*HEADER    TRANSFERASE                             09-MAR-06   2GAQ              
*TITLE     NMR SOLUTION STRUCTURE OF THE FRB DOMAIN OF MTOR                      
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: FKBP12-RAPAMYCIN COMPLEX-ASSOCIATED PROTEIN;               
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: FRB DOMAIN;                                                
*COMPND   5 SYNONYM: FK506-BINDING PROTEIN 12- RAPAMYCIN COMPLEX-                
*COMPND   6 ASSOCIATED PROTEIN 1, RAPAMYCIN TARGET PROTEIN, RAPT1,               
*COMPND   7 MAMMALIAN TARGET OF RAPAMYCIN, MTOR;                                 
*COMPND   8 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 GENE: FRAP1, FRAP, FRAP2;                                            
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   7 EXPRESSION_SYSTEM_STRAIN: BL21                                       
*KEYWDS    FOUR HELICAL UP AND DOWN BUNDLE                                       
*EXPDTA    NMR, 19 STRUCTURES                                                    
*AUTHOR    M.LEONE, M.PELLECCHIA                                                 
*REVDAT   1   08-AUG-06 2GAQ    0                                                



 34 PHE  O      38 GLU- HN      1.80 
 34 PHE  O      38 GLU- N       2.70 
 63 ASP- O      67 ALA  HN      1.80 
 63 ASP- O      67 ALA  N       2.70 
 64 LEU  O      68 GLN  HN 1.80
 64 LEU  O      68 GLN  N       2.70
 65 MET  O      69 GLU- HN      1.80 
 65 MET  O      69 GLU- N       2.70 
 70 TRP  O      74 TYR  HN      1.80 
 70 TRP  O      74 TYR  N       2.70 
 71 CYS  O      75 MET  HN      1.80 
 71 CYS  O      75 MET  N       2.70 
 79 ASN  O      81 LYS+ HN      1.80 
 79 ASN  O      81 LYS+ N       2.70 
 82 ASP- O      86 ALA  HN      1.80 
 82 ASP- O      86 ALA  N       2.70 
 83 LEU  O      87 TRP  HN      1.80 
 83 LEU  O      87 TRP  N       2.70 
 86 ALA  O      90 TYR  HN      1.80 
 86 ALA  O      90 TYR  N       2.70 
 87 TRP  O      91 TYR  HN      1.80 
 87 TRP  O      91 TYR  N       2.70 
 89 LEU  O      93 VAL  HN      1.80 
 89 LEU  O      93 VAL  N       2.70 
 90 TYR  O      94 PHE  HN      1.80 
 90 TYR  O      94 PHE  N       2.70 
 85 GLN  O      89 LEU  HN 1.80
 85 GLN  O      89 LEU  N 2.70

 34 PHE  O      38 GLU- HN      2.50 
 34 PHE  O      38 GLU- N       3.50 
 63 ASP- O      67 ALA  HN      2.00 
 63 ASP- O      67 ALA  N       3.00 
 65 MET  O      69 GLU- HN      2.00 
 65 MET  O      69 GLU- N       3.00 
 64 LEU  O      68 GLN  HN 2.00
 64 LEU  O      68 GLN  N       3.00
 70 TRP  O      74 TYR  HN      2.00 
 70 TRP  O      74 TYR  N       3.00 
 71 CYS  O      75 MET  HN      2.00 
 71 CYS  O      75 MET  N       3.00 
 79 ASN  O      81 LYS+ HN      2.50 
 79 ASN  O      81 LYS+ N       3.00 
 82 ASP- O      86 ALA  HN      2.00 
 82 ASP- O      86 ALA  N       3.00 
 83 LEU  O      87 TRP  HN      2.00 
 83 LEU  O      87 TRP  N       3.00 
 85 GLN  O      89 LEU  HN 2.00
 85 GLN  O      89 LEU  N 3.00
 86 ALA  O      90 TYR  HN      2.00 
 86 ALA  O      90 TYR  N       3.00 
 87 TRP  O      91 TYR  HN      2.00 
 87 TRP  O      91 TYR  N       3.00 
 89 LEU  O      93 VAL  HN      2.00 
 89 LEU  O      93 VAL  N       3.00 
 90 TYR  O      94 PHE  HN      2.00 
 90 TYR  O      94 PHE  N       3.00 
  2 LEU  HN      2 LEU  HA      2.40                
  2 LEU  HN      2 LEU  QB      3.56                
  2 LEU  HN      2 LEU  HG      3.73                
  2 LEU  HN      2 LEU  QQD     4.94                
  2 LEU  HA      3 ILE  HN      2.40                
  2 LEU  HA      6 ALA  HN      2.65                
  3 ILE  HN      3 ILE  HA      2.80                
  3 ILE  HN      3 ILE  HB      3.67                
  3 ILE  HN      3 ILE  HG12    5.22                
  3 ILE  HN      3 ILE  HG13    5.22                
  3 ILE  HN      3 ILE  QG1     4.53                
  3 ILE  HN      3 ILE  QD1     4.76                
  3 ILE  HN      4 ARG+ HN      2.65                
  3 ILE  QD1     4 ARG+ HN      4.92                
  4 ARG+ HN      4 ARG+ HA      2.80                
  4 ARG+ HN      4 ARG+ HB2     3.89                
  4 ARG+ HN      4 ARG+ HB3     3.89                
  4 ARG+ HN      4 ARG+ QB      3.51                
  4 ARG+ HN      4 ARG+ HG2     3.92                
  4 ARG+ HN      4 ARG+ HG3     3.92                
  4 ARG+ HN      4 ARG+ QG      3.46                
  4 ARG+ HN      4 ARG+ QD      6.38                
  4 ARG+ HN      6 ALA  HN      2.99                
  5 VAL  HN      5 VAL  HB      3.33                
  5 VAL  HN      6 ALA  HN      2.46                
  5 VAL  HA      5 VAL  HB      2.40                
  5 VAL  HA      6 ALA  HN      3.61                
  5 VAL  QQG     6 ALA  HN      4.86                
  5 VAL  QQG     7 ILE  HB      5.64                
  5 VAL  QQG     7 ILE  QG2     8.65                
  5 VAL  QQG     7 ILE  QD1     7.50                
  6 ALA  HN      6 ALA  HA      2.43                
  6 ALA  HN      6 ALA  QB      3.43                
  6 ALA  HN      7 ILE  HN      2.49                
  7 ILE  HN      7 ILE  HB      2.55                
  7 ILE  HN      8 LEU  HN      3.39                
  7 ILE  QG2     7 ILE  QD1     4.46                
  7 ILE  QD1     8 LEU  QB      7.40                
  7 ILE  QD1     9 TRP  HE1     6.16                
  7 ILE  QD1    11 GLU- QB      4.71                
  7 ILE  QD1    12 MET  HA      5.91                
  7 ILE  QD1    12 MET  QG      6.23                
  8 LEU  HN      8 LEU  HA      2.83                
  8 LEU  HN      8 LEU  QB      3.87                
  8 LEU  HN      8 LEU  HG      4.76                
  8 LEU  HN      8 LEU  QD1     4.82                
  8 LEU  HN      8 LEU  QD2     4.82                
  8 LEU  HN      8 LEU  QQD     4.18                
  8 LEU  HA      9 TRP  HN      3.02                
  8 LEU  HA     10 HIS+ HN      4.69                
  8 LEU  QB      9 TRP  QB      7.25                
  8 LEU  QB     11 GLU- QG      5.18                
  8 LEU  HG     11 GLU- QG      3.83                
  8 LEU  QD1    10 HIS+ HN      6.53                
  8 LEU  QD1    11 GLU- QG      7.34                
  8 LEU  QD1    50 THR  QG2     5.73                
  8 LEU  QD1    52 LYS+ QB      6.78                
  8 LEU  QD1    52 LYS+ QG      5.51                
  8 LEU  QD2    10 HIS+ HN      6.53                
  8 LEU  QD2    11 GLU- QG      7.34                
  8 LEU  QD2    50 THR  QG2     5.73                
  8 LEU  QD2    52 LYS+ QB      6.78                
  8 LEU  QD2    52 LYS+ QG      5.51                
  8 LEU  QQD     9 TRP  HN      6.21                
  8 LEU  QQD    10 HIS+ HD2     6.55                
  8 LEU  QQD    11 GLU- QG      6.15                
  8 LEU  QQD    50 THR  QG2     5.35                
  8 LEU  QQD    52 LYS+ QB      6.08                
  8 LEU  QQD    52 LYS+ QG      4.80                
  9 TRP  HN      9 TRP  HD1     4.66                
  9 TRP  HN     10 HIS+ HN      3.86                
  9 TRP  HN     53 GLU- HA      3.33                
  9 TRP  HD1    12 MET  QB      5.14                
  9 TRP  HD1    12 MET  HG2     5.50                
  9 TRP  HD1    12 MET  HG3     5.50                
  9 TRP  HE1    43 MET  QB      5.42                
  9 TRP  HE1    43 MET  QG      4.67                
  9 TRP  HZ2    43 MET  HA      3.86                
  9 TRP  HZ2    43 MET  QB      4.89                
  9 TRP  HZ2    43 MET  QG      5.48                
  9 TRP  HZ2    46 ARG+ HB2     4.48                
  9 TRP  HZ2    46 ARG+ HB3     4.48                
  9 TRP  HZ2    46 ARG+ QB      3.97                
  9 TRP  HH2    47 GLY  HN      4.14                
  9 TRP  HH2    48 PRO  QD      5.54                
 10 HIS+ HN     10 HIS+ HB2     3.05                
 10 HIS+ HN     10 HIS+ HB3     3.05                
 10 HIS+ HN     10 HIS+ QB      2.86                
 10 HIS+ HN     10 HIS+ HD2     4.20                
 10 HIS+ HN     11 GLU- HN      3.05                
 10 HIS+ HA     12 MET  HN      4.66                
 10 HIS+ HA     56 PHE  QE      6.54                
 10 HIS+ HA     56 PHE  HD1     5.38                
 10 HIS+ QB     97 ILE  QG2     6.07                
 10 HIS+ HD2    11 GLU- HN      2.40                
 11 GLU- HN     11 GLU- QG      5.94                
 11 GLU- HN     12 MET  HN      2.83                
 11 GLU- QB     12 MET  HN      4.18                
 11 GLU- QG     12 MET  HN      4.61                
 12 MET  HN     12 MET  HA      2.80                
 12 MET  HN     12 MET  HG2     3.92                
 12 MET  HN     12 MET  HG3     3.92                
 12 MET  HN     12 MET  QG      3.59                
 12 MET  HA     15 GLU- HN      3.64                
 12 MET  HA     16 GLY  HN      3.33                
 12 MET  QB     40 LEU  QQD     6.62                
 12 MET  HG2    40 LEU  QD1     7.31                
 12 MET  HG2    40 LEU  QD2     7.31                
 12 MET  HG3    40 LEU  QD1     7.31                
 12 MET  HG3    40 LEU  QD2     7.31                
 12 MET  QG     13 TRP  HD1     5.85                
 12 MET  QG     40 LEU  QB      6.14                
 12 MET  QG     40 LEU  QQD     5.61                
 13 TRP  QB     17 LEU  HN      5.38                
 13 TRP  QB     40 LEU  QQD     8.73                
 13 TRP  QB     97 ILE  QG2     7.40                
 13 TRP  HD1    40 LEU  QQD     7.85                
 13 TRP  HD1    64 LEU  QD1     6.53                
 13 TRP  HD1    64 LEU  QD2     6.53                
 13 TRP  HD1    64 LEU  QQD     5.35                
 13 TRP  HE1    44 MET  QB      4.64                
 13 TRP  HE1    56 PHE  HD1     5.50                
 13 TRP  HE1    64 LEU  QD1     4.36                
 13 TRP  HE1    64 LEU  QD2     4.36                
 13 TRP  HE1    64 LEU  QQD     3.75                
 13 TRP  HZ2    40 LEU  QB      6.38                
 13 TRP  HZ2    44 MET  QG      6.38                
 13 TRP  HZ2    64 LEU  QQD     6.49                
 13 TRP  HH2    64 LEU  QQD     5.12                
 14 HIS+ HB2    15 GLU- HN      2.86                
 14 HIS+ HB3    15 GLU- HN      2.86                
 14 HIS+ HD2    94 PHE  HA      5.50                
 14 HIS+ HD2    97 ILE  QD1     6.53                
 15 GLU- HN     15 GLU- QB      3.71                
 15 GLU- HN     15 GLU- HG2     3.70                
 15 GLU- HN     15 GLU- HG3     3.70                
 15 GLU- HN     16 GLY  HN      2.65                
 15 GLU- HA     17 LEU  HN      3.48                
 15 GLU- HA     18 GLU- HN      3.11                
 15 GLU- HA     18 GLU- QB      5.20                
 15 GLU- QB     16 GLY  HN      3.83                
 15 GLU- QB     19 GLU- HN      4.73                
 16 GLY  HN     17 LEU  HN      2.74                
 16 GLY  HN     36 VAL  QQG     6.69                
 16 GLY  QA     18 GLU- HN      4.39                
 16 GLY  QA     19 GLU- QB      4.93                
 17 LEU  HN     17 LEU  HG      3.64                
 17 LEU  HN     17 LEU  QQD     6.11                
 17 LEU  HN     18 GLU- HN      2.96                
 17 LEU  HN     36 VAL  QQG     6.35                
 17 LEU  HA     17 LEU  HG      3.92                
 17 LEU  HA     18 GLU- HN      3.61                
 17 LEU  HA     20 ALA  QB      5.26                
 17 LEU  HA     21 SER  HN      3.21                
 17 LEU  HA     40 LEU  QQD     5.90                
 17 LEU  QB     40 LEU  QQD     6.74                
 17 LEU  QB     93 VAL  QQG     7.10                
 17 LEU  QB     94 PHE  HA      4.36                
 17 LEU  QB     97 ILE  QD1     7.40                
 17 LEU  HG     40 LEU  QQD     5.46                
 17 LEU  HG     64 LEU  QD1     5.47                
 17 LEU  HG     64 LEU  QD2     5.47                
 17 LEU  HG     64 LEU  QQD     4.87                
 17 LEU  HG     93 VAL  QQG     6.82                
 17 LEU  QD1    64 LEU  QD1    10.70                
 17 LEU  QD1    64 LEU  QD2    10.70                
 17 LEU  QD1    93 VAL  QG1     8.74                
 17 LEU  QD1    93 VAL  QG2     8.74                
 17 LEU  QD2    64 LEU  QD1    10.70                
 17 LEU  QD2    64 LEU  QD2    10.70                
 17 LEU  QD2    93 VAL  QG1     8.74                
 17 LEU  QD2    93 VAL  QG2     8.74                
 17 LEU  QQD    18 GLU- HN      8.10                
 17 LEU  QQD    37 LEU  QQD     8.56                
 17 LEU  QQD    40 LEU  QQD     9.95                
 17 LEU  QQD    64 LEU  QQD     8.49                
 17 LEU  QQD    90 TYR  HA      6.27                
 17 LEU  QQD    93 VAL  HB      8.10                
 17 LEU  QQD    93 VAL  QQG     6.74                
 17 LEU  QQD    94 PHE  HA      7.82                
 17 LEU  QQD    97 ILE  QG2     8.85                
 17 LEU  QQD    97 ILE  QD1     6.55                
 18 GLU- HN     18 GLU- QB      3.74                
 18 GLU- HN     18 GLU- QG      5.35                
 18 GLU- HN     19 GLU- HN      2.80                
 18 GLU- HN     36 VAL  QQG     7.31                
 18 GLU- HA     21 SER  HN      3.33                
 18 GLU- HA     22 ARG+ HN      4.01                
 18 GLU- QG     19 GLU- HN      6.19                
 18 GLU- QG     22 ARG+ HB2     4.98                
 18 GLU- QG     22 ARG+ HB3     4.98                
 18 GLU- QG     22 ARG+ QB      4.24                
 19 GLU- HN     20 ALA  HN      2.77                
 19 GLU- HN     20 ALA  QB      6.53                
 19 GLU- HN     36 VAL  QQG     7.62                
 19 GLU- HA     20 ALA  HN      3.61                
 19 GLU- HA     22 ARG+ HN      4.94                
 19 GLU- QB     20 ALA  HN      3.80                
 19 GLU- QB     36 VAL  QQG     6.64                
 19 GLU- QG     20 ALA  HN      6.28                
 19 GLU- QG     36 VAL  HB      3.49                
 19 GLU- QG     36 VAL  QQG     8.19                
 20 ALA  HN     21 SER  HN      2.86                
 20 ALA  HN     36 VAL  QQG     7.22                
 20 ALA  HA     23 LEU  QB      3.90                
 20 ALA  QB     21 SER  HN      3.61                
 20 ALA  QB     36 VAL  HA      6.53                
 20 ALA  QB     36 VAL  QQG     7.29                
 20 ALA  QB     37 LEU  HN      4.26                
 20 ALA  QB     37 LEU  HA      4.54                
 20 ALA  QB     37 LEU  QQD     6.40                
 21 SER  HN     21 SER  QB      3.71                
 21 SER  HN     22 ARG+ HN      2.65                
 21 SER  HN     36 VAL  QQG     7.25                
 21 SER  HA     22 ARG+ HN      3.36                
 21 SER  QB     25 PHE  HN      4.98                
 22 ARG+ HN     22 ARG+ HA      2.68                
 22 ARG+ HN     22 ARG+ HB2     2.62                
 22 ARG+ HN     22 ARG+ HB3     2.62                
 22 ARG+ HN     22 ARG+ QG      5.26                
 22 ARG+ HA     25 PHE  HN      3.55                
 22 ARG+ QG     26 GLY  QA      6.14                
 22 ARG+ QG     27 GLU- QG      6.23                
 23 LEU  QB     24 TYR  HN      4.27                
 23 LEU  QB     27 GLU- QB      5.98                
 23 LEU  QB     29 ASN  QB      5.55                
 23 LEU  QB     32 GLY  QA      5.43                
 23 LEU  QB     33 MET  HA      3.99                
 24 TYR  HN     25 PHE  HN      2.99                
 24 TYR  HA     25 PHE  HN      3.64                
 24 TYR  HA     27 GLU- HN      3.21                
 24 TYR  HA     28 ARG+ HN      3.67                
