   3.330  -8.152   4.582
  421   1HG   GLN  56          2HG       GLN  56   4.876  -8.533   7.166
  422   2HG   GLN  56          3HG       GLN  56   4.067  -9.925   6.447
  423   1HE2  GLN  56          1HE2      GLN  56   5.840 -11.123   5.755
  424   2HE2  GLN  56          2HE2      GLN  56   6.967 -10.511   4.556
  425    H    ALA  57           H        ALA  57   3.816  -5.926   3.597
  426    HA   ALA  57           HA       ALA  57   6.545  -5.302   3.457
  427   1HB   ALA  57          1HB       ALA  57   4.185  -4.033   2.003
  428   2HB   ALA  57          2HB       ALA  57   5.890  -3.808   1.592
  429   3HB   ALA  57          3HB       ALA  57   5.157  -5.425   1.472
  430    H    GLY  58           H        GLY  58   3.819  -3.159   4.370
  431   1HA   GLY  58          1HA       GLY  58   5.082  -0.710   4.678
  432   2HA   GLY  58          2HA       GLY  58   3.638  -1.297   5.541
  433    H    ALA  59           H        ALA  59   5.417  -3.598   6.706
  434    HA   ALA  59           HA       ALA  59   6.124  -2.535   9.155
  435   1HB   ALA  59          1HB       ALA  59   7.562  -4.759   7.664
  436   2HB   ALA  59          2HB       ALA  59   7.615  -4.453   9.410
  437   3HB   ALA  59          3HB       ALA  59   6.087  -4.940   8.653
  438    H    PHE  60           H        PHE  60   7.900  -2.059   6.093
  439    HA   PHE  60           HA       PHE  60  10.373  -1.297   7.228
  440   1HB   PHE  60          2HB       PHE  60  10.825  -0.037   5.268
  441   2HB   PHE  60          3HB       PHE  60  10.110  -1.592   4.861
  442    HD1  PHE  60           1HD      PHE  60   8.428  -1.623   3.184
  443    HD2  PHE  60           2HD      PHE  60   9.347   2.077   5.188
  444    HE1  PHE  60           1HE      PHE  60   6.825  -0.449   1.745
  445    HE2  PHE  60           2HE      PHE  60   7.646   3.235   3.819
  446    HZ   PHE  60           HZ       PHE  60   6.387   1.993   2.076
  447    H    GLU  61           H        GLU  61   7.352   0.537   7.124
  448    HA   GLU  61           HA       GLU  61   8.635   2.724   8.736
  449   1HB   GLU  61          2HB       GLU  61   7.967   3.362   6.426
  450   2HB   GLU  61          3HB       GLU  61   6.304   2.905   6.798
  451   1HG   GLU  61          2HG       GLU  61   6.506   5.286   6.929
  452   2HG   GLU  61          3HG       GLU  61   6.374   4.749   8.604
  453    H    HIS  62           H        HIS  62   6.137   0.313   8.651
  454    HA   HIS  62           HA       HIS  62   4.705  -0.457  10.179
  455   1HB   HIS  62          2HB       HIS  62   5.349   1.744  12.149
  456   2HB   HIS  62          3HB       HIS  62   4.742   0.124  12.451
  457    HD1  HIS  62           HD1      HIS  62   7.330  -1.219  10.651
  458    HD2  HIS  62           HD2      HIS  62   7.372   1.601  13.777
  459    HE1  HIS  62           HE1      HIS  62   9.586  -1.406  11.757
  460    H    LEU  63           H        LEU  63   3.504   0.781   8.166
  461    HA   LEU  63           HA       LEU  63   2.103   3.204   9.025
  462   1HB   LEU  63          2HB       LEU  63   1.452   1.420   6.641
  463   2HB   LEU  63          3HB       LEU  63   0.878   3.051   6.961
  464    HG   LEU  63           HG       LEU  63   2.428   3.525   5.435
  465   1HD1  LEU  63          1HD1      LEU  63   4.241   3.555   7.894
  466   2HD1  LEU  63          2HD1      LEU  63   4.380   4.534   6.431
  467   3HD1  LEU  63          3HD1      LEU  63   2.996   4.755   7.524
  468   1HD2  LEU  63          1HD2      LEU  63   4.443   1.530   6.535
  469   2HD2  LEU  63          2HD2      LEU  63   3.274   1.151   5.264
  470   3HD2  LEU  63          3HD2      LEU  63   4.507   2.397   4.991
  471    H    LYS  64           H        LYS  64  -0.323   3.362   8.892
  472    HA   LYS  64           HA       LYS  64  -1.692   0.882   9.806
  473   1HB   LYS  64          2HB       LYS  64  -3.238   2.388  11.134
  474   2HB   LYS  64          3HB       LYS  64  -1.645   1.990  11.772
  475   1HG   LYS  64          2HG       LYS  64  -1.682   4.161  12.352
  476   2HG   LYS  64          3HG       LYS  64  -0.882   4.300  10.816
  477   1HD   LYS  64          2HD       LYS  64  -2.353   5.829  10.298
  478   2HD   LYS  64          3HD       LYS  64  -3.569   4.586  10.057
  479   1HE   LYS  64          2HE       LYS  64  -2.997   6.064  12.692
  480   2HE   LYS  64          3HE       LYS  64  -4.244   6.543  11.539
  481   1HZ   LYS  64          1HZ       LYS  64  -5.375   4.512  11.904