 24 TYR  HA     29 ASN  HN      3.02                
 24 TYR  HA     30 VAL  QQG     5.20                
 24 TYR  QB     25 PHE  HN      4.42                
 24 TYR  QB     26 GLY  HN      5.57                
 24 TYR  QB     33 MET  HN      6.38                
 24 TYR  QB     33 MET  QG      7.25                
 25 PHE  HN     25 PHE  HB2     3.14                
 25 PHE  HN     25 PHE  HB3     3.14                
 25 PHE  HN     26 GLY  HN      2.90                
 26 GLY  HN     27 GLU- HN      2.77                
 27 GLU- HN     27 GLU- QB      3.83                
 27 GLU- HN     27 GLU- QG      4.67                
 27 GLU- HN     28 ARG+ HN      2.71                
 27 GLU- QB     29 ASN  HN      4.36                
 27 GLU- QB     29 ASN  QB      5.55                
 27 GLU- QG     29 ASN  QB      4.16                
 28 ARG+ HN     29 ASN  HN      3.30                
 28 ARG+ HA     29 ASN  HN      2.86                
 29 ASN  HN     29 ASN  HB2     2.90                
 29 ASN  HN     29 ASN  HB3     2.90                
 29 ASN  HN     29 ASN  QB      2.65                
 29 ASN  HA     31 LYS+ HN      3.52                
 29 ASN  HA     32 GLY  HN      3.95                
 29 ASN  QB     30 VAL  QQG     7.82                
 30 VAL  HN     30 VAL  HB      3.36                
 30 VAL  HN     30 VAL  QG1     4.57                
 30 VAL  HN     30 VAL  QG2     4.57                
 30 VAL  HN     30 VAL  QQG     3.77                
 30 VAL  HN     31 LYS+ HN      2.68                
 30 VAL  HB     34 PHE  QD      6.75                
 30 VAL  QG1    31 LYS+ HN      5.94                
 30 VAL  QG1    33 MET  QG      5.54                
 30 VAL  QG1    74 TYR  QD      8.67                
 30 VAL  QG1    80 VAL  QQG     6.79                
 30 VAL  QG1    83 LEU  QB      5.89                
 30 VAL  QG1    83 LEU  HG      4.11                
 30 VAL  QG1    83 LEU  QQD     8.66                
 30 VAL  QG2    31 LYS+ HN      5.94                
 30 VAL  QG2    33 MET  QG      5.54                
 30 VAL  QG2    74 TYR  QD      8.67                
 30 VAL  QG2    80 VAL  QQG     6.79                
 30 VAL  QG2    83 LEU  QB      5.89                
 30 VAL  QG2    83 LEU  HG      4.11                
 30 VAL  QG2    83 LEU  QQD     8.66                
 30 VAL  QQG    31 LYS+ HN      5.60                
 30 VAL  QQG    31 LYS+ HA      7.62                
 30 VAL  QQG    33 MET  HN      7.13                
 30 VAL  QQG    33 MET  QG      5.22                
 30 VAL  QQG    34 PHE  HN      5.89                
 30 VAL  QQG    34 PHE  QB      8.96                
 30 VAL  QQG    74 TYR  QD      8.08                
 30 VAL  QQG    74 TYR  QE      9.32                
 30 VAL  QQG    80 VAL  QQG     6.04                
 30 VAL  QQG    83 LEU  QB      5.37                
 30 VAL  QQG    83 LEU  HG      3.68                
 30 VAL  QQG    83 LEU  QQD     7.95                
 31 LYS+ HN     31 LYS+ QG      5.73                
 31 LYS+ HN     32 GLY  HN      2.59                
 31 LYS+ HA     31 LYS+ QD      3.80                
 31 LYS+ HA     34 PHE  HN      3.61                
 31 LYS+ HA     34 PHE  QB      3.99                
 31 LYS+ HA     34 PHE  QD      7.62                
 31 LYS+ QB     32 GLY  HN      4.70                
 31 LYS+ QB     34 PHE  QD      8.34                
 31 LYS+ QG     35 GLU- QB      6.70                
 31 LYS+ QD     32 GLY  HN      4.70                
 32 GLY  HN     33 MET  HN      3.05                
 32 GLY  HA1    35 GLU- HB2     5.30                
 32 GLY  HA1    35 GLU- HB3     5.30                
 32 GLY  HA2    35 GLU- HB2     5.30                
 32 GLY  HA2    35 GLU- HB3     5.30                
 32 GLY  QA     34 PHE  HN      3.78                
 32 GLY  QA     35 GLU- QB      4.03                
 33 MET  HN     33 MET  QG      5.07                
 33 MET  HN     34 PHE  HN      2.86                
 33 MET  HA     35 GLU- HN      3.45                
 33 MET  HA     37 LEU  HN      4.04                
 33 MET  HA     37 LEU  QQD     6.39                
 33 MET  QB     34 PHE  HN      4.02                
 33 MET  QG     34 PHE  QD      7.48                
 33 MET  QG     36 VAL  QQG     7.35                
 33 MET  QG     37 LEU  QQD     8.51                
 34 PHE  HN     34 PHE  QB      3.49                
 34 PHE  HN     35 GLU- HN      2.40                
 34 PHE  HA     35 GLU- HN      3.27                
 34 PHE  HA     37 LEU  HN      4.51                
 34 PHE  HA     38 GLU- HN      4.35                
 34 PHE  QB     35 GLU- HN      3.74                
 34 PHE  QD     74 TYR  HB2     7.62                
 34 PHE  QD     74 TYR  HB3     7.62                
 34 PHE  QD     74 TYR  QB      6.97                
 34 PHE  QD     74 TYR  QE      8.82                
 34 PHE  QD     75 MET  QG      8.50                
 34 PHE  QE     74 TYR  QD      8.55                
 34 PHE  QE     74 TYR  QE      9.75                
 35 GLU- HN     35 GLU- HB2     2.55                
 35 GLU- HN     35 GLU- HB3     2.55                
 35 GLU- HN     35 GLU- QB      2.32                
 35 GLU- HN     36 VAL  HN      2.86                
 35 GLU- HA     37 LEU  HN      5.50                
 35 GLU- HA     38 GLU- HN      3.30                
 35 GLU- HA     38 GLU- QB      4.18                
 36 VAL  HN     36 VAL  HB      2.46                
 36 VAL  HN     37 LEU  HN      2.43                
 36 VAL  HA     39 PRO  QG      6.38                
 36 VAL  HA     40 LEU  QQD     8.10                
 36 VAL  HB     37 LEU  HN      4.32                
 36 VAL  QQG    37 LEU  HN      7.62                
 36 VAL  QQG    39 PRO  QG      7.88                
 36 VAL  QQG    40 LEU  HG      5.42                
 36 VAL  QQG    40 LEU  QQD     7.83                
 37 LEU  HN     37 LEU  QQD     6.11                
 37 LEU  HN     38 GLU- HN      3.24                
 37 LEU  HA     40 LEU  HN      3.92                
 37 LEU  HA     40 LEU  QQD     5.83                
 37 LEU  QQD    40 LEU  HG      5.31                
 37 LEU  QQD    40 LEU  QD1     7.20                
 37 LEU  QQD    40 LEU  QD2     7.20                
 37 LEU  QQD    40 LEU  QQD     6.82                
 37 LEU  QQD    64 LEU  QD1     6.89                
 37 LEU  QQD    64 LEU  QD2     6.89                
 37 LEU  QQD    64 LEU  QQD     6.19                
 38 GLU- HN     38 GLU- HA      2.80                
 38 GLU- HN     38 GLU- QB      3.77                
 38 GLU- HN     38 GLU- QG      3.65                
 38 GLU- HN     39 PRO  HD2     2.96                
 38 GLU- HN     39 PRO  HD3     2.96                
 38 GLU- HA     41 HIS+ HN      3.83                
 38 GLU- QB     39 PRO  QG      4.65                
 38 GLU- QB     39 PRO  QD      5.95                
 39 PRO  HA     42 ALA  HN      2.90                
 39 PRO  HA     42 ALA  QB      4.67                
 39 PRO  HA     43 MET  HN      3.48                
 39 PRO  QB     40 LEU  QQD     8.97                
 39 PRO  QG     40 LEU  QQD     7.42                
 40 LEU  HN     40 LEU  HG      3.55                
 40 LEU  HN     40 LEU  QD1     6.47                
 40 LEU  HN     40 LEU  QD2     6.47                
 40 LEU  HN     40 LEU  QQD     6.10                
 40 LEU  HN     41 HIS+ HN      2.40                
 40 LEU  HA     41 HIS+ HN      3.36                
 40 LEU  HA     43 MET  HN      3.95                
 40 LEU  QQD    41 HIS+ HN      6.05                
 40 LEU  QQD    43 MET  QB      8.32                
 41 HIS+ HN     41 HIS+ HA      2.74                
 41 HIS+ HN     41 HIS+ QB      3.46                
 41 HIS+ HN     42 ALA  HN      2.65                
 41 HIS+ HA     44 MET  HN      3.86                
 41 HIS+ QB     42 ALA  HN      3.68                
 42 ALA  HN     42 ALA  QB      3.43                
 42 ALA  HN     43 MET  HN      2.59                
 42 ALA  HA     44 MET  HN      3.39                
 42 ALA  HA     45 GLU- HN      2.99                
 42 ALA  HA     45 GLU- HB2     3.05                
 42 ALA  HA     45 GLU- HB3     3.33                
 42 ALA  QB     43 MET  HN      3.43                
 43 MET  HN     43 MET  QG      3.37                
 43 MET  HN     44 MET  HN      2.80                
 43 MET  HA     44 MET  HN      3.30                
 43 MET  HA     46 ARG+ QB      3.81                
 44 MET  HN     44 MET  QG      4.95                
 44 MET  HN     45 GLU- HN      2.71                
 44 MET  QB     64 LEU  QD1     6.29                
 44 MET  QB     64 LEU  QD2     6.29                
 44 MET  QB     64 LEU  QQD     5.82                
 44 MET  QG     64 LEU  QQD     8.01                
 45 GLU- HN     45 GLU- HB2     2.77                
 45 GLU- HN     45 GLU- HB3     2.68                
 45 GLU- HA     45 GLU- HB2     3.02                
 45 GLU- HA     46 ARG+ HN      3.61                
 45 GLU- HA     47 GLY  HN      3.73                
 45 GLU- HB2    46 ARG+ HN      3.83                
 45 GLU- HB3    46 ARG+ HN      2.71                
 46 ARG+ HN     46 ARG+ HA      2.71                
 46 ARG+ HN     46 ARG+ HB2     3.30                
 46 ARG+ HN     46 ARG+ HB3     3.30                
 46 ARG+ HN     46 ARG+ QB      2.93                
 46 ARG+ HN     46 ARG+ QG      4.61                
 46 ARG+ HB2    47 GLY  HN      4.01                
 46 ARG+ HB3    47 GLY  HN      4.01                
 46 ARG+ QB     47 GLY  HN      3.76                
 49 GLN  HB2    50 THR  HN      3.79                
 49 GLN  HB3    50 THR  HN      3.79                
 49 GLN  QB     50 THR  HN      3.60                
 49 GLN  HG2    50 THR  HN      3.33                
 49 GLN  HG3    50 THR  HN      3.33                
 49 GLN  QG     50 THR  HN      3.00                
 50 THR  HN     50 THR  HB      3.02                
 50 THR  HN     51 LEU  HN      3.39                
 50 THR  QG2    51 LEU  HN      4.05                
 51 LEU  HN     51 LEU  QB      3.68                
 51 LEU  HN     51 LEU  HG      5.50                
 51 LEU  HN     51 LEU  QQD     7.63                
 51 LEU  HN     52 LYS+ HN      2.40                
 51 LEU  HN     53 GLU- HN      4.17                
 51 LEU  HA     51 LEU  HG      3.02                
 51 LEU  QB     52 LYS+ QG      4.65                
 51 LEU  HG     54 THR  QG2     5.88                
 51 LEU  QQD    52 LYS+ HN      6.21                
 51 LEU  QQD    54 THR  QG2     6.74                
 52 LYS+ HN     52 LYS+ QG      4.14                
 52 LYS+ HN     52 LYS+ QE      5.73                
 52 LYS+ QG     53 GLU- HN      5.35                
 53 GLU- HN     53 GLU- HA      2.77                
 53 GLU- HN     54 THR  HN      3.95                
 53 GLU- HA     54 THR  HN      2.40                
 54 THR  HN     54 THR  HB      3.02                
 54 THR  HN     55 SER  HN      2.52                
 54 THR  HA     54 THR  HB      2.99                
 54 THR  HA     58 GLN  HN      4.38                
 54 THR  QG2    58 GLN  HN      4.61                
 55 SER  HN     55 SER  QB      3.90                
 55 SER  HN     56 PHE  HN      3.42                
 55 SER  HA     58 GLN  HN      3.73                
 56 PHE  HN     57 ASN  HN      2.96                
 56 PHE  HA     58 GLN  HN      4.07                
 56 PHE  HA     59 ALA  HN      3.30                
 56 PHE  HA     60 TYR  QD      7.64                
 56 PHE  HA     60 TYR  QE      6.18                
 56 PHE  QB     57 ASN  QB      7.04                
 56 PHE  HD1    57 ASN  HN      3.67                
 57 ASN  HN     57 ASN  HB2     3.55                
 57 ASN  HN     57 ASN  HB3     3.55                
 57 ASN  HN     57 ASN  QB      3.25                
 57 ASN  HN     58 GLN  HN      3.05                
 57 ASN  HB2    58 GLN  HN      4.51                
 57 ASN  HB3    58 GLN  HN      4.51                
 57 ASN  QB     58 GLN  HN      4.25                
 58 GLN  HN     58 GLN  HA      2.71                
 58 GLN  HN     58 GLN  HB2     3.76                
 58 GLN  HN     58 GLN  HB3     3.76                
 58 GLN  HN     58 GLN  QB      3.43                
 58 GLN  HN     59 ALA  HN      2.55                
 58 GLN  HB2    59 ALA  HN      4.69                
 58 GLN  HB3    59 ALA  HN      4.69                
 58 GLN  QB     58 GLN  QG      2.32                
 58 GLN  QB     59 ALA  HN      4.12                
 59 ALA  HN     59 ALA  QB      3.43                
 59 ALA  HN     60 TYR  HN      2.49                
 59 ALA  QB     60 TYR  HN      3.43                
 60 TYR  HN     60 TYR  HA      2.90                
 60 TYR  HN     61 GLY  HN      3.33                
 60 TYR  HA     61 GLY  HN      3.55                
 60 TYR  HA     62 ARG+ HN      3.27                
 60 TYR  HA     63 ASP- HN      3.73                
 60 TYR  QB     93 VAL  HB      5.17                
 60 TYR  QD     96 ARG+ QB      7.09                
 60 TYR  QE     93 VAL  QG1     7.89                
 60 TYR  QE     93 VAL  QG2     7.89                
 60 TYR  QE     93 VAL  QQG     7.09                
 60 TYR  QE     96 ARG+ QB      8.51                
 61 GLY  HN     61 GLY  HA1     2.86                
 61 GLY  HN     61 GLY  HA2     2.86                
 61 GLY  HN     61 GLY  QA      2.49                
 61 GLY  HN     62 ARG+ HN      2.62                
 61 GLY  QA     63 ASP- HN      4.36                
 62 ARG+ HN     62 ARG+ HA      2.77                
 62 ARG+ HN     62 ARG+ QB      3.90                
 62 ARG+ HN     62 ARG+ QG      4.02                
 62 ARG+ HN     62 ARG+ QD      4.83                
 62 ARG+ HN     63 ASP- HN      3.08                
 62 ARG+ HA     63 ASP- HN      3.36                
 62 ARG+ QG     63 ASP- HN      6.38                
 62 ARG+ QG     89 LEU  QQD     8.51                
 63 ASP- HN     63 ASP- HA      2.80                
 63 ASP- HN     63 ASP- HB2     3.89                
 63 ASP- HN     63 ASP- HB3     3.89                
 63 ASP- HN     63 ASP- QB      3.36                
 64 LEU  HA     67 ALA  HN      2.96                
 64 LEU  HA     68 GLN  HN      3.95                
 64 LEU  QB     93 VAL  QG1     6.54                
 64 LEU  QB     93 VAL  QG2     6.54                
 64 LEU  QB     93 VAL  QQG     6.28                
 64 LEU  QD1    93 VAL  QG1     8.88                
 64 LEU  QD1    93 VAL  QG2     8.88                
 64 LEU  QD1    97 ILE  QD1     7.56                
 64 LEU  QD2    93 VAL  QG1     8.88                
 64 LEU  QD2    93 VAL  QG2     8.88                
 64 LEU  QD2    97 ILE  QD1     7.56                
 64 LEU  QQD    67 ALA  QB      9.13                
 64 LEU  QQD    90 TYR  QE      8.28                
 64 LEU  QQD    93 VAL  QQG     6.82                
 64 LEU  QQD    97 ILE  QD1     6.70                
 66 GLU- QB     67 ALA  HN      4.08                
 67 ALA  HN     67 ALA  HA      2.77                
 67 ALA  HN     68 GLN  HN      2.68                
 67 ALA  HN     89 LEU  QB      6.38                
 67 ALA  HN     89 LEU  QQD     5.59                
 67 ALA  HA     86 ALA  QB      4.51                
 67 ALA  HA     89 LEU  QB      4.58                
 67 ALA  QB     89 LEU  QQD     8.26                
 68 GLN  HN     68 GLN  HA      2.77                
 68 GLN  HN     68 GLN  QG      4.98                
 68 GLN  HN     69 GLU- HN      2.40                
 68 GLN  HN     70 TRP  HN      3.45                
 68 GLN  QB     69 GLU- HN      3.90                
 68 GLN  QB     69 GLU- HA      5.54                
 68 GLN  QG     69 GLU- HN      3.93                
 68 GLN  QG     69 GLU- HA      4.98                
 68 GLN  QG     71 CYS  QB      5.70                
 69 GLU- HN     69 GLU- QB      3.93                
 69 GLU- HN     69 GLU- QG      4.33                
 69 GLU- HN     70 TRP  HN      3.17                
 69 GLU- QB     70 TRP  QB      6.91                
 70 TRP  QB     74 TYR  HN      3.80                
 70 TRP  QB     85 GLN  QB      7.25                
 71 CYS  HA     74 TYR  HN      3.02                
 71 CYS  HA     75 MET  HN      5.50                
 71 CYS  QB     75 MET  QG      5.67                
 72 ARG+ HA     75 MET  QB      3.37                
 73 LYS+ HA     74 TYR  HN      3.61                
 73 LYS+ HA     77 SER  HN      3.05                
 73 LYS+ QB     74 TYR  HN      4.33                
 73 LYS+ QB     77 SER  QB      7.25                
 74 TYR  HN     74 TYR  HA      2.83                
 74 TYR  HN     74 TYR  HB2     3.30                
 74 TYR  HN     74 TYR  HB3     3.30                
 74 TYR  HN     74 TYR  QB      2.95                
 74 TYR  HN     75 MET  HN      2.55                
 74 TYR  HA     78 GLY  HN      3.11                
 74 TYR  HA     79 ASN  HN      3.30                
 74 TYR  HB2    78 GLY  HN      5.50                
 74 TYR  HB3    78 GLY  HN      5.50                
 74 TYR  QB     75 MET  HN      4.36                
 74 TYR  QB     78 GLY  HN      4.95                
 74 TYR  QE     83 LEU  QQD     8.87                
 75 MET  HN     75 MET  HA      2.86                
 75 MET  HN     75 MET  QG      4.73                
 75 MET  HN     76 LYS+ HN      2.46                
 75 MET  HN     77 SER  HN      3.48                
 75 MET  QB     76 LYS+ HN      4.05                
 76 LYS+ HN     76 LYS+ QB      3.46                
 76 LYS+ HN     77 SER  HN      2.40                
 76 LYS+ HN     78 GLY  HN      3.79                
 76 LYS+ HA     77 SER  HN      3.58                
 76 LYS+ HA     78 GLY  HN      4.32                
 76 LYS+ QB     77 SER  HN      3.49                
 76 LYS+ QG     77 SER  QB      7.25                
 77 SER  HN     77 SER  HA      2.80                
 77 SER  HN     77 SER  QB      3.71                
 77 SER  HN     78 GLY  HN      2.40                
 77 SER  QB     78 GLY  HN      4.27                
 77 SER  QB     79 ASN  HN      4.73                
 78 GLY  HN     79 ASN  HN      3.02                
 79 ASN  HN     79 ASN  QB      3.87                
 79 ASN  HA     80 VAL  HN      2.40                
 79 ASN  HA     82 ASP- HN      5.16                
 80 VAL  HN     80 VAL  HB      2.40                
 80 VAL  HA     82 ASP- HN      3.30                
 80 VAL  HA     83 LEU  HN      2.96                
 80 VAL  HA     83 LEU  QB      4.76                
 80 VAL  HA     84 THR  HN      3.48                
 80 VAL  QQG    81 LYS+ QB      8.16                
 80 VAL  QQG    81 LYS+ QG      7.48                
 80 VAL  QQG    81 LYS+ QD      7.38                
 80 VAL  QQG    82 ASP- HN      6.29                
 80 VAL  QQG    83 LEU  HG      6.41                
 80 VAL  QQG    83 LEU  QQD     9.10                
 80 VAL  QQG    84 THR  QG2     7.84                
 81 LYS+ HN     81 LYS+ HA      2.74                
 81 LYS+ HN     81 LYS+ QB      3.87                
 81 LYS+ HN     81 LYS+ QG      5.73                
 81 LYS+ HN     81 LYS+ QD      6.38                
 81 LYS+ HN     82 ASP- HN      3.33                
 81 LYS+ QB     82 ASP- HN      4.05                
 81 LYS+ QG     82 ASP- HN      5.66                
 81 LYS+ QD     84 THR  HN      5.11                
 81 LYS+ QD     84 THR  QG2     4.30                
 82 ASP- HN     83 LEU  HN      2.59                
 83 LEU  HN     83 LEU  HA      2.74                
 83 LEU  HA     86 ALA  HN      3.02                
 83 LEU  QB     84 THR  HA      6.38                
 83 LEU  QB     84 THR  QG2     5.61                
 83 LEU  QQD    86 ALA  QB      6.71                
 84 THR  HN     84 THR  HA      2.77                
 84 THR  HN     84 THR  HB      2.71                
 84 THR  HN     85 GLN  HN      2.83                
 85 GLN  HN     85 GLN  QG      5.60                
 85 GLN  HN     86 ALA  HN      2.40                
 86 ALA  HN     86 ALA  HA      2.90                
 86 ALA  HN     87 TRP  HN      2.68                
 86 ALA  HA     87 TRP  HN      3.61                
 86 ALA  HA     89 LEU  HN      3.95                
 86 ALA  HA     89 LEU  QQD     6.08                
 86 ALA  QB     89 LEU  HN      5.94                
 86 ALA  QB     89 LEU  QQD     8.66                
 86 ALA  QB     90 TYR  QD      6.31                
 87 TRP  HN     88 ASP- HN      2.55                
 87 TRP  HA     88 ASP- HN      3.48                
 87 TRP  HA     90 TYR  HN      3.73                
 87 TRP  QB     88 ASP- HN      4.36                
 87 TRP  QB     91 TYR  HN      5.51                
 87 TRP  HE3    90 TYR  QB      4.36                
 88 ASP- HN     88 ASP- HB2     3.17                
 88 ASP- HN     88 ASP- HB3     3.17                
 88 ASP- HN     88 ASP- QB      2.97                
 88 ASP- HN     89 LEU  HN      2.49                
 88 ASP- HA     91 TYR  HN      4.57                
 88 ASP- HA     92 HIS+ HN      3.45                
 88 ASP- HB2    89 LEU  HN      5.50                
 88 ASP- HB3    89 LEU  HN      5.50                
 89 LEU  HN     89 LEU  HA      2.71                
 89 LEU  HN     89 LEU  HG      2.74                
 89 LEU  HN     89 LEU  QQD     7.63                
 89 LEU  HN     90 TYR  HN      2.62                
 89 LEU  HA     92 HIS+ HN      3.42                
 89 LEU  QB     90 TYR  HN      4.80                
 89 LEU  QB     93 VAL  QG1     7.31                
 89 LEU  QB     93 VAL  QG2     7.31                
 89 LEU  QB     93 VAL  QQG     6.70                
 89 LEU  QQD    90 TYR  HN      7.63                
 89 LEU  QQD    93 VAL  QG1     8.66                
 89 LEU  QQD    93 VAL  QG2     8.66                
 89 LEU  QQD    93 VAL  QQG     8.24                
 90 TYR  HN     91 TYR  HN      3.36                
 90 TYR  HA     93 VAL  HB      4.66                
 91 TYR  HN     91 TYR  HB2     3.48                
 91 TYR  HN     91 TYR  HB3     3.48                
 91 TYR  HN     91 TYR  QB      3.25                
 91 TYR  HN     91 TYR  QE      6.98                
 91 TYR  HN     92 HIS+ HN      2.86                
 91 TYR  HB2    92 HIS+ HN      3.61                
 91 TYR  HB3    92 HIS+ HN      3.61                
 91 TYR  QB     92 HIS+ HN      3.42                
 91 TYR  QD     92 HIS+ HN      7.42                
 91 TYR  QD     92 HIS+ HB2     7.64                
 91 TYR  QD     94 PHE  QB      8.52                
 91 TYR  QE     92 HIS+ HN      7.63                
 91 TYR  QE     92 HIS+ HB2     7.63                
 91 TYR  QE     94 PHE  QB      7.61                
 92 HIS+ HN     92 HIS+ HB2     2.52                
 92 HIS+ HN     92 HIS+ HB3     2.68                
 92 HIS+ HN     93 VAL  HN      2.65                
 92 HIS+ HN     93 VAL  QQG     7.16                
 92 HIS+ HB3    93 VAL  HN      3.27                
 93 VAL  HN     93 VAL  HA      2.74                
 93 VAL  HN     93 VAL  HB      2.71                
 93 VAL  HN     93 VAL  QG1     4.73                
 93 VAL  HN     93 VAL  QG2     4.73                
 93 VAL  HN     93 VAL  QQG     4.00                
 93 VAL  HN     94 PHE  HN      3.02                
 93 VAL  HN     94 PHE  QB      4.36                
 93 VAL  HA     94 PHE  HN      3.61                
 93 VAL  HA     96 ARG+ HN      3.58                
 93 VAL  HA     96 ARG+ QB      3.99                
 93 VAL  HA     96 ARG+ QG      5.32                
 93 VAL  HB     97 ILE  QG1     6.29                
 93 VAL  QG1    94 PHE  HN      6.12                
 93 VAL  QG1    96 ARG+ QG      7.40                
 93 VAL  QG1    97 ILE  QG2     4.92                
 93 VAL  QG1    97 ILE  HG12    3.89                
 93 VAL  QG1    97 ILE  HG13    3.89                
 93 VAL  QG1    97 ILE  QD1     7.56                
 93 VAL  QG2    94 PHE  HN      6.12                
 93 VAL  QG2    96 ARG+ QG      7.40                
 93 VAL  QG2    97 ILE  QG2     4.92                
 93 VAL  QG2    97 ILE  HG12    3.89                
 93 VAL  QG2    97 ILE  HG13    3.89                
 93 VAL  QG2    97 ILE  QD1     7.56                
 93 VAL  QQG    94 PHE  HN      5.20                
 93 VAL  QQG    97 ILE  QG2     4.43                
 93 VAL  QQG    97 ILE  QG1     3.19                
 93 VAL  QQG    97 ILE  QD1     6.63                
 94 PHE  HA     97 ILE  HG12    5.50                
 94 PHE  HA     97 ILE  HG13    5.50                
 94 PHE  HA     97 ILE  QG1     4.72                
 94 PHE  QD     95 ARG+ HN      5.23                
 95 ARG+ HA     98 SER  HN      3.52                
 96 ARG+ HN     96 ARG+ QB      3.71                
 96 ARG+ HN     96 ARG+ QG      3.93                
 96 ARG+ HN     97 ILE  HN      2.74                
 96 ARG+ QB     97 ILE  QG1     5.43                
 97 ILE  HN     97 ILE  QG2     4.76                
 97 ILE  HN     97 ILE  HG12    3.67                
 97 ILE  HN     97 ILE  HG13    3.67                
 97 ILE  HN     97 ILE  QG1     3.42                
 97 ILE  HN     97 ILE  QD1     4.30                
 97 ILE  HN     98 SER  HN      2.71                
 97 ILE  HG12   98 SER  HN      4.79                
 97 ILE  HG13   98 SER  HN      4.79                
 97 ILE  QG1    98 SER  HN      4.58                
 97 ILE  QD1    98 SER  HN      5.23                
 98 SER  HN     98 SER  QB      3.83                
 99 LYS+ HN     99 LYS+ QG      4.02                
 99 LYS+ HN     99 LYS+ QD      5.76                
 99 LYS+ HN    100 GLN  HN      2.40                
 99 LYS+ HA    100 GLN  HN      2.83                
100 GLN  HN    100 GLN  HB2     2.52                
100 GLN  HN    100 GLN  HB3     2.52                
100 GLN  HN    100 GLN  QB      2.30                
100 GLN  HN    100 GLN  QG      5.20                
   9 TRP   PHI    -120.0   -20.0
   9 TRP   PSI    -100.0     0.0
  11 GLU-  PHI    -120.0   -20.0
  11 GLU-  PSI    -100.0     0.0
  15 GLU-  PHI    -120.0   -20.0
  15 GLU-  PSI    -100.0     0.0
  17 LEU   PHI    -120.0   -20.0
  17 LEU   PSI    -100.0     0.0
  18 GLU-  PHI    -120.0   -20.0
  18 GLU-  PSI    -100.0     0.0
  19 GLU-  PHI    -120.0   -20.0
  19 GLU-  PSI    -100.0     0.0
  20 ALA   PHI    -120.0   -20.0
  20 ALA   PSI    -100.0     0.0
  21 SER   PHI    -120.0   -20.0
  21 SER   PSI    -100.0     0.0
  22 ARG+  PHI    -120.0   -20.0
  22 ARG+  PSI    -100.0     0.0
  23 LEU   PHI    -120.0   -20.0
  23 LEU   PSI    -100.0     0.0
  24 TYR   PHI    -120.0   -20.0
  24 TYR   PSI    -100.0     0.0
  25 PHE   PHI    -120.0   -20.0
  25 PHE   PSI    -100.0     0.0
  30 VAL   PHI    -120.0   -20.0
  30 VAL   PSI    -100.0     0.0
  31 LYS+  PHI    -120.0   -20.0
  31 LYS+  PSI    -100.0     0.0
  33 MET   PHI    -120.0   -20.0
  33 MET   PSI    -100.0     0.0
  34 PHE   PHI    -120.0   -20.0
  34 PHE   PSI    -100.0     0.0
  35 GLU-  PHI    -120.0   -20.0
  35 GLU-  PSI    -100.0     0.0
  36 VAL   PHI    -120.0   -20.0
  36 VAL   PSI    -100.0     0.0
  37 LEU   PHI    -120.0   -20.0
  37 LEU   PSI    -100.0     0.0
  38 GLU-  PHI    -120.0   -20.0
  38 GLU-  PSI    -100.0     0.0
  40 LEU   PHI    -120.0   -20.0
  40 LEU   PSI    -100.0     0.0
  42 ALA   PHI    -120.0   -20.0
  42 ALA   PSI    -100.0     0.0
  43 MET   PHI    -120.0   -20.0
  43 MET   PSI    -100.0     0.0
  44 MET   PHI    -120.0    80.0
  44 MET   PSI    -100.0    60.0
  45 GLU-  PHI    -120.0   -20.0
  45 GLU-  PSI    -100.0     0.0
  46 ARG+  PHI    -120.0   -20.0
  46 ARG+  PSI    -100.0     0.0
  50 THR   PHI    -120.0   -20.0
  50 THR   PSI    -100.0     0.0
  51 LEU   PHI    -200.0   -80.0
  51 LEU   PSI      40.0   220.0
  52 LYS+  PHI    -120.0   -20.0
  52 LYS+  PSI    -100.0     0.0
  53 GLU-  PHI    -200.0   -80.0
  53 GLU-  PSI      40.0   220.0
  54 THR   PHI    -200.0   -80.0
  54 THR   PSI      40.0   220.0
  55 SER   PHI    -200.0   -80.0
  56 PHE   PSI    -100.0     0.0
  57 ASN   PHI    -120.0   -20.0
  57 ASN   PSI    -100.0     0.0
  58 GLN   PHI    -120.0   -20.0
  58 GLN   PSI    -100.0     0.0
  59 ALA   PHI    -120.0   -20.0
  59 ALA   PSI    -100.0     0.0
  62 ARG+  PHI    -120.0   -20.0
  62 ARG+  PSI    -100.0     0.0
  63 ASP-  PSI      40.0   220.0
  66 GLU-  PHI    -120.0   -20.0
  66 GLU-  PSI    -100.0     0.0
  67 ALA   PHI    -120.0   -20.0
  67 ALA   PSI    -100.0     0.0
  68 GLN   PHI    -120.0   -20.0
  68 GLN   PSI    -100.0     0.0
  73 LYS+  PHI    -120.0   -20.0
  73 LYS+  PSI    -100.0     0.0
  74 TYR   PHI    -120.0   -20.0
  74 TYR   PSI    -100.0     0.0
  75 MET   PHI    -120.0   -20.0
  75 MET   PSI    -100.0     0.0
  77 SER   PHI    -120.0    80.0
  77 SER   PSI    -100.0    60.0
  80 VAL   PHI    -120.0   -20.0
  80 VAL   PSI    -100.0     0.0
  81 LYS+  PHI    -120.0   -20.0
  81 LYS+  PSI    -100.0     0.0
  82 ASP-  PHI    -120.0   -20.0
  82 ASP-  PSI    -100.0     0.0
  83 LEU   PHI    -120.0   -20.0
  83 LEU   PSI    -100.0     0.0
  84 THR   PHI    -120.0   -20.0
  84 THR   PSI    -100.0     0.0
  85 GLN   PHI    -120.0   -20.0
  85 GLN   PSI    -100.0     0.0
  86 ALA   PHI    -120.0   -20.0
  86 ALA   PSI    -100.0     0.0
  87 TRP   PHI    -120.0   -20.0
  87 TRP   PSI    -100.0     0.0
  88 ASP-  PHI    -120.0   -20.0
  88 ASP-  PSI    -100.0     0.0
  89 LEU   PHI    -120.0   -20.0
  89 LEU   PSI    -100.0     0.0
  90 TYR   PHI    -120.0   -20.0
  90 TYR   PSI    -100.0     0.0
  91 TYR   PHI    -120.0   -20.0
  91 TYR   PSI    -100.0     0.0
  93 VAL   PHI    -120.0   -20.0
  93 VAL   PSI    -100.0     0.0
  94 PHE   PHI    -120.0    80.0
  94 PHE   PSI    -100.0    60.0
  95 ARG+  PHI    -120.0   -20.0
  95 ARG+  PSI    -100.0     0.0
  96 ARG+  PHI    -120.0   -20.0
  96 ARG+  PSI    -100.0     0.0
  97 ILE   PHI    -120.0   -20.0
  97 ILE   PSI    -100.0     0.0
  98 SER   PHI    -120.0    80.0
  98 SER   PSI    -100.0    60.0

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    GLU   1          1H        GLU   1  13.467 -16.152 -10.453
    2   2H    GLU   1          2H        GLU   1  14.535 -15.684  -9.242
    3    HA   GLU   1           HA       GLU   1  12.352 -13.889  -9.258
    4   1HB   GLU   1          2HB       GLU   1  14.187 -12.236  -9.486
    5   2HB   GLU   1          1HB       GLU   1  14.643 -13.431  -8.319
    6   1HG   GLU   1          2HG       GLU   1  15.978 -14.602 -10.142
    7   2HG   GLU   1          1HG       GLU   1  15.629 -13.243 -11.180
    8    H    LEU   2           H        LEU   2  11.760 -12.314 -10.896
    9    HA   LEU   2           HA       LEU   2  10.851 -11.887 -13.003
   10   1HB   LEU   2          2HB       LEU   2  12.256 -11.254 -14.571
   11   2HB   LEU   2          1HB       LEU   2  13.048 -10.917 -12.983
   12    HG   LEU   2           HG       LEU   2  14.164 -13.315 -13.843
   13   1HD1  LEU   2          1HD1      LEU   2  14.945 -12.799 -16.113
   14   2HD1  LEU   2          2HD1      LEU   2  13.175 -12.974 -16.069
   15   3HD1  LEU   2          3HD1      LEU   2  13.908 -11.354 -16.151
   16   1HD2  LEU   2          1HD2      LEU   2  16.169 -11.920 -14.131