  482   2HZ   LYS  64          2HZ       LYS  64  -4.180   3.921  12.873
  483   3HZ   LYS  64          3HZ       LYS  64  -5.086   5.207  13.365
  484    H    ILE  65           H        ILE  65  -3.134   0.263   8.392
  485    HA   ILE  65           HA       ILE  65  -4.319   2.237   6.552
  486    HB   ILE  65           HB       ILE  65  -3.940  -0.619   5.710
  487   1HG1  ILE  65          2HG1      ILE  65  -1.696   1.394   5.743
  488   2HG1  ILE  65          3HG1      ILE  65  -1.792  -0.308   6.299
  489   1HG2  ILE  65          1HG2      ILE  65  -5.404   0.834   4.436
  490   2HG2  ILE  65          2HG2      ILE  65  -4.092   1.972   4.162
  491   3HG2  ILE  65          3HG2      ILE  65  -4.014   0.350   3.466
  492   1HD1  ILE  65          1HD1      ILE  65  -2.064  -0.972   3.908
  493   2HD1  ILE  65          2HD1      ILE  65  -1.547   0.671   3.472
  494   3HD1  ILE  65          3HD1      ILE  65  -0.494  -0.421   4.422
  495    H    ILE  66           H        ILE  66  -6.535   2.018   6.224
  496    HA   ILE  66           HA       ILE  66  -7.913  -0.085   7.814
  497    HB   ILE  66           HB       ILE  66  -8.722   2.835   7.571
  498   1HG1  ILE  66          2HG1      ILE  66  -8.401   2.420  10.234
  499   2HG1  ILE  66          3HG1      ILE  66  -7.174   1.297   9.655
  500   1HG2  ILE  66          1HG2      ILE  66  -9.935   0.557   9.191
  501   2HG2  ILE  66          2HG2      ILE  66 -10.459   2.250   9.203
  502   3HG2  ILE  66          3HG2      ILE  66 -10.659   1.288   7.741
  503   1HD1  ILE  66          1HD1      ILE  66  -7.391   4.285   9.051
  504   2HD1  ILE  66          2HD1      ILE  66  -6.226   3.503  10.135
  505   3HD1  ILE  66          3HD1      ILE  66  -6.121   3.238   8.389
  506    HA   PRO  67           HA       PRO  67 -10.039  -0.520   3.787
  507   1HB   PRO  67          2HB       PRO  67 -11.880  -2.409   4.509
  508   2HB   PRO  67          3HB       PRO  67 -10.170  -2.816   4.242
  509   1HG   PRO  67          2HG       PRO  67 -11.558  -2.317   6.873
  510   2HG   PRO  67          3HG       PRO  67 -10.423  -3.629   6.458
  511   1HD   PRO  67          2HD       PRO  67  -9.681  -1.371   7.788
  512   2HD   PRO  67          3HD       PRO  67  -8.564  -2.192   6.660
  513    H    GLU  68           H        GLU  68 -10.939   1.642   3.796
  514    HA   GLU  68           HA       GLU  68 -12.824   2.685   5.419
  515   1HB   GLU  68          2HB       GLU  68 -11.583   3.663   3.338
  516   2HB   GLU  68          3HB       GLU  68 -12.950   3.047   2.387
  517   1HG   GLU  68          2HG       GLU  68 -14.484   4.308   3.885
  518   2HG   GLU  68          3HG       GLU  68 -13.077   4.895   4.793
  519    H    LYS  69           H        LYS  69 -13.397   0.641   2.582
  520    HA   LYS  69           HA       LYS  69 -14.958  -0.833   2.025
  521   1HB   LYS  69          2HB       LYS  69 -14.637  -1.469   4.427
  522   2HB   LYS  69          3HB       LYS  69 -16.124  -0.621   4.840
  523   1HG   LYS  69          2HG       LYS  69 -16.059  -2.777   2.689
  524   2HG   LYS  69          3HG       LYS  69 -16.082  -3.169   4.416
  525   1HD   LYS  69          2HD       LYS  69 -18.190  -1.829   4.691
  526   2HD   LYS  69          3HD       LYS  69 -18.188  -1.489   2.960
  527   1HE   LYS  69          2HE       LYS  69 -19.733  -3.298   3.428
  528   2HE   LYS  69          3HE       LYS  69 -18.400  -3.879   2.423
  529   1HZ   LYS  69          1HZ       LYS  69 -18.959  -5.395   4.210
  530   2HZ   LYS  69          2HZ       LYS  69 -17.421  -4.851   4.381
  531   3HZ   LYS  69          3HZ       LYS  69 -18.616  -4.253   5.342
  532    H    GLU  70           H        GLU  70 -16.736   1.495   4.096
  533    HA   GLU  70           HA       GLU  70 -17.944   2.860   1.948
  534   1HB   GLU  70          2HB       GLU  70 -19.303   0.729   1.759
  535   2HB   GLU  70          3HB       GLU  70 -19.915   1.015   3.394
  536   1HG   GLU  70          2HG       GLU  70 -20.879   3.184   2.604
  537   2HG   GLU  70          3HG       GLU  70 -20.246   2.856   0.982
  538    H    ALA  71           H        ALA  71 -18.614   1.692   5.323
  539    HA   ALA  71           HA       ALA  71 -18.181   4.207   6.554
  540   1HB   ALA  71          1HB       ALA  71 -21.021   3.065   6.411
  541   2HB   ALA  71          2HB       ALA  71 -20.490   4.382   7.478
  542   3HB   ALA  71          3HB       ALA  71 -20.507   4.620   5.717