   17   2HD2  LEU   2          2HD2      LEU   2  15.159 -10.454 -14.138
   18   3HD2  LEU   2          3HD2      LEU   2  15.277 -11.447 -12.665
   19    H    ILE   3           H        ILE   3   9.741 -14.159 -12.512
   20    HA   ILE   3           HA       ILE   3  10.441 -16.419 -14.038
   21    HB   ILE   3           HB       ILE   3   8.301 -17.282 -13.687
   22   1HG1  ILE   3          2HG1      ILE   3   6.838 -15.671 -14.188
   23   2HG1  ILE   3          1HG1      ILE   3   6.568 -16.335 -12.535
   24   1HG2  ILE   3          1HG2      ILE   3   8.370 -17.208 -11.222
   25   2HG2  ILE   3          2HG2      ILE   3  10.012 -17.350 -11.893
   26   3HG2  ILE   3          3HG2      ILE   3   9.433 -15.782 -11.284
   27   1HD1  ILE   3          1HD1      ILE   3   6.028 -13.967 -12.654
   28   2HD1  ILE   3          2HD1      ILE   3   7.414 -14.259 -11.575
   29   3HD1  ILE   3          3HD1      ILE   3   7.681 -13.603 -13.208
   30    H    ARG   4           H        ARG   4   8.664 -13.560 -14.957
   31    HA   ARG   4           HA       ARG   4   8.612 -14.321 -17.835
   32   1HB   ARG   4          2HB       ARG   4   6.322 -13.178 -16.226
   33   2HB   ARG   4          1HB       ARG   4   6.357 -13.436 -17.997
   34   1HG   ARG   4          2HG       ARG   4   6.956 -15.946 -16.592
   35   2HG   ARG   4          1HG       ARG   4   5.449 -15.301 -16.029
   36   1HD   ARG   4          2HD       ARG   4   4.987 -16.734 -17.862
   37   2HD   ARG   4          1HD       ARG   4   4.711 -15.104 -18.447
   38    HE   ARG   4           HE       ARG   4   6.953 -16.863 -19.120
   39   1HH1  ARG   4          2HH2      ARG   4   5.401 -13.748 -19.628
   40   2HH1  ARG   4          1HH2      ARG   4   6.209 -13.462 -21.137
   41   1HH2  ARG   4          1HH1      ARG   4   7.966 -16.450 -21.117
   42   2HH2  ARG   4          2HH1      ARG   4   7.626 -14.977 -21.958
   43    H    VAL   5           H        VAL   5   7.375 -11.588 -15.925
   44    HA   VAL   5           HA       VAL   5   9.169  -9.610 -17.305
   45    HB   VAL   5           HB       VAL   5   7.050  -9.506 -18.214
   46   1HG1  VAL   5          1HG1      VAL   5   5.033  -8.953 -16.931
   47   2HG1  VAL   5          2HG1      VAL   5   5.668 -10.551 -16.471
   48   3HG1  VAL   5          3HG1      VAL   5   5.936  -9.148 -15.410
   49   1HG2  VAL   5          1HG2      VAL   5   6.388  -7.254 -17.801
   50   2HG2  VAL   5          2HG2      VAL   5   7.488  -7.185 -16.403
   51   3HG2  VAL   5          3HG2      VAL   5   8.142  -7.449 -18.037
   52    H    ALA   6           H        ALA   6   8.748 -11.102 -14.325
   53    HA   ALA   6           HA       ALA   6   9.307 -10.625 -12.145
   54   1HB   ALA   6          1HB       ALA   6  10.926  -8.911 -11.647
   55   2HB   ALA   6          2HB       ALA   6  11.455  -9.921 -13.013
   56   3HB   ALA   6          3HB       ALA   6  10.813  -8.288 -13.309
   57    H    ILE   7           H        ILE   7   6.835  -9.552 -13.420
   58    HA   ILE   7           HA       ILE   7   6.180  -6.958 -12.609
   59    HB   ILE   7           HB       ILE   7   4.760  -7.756 -14.204
   60   1HG1  ILE   7          2HG1      ILE   7   2.683  -7.328 -13.428
   61   2HG1  ILE   7          1HG1      ILE   7   3.114  -7.774 -11.741
   62   1HG2  ILE   7          1HG2      ILE   7   3.296  -9.640 -13.950
   63   2HG2  ILE   7          2HG2      ILE   7   4.991 -10.174 -13.836
   64   3HG2  ILE   7          3HG2      ILE   7   4.003 -10.028 -12.363
   65   1HD1  ILE   7          1HD1      ILE   7   2.829  -5.360 -11.988
   66   2HD1  ILE   7          2HD1      ILE   7   4.512  -5.771 -11.578
   67   3HD1  ILE   7          3HD1      ILE   7   4.086  -5.329 -13.249
   68    H    LEU   8           H        LEU   8   4.367  -9.559 -11.034
   69    HA   LEU   8           HA       LEU   8   3.745  -9.922  -8.810
   70   1HB   LEU   8          2HB       LEU   8   6.617  -9.414  -8.744
   71   2HB   LEU   8          1HB       LEU   8   5.723  -9.155  -7.210
   72    HG   LEU   8           HG       LEU   8   6.641 -11.499  -7.380
   73   1HD1  LEU   8          1HD1      LEU   8   4.615 -12.561  -6.722
   74   2HD1  LEU   8          2HD1      LEU   8   4.768 -10.939  -6.003
   75   3HD1  LEU   8          3HD1      LEU   8   3.663 -11.205  -7.371
   76   1HD2  LEU   8          1HD2      LEU   8   5.718 -13.078  -8.909
   77   2HD2  LEU   8          2HD2      LEU   8   4.775 -11.807  -9.725
   78   3HD2  LEU   8          3HD2      LEU   8   6.552 -11.790  -9.810
   79    H    TRP   9           H        TRP   9   2.640  -8.973  -7.213
   80    HA   TRP   9           HA       TRP   9   2.197  -6.143  -7.389
   81   1HB   TRP   9          2HB       TRP   9   1.032  -8.123  -5.477
   82   2HB   TRP   9          1HB       TRP   9   0.749  -6.417  -5.362
   83    HD1  TRP   9           HD       TRP   9   0.797  -6.535  -8.909
   84    HE1  TRP   9           1HE      TRP   9  -1.565  -6.801  -9.786
   85    HE3  TRP   9           3HE      TRP   9  -1.254  -8.590  -4.799
   86    HZ2  TRP   9           2HZ      TRP   9  -3.995  -7.933  -8.859
   87    HZ3  TRP   9           3HZ      TRP   9  -3.701  -8.960  -4.699
   88    HH2  TRP   9           HH       TRP   9  -5.066  -8.578  -6.725
   89    H    HIS  10           H        HIS  10   3.608  -8.119  -4.683
   90    HA   HIS  10           HA       HIS  10   4.677  -6.362  -2.942
   91   1HB   HIS  10          2HB       HIS  10   5.181  -8.489  -2.510
   92   2HB   HIS  10          1HB       HIS  10   5.604  -8.862  -4.221
   93    HD1  HIS  10           1HD      HIS  10   7.302  -8.309  -0.949
   94    HD2  HIS  10           2HD      HIS  10   8.052  -7.959  -5.011
   95    HE1  HIS  10           1HE      HIS  10   9.829  -8.155  -1.192
   96    H    GLU  11           H        GLU  11   6.026  -6.869  -6.221
   97    HA   GLU  11           HA       GLU  11   8.335  -5.204  -6.022
   98   1HB   GLU  11          2HB       GLU  11   6.685  -6.161  -8.372
   99   2HB   GLU  11          1HB       GLU  11   8.165  -5.245  -8.523
  100   1HG   GLU  11          2HG       GLU  11   8.013  -7.796  -6.932
  101   2HG   GLU  11          1HG       GLU  11   8.343  -7.738  -8.692
  102    H    MET  12           H        MET  12   5.063  -4.486  -7.387
  103    HA   MET  12           HA       MET  12   5.636  -1.674  -7.814
  104   1HB   MET  12          2HB       MET  12   3.435  -1.533  -8.611
  105   2HB   MET  12          1HB       MET  12   3.905  -3.144  -9.068
  106   1HG   MET  12          2HG       MET  12   2.783  -3.754  -6.672
  107   2HG   MET  12          1HG       MET  12   1.912  -2.297  -7.002
  108   1HE   MET  12          1HE       MET  12  -0.805  -3.211  -8.958
  109   2HE   MET  12          2HE       MET  12  -0.241  -2.793  -7.322
  110   3HE   MET  12          3HE       MET  12   0.342  -1.870  -8.728
  111    H    TRP  13           H        TRP  13   4.547  -3.663  -5.071
  112    HA   TRP  13           HA       TRP  13   3.332  -1.572  -3.489
  113   1HB   TRP  13          2HB       TRP  13   3.861  -4.455  -3.194
  114   2HB   TRP  13          1HB       TRP  13   4.021  -3.555  -1.727
  115    HD1  TRP  13           HD       TRP  13   1.354  -2.665  -4.412
  116    HE1  TRP  13           1HE      TRP  13  -0.918  -3.093  -3.360
  117    HE3  TRP  13           3HE      TRP  13   2.888  -4.881  -0.172
  118    HZ2  TRP  13           2HZ      TRP  13  -1.898  -4.269  -0.963
  119    HZ3  TRP  13           3HZ      TRP  13   1.325  -5.188   1.696
  120    HH2  TRP  13           HH       TRP  13  -1.119  -5.004   1.261
  121    H    HIS  14           H        HIS  14   6.624  -3.078  -3.528
  122    HA   HIS  14           HA       HIS  14   7.861  -1.774  -1.417
  123   1HB   HIS  14          2HB       HIS  14   8.652  -2.996  -3.971
  124   2HB   HIS  14          1HB       HIS  14   9.739  -1.711  -3.453
  125    HD1  HIS  14           1HD      HIS  14   9.417  -5.226  -2.990
  126    HD2  HIS  14           2HD      HIS  14  10.281  -1.953  -0.595
  127    HE1  HIS  14           1HE      HIS  14  10.921  -6.098  -1.112
  128    H    GLU  15           H        GLU  15   7.579  -0.519  -4.752
  129    HA   GLU  15           HA       GLU  15   8.468   2.134  -3.879
  130   1HB   GLU  15          2HB       GLU  15   7.921   1.004  -6.612
  131   2HB   GLU  15          1HB       GLU  15   8.210   2.718  -6.318
  132   1HG   GLU  15          2HG       GLU  15  10.312   1.892  -5.012
  133   2HG   GLU  15          1HG       GLU  15  10.061   0.386  -5.937
  134    H    GLY  16           H        GLY  16   5.349   0.596  -5.117
  135   1HA   GLY  16          2HA       GLY  16   3.886   2.980  -5.418
  136   2HA   GLY  16          1HA       GLY  16   3.241   1.393  -5.037
  137    H    LEU  17           H        LEU  17   4.719   1.072  -2.507
  138    HA   LEU  17           HA       LEU  17   3.293   2.831  -0.647
  139   1HB   LEU  17          2HB       LEU  17   4.931   0.421  -0.432
  140   2HB   LEU  17          1HB       LEU  17   4.800   1.559   0.938
  141    HG   LEU  17           HG       LEU  17   2.426   0.478  -0.633
  142   1HD1  LEU  17          1HD1      LEU  17   1.958  -0.920   1.345
  143   2HD1  LEU  17          2HD1      LEU  17   3.522  -1.344   0.610
  144   3HD1  LEU  17          3HD1      LEU  17   3.473  -0.365   2.096
  145   1HD2  LEU  17          1HD2      LEU  17   1.148   1.421   1.285
  146   2HD2  LEU  17          2HD2      LEU  17   2.669   1.998   2.007
  147   3HD2  LEU  17          3HD2      LEU  17   2.102   2.679   0.463
  148    H    GLU  18           H        GLU  18   6.718   2.548  -1.832
  149    HA   GLU  18           HA       GLU  18   7.725   4.558  -0.007
  150   1HB   GLU  18          2HB       GLU  18   9.057   2.814  -1.134
  151   2HB   GLU  18          1HB       GLU  18   8.880   3.727  -2.633
  152   1HG   GLU  18          2HG       GLU  18  10.372   5.282  -1.985
  153   2HG   GLU  18          1HG       GLU  18   9.659   5.423  -0.362
  154    H    GLU  19           H        GLU  19   6.669   4.838  -3.473
  155    HA   GLU  19           HA       GLU  19   7.091   7.692  -3.706
  156   1HB   GLU  19          2HB       GLU  19   7.136   6.244  -5.575
  157   2HB   GLU  19          1HB       GLU  19   5.424   5.790  -5.285
  158   1HG   GLU  19          2HG       GLU  19   5.684   7.407  -7.109
  159   2HG   GLU  19          1HG       GLU  19   4.718   8.056  -5.742
  160    H    ALA  20           H        ALA  20   4.662   5.821  -2.064
  161    HA   ALA  20           HA       ALA  20   2.678   8.043  -2.070
  162   1HB   ALA  20          1HB       ALA  20   1.223   6.438  -1.005
  163   2HB   ALA  20          2HB       ALA  20   1.831   5.822  -2.561
  164   3HB   ALA  20          3HB       ALA  20   2.517   5.216  -1.033
  165    H    SER  21           H        SER  21   4.106   5.759   0.345
  166    HA   SER  21           HA       SER  21   3.615   7.200   2.683
  167   1HB   SER  21          2HB       SER  21   5.963   5.415   2.089
  168   2HB   SER  21          1HB       SER  21   5.393   5.950   3.689
  169    HG   SER  21           HG       SER  21   4.621   3.782   2.878
  170    H    ARG  22           H        ARG  22   6.335   7.655   0.285
  171    HA   ARG  22           HA       ARG  22   7.686   9.615   1.850
  172   1HB   ARG  22          2HB       ARG  22   8.893   8.408   0.157
  173   2HB   ARG  22          1HB       ARG  22   7.868   9.045  -1.109
  174   1HG   ARG  22          2HG       ARG  22   8.646  11.348  -0.598
  175   2HG   ARG  22          1HG       ARG  22   9.659  10.723   0.693
  176   1HD   ARG  22          2HD       ARG  22   9.925   9.565  -2.057
  177   2HD   ARG  22          1HD       ARG  22  10.640  11.152  -1.677
  178    HE   ARG  22           HE       ARG  22  11.422   9.604   0.420
  179   1HH1  ARG  22          2HH2      ARG  22  11.721   9.138  -3.032
  180   2HH1  ARG  22          1HH2      ARG  22  13.249   8.323  -2.935
  181   1HH2  ARG  22          1HH1      ARG  22  13.449   8.543   0.535
  182   2HH2  ARG  22          2HH1      ARG  22  14.204   7.992  -0.922
  183    H    LEU  23           H        LEU  23   5.212   9.966  -0.795
  184    HA   LEU  23           HA       LEU  23   5.147  12.818  -1.020
  185   1HB   LEU  23          2HB       LEU  23   3.450  10.526  -1.792
  186   2HB   LEU  23          1HB       LEU  23   2.612  12.037  -1.535
  187    HG   LEU  23           HG       LEU  23   5.132  12.016  -3.167
  188   1HD1  LEU  23          1HD1      LEU  23   3.755  11.606  -5.168
  189   2HD1  LEU  23          2HD1      LEU  23   3.720  10.202  -4.077
  190   3HD1  LEU  23          3HD1      LEU  23   2.333  11.314  -4.139
  191   1HD2  LEU  23          1HD2      LEU  23   3.942  13.885  -4.272
  192   2HD2  LEU  23          2HD2      LEU  23   2.535  13.616  -3.214
  193   3HD2  LEU  23          3HD2      LEU  23   4.079  14.165  -2.520
  194    H    TYR  24           H        TYR  24   4.057  10.673   1.465
  195    HA   TYR  24           HA       TYR  24   2.783  12.959   2.917
  196   1HB   TYR  24          2HB       TYR  24   1.471  10.859   2.610
  197   2HB   TYR  24          1HB       TYR  24   2.712   9.953   3.454
  198    HD1  TYR  24           1HD      TYR  24   1.009  13.262   4.138
  199    HD2  TYR  24           2HD      TYR  24   2.124   9.350   5.511
  200    HE1  TYR  24           1HE      TYR  24  -0.290  13.631   6.209
  201    HE2  TYR  24           2HE      TYR  24   0.825   9.714   7.587
  202    HH   TYR  24           HH       TYR  24  -0.085  11.193   8.866
  203    H    PHE  25           H        PHE  25   5.402  10.516   3.315
  204    HA   PHE  25           HA       PHE  25   6.363  10.748   5.811
  205   1HB   PHE  25          2HB       PHE  25   7.245   9.346   4.015
  206   2HB   PHE  25          1HB       PHE  25   7.943  10.803   3.232
  207    HD1  PHE  25           1HD      PHE  25  10.222  11.010   3.457
  208    HD2  PHE  25           2HD      PHE  25   7.928   9.284   6.654
  209    HE1  PHE  25           1HE      PHE  25  12.287  10.787   4.819
  210    HE2  PHE  25           2HE      PHE  25   9.986   9.060   8.016
  211    HZ   PHE  25           HZ       PHE  25  12.168   9.803   7.093
  212    H    GLY  26           H        GLY  26   7.428  12.971   3.174
  213   1HA   GLY  26          2HA       GLY  26   7.556  15.254   5.057
  214   2HA   GLY  26          1HA       GLY  26   9.078  14.727   4.385
  215    H    GLU  27           H        GLU  27   5.953  14.581   2.638
  216    HA   GLU  27           HA       GLU  27   6.974  16.789   0.928
  217   1HB   GLU  27          2HB       GLU  27   5.975  14.209   0.173
  218   2HB   GLU  27          1HB       GLU  27   4.961  15.472  -0.507
  219   1HG   GLU  27          2HG       GLU  27   6.568  15.601  -2.119
  220   2HG   GLU  27          1HG       GLU  27   7.502  16.505  -0.946
  221    H    ARG  28           H        ARG  28   4.640  16.180   3.320
  222    HA   ARG  28           HA       ARG  28   2.529  16.993   3.872
  223   1HB   ARG  28          2HB       ARG  28   4.390  19.087   3.391
  224   2HB   ARG  28          1HB       ARG  28   2.761  19.608   2.926
  225   1HG   ARG  28          2HG       ARG  28   1.965  18.586   5.149
  226   2HG   ARG  28          1HG       ARG  28   3.683  18.502   5.595
  227   1HD   ARG  28          2HD       ARG  28   3.937  20.893   5.352
  228   2HD   ARG  28          1HD       ARG  28   2.309  21.047   4.646
  229    HE   ARG  28           HE       ARG  28   2.475  19.857   7.312
  230   1HH1  ARG  28          2HH2      ARG  28   1.767  22.767   5.475
  231   2HH1  ARG  28          1HH2      ARG  28   0.949  23.550   6.787
  232   1HH2  ARG  28          1HH1      ARG  28   1.381  20.923   9.015
  233   2HH2  ARG  28          2HH1      ARG  28   0.739  22.509   8.754
  234    H    ASN  29           H        ASN  29   2.692  15.694   1.237
  235    HA   ASN  29           HA       ASN  29   0.376  16.974  -0.050
  236   1HB   ASN  29          2HB       ASN  29   2.663  17.466  -1.192
  237   2HB   ASN  29          1HB       ASN  29   2.697  15.771  -1.625
  238   1HD2  ASN  29          2HD2      ASN  29   2.779  17.407  -3.640
  239   2HD2  ASN  29          1HD2      ASN  29   1.226  17.573  -4.417
  240    H    VAL  30           H        VAL  30   0.006  15.090   1.787
  241    HA   VAL  30           HA       VAL  30  -0.090  12.393   1.174
  242    HB   VAL  30           HB       VAL  30  -0.770  13.603   3.231
  243   1HG1  VAL  30          1HG1      VAL  30  -3.168  13.856   3.628
  244   2HG1  VAL  30          2HG1      VAL  30  -2.593  15.020   2.412
  245   3HG1  VAL  30          3HG1      VAL  30  -3.497  13.574   1.902
  246   1HG2  VAL  30          1HG2      VAL  30  -2.120  11.701   3.901
  247   2HG2  VAL  30          2HG2      VAL  30  -2.248  11.211   2.195
  248   3HG2  VAL  30          3HG2      VAL  30  -0.657  11.255   2.990
  249    H    LYS  31           H        LYS  31  -1.965  15.005  -0.337
  250    HA   LYS  31           HA       LYS  31  -3.936  13.525  -1.766
  251   1HB   LYS  31          2HB       LYS  31  -3.940  15.893  -1.316
  252   2HB   LYS  31          1HB       LYS  31  -2.482  16.090  -2.351
  253   1HG   LYS  31          2HG       LYS  31  -5.040  14.971  -3.506
  254   2HG   LYS  31          1HG       LYS  31  -4.827  16.709  -3.323
  255   1HD   LYS  31          2HD       LYS  31  -2.417  15.949  -4.490
  256   2HD   LYS  31          1HD       LYS  31  -3.574  14.865  -5.253
  257   1HE   LYS  31          2HE       LYS  31  -4.978  16.775  -5.886
  258   2HE   LYS  31          1HE       LYS  31  -3.834  17.880  -5.090
  259   1HZ   LYS  31          1HZ       LYS  31  -3.384  17.716  -7.396
  260   2HZ   LYS  31          2HZ       LYS  31  -2.145  17.036  -6.571
  261   3HZ   LYS  31          3HZ       LYS  31  -3.245  16.090  -7.320
  262    H    GLY  32           H        GLY  32  -0.406  14.088  -2.429
  263   1HA   GLY  32          2HA       GLY  32  -0.428  13.066  -5.142
  264   2HA   GLY  32          1HA       GLY  32   0.960  13.313  -4.110
  265    H    MET  33           H        MET  33   0.501  11.651  -1.940
  266    HA   MET  33           HA       MET  33   1.205   9.043  -2.782
  267   1HB   MET  33          2HB       MET  33   1.325   8.573  -0.653
  268   2HB   MET  33          1HB       MET  33   1.441  10.378  -0.612
  269   1HG   MET  33          2HG       MET  33   0.170  10.063   1.170
  270   2HG   MET  33          1HG       MET  33  -1.122  10.108  -0.072
  271   1HE   MET  33          1HE       MET  33  -0.888   7.264   3.127
  272   2HE   MET  33          2HE       MET  33   0.457   8.377   2.782
  273   3HE   MET  33          3HE       MET  33  -1.203   9.004   2.920
  274    H    PHE  34           H        PHE  34  -1.940  10.471  -2.176
  275    HA   PHE  34           HA       PHE  34  -3.547   8.166  -2.362
  276   1HB   PHE  34          2HB       PHE  34  -3.979  11.112  -2.607
  277   2HB   PHE  34          1HB       PHE  34  -5.281   9.971  -3.022
  278    HD1  PHE  34           1HD      PHE  34  -4.309  11.960  -0.454
  279    HD2  PHE  34           2HD      PHE  34  -5.182   7.827  -1.219
  280    HE1  PHE  34           1HE      PHE  34  -4.873  11.637   1.924
  281    HE2  PHE  34           2HE      PHE  34  -5.840   7.535   1.152
  282    HZ   PHE  34           HZ       PHE  34  -5.728   9.453   2.685
  283    H    GLU  35           H        GLU  35  -1.814   9.820  -4.883
  284    HA   GLU  35           HA       GLU  35  -3.635   8.939  -7.048
  285   1HB   GLU  35          2HB       GLU  35  -2.421  11.261  -6.893
  286   2HB   GLU  35          1HB       GLU  35  -0.981  10.385  -7.350
  287   1HG   GLU  35          2HG       GLU  35  -1.799  11.111  -9.352
  288   2HG   GLU  35          1HG       GLU  35  -2.423   9.432  -9.275
  289    H    VAL  36           H        VAL  36  -0.367   8.242  -5.699
  290    HA   VAL  36           HA       VAL  36   0.283   6.227  -7.735
  291    HB   VAL  36           HB       VAL  36   2.070   7.597  -6.927
  292   1HG1  VAL  36          1HG1      VAL  36   2.911   7.422  -4.699
  293   2HG1  VAL  36          2HG1      VAL  36   1.265   8.098  -4.672
  294   3HG1  VAL  36          3HG1      VAL  36   1.539   6.401  -4.214
  295   1HG2  VAL  36          1HG2      VAL  36   3.634   5.924  -6.439
  296   2HG2  VAL  36          2HG2      VAL  36   2.334   4.743  -6.157
  297   3HG2  VAL  36          3HG2      VAL  36   2.555   5.454  -7.773
  298    H    LEU  37           H        LEU  37  -0.969   6.275  -4.354
  299    HA   LEU  37           HA       LEU  37  -1.283   3.376  -4.172
  300   1HB   LEU  37          2HB       LEU  37  -1.106   5.441  -2.378
  301   2HB   LEU  37          1HB       LEU  37  -2.814   4.978  -2.339
  302    HG   LEU  37           HG       LEU  37  -1.584   2.506  -2.430
  303   1HD1  LEU  37          1HD1      LEU  37   0.226   2.517  -0.825
  304   2HD1  LEU  37          2HD1      LEU  37   0.641   3.452  -2.280
  305   3HD1  LEU  37          3HD1      LEU  37   0.194   4.295  -0.779
  306   1HD2  LEU  37          1HD2      LEU  37  -2.087   2.387  -0.037
  307   2HD2  LEU  37          2HD2      LEU  37  -2.228   4.160   0.035
  308   3HD2  LEU  37          3HD2      LEU  37  -3.396   3.212  -0.917
  309    H    GLU  38           H        GLU  38  -3.387   6.045  -5.343
  310    HA   GLU  38           HA       GLU  38  -5.895   4.955  -5.396
  311   1HB   GLU  38          2HB       GLU  38  -4.557   7.041  -6.753
  312   2HB   GLU  38          1HB       GLU  38  -5.285   6.072  -7.991
  313   1HG   GLU  38          2HG       GLU  38  -7.111   6.539  -5.726
  314   2HG   GLU  38          1HG       GLU  38  -6.564   7.997  -6.517
  315    HA   PRO  39           HA       PRO  39  -5.080   1.907  -9.016
  316   1HB   PRO  39          2HB       PRO  39  -2.675   1.448 -10.034
  317   2HB   PRO  39          1HB       PRO  39  -3.661   2.794 -10.599
  318   1HG   PRO  39          2HG       PRO  39  -1.360   2.849  -8.587
  319   2HG   PRO  39          1HG       PRO  39  -1.640   3.932  -9.945
  320   1HD   PRO  39          1HD       PRO  39  -2.479   4.564  -7.356
  321   2HD   PRO  39          2HD       PRO  39  -3.413   5.108  -8.809
  322    H    LEU  40           H        LEU  40  -2.814   2.131  -6.259
  323    HA   LEU  40           HA       LEU  40  -2.206  -0.740  -6.100
  324   1HB   LEU  40          2HB       LEU  40  -1.855   1.428  -4.026
  325   2HB   LEU  40          1HB       LEU  40  -1.210  -0.177  -3.985
  326    HG   LEU  40           HG       LEU  40  -0.459   1.914  -6.067
  327   1HD1  LEU  40          1HD1      LEU  40   1.589   1.900  -4.726
  328   2HD1  LEU  40          2HD1      LEU  40   0.202   2.339  -3.701
  329   3HD1  LEU  40          3HD1      LEU  40   0.882   0.697  -3.623
  330   1HD2  LEU  40          1HD2      LEU  40   1.305   0.442  -6.668
  331   2HD2  LEU  40          2HD2      LEU  40   0.705  -0.809  -5.554
  332   3HD2  LEU  40          3HD2      LEU  40  -0.262  -0.344  -6.973
  333    H    HIS  41           H        HIS  41  -4.881   1.336  -5.088
  334    HA   HIS  41           HA       HIS  41  -6.107  -0.544  -3.280
  335   1HB   HIS  41          2HB       HIS  41  -6.967   1.413  -2.825
  336   2HB   HIS  41          1HB       HIS  41  -6.447   2.101  -4.403
  337    HD1  HIS  41           1HD      HIS  41  -8.196   1.608  -6.429
  338    HD2  HIS  41           2HD      HIS  41  -9.553   1.150  -2.519
  339    HE1  HIS  41           1HE      HIS  41 -10.769   1.467  -6.560
  340    H    ALA  42           H        ALA  42  -6.525   0.264  -6.758
  341    HA   ALA  42           HA       ALA  42  -8.678  -1.615  -7.221
  342   1HB   ALA  42          1HB       ALA  42  -8.447  -0.906  -9.517
  343   2HB   ALA  42          2HB       ALA  42  -8.491   0.486  -8.408
  344   3HB   ALA  42          3HB       ALA  42  -6.944  -0.039  -9.117
  345    H    MET  43           H        MET  43  -5.189  -1.560  -7.920
  346    HA   MET  43           HA       MET  43  -5.010  -4.198  -9.148
  347   1HB   MET  43          2HB       MET  43  -2.995  -2.159  -8.064
  348   2HB   MET  43          1HB       MET  43  -2.528  -3.659  -8.783
  349   1HG   MET  43          2HG       MET  43  -3.183  -3.002 -10.918
  350   2HG   MET  43          1HG       MET  43  -4.321  -1.806 -10.334
  351   1HE   MET  43          1HE       MET  43  -1.222  -0.086 -12.301
  352   2HE   MET  43          2HE       MET  43  -1.670  -1.801 -12.469
  353   3HE   MET  43          3HE       MET  43  -2.933  -0.549 -12.450
  354    H    MET  44           H        MET  44  -5.705  -3.301  -5.964
  355    HA   MET  44           HA       MET  44  -4.541  -5.833  -4.853
  356   1HB   MET  44          2HB       MET  44  -3.781  -3.705  -3.862
  357   2HB   MET  44          1HB       MET  44  -5.478  -3.402  -3.376
  358   1HG   MET  44          2HG       MET  44  -3.929  -4.399  -1.625
  359   2HG   MET  44          1HG       MET  44  -5.492  -5.232  -1.902
  360   1HE   MET  44          1HE       MET  44  -1.453  -6.881  -3.504
  361   2HE   MET  44          2HE       MET  44  -2.285  -5.481  -4.220
  362   3HE   MET  44          3HE       MET  44  -1.583  -5.361  -2.589
  363    H    GLU  45           H        GLU  45  -7.493  -4.088  -5.642
  364    HA   GLU  45           HA       GLU  45  -9.205  -5.849  -4.005
  365   1HB   GLU  45          2HB       GLU  45  -9.428  -3.310  -4.341
  366   2HB   GLU  45          1HB       GLU  45 -10.103  -3.754  -5.932
  367   1HG   GLU  45          2HG       GLU  45 -11.499  -5.515  -4.355
  368   2HG   GLU  45          1HG       GLU  45 -11.254  -4.252  -3.176
  369    H    ARG  46           H        ARG  46  -8.399  -5.309  -7.497
  370    HA   ARG  46           HA       ARG  46 -10.354  -6.779  -8.786
  371   1HB   ARG  46          2HB       ARG  46  -8.210  -5.457  -9.586
  372   2HB   ARG  46          1HB       ARG  46  -7.492  -7.068  -9.602
  373   1HG   ARG  46          2HG       ARG  46  -9.000  -7.867 -11.220
  374   2HG   ARG  46          1HG       ARG  46 -10.187  -6.593 -10.890
  375   1HD   ARG  46          2HD       ARG  46  -9.279  -5.462 -12.654
  376   2HD   ARG  46          1HD       ARG  46  -7.862  -5.186 -11.654
  377    HE   ARG  46           HE       ARG  46  -7.876  -7.754 -12.962
  378   1HH1  ARG  46          2HH2      ARG  46  -7.003  -4.375 -13.335
  379   2HH1  ARG  46          1HH2      ARG  46  -5.879  -4.668 -14.624
  380   1HH2  ARG  46          1HH1      ARG  46  -6.385  -8.107 -14.667
  381   2HH2  ARG  46          2HH1      ARG  46  -5.545  -6.760 -15.359
  382    H    GLY  47           H        GLY  47  -7.727  -8.045  -6.760
  383   1HA   GLY  47          2HA       GLY  47  -8.062 -10.157  -5.667
  384   2HA   GLY  47          1HA       GLY  47  -8.842 -10.787  -7.103
  385    HA   PRO  48           HA       PRO  48  -4.159 -11.655  -7.054
  386   1HB   PRO  48          2HB       PRO  48  -4.135 -14.165  -6.220
  387   2HB   PRO  48          1HB       PRO  48  -3.970 -12.719  -5.116
  388   1HG   PRO  48          2HG       PRO  48  -6.445 -14.485  -5.625
  389   2HG   PRO  48          1HG       PRO  48  -5.866 -13.886  -4.070
  390   1HD   PRO  48          1HD       PRO  48  -7.833 -12.533  -5.572
  391   2HD   PRO  48          2HD       PRO  48  -6.653 -11.628  -4.516
  392    H    GLN  49           H        GLN  49  -3.224 -12.740  -8.716
  393    HA   GLN  49           HA       GLN  49  -5.059 -13.889 -10.732
  394   1HB   GLN  49          2HB       GLN  49  -3.872 -12.006 -11.484
  395   2HB   GLN  49          1HB       GLN  49  -2.314 -12.666 -10.888
  396   1HG   GLN  49          2HG       GLN  49  -1.998 -13.284 -13.003
  397   2HG   GLN  49          1HG       GLN  49  -3.144 -14.611 -12.623
  398   1HE2  GLN  49          2HE2      GLN  49  -3.616 -14.741 -14.911
  399   2HE2  GLN  49          1HE2      GLN  49  -4.598 -13.496 -15.630
  400    H    THR  50           H        THR  50  -1.605 -14.470 -10.522
  401    HA   THR  50           HA       THR  50  -1.655 -17.260 -10.923
  402    HB   THR  50           HB       THR  50   0.147 -16.352 -11.786
  403    HG1  THR  50           1HG      THR  50   1.945 -17.232 -10.623
  404   1HG2  THR  50          1HG2      THR  50   1.777 -14.872 -10.711
  405   2HG2  THR  50          2HG2      THR  50   0.159 -14.131 -10.734
  406   3HG2  THR  50          3HG2      THR  50   0.791 -14.842  -9.230
  407    H    LEU  51           H        LEU  51   0.458 -16.686  -8.404
  408    HA   LEU  51           HA       LEU  51  -1.186 -16.870  -5.989
  409   1HB   LEU  51          2HB       LEU  51  -0.904 -19.258  -7.347
  410   2HB   LEU  51          1HB       LEU  51   0.553 -19.289  -6.410
  411    HG   LEU  51           HG       LEU  51  -0.712 -18.974  -4.365
  412   1HD1  LEU  51          1HD1      LEU  51  -3.165 -19.190  -4.370
  413   2HD1  LEU  51          2HD1      LEU  51  -2.640 -17.708  -5.203
  414   3HD1  LEU  51          3HD1      LEU  51  -3.170 -19.120  -6.148
  415   1HD2  LEU  51          1HD2      LEU  51  -1.781 -21.237  -4.470
  416   2HD2  LEU  51          2HD2      LEU  51  -1.702 -21.176  -6.247
  417   3HD2  LEU  51          3HD2      LEU  51  -0.201 -21.225  -5.291
  418    H    LYS  52           H        LYS  52   0.853 -15.109  -7.084
  419    HA   LYS  52           HA       LYS  52   3.107 -15.527  -5.146
  420   1HB   LYS  52          2HB       LYS  52   3.226 -13.965  -7.750
  421   2HB   LYS  52          1HB       LYS  52   4.542 -14.400  -6.719
  422   1HG   LYS  52          2HG       LYS  52   3.899 -16.865  -7.221
  423   2HG   LYS  52          1HG       LYS  52   2.936 -16.195  -8.517
  424   1HD   LYS  52          2HD       LYS  52   4.962 -14.970  -9.314
  425   2HD   LYS  52          1HD       LYS  52   5.898 -15.871  -8.086
  426   1HE   LYS  52          2HE       LYS  52   4.569 -17.956  -9.192
  427   2HE   LYS  52          1HE       LYS  52   4.561 -16.886 -10.596
  428   1HZ   LYS  52          1HZ       LYS  52   6.459 -18.238 -10.596
  429   2HZ   LYS  52          2HZ       LYS  52   6.951 -16.700 -10.325
  430   3HZ   LYS  52          3HZ       LYS  52   6.889 -17.777  -9.099
  431    H    GLU  53           H        GLU  53   0.892 -13.107  -6.569
  432    HA   GLU  53           HA       GLU  53   1.642 -10.945  -4.710
  433   1HB   GLU  53          2HB       GLU  53   0.052  -9.703  -5.938
  434   2HB   GLU  53          1HB       GLU  53   1.346 -10.435  -6.951
  435   1HG   GLU  53          2HG       GLU  53  -0.985 -12.145  -6.978
  436   2HG   GLU  53          1HG       GLU  53  -1.463 -10.502  -7.389
  437    H    THR  54           H        THR  54   0.988 -12.936  -3.088
  438    HA   THR  54           HA       THR  54  -1.522 -12.018  -1.791
  439    HB   THR  54           HB       THR  54  -1.100 -14.846  -2.655
  440    HG1  THR  54           1HG      THR  54  -2.382 -12.543  -3.641
  441   1HG2  THR  54          1HG2      THR  54  -3.337 -15.301  -1.787
  442   2HG2  THR  54          2HG2      THR  54  -2.224 -14.830  -0.481
  443   3HG2  THR  54          3HG2      THR  54  -3.418 -13.662  -1.098
  444    H    SER  55           H        SER  55   1.154 -11.430  -1.043
  445    HA   SER  55           HA       SER  55   1.463 -13.080   1.457
  446   1HB   SER  55          2HB       SER  55   3.249 -12.511  -0.586
  447   2HB   SER  55          1HB       SER  55   3.688 -11.444   0.795
  448    HG   SER  55           HG       SER  55   4.664 -13.594   1.042
  449    H    PHE  56           H        PHE  56  -0.314 -10.701   0.840
  450    HA   PHE  56           HA       PHE  56   0.632  -8.833   2.970
  451   1HB   PHE  56          2HB       PHE  56  -0.991  -7.818   0.699
  452   2HB   PHE  56          1HB       PHE  56   0.297  -7.015   1.662
  453    HD1  PHE  56           1HD      PHE  56  -0.562  -7.611  -1.452
  454    HD2  PHE  56           2HD      PHE  56   2.677  -8.664   1.153
  455    HE1  PHE  56           1HE      PHE  56   0.878  -8.062  -3.412
  456    HE2  PHE  56           2HE      PHE  56   4.118  -9.125  -0.786
  457    HZ   PHE  56           HZ       PHE  56   3.145  -9.027  -3.076
  458    H    ASN  57           H        ASN  57  -2.226  -9.765   0.913
  459    HA   ASN  57           HA       ASN  57  -4.186  -8.919   2.807
  460   1HB   ASN  57          2HB       ASN  57  -4.352 -10.772   0.391
  461   2HB   ASN  57          1HB       ASN  57  -5.718 -10.172   1.269
  462   1HD2  ASN  57          2HD2      ASN  57  -6.489  -9.252  -0.595
  463   2HD2  ASN  57          1HD2      ASN  57  -5.786  -7.794  -1.231
  464    H    GLN  58           H        GLN  58  -2.440 -11.965   2.329
  465    HA   GLN  58           HA       GLN  58  -3.936 -13.361   4.484
  466   1HB   GLN  58          2HB       GLN  58  -3.268 -14.237   2.067
  467   2HB   GLN  58          1HB       GLN  58  -1.727 -14.549   2.858
  468   1HG   GLN  58          2HG       GLN  58  -3.131 -16.523   3.052
  469   2HG   GLN  58          1HG       GLN  58  -2.962 -15.814   4.658
  470   1HE2  GLN  58          2HE2      GLN  58  -5.108 -16.303   1.925
  471   2HE2  GLN  58          1HE2      GLN  58  -6.565 -15.877   2.793
  472    H    ALA  59           H        ALA  59  -1.150 -11.374   4.254
  473    HA   ALA  59           HA       ALA  59   0.055 -12.674   6.681
  474   1HB   ALA  59          1HB       ALA  59   2.093 -11.609   6.038
  475   2HB   ALA  59          2HB       ALA  59   1.497 -12.701   4.766
  476   3HB   ALA  59          3HB       ALA  59   1.314 -10.940   4.585
  477    H    TYR  60           H        TYR  60  -0.976  -9.601   5.236
  478    HA   TYR  60           HA       TYR  60  -1.200  -8.426   7.978
  479   1HB   TYR  60          2HB       TYR  60   0.053  -6.851   5.723
  480   2HB   TYR  60          1HB       TYR  60   0.118  -6.551   7.494
  481    HD1  TYR  60           1HD      TYR  60   1.615  -7.899   8.915
  482    HD2  TYR  60           2HD      TYR  60   1.641  -8.256   4.635
  483    HE1  TYR  60           1HE      TYR  60   3.714  -9.192   9.034
  484    HE2  TYR  60           2HE      TYR  60   3.714  -9.571   4.747
  485    HH   TYR  60           HH       TYR  60   5.436 -10.207   6.047
  486    H    GLY  61           H        GLY  61  -3.552  -9.185   6.919
  487   1HA   GLY  61          2HA       GLY  61  -4.892  -7.676   4.978
  488   2HA   GLY  61          1HA       GLY  61  -5.652  -8.314   6.397
  489    H    ARG  62           H        ARG  62  -3.834  -6.618   8.108
  490    HA   ARG  62           HA       ARG  62  -5.450  -4.217   8.178
  491   1HB   ARG  62          2HB       ARG  62  -3.381  -5.471   9.997
  492   2HB   ARG  62          1HB       ARG  62  -4.083  -3.879  10.309
  493   1HG   ARG  62          2HG       ARG  62  -6.314  -4.809  10.362
  494   2HG   ARG  62          1HG       ARG  62  -5.684  -6.417   9.888
  495   1HD   ARG  62          2HD       ARG  62  -4.933  -6.869  11.989
  496   2HD   ARG  62          1HD       ARG  62  -4.308  -5.211  12.207
  497    HE   ARG  62           HE       ARG  62  -7.192  -5.346  12.213
  498   1HH1  ARG  62          2HH2      ARG  62  -4.380  -5.692  14.279
  499   2HH1  ARG  62          1HH2      ARG  62  -5.242  -5.334  15.740
  500   1HH2  ARG  62          1HH1      ARG  62  -8.303  -4.868  14.158
  501   2HH2  ARG  62          2HH1      ARG  62  -7.438  -4.879  15.656
  502    H    ASP  63           H        ASP  63  -2.375  -5.009   6.819
  503    HA   ASP  63           HA       ASP  63  -0.827  -2.622   7.148
  504   1HB   ASP  63          2HB       ASP  63   0.489  -3.501   5.504
  505   2HB   ASP  63          1HB       ASP  63  -0.195  -4.925   6.377
  506    H    LEU  64           H        LEU  64  -0.340  -2.072   4.267
  507    HA   LEU  64           HA       LEU  64  -1.784   0.068   3.391
  508   1HB   LEU  64          2HB       LEU  64   0.018  -0.790   2.144
  509   2HB   LEU  64          1HB       LEU  64  -0.876  -2.306   1.801
  510    HG   LEU  64           HG       LEU  64  -2.073   0.320   0.852
  511   1HD1  LEU  64          1HD1      LEU  64  -0.841   0.109  -1.232
  512   2HD1  LEU  64          2HD1      LEU  64   0.304   0.361   0.108
  513   3HD1  LEU  64          3HD1      LEU  64   0.086  -1.265  -0.583
  514   1HD2  LEU  64          1HD2      LEU  64  -2.868  -1.038  -0.960
  515   2HD2  LEU  64          2HD2      LEU  64  -1.996  -2.457  -0.332
  516   3HD2  LEU  64          3HD2      LEU  64  -3.347  -1.761   0.593
  517    H    MET  65           H        MET  65  -2.958  -3.331   3.126
  518    HA   MET  65           HA       MET  65  -5.175  -3.005   1.491
  519   1HB   MET  65          2HB       MET  65  -3.997  -5.099   2.688
  520   2HB   MET  65          1HB       MET  65  -5.273  -4.867   3.861
  521   1HG   MET  65          2HG       MET  65  -5.651  -5.221   0.892
  522   2HG   MET  65          1HG       MET  65  -5.892  -6.456   2.169
  523   1HE   MET  65          1HE       MET  65  -9.245  -5.666   3.718
  524   2HE   MET  65          2HE       MET  65  -8.060  -6.919   3.272
  525   3HE   MET  65          3HE       MET  65  -7.583  -5.586   4.351
  526    H    GLU  66           H        GLU  66  -4.996  -2.622   5.068
  527    HA   GLU  66           HA       GLU  66  -7.787  -1.582   5.290
  528   1HB   GLU  66          2HB       GLU  66  -5.754  -2.623   7.186
  529   2HB   GLU  66          1HB       GLU  66  -6.929  -1.442   7.736
  530   1HG   GLU  66          2HG       GLU  66  -7.897  -3.805   6.138
  531   2HG   GLU  66          1HG       GLU  66  -7.476  -4.009   7.839
  532    H    ALA  67           H        ALA  67  -4.395  -0.433   5.605
  533    HA   ALA  67           HA       ALA  67  -4.793   2.247   6.398
  534   1HB   ALA  67          1HB       ALA  67  -2.685   2.626   5.315
  535   2HB   ALA  67          2HB       ALA  67  -2.655   1.104   6.238
  536   3HB   ALA  67          3HB       ALA  67  -2.807   1.067   4.465
  537    H    GLN  68           H        GLN  68  -5.406   0.808   3.229
  538    HA   GLN  68           HA       GLN  68  -6.298   3.403   2.072
  539   1HB   GLN  68          2HB       GLN  68  -4.885   2.326   0.652
  540   2HB   GLN  68          1HB       GLN  68  -5.561   0.706   1.038
  541   1HG   GLN  68          2HG       GLN  68  -7.364   2.668  -0.347
  542   2HG   GLN  68          1HG       GLN  68  -6.074   1.945  -1.292
  543   1HE2  GLN  68          2HE2      GLN  68  -9.251   1.418   0.026
  544   2HE2  GLN  68          1HE2      GLN  68  -9.295  -0.261  -0.469
  545    H    GLU  69           H        GLU  69  -7.620   0.072   2.784
  546    HA   GLU  69           HA       GLU  69 -10.162   0.261   1.769
  547   1HB   GLU  69          2HB       GLU  69  -8.925  -1.566   3.222
  548   2HB   GLU  69          1HB       GLU  69  -9.928  -0.851   4.499
  549   1HG   GLU  69          2HG       GLU  69 -11.878  -1.041   2.722
  550   2HG   GLU  69          1HG       GLU  69 -10.820  -2.198   1.927
  551    H    TRP  70           H        TRP  70  -8.988   1.899   4.685
  552    HA   TRP  70           HA       TRP  70 -11.467   3.130   5.497
  553   1HB   TRP  70          2HB       TRP  70  -8.587   3.870   5.977
  554   2HB   TRP  70          1HB       TRP  70 -10.029   4.414   6.893
  555    HD1  TRP  70           HD       TRP  70 -10.845   0.953   6.547
  556    HE1  TRP  70           1HE      TRP  70  -9.859  -0.526   8.336
  557    HE3  TRP  70           3HE      TRP  70  -7.597   4.269   8.514
  558    HZ2  TRP  70           2HZ      TRP  70  -8.057  -0.232  10.482
  559    HZ3  TRP  70           3HZ      TRP  70  -6.002   3.529  10.265
  560    HH2  TRP  70           HH       TRP  70  -6.285   1.293  11.307
  561    H    CYS  71           H        CYS  71 -11.440   3.360   2.785
  562    HA   CYS  71           HA       CYS  71 -10.531   5.994   1.888
  563   1HB   CYS  71          2HB       CYS  71 -11.633   5.392  -0.184
  564   2HB   CYS  71          1HB       CYS  71 -10.441   4.170   0.364
  565    HG   CYS  71           HG       CYS  71 -12.508   3.130  -0.916
  566    H    ARG  72           H        ARG  72 -13.747   4.372   2.385
  567    HA   ARG  72           HA       ARG  72 -15.448   6.615   2.263
  568   1HB   ARG  72          2HB       ARG  72 -15.689   4.091   3.912
  569   2HB   ARG  72          1HB       ARG  72 -16.967   5.255   3.634
  570   1HG   ARG  72          2HG       ARG  72 -16.802   4.866   1.203
  571   2HG   ARG  72          1HG       ARG  72 -15.514   3.676   1.495
  572   1HD   ARG  72          2HD       ARG  72 -17.559   2.930   3.265
  573   2HD   ARG  72          1HD       ARG  72 -18.413   3.386   1.773
  574    HE   ARG  72           HE       ARG  72 -16.345   1.875   0.861
  575   1HH1  ARG  72          2HH2      ARG  72 -18.845   1.239   3.242
  576   2HH1  ARG  72          1HH2      ARG  72 -18.855  -0.473   2.965
  577   1HH2  ARG  72          1HH1      ARG  72 -16.373  -0.398   0.536
  578   2HH2  ARG  72          2HH1      ARG  72 -17.470  -1.367   1.457
  579    H    LYS  73           H        LYS  73 -13.221   5.682   4.840
  580    HA   LYS  73           HA       LYS  73 -14.308   7.602   6.778
  581   1HB   LYS  73          2HB       LYS  73 -13.008   5.248   7.159
  582   2HB   LYS  73          1HB       LYS  73 -11.662   6.362   7.255
  583   1HG   LYS  73          2HG       LYS  73 -12.426   6.282   9.463
  584   2HG   LYS  73          1HG       LYS  73 -13.217   7.736   8.878
  585   1HD   LYS  73          2HD       LYS  73 -14.780   5.321   8.356
  586   2HD   LYS  73          1HD       LYS  73 -14.429   5.597  10.094
  587   1HE   LYS  73          2HE       LYS  73 -15.583   7.836   8.400
  588   2HE   LYS  73          1HE       LYS  73 -16.635   6.608   9.066
  589   1HZ   LYS  73          1HZ       LYS  73 -16.453   8.437  10.478
  590   2HZ   LYS  73          2HZ       LYS  73 -15.794   7.139  11.212
  591   3HZ   LYS  73          3HZ       LYS  73 -14.830   8.302  10.591
  592    H    TYR  74           H        TYR  74 -11.183   7.155   4.972
  593    HA   TYR  74           HA       TYR  74 -10.097   9.732   5.468
  594   1HB   TYR  74          2HB       TYR  74  -8.625   8.264   4.652
  595   2HB   TYR  74          1HB       TYR  74  -9.774   7.602   3.439
  596    HD1  TYR  74           1HD      TYR  74  -8.189  10.974   4.090
  597    HD2  TYR  74           2HD      TYR  74  -9.272   7.903   1.300
  598    HE1  TYR  74           1HE      TYR  74  -7.225  12.309   2.244
  599    HE2  TYR  74           2HE      TYR  74  -8.266   9.221  -0.533
  600    HH   TYR  74           HH       TYR  74  -7.349  11.142  -1.110
  601    H    MET  75           H        MET  75 -12.666   8.896   3.181
  602    HA   MET  75           HA       MET  75 -12.679  11.359   1.637
  603   1HB   MET  75          2HB       MET  75 -14.134   8.802   1.761
  604   2HB   MET  75          1HB       MET  75 -15.113  10.187   1.316
  605   1HG   MET  75          2HG       MET  75 -12.440   9.614  -0.014
  606   2HG   MET  75          1HG       MET  75 -13.963   8.967  -0.601
  607   1HE   MET  75          1HE       MET  75 -13.630  11.615  -3.280
  608   2HE   MET  75          2HE       MET  75 -12.460  10.432  -2.647
  609   3HE   MET  75          3HE       MET  75 -14.167   9.973  -2.848
  610    H    LYS  76           H        LYS  76 -15.095  10.080   4.000
  611    HA   LYS  76           HA       LYS  76 -16.311  12.667   4.263
  612   1HB   LYS  76          2HB       LYS  76 -16.878   9.925   5.090
  613   2HB   LYS  76          1HB       LYS  76 -17.393  11.167   6.250
  614   1HG   LYS  76          2HG       LYS  76 -17.995  11.417   3.266
  615   2HG   LYS  76          1HG       LYS  76 -19.080  10.578   4.360
  616   1HD   LYS  76          2HD       LYS  76 -19.934  12.529   5.109
  617   2HD   LYS  76          1HD       LYS  76 -18.337  13.176   5.470
  618   1HE   LYS  76          2HE       LYS  76 -18.104  14.150   3.358
  619   2HE   LYS  76          1HE       LYS  76 -19.259  13.044   2.600
  620   1HZ   LYS  76          1HZ       LYS  76 -20.148  15.221   2.943
  621   2HZ   LYS  76          2HZ       LYS  76 -20.983  14.097   3.785
  622   3HZ   LYS  76          3HZ       LYS  76 -19.952  15.098   4.562
  623    H    SER  77           H        SER  77 -14.292  10.646   6.452
  624    HA   SER  77           HA       SER  77 -14.313  12.538   8.637
  625   1HB   SER  77          2HB       SER  77 -13.920  10.050   8.859
  626   2HB   SER  77          1HB       SER  77 -12.313  10.328   8.180
  627    HG   SER  77           HG       SER  77 -13.031  12.118  10.208
  628    H    GLY  78           H        GLY  78 -12.052  11.759   5.791
  629   1HA   GLY  78          2HA       GLY  78 -10.166  12.902   5.038
  630   2HA   GLY  78          1HA       GLY  78 -11.148  14.309   5.285
  631    H    ASN  79           H        ASN  79 -10.036  12.199   7.869
  632    HA   ASN  79           HA       ASN  79  -8.683  14.530   9.015
  633   1HB   ASN  79          2HB       ASN  79 -10.237  12.225  10.211
  634   2HB   ASN  79          1HB       ASN  79  -8.913  12.851  11.157
  635   1HD2  ASN  79          2HD2      ASN  79  -8.993  15.008  11.977
  636   2HD2  ASN  79          1HD2      ASN  79 -10.509  15.861  11.925
  637    H    VAL  80           H        VAL  80  -6.559  14.473   8.940
  638    HA   VAL  80           HA       VAL  80  -4.804  12.480   8.125
  639    HB   VAL  80           HB       VAL  80  -4.290  14.864   9.921
  640   1HG1  VAL  80          1HG1      VAL  80  -1.982  14.598   9.394
  641   2HG1  VAL  80          2HG1      VAL  80  -2.557  13.180  10.303
  642   3HG1  VAL  80          3HG1      VAL  80  -2.304  13.067   8.545
  643   1HG2  VAL  80          1HG2      VAL  80  -3.397  15.767   7.863
  644   2HG2  VAL  80          2HG2      VAL  80  -3.825  14.279   6.986
  645   3HG2  VAL  80          3HG2      VAL  80  -5.108  15.328   7.639
  646    H    LYS  81           H        LYS  81  -6.558  12.667  11.165
  647    HA   LYS  81           HA       LYS  81  -5.053  11.002  12.831
  648   1HB   LYS  81          2HB       LYS  81  -7.722  12.069  12.768
  649   2HB   LYS  81          1HB       LYS  81  -7.718  10.401  13.329
  650   1HG   LYS  81          2HG       LYS  81  -6.024  12.675  14.408
  651   2HG   LYS  81          1HG       LYS  81  -7.396  11.874  15.209
  652   1HD   LYS  81          2HD       LYS  81  -5.890   9.706  14.669
  653   2HD   LYS  81          1HD       LYS  81  -4.592  10.936  14.802
  654   1HE   LYS  81          2HE       LYS  81  -4.957  11.297  16.992
  655   2HE   LYS  81          1HE       LYS  81  -6.673  10.721  16.906
  656   1HZ   LYS  81          1HZ       LYS  81  -5.249   9.012  17.894
  657   2HZ   LYS  81          2HZ       LYS  81  -5.798   8.537  16.426
  658   3HZ   LYS  81          3HZ       LYS  81  -4.262   9.049  16.581
  659    H    ASP  82           H        ASP  82  -6.959  10.119   9.942
  660    HA   ASP  82           HA       ASP  82  -6.556   7.210  10.378
  661   1HB   ASP  82          2HB       ASP  82  -7.664   8.740   8.056
  662   2HB   ASP  82          1HB       ASP  82  -7.622   6.958   8.272
  663    H    LEU  83           H        LEU  83  -5.044   9.864   8.558
  664    HA   LEU  83           HA       LEU  83  -3.477   8.226   6.792
  665   1HB   LEU  83          2HB       LEU  83  -3.697  11.123   7.419
  666   2HB   LEU  83          1HB       LEU  83  -2.260  10.494   6.548
  667    HG   LEU  83           HG       LEU  83  -3.867  11.251   4.858
  668   1HD1  LEU  83          1HD1      LEU  83  -4.214   9.270   3.613
  669   2HD1  LEU  83          2HD1      LEU  83  -2.587   9.319   4.333
  670   3HD1  LEU  83          3HD1      LEU  83  -3.842   8.273   5.038
  671   1HD2  LEU  83          1HD2      LEU  83  -6.105  10.424   4.684
  672   2HD2  LEU  83          2HD2      LEU  83  -5.923   9.494   6.191
  673   3HD2  LEU  83          3HD2      LEU  83  -5.894  11.272   6.235
  674    H    THR  84           H        THR  84  -2.825  10.001   9.840
  675    HA   THR  84           HA       THR  84  -0.078   9.411  10.231
  676    HB   THR  84           HB       THR  84  -1.207  11.040  11.497
  677    HG1  THR  84           1HG      THR  84  -0.421  10.201  13.623
  678   1HG2  THR  84          1HG2      THR  84  -2.616  10.491  13.419
  679   2HG2  THR  84          2HG2      THR  84  -3.405  10.029  11.893
  680   3HG2  THR  84          3HG2      THR  84  -2.654   8.784  12.917
  681    H    GLN  85           H        GLN  85  -2.976   7.373  10.852
  682    HA   GLN  85           HA       GLN  85  -1.472   5.080  11.900
  683   1HB   GLN  85          2HB       GLN  85  -4.299   5.754  11.437
  684   2HB   GLN  85          1HB       GLN  85  -3.859   4.083  11.165
  685   1HG   GLN  85          2HG       GLN  85  -4.466   4.241  13.403
  686   2HG   GLN  85          1HG       GLN  85  -2.675   4.148  13.400
  687   1HE2  GLN  85          2HE2      GLN  85  -2.484   5.075  15.490
  688   2HE2  GLN  85          1HE2      GLN  85  -2.927   6.745  15.747
  689    H    ALA  86           H        ALA  86  -3.011   5.874   8.720
  690    HA   ALA  86           HA       ALA  86  -2.319   3.563   7.303
  691   1HB   ALA  86          1HB       ALA  86  -2.562   4.943   5.346
  692   2HB   ALA  86          2HB       ALA  86  -3.860   5.243   6.526
  693   3HB   ALA  86          3HB       ALA  86  -2.527   6.409   6.353
  694    H    TRP  87           H        TRP  87  -0.305   6.472   7.973
  695    HA   TRP  87           HA       TRP  87   1.998   5.769   6.443
  696   1HB   TRP  87          2HB       TRP  87   2.272   7.850   6.992
  697   2HB   TRP  87          1HB       TRP  87   1.223   7.719   8.445
  698    HD1  TRP  87           HD       TRP  87   2.362   7.725  10.709
  699    HE1  TRP  87           1HE      TRP  87   4.725   7.556  11.591
  700    HE3  TRP  87           3HE      TRP  87   4.689   6.605   6.382
  701    HZ2  TRP  87           2HZ      TRP  87   7.294   7.046  10.541
  702    HZ3  TRP  87           3HZ      TRP  87   7.171   6.666   6.272
  703    HH2  TRP  87           HH       TRP  87   8.472   6.797   8.375
  704    H    ASP  88           H        ASP  88   0.845   4.843   9.701
  705    HA   ASP  88           HA       ASP  88   3.306   3.580  10.557
  706   1HB   ASP  88          2HB       ASP  88   1.730   4.365  12.272
  707   2HB   ASP  88          1HB       ASP  88   0.497   3.305  11.686
  708    H    LEU  89           H        LEU  89   0.184   2.472   8.998
  709    HA   LEU  89           HA       LEU  89   0.878  -0.347   8.984
  710   1HB   LEU  89          2HB       LEU  89  -1.153   1.231   7.392
  711   2HB   LEU  89          1HB       LEU  89  -1.029  -0.520   7.465
  712    HG   LEU  89           HG       LEU  89  -1.393   1.184   9.963
  713   1HD1  LEU  89          1HD1      LEU  89  -3.750   0.655   9.831
  714   2HD1  LEU  89          2HD1      LEU  89  -3.231   1.640   8.443
  715   3HD1  LEU  89          3HD1      LEU  89  -3.508  -0.106   8.241
  716   1HD2  LEU  89          1HD2      LEU  89  -2.193  -0.914  10.917
  717   2HD2  LEU  89          2HD2      LEU  89  -1.890  -1.755   9.377
  718   3HD2  LEU  89          3HD2      LEU  89  -0.528  -1.100  10.317
  719    H    TYR  90           H        TYR  90   1.170   2.316   6.682
  720    HA   TYR  90           HA       TYR  90   2.386   0.914   4.430
  721   1HB   TYR  90          2HB       TYR  90   2.509   3.838   5.295
  722   2HB   TYR  90          1HB       TYR  90   3.025   3.230   3.762
  723    HD1  TYR  90           1HD      TYR  90   0.935   5.308   4.538
  724    HD2  TYR  90           2HD      TYR  90   0.667   1.166   3.435
  725    HE1  TYR  90           1HE      TYR  90  -1.374   5.649   3.725
  726    HE2  TYR  90           2HE      TYR  90  -1.567   1.560   2.496
  727    HH   TYR  90           HH       TYR  90  -3.146   3.011   2.066
  728    H    TYR  91           H        TYR  91   3.847   2.632   7.176
  729    HA   TYR  91           HA       TYR  91   6.648   2.128   6.314
  730   1HB   TYR  91          2HB       TYR  91   5.710   4.162   7.648
  731   2HB   TYR  91          1HB       TYR  91   5.648   3.103   9.023
  732    HD1  TYR  91           1HD      TYR  91   8.139   3.655   6.261
  733    HD2  TYR  91           2HD      TYR  91   7.304   3.463  10.471
  734    HE1  TYR  91           1HE      TYR  91  10.531   4.022   6.747
  735    HE2  TYR  91           2HE      TYR  91   9.690   3.847  10.968
  736    HH   TYR  91           HH       TYR  91  11.663   4.441  10.134
  737    H    HIS  92           H        HIS  92   4.440   0.766   8.780
  738    HA   HIS  92           HA       HIS  92   6.269  -1.035   9.995
  739   1HB   HIS  92          2HB       HIS  92   4.037  -0.284  10.965
  740   2HB   HIS  92          1HB       HIS  92   3.217  -1.240   9.757
  741    HD1  HIS  92           1HD      HIS  92   5.856  -1.899  12.434
  742    HD2  HIS  92           2HD      HIS  92   2.619  -3.595  10.487
  743    HE1  HIS  92           1HE      HIS  92   5.460  -4.171  13.571
  744    H    VAL  93           H        VAL  93   3.892  -1.342   7.268
  745    HA   VAL  93           HA       VAL  93   4.645  -4.077   6.620
  746    HB   VAL  93           HB       VAL  93   2.442  -2.910   6.324
  747   1HG1  VAL  93          1HG1      VAL  93   1.961  -2.350   3.995
  748   2HG1  VAL  93          2HG1      VAL  93   3.062  -1.160   4.726
  749   3HG1  VAL  93          3HG1      VAL  93   3.697  -2.393   3.612
  750   1HG2  VAL  93          1HG2      VAL  93   1.988  -4.697   4.728
  751   2HG2  VAL  93          2HG2      VAL  93   3.740  -4.944   4.540
  752   3HG2  VAL  93          3HG2      VAL  93   2.970  -5.205   6.123
  753    H    PHE  94           H        PHE  94   5.718  -0.824   5.464
  754    HA   PHE  94           HA       PHE  94   7.120  -1.343   3.174
  755   1HB   PHE  94          2HB       PHE  94   6.861   0.811   4.051
  756   2HB   PHE  94          1HB       PHE  94   7.757   0.381   5.543
  757    HD1  PHE  94           1HD      PHE  94   8.160   0.648   1.825
  758    HD2  PHE  94           2HD      PHE  94  10.037   0.655   5.690
  759    HE1  PHE  94           1HE      PHE  94  10.306   1.327   0.781
  760    HE2  PHE  94           2HE      PHE  94  12.187   1.335   4.648
  761    HZ   PHE  94           HZ       PHE  94  12.313   1.671   2.192
  762    H    ARG  95           H        ARG  95   8.051  -2.413   6.398
  763    HA   ARG  95           HA       ARG  95  10.609  -3.628   5.441
  764   1HB   ARG  95          2HB       ARG  95  11.149  -3.880   7.634
  765   2HB   ARG  95          1HB       ARG  95  10.498  -2.215   7.425
  766   1HG   ARG  95          2HG       ARG  95   9.632  -2.862   9.485
  767   2HG   ARG  95          1HG       ARG  95   8.300  -3.242   8.383
  768   1HD   ARG  95          2HD       ARG  95   8.451  -5.480   8.835
  769   2HD   ARG  95          1HD       ARG  95  10.200  -5.489   8.641
  770    HE   ARG  95           HE       ARG  95   8.767  -5.479  11.041
  771   1HH1  ARG  95          2HH2      ARG  95  11.761  -4.336   9.616
  772   2HH1  ARG  95          1HH2      ARG  95  12.567  -4.107  11.132
  773   1HH2  ARG  95          1HH1      ARG  95   9.818  -5.121  13.026
  774   2HH2  ARG  95          2HH1      ARG  95  11.454  -4.539  13.051
  775    H    ARG  96           H        ARG  96   7.404  -4.586   6.709
  776    HA   ARG  96           HA       ARG  96   7.770  -7.386   6.961
  777   1HB   ARG  96          2HB       ARG  96   5.306  -5.735   6.409
  778   2HB   ARG  96          1HB       ARG  96   5.343  -7.458   6.913
  779   1HG   ARG  96          2HG       ARG  96   6.405  -5.160   8.621
  780   2HG   ARG  96          1HG       ARG  96   4.812  -5.856   8.797
  781   1HD   ARG  96          2HD       ARG  96   5.737  -8.006   9.345
  782   2HD   ARG  96          1HD       ARG  96   7.388  -7.406   9.021
  783    HE   ARG  96           HE       ARG  96   6.284  -5.616  10.820
  784   1HH1  ARG  96          2HH2      ARG  96   6.686  -9.083  10.902
  785   2HH1  ARG  96          1HH2      ARG  96   6.906  -9.171  12.619
  786   1HH2  ARG  96          1HH1      ARG  96   6.599  -5.743  13.110
  787   2HH2  ARG  96          2HH1      ARG  96   6.892  -7.289  13.834
  788    H    ILE  97           H        ILE  97   5.973  -5.626   4.398
  789    HA   ILE  97           HA       ILE  97   5.792  -7.859   2.524
  790    HB   ILE  97           HB       ILE  97   5.175  -6.146   0.900
  791   1HG1  ILE  97          2HG1      ILE  97   4.570  -4.221   3.018
  792   2HG1  ILE  97          1HG1      ILE  97   6.279  -4.332   2.473
  793   1HG2  ILE  97          1HG2      ILE  97   2.915  -5.949   1.942
  794   2HG2  ILE  97          2HG2      ILE  97   3.595  -7.578   2.172
  795   3HG2  ILE  97          3HG2      ILE  97   3.611  -6.410   3.513
  796   1HD1  ILE  97          1HD1      ILE  97   5.076  -2.566   1.310
  797   2HD1  ILE  97          2HD1      ILE  97   5.571  -3.856   0.188
  798   3HD1  ILE  97          3HD1      ILE  97   3.879  -3.746   0.728
  799    H    SER  98           H        SER  98   8.290  -5.569   3.353
  800    HA   SER  98           HA       SER  98   9.796  -5.421   0.920
  801   1HB   SER  98          2HB       SER  98  10.561  -3.914   2.350
  802   2HB   SER  98          1HB       SER  98  10.239  -4.937   3.793
  803    HG   SER  98           HG       SER  98  12.518  -4.404   3.167
  804    H    LYS  99           H        LYS  99   9.762  -7.740   3.667
  805    HA   LYS  99           HA       LYS  99  10.828  -9.758   4.015
  806   1HB   LYS  99          2HB       LYS  99  10.331  -9.959   1.069
  807   2HB   LYS  99          1HB       LYS  99  11.314 -11.137   1.864
  808   1HG   LYS  99          2HG       LYS  99   9.294 -11.107   3.587
  809   2HG   LYS  99          1HG       LYS  99   8.455 -10.589   2.088
  810   1HD   LYS  99          2HD       LYS  99   8.465 -12.822   1.483
  811   2HD   LYS  99          1HD       LYS  99  10.201 -12.625   1.219
  812   1HE   LYS  99          2HE       LYS  99  10.540 -13.209   3.693
  813   2HE   LYS  99          1HE       LYS  99   8.833 -13.621   3.760
  814   1HZ   LYS  99          1HZ       LYS  99  10.055 -15.510   3.336
  815   2HZ   LYS  99          2HZ       LYS  99   9.275 -15.161   1.938
  816   3HZ   LYS  99          3HZ       LYS  99  10.871 -14.836   2.097
  817    H    GLN 100           H        GLN 100  12.464  -7.318   3.933
  818    HA   GLN 100           HA       GLN 100  14.969  -7.410   2.875
  819   1HB   GLN 100          2HB       GLN 100  14.110  -5.850   4.577
  820   2HB   GLN 100          1HB       GLN 100  14.420  -7.109   5.814
  821   1HG   GLN 100          2HG       GLN 100  16.309  -5.788   5.963
  822   2HG   GLN 100          1HG       GLN 100  16.837  -7.086   4.846
  823   1HE2  GLN 100          2HE2      GLN 100  16.718  -6.505   2.419
  824   2HE2  GLN 100          1HE2      GLN 100  17.087  -4.837   2.071
  Start of MODEL    2
    1   1H    GLU   1          1H        GLU   1  -0.265  -8.041 -18.012
    2   2H    GLU   1          2H        GLU   1  -0.524  -6.544 -17.291
    3    HA   GLU   1           HA       GLU   1   1.980  -6.455 -18.463
    4   1HB   GLU   1          2HB       GLU   1   0.875  -6.407 -15.677
    5   2HB   GLU   1          1HB       GLU   1   2.642  -6.369 -15.973
    6   1HG   GLU   1          2HG       GLU   1   2.489  -4.260 -17.101
    7   2HG   GLU   1          1HG       GLU   1   0.738  -4.360 -17.232
    8    H    LEU   2           H        LEU   2   0.699  -8.945 -16.177
    9    HA   LEU   2           HA       LEU   2   2.810 -10.649 -15.733
   10   1HB   LEU   2          2HB       LEU   2   1.187 -12.375 -15.500
   11   2HB   LEU   2          1HB       LEU   2   0.738 -10.845 -14.670
   12    HG   LEU   2           HG       LEU   2  -0.572 -10.685 -17.114
   13   1HD1  LEU   2          1HD1      LEU   2  -1.790 -12.777 -17.355
   14   2HD1  LEU   2          2HD1      LEU   2  -0.049 -12.991 -17.657
   15   3HD1  LEU   2          3HD1      LEU   2  -0.758 -13.530 -16.117
   16   1HD2  LEU   2          1HD2      LEU   2  -2.582 -11.074 -15.736
   17   2HD2  LEU   2          2HD2      LEU   2  -1.569 -11.748 -14.437
   18   3HD2  LEU   2          3HD2      LEU   2  -1.421 -10.031 -14.882
   19    H    ILE   3           H        ILE   3   4.194 -10.482 -17.487
   20    HA   ILE   3           HA       ILE   3   3.648 -11.881 -19.960
   21    HB   ILE   3           HB       ILE   3   4.718  -9.909 -20.174
   22   1HG1  ILE   3          2HG1      ILE   3   5.315 -11.651 -21.629
   23   2HG1  ILE   3          1HG1      ILE   3   6.374 -10.195 -21.503
   24   1HG2  ILE   3          1HG2      ILE   3   6.882  -9.306 -19.170
   25   2HG2  ILE   3          2HG2      ILE   3   5.639  -9.537 -17.917
   26   3HG2  ILE   3          3HG2      ILE   3   6.860 -10.800 -18.203
   27   1HD1  ILE   3          1HD1      ILE   3   7.659 -12.212 -21.928
   28   2HD1  ILE   3          2HD1      ILE   3   8.046 -11.527 -20.332
   29   3HD1  ILE   3          3HD1      ILE   3   7.002 -12.963 -20.455
   30    H    ARG   4           H        ARG   4   5.499 -12.512 -17.061
   31    HA   ARG   4           HA       ARG   4   5.759 -15.398 -17.477
   32   1HB   ARG   4          2HB       ARG   4   8.131 -15.479 -17.540
   33   2HB   ARG   4          1HB       ARG   4   7.384 -14.786 -19.023
   34   1HG   ARG   4          2HG       ARG   4   9.226 -13.391 -18.789
   35   2HG   ARG   4          1HG       ARG   4   8.063 -12.484 -17.842
   36   1HD   ARG   4          2HD       ARG   4   9.138 -12.838 -15.932
   37   2HD   ARG   4          1HD       ARG   4   9.494 -14.549 -16.323
   38    HE   ARG   4           HE       ARG   4  10.946 -12.833 -18.053
   39   1HH1  ARG   4          2HH2      ARG   4  11.047 -13.924 -14.703
   40   2HH1  ARG   4          1HH2      ARG   4  12.765 -13.745 -14.578
   41   1HH2  ARG   4          1HH1      ARG   4  13.187 -12.652 -17.851
   42   2HH2  ARG   4          2HH1      ARG   4  13.955 -13.032 -16.349
   43    H    VAL   5           H        VAL   5   7.168 -12.595 -15.743
   44    HA   VAL   5           HA       VAL   5   7.498 -13.968 -13.227
   45    HB   VAL   5           HB       VAL   5   9.053 -12.362 -13.891
   46   1HG1  VAL   5          1HG1      VAL   5   8.569  -9.956 -13.981
   47   2HG1  VAL   5          2HG1      VAL   5   7.695 -10.833 -15.260
   48   3HG1  VAL   5          3HG1      VAL   5   6.831 -10.290 -13.803
   49   1HG2  VAL   5          1HG2      VAL   5   9.178 -10.992 -11.923
   50   2HG2  VAL   5          2HG2      VAL   5   7.521 -11.472 -11.486
   51   3HG2  VAL   5          3HG2      VAL   5   8.807 -12.698 -11.576
   52    H    ALA   6           H        ALA   6   4.818 -12.521 -14.800
   53    HA   ALA   6           HA       ALA   6   2.680 -11.894 -14.244
   54   1HB   ALA   6          1HB       ALA   6   1.626 -12.769 -12.324
   55   2HB   ALA   6          2HB       ALA   6   2.507 -14.014 -13.241
   56   3HB   ALA   6          3HB       ALA   6   3.183 -13.384 -11.720
   57    H    ILE   7           H        ILE   7   4.919 -10.047 -13.819
   58    HA   ILE   7           HA       ILE   7   5.675  -8.266 -12.531
   59    HB   ILE   7           HB       ILE   7   4.291  -7.507 -14.326
   60   1HG1  ILE   7          2HG1      ILE   7   5.687  -6.089 -13.334
   61   2HG1  ILE   7          1HG1      ILE   7   4.115  -5.286 -13.713
   62   1HG2  ILE   7          1HG2      ILE   7   2.084  -6.521 -13.873
   63   2HG2  ILE   7          2HG2      ILE   7   2.055  -8.286 -13.645
   64   3HG2  ILE   7          3HG2      ILE   7   2.104  -7.207 -12.231
   65   1HD1  ILE   7          1HD1      ILE   7   5.114  -4.400 -11.687
   66   2HD1  ILE   7          2HD1      ILE   7   3.581  -5.235 -11.338
   67   3HD1  ILE   7          3HD1      ILE   7   5.130  -6.026 -10.963
   68    H    LEU   8           H        LEU   8   5.816  -9.754 -10.562
   69    HA   LEU   8           HA       LEU   8   4.079  -9.973  -8.469
   70   1HB   LEU   8          2HB       LEU   8   6.966  -9.786  -8.815
   71   2HB   LEU   8          1HB       LEU   8   6.368  -9.302  -7.191
   72    HG   LEU   8           HG       LEU   8   6.995 -11.701  -7.202
   73   1HD1  LEU   8          1HD1      LEU   8   4.974 -12.567  -6.299
   74   2HD1  LEU   8          2HD1      LEU   8   5.296 -10.912  -5.728
   75   3HD1  LEU   8          3HD1      LEU   8   4.057 -11.198  -6.972
   76   1HD2  LEU   8          1HD2      LEU   8   5.798 -13.315  -8.510
   77   2HD2  LEU   8          2HD2      LEU   8   4.898 -12.027  -9.347
   78   3HD2  LEU   8          3HD2      LEU   8   6.655 -12.181  -9.582
   79    H    TRP   9           H        TRP   9   3.380  -8.899  -6.702
   80    HA   TRP   9           HA       TRP   9   3.097  -5.993  -7.010
   81   1HB   TRP   9          2HB       TRP   9   1.981  -7.865  -5.020
   82   2HB   TRP   9          1HB       TRP   9   1.761  -6.086  -5.055
   83    HD1  TRP   9           HD       TRP   9   1.459  -6.208  -8.436
   84    HE1  TRP   9           1HE      TRP   9  -0.758  -7.047  -9.341
   85    HE3  TRP   9           3HE      TRP   9  -0.122  -8.614  -4.331
   86    HZ2  TRP   9           2HZ      TRP   9  -2.901  -8.669  -8.406
   87    HZ3  TRP   9           3HZ      TRP   9  -2.386  -9.611  -4.257
   88    HH2  TRP   9           HH       TRP   9  -3.758  -9.646  -6.296
   89    H    HIS  10           H        HIS  10   4.729  -8.194  -4.633
   90    HA   HIS  10           HA       HIS  10   5.768  -6.381  -2.797
   91   1HB   HIS  10          2HB       HIS  10   6.202  -8.424  -2.190
   92   2HB   HIS  10          1HB       HIS  10   6.371  -9.018  -3.882
   93    HD1  HIS  10           1HD      HIS  10   8.446  -8.625  -0.922
   94    HD2  HIS  10           2HD      HIS  10   8.833  -8.342  -5.024
   95    HE1  HIS  10           1HE      HIS  10  10.945  -8.766  -1.404
   96    H    GLU  11           H        GLU  11   6.752  -6.840  -6.140
   97    HA   GLU  11           HA       GLU  11   9.334  -5.569  -6.065
   98   1HB   GLU  11          2HB       GLU  11   7.422  -6.137  -8.417
   99   2HB   GLU  11          1HB       GLU  11   9.100  -5.736  -8.565
  100   1HG   GLU  11          2HG       GLU  11   8.202  -8.126  -7.006
  101   2HG   GLU  11          1HG       GLU  11   8.428  -8.125  -8.785
  102    H    MET  12           H        MET  12   6.031  -4.596  -7.169
  103    HA   MET  12           HA       MET  12   6.763  -1.794  -7.650
  104   1HB   MET  12          2HB       MET  12   4.672  -1.493  -8.431
  105   2HB   MET  12          1HB       MET  12   5.133  -3.134  -8.992
  106   1HG   MET  12          2HG       MET  12   3.794  -4.101  -7.174
  107   2HG   MET  12          1HG       MET  12   3.290  -2.446  -6.693
  108   1HE   MET  12          1HE       MET  12   1.127  -1.437  -9.903
  109   2HE   MET  12          2HE       MET  12   1.752  -0.868  -8.337
  110   3HE   MET  12          3HE       MET  12   2.871  -1.155  -9.692
  111    H    TRP  13           H        TRP  13   5.582  -3.761  -4.957
  112    HA   TRP  13           HA       TRP  13   4.362  -1.670  -3.397
  113   1HB   TRP  13          2HB       TRP  13   4.798  -4.562  -3.090
  114   2HB   TRP  13          1HB       TRP  13   4.928  -3.661  -1.615
  115    HD1  TRP  13           HD       TRP  13   2.658  -1.441  -2.279
  116    HE1  TRP  13           1HE      TRP  13   0.246  -2.172  -2.044
  117    HE3  TRP  13           3HE      TRP  13   3.328  -6.367  -2.941
  118    HZ2  TRP  13           2HZ      TRP  13  -1.203  -4.596  -2.211
  119    HZ3  TRP  13           3HZ      TRP  13   1.443  -7.938  -2.649
  120    HH2  TRP  13           HH       TRP  13  -0.840  -7.039  -2.395
  121    H    HIS  14           H        HIS  14   7.652  -3.215  -3.421
  122    HA   HIS  14           HA       HIS  14   8.871  -1.946  -1.266
  123   1HB   HIS  14          2HB       HIS  14   9.758  -2.932  -3.944
  124   2HB   HIS  14          1HB       HIS  14  10.856  -1.895  -3.042
  125    HD1  HIS  14           1HD      HIS  14  10.908  -5.182  -3.530
  126    HD2  HIS  14           2HD      HIS  14  10.223  -2.912  -0.094
  127    HE1  HIS  14           1HE      HIS  14  11.858  -6.529  -1.538
  128    H    GLU  15           H        GLU  15   8.662  -0.657  -4.561
  129    HA   GLU  15           HA       GLU  15   9.569   2.053  -3.726
  130   1HB   GLU  15          2HB       GLU  15   9.370   0.550  -6.263
  131   2HB   GLU  15          1HB       GLU  15   9.080   2.284  -6.324
  132   1HG   GLU  15          2HG       GLU  15  11.441   1.446  -4.693
  133   2HG   GLU  15          1HG       GLU  15  11.563   1.178  -6.427
  134    H    GLY  16           H        GLY  16   6.478   0.537  -5.105
  135   1HA   GLY  16          2HA       GLY  16   4.983   2.893  -5.252
  136   2HA   GLY  16          1HA       GLY  16   4.350   1.301  -4.934
  137    H    LEU  17           H        LEU  17   5.794   0.929  -2.333
  138    HA   LEU  17           HA       LEU  17   4.210   2.626  -0.544
  139   1HB   LEU  17          2HB       LEU  17   5.903   0.270  -0.220
  140   2HB   LEU  17          1HB       LEU  17   5.523   1.366   1.146
  141    HG   LEU  17           HG       LEU  17   3.211   0.757  -0.617
  142   1HD1  LEU  17          1HD1      LEU  17   2.803  -1.478   0.313
  143   2HD1  LEU  17          2HD1      LEU  17   4.299  -1.458  -0.652
  144   3HD1  LEU  17          3HD1      LEU  17   4.386  -1.438   1.125
  145   1HD2  LEU  17          1HD2      LEU  17   2.103   0.481   1.574
  146   2HD2  LEU  17          2HD2      LEU  17   3.684   0.568   2.387
  147   3HD2  LEU  17          3HD2      LEU  17   3.050   1.987   1.523
  148    H    GLU  18           H        GLU  18   7.546   2.658  -1.823
  149    HA   GLU  18           HA       GLU  18   8.568   4.525   0.209
  150   1HB   GLU  18          2HB       GLU  18  10.079   2.929  -0.740
  151   2HB   GLU  18          1HB       GLU  18   9.792   3.576  -2.356
  152   1HG   GLU  18          2HG       GLU  18  10.988   5.546  -1.918
  153   2HG   GLU  18          1HG       GLU  18  10.606   5.542  -0.212
  154    H    GLU  19           H        GLU  19   7.788   4.758  -3.319
  155    HA   GLU  19           HA       GLU  19   8.095   7.592  -3.599
  156   1HB   GLU  19          2HB       GLU  19   8.250   6.054  -5.426
  157   2HB   GLU  19          1HB       GLU  19   6.540   5.569  -5.183
  158   1HG   GLU  19          2HG       GLU  19   6.942   7.154  -7.079
  159   2HG   GLU  19          1HG       GLU  19   5.760   7.717  -5.856
  160    H    ALA  20           H        ALA  20   5.477   5.573  -2.300
  161    HA   ALA  20           HA       ALA  20   3.535   7.807  -2.192
  162   1HB   ALA  20          1HB       ALA  20   2.136   6.214  -1.082
  163   2HB   ALA  20          2HB       ALA  20   2.754   5.548  -2.612
  164   3HB   ALA  20          3HB       ALA  20   3.456   5.019  -1.064
  165    H    SER  21           H        SER  21   5.027   5.655   0.320
  166    HA   SER  21           HA       SER  21   4.355   7.124   2.582
  167   1HB   SER  21          2HB       SER  21   6.026   6.004   3.782
  168   2HB   SER  21          1HB       SER  21   5.418   4.853   2.608
  169    HG   SER  21           HG       SER  21   7.384   5.979   1.307
  170    H    ARG  22           H        ARG  22   6.871   7.896   0.156
  171    HA   ARG  22           HA       ARG  22   8.334   9.860   1.731
  172   1HB   ARG  22          2HB       ARG  22   9.397   8.634  -0.072
  173   2HB   ARG  22          1HB       ARG  22   8.241   9.274  -1.231
  174   1HG   ARG  22          2HG       ARG  22   9.057  11.581  -0.818
  175   2HG   ARG  22          1HG       ARG  22  10.116  11.025   0.440
  176   1HD   ARG  22          2HD       ARG  22  10.483   9.676  -2.172
  177   2HD   ARG  22          1HD       ARG  22  10.869  11.396  -2.105
  178    HE   ARG  22           HE       ARG  22  12.391   9.298  -1.058
  179   1HH1  ARG  22          2HH2      ARG  22  11.372  12.494   0.012
  180   2HH1  ARG  22          1HH2      ARG  22  12.784  12.755   0.984
  181   1HH2  ARG  22          1HH1      ARG  22  14.226   9.686   0.242
  182   2HH2  ARG  22          2HH1      ARG  22  14.352  11.177   1.109
  183    H    LEU  23           H        LEU  23   5.580   9.979  -0.589
  184    HA   LEU  23           HA       LEU  23   5.343  12.856  -0.814
  185   1HB   LEU  23          2HB       LEU  23   3.801  10.516  -1.582
  186   2HB   LEU  23          1HB       LEU  23   2.948  12.078  -1.324
  187    HG   LEU  23           HG       LEU  23   3.556  11.739  -3.737
  188   1HD1  LEU  23          1HD1      LEU  23   4.601  13.825  -4.145
  189   2HD1  LEU  23          2HD1      LEU  23   3.351  13.982  -2.888
  190   3HD1  LEU  23          3HD1      LEU  23   5.071  13.967  -2.435
  191   1HD2  LEU  23          1HD2      LEU  23   5.821  11.834  -4.466
  192   2HD2  LEU  23          2HD2      LEU  23   6.408  11.817  -2.786
  193   3HD2  LEU  23          3HD2      LEU  23   5.574  10.393  -3.451
  194    H    TYR  24           H        TYR  24   4.600  10.579   1.648
  195    HA   TYR  24           HA       TYR  24   3.023  12.611   3.257
  196   1HB   TYR  24          2HB       TYR  24   2.001  10.456   3.010
  197   2HB   TYR  24          1HB       TYR  24   3.538   9.630   3.416
  198    HD1  TYR  24           1HD      TYR  24   4.461   9.822   5.709
  199    HD2  TYR  24           2HD      TYR  24   0.486  11.099   4.740
  200    HE1  TYR  24           1HE      TYR  24   3.951   9.988   8.095
  201    HE2  TYR  24           2HE      TYR  24  -0.122  10.872   7.147
  202    HH   TYR  24           HH       TYR  24   0.601  10.530   9.192
  203    H    PHE  25           H        PHE  25   5.925  10.481   3.473
  204    HA   PHE  25           HA       PHE  25   6.743  10.693   6.020
  205   1HB   PHE  25          2HB       PHE  25   7.770   9.319   4.290
  206   2HB   PHE  25          1HB       PHE  25   8.398  10.790   3.472
  207    HD1  PHE  25           1HD      PHE  25  10.020  12.263   4.848
  208    HD2  PHE  25           2HD      PHE  25   9.215   8.122   5.675
  209    HE1  PHE  25           1HE      PHE  25  12.006  12.184   6.288
  210    HE2  PHE  25           2HE      PHE  25  11.280   8.017   7.049
  211    HZ   PHE  25           HZ       PHE  25  12.673  10.047   7.361
  212    H    GLY  26           H        GLY  26   7.498  12.988   3.399
  213   1HA   GLY  26          2HA       GLY  26   7.673  15.296   5.185
  214   2HA   GLY  26          1HA       GLY  26   9.234  14.794   4.570
  215    H    GLU  27           H        GLU  27   6.183  14.413   2.741
  216    HA   GLU  27           HA       GLU  27   7.026  16.680   0.942
  217   1HB   GLU  27          2HB       GLU  27   6.681  13.944   0.355
  218   2HB   GLU  27          1HB       GLU  27   5.280  14.751  -0.284
  219   1HG   GLU  27          2HG       GLU  27   6.480  15.714  -1.940
  220   2HG   GLU  27          1HG       GLU  27   7.750  16.243  -0.866
  221    H    ARG  28           H        ARG  28   4.708  15.814   3.280
  222    HA   ARG  28           HA       ARG  28   2.552  16.464   3.782
  223   1HB   ARG  28          2HB       ARG  28   4.305  18.521   3.759
  224   2HB   ARG  28          1HB       ARG  28   3.148  19.128   2.598
  225   1HG   ARG  28          2HG       ARG  28   1.596  19.504   4.165
  226   2HG   ARG  28          1HG       ARG  28   1.878  17.950   4.972
  227   1HD   ARG  28          2HD       ARG  28   3.809  20.310   5.198
  228   2HD   ARG  28          1HD       ARG  28   2.513  20.012   6.354
  229    HE   ARG  28           HE       ARG  28   4.992  18.562   6.064
  230   1HH1  ARG  28          2HH2      ARG  28   1.753  18.372   7.392
  231   2HH1  ARG  28          1HH2      ARG  28   2.159  17.146   8.551
  232   1HH2  ARG  28          1HH1      ARG  28   5.491  16.929   7.611
  233   2HH2  ARG  28          2HH1      ARG  28   4.243  16.353   8.653
  234    H    ASN  29           H        ASN  29   2.773  15.086   1.238
  235    HA   ASN  29           HA       ASN  29   0.544  16.314  -0.255
  236   1HB   ASN  29          2HB       ASN  29   3.043  16.458  -1.156
  237   2HB   ASN  29          1HB       ASN  29   2.768  14.767  -1.600
  238   1HD2  ASN  29          2HD2      ASN  29   2.172  18.029  -2.333
  239   2HD2  ASN  29          1HD2      ASN  29   1.106  17.768  -3.696
  240    H    VAL  30           H        VAL  30  -0.467  14.905   1.346
  241    HA   VAL  30           HA       VAL  30  -0.371  12.072   1.348
  242    HB   VAL  30           HB       VAL  30  -2.468  14.099   2.169
  243   1HG1  VAL  30          1HG1      VAL  30  -3.528  12.264   3.381
  244   2HG1  VAL  30          2HG1      VAL  30  -3.556  11.957   1.628
  245   3HG1  VAL  30          3HG1      VAL  30  -2.383  11.107   2.663
  246   1HG2  VAL  30          1HG2      VAL  30  -1.711  13.507   4.414
  247   2HG2  VAL  30          2HG2      VAL  30  -0.508  12.387   3.732
  248   3HG2  VAL  30          3HG2      VAL  30  -0.362  14.137   3.439
  249    H    LYS  31           H        LYS  31  -2.495  14.398  -0.435
  250    HA   LYS  31           HA       LYS  31  -3.972  12.653  -2.053
  251   1HB   LYS  31          2HB       LYS  31  -4.283  15.059  -1.680
  252   2HB   LYS  31          1HB       LYS  31  -2.859  15.363  -2.727
  253   1HG   LYS  31          2HG       LYS  31  -5.212  13.783  -3.828
  254   2HG   LYS  31          1HG       LYS  31  -5.296  15.516  -3.781
  255   1HD   LYS  31          2HD       LYS  31  -2.756  14.565  -4.930
  256   2HD   LYS  31          1HD       LYS  31  -4.175  14.019  -5.797
  257   1HE   LYS  31          2HE       LYS  31  -4.994  16.360  -5.896
  258   2HE   LYS  31          1HE       LYS  31  -3.497  16.881  -5.093
  259   1HZ   LYS  31          1HZ       LYS  31  -3.443  16.955  -7.524
  260   2HZ   LYS  31          2HZ       LYS  31  -2.261  16.038  -6.872
  261   3HZ   LYS  31          3HZ       LYS  31  -3.553  15.322  -7.562
  262    H    GLY  32           H        GLY  32  -0.506  13.621  -2.354
  263   1HA   GLY  32          2HA       GLY  32  -0.066  12.668  -5.038
  264   2HA   GLY  32          1HA       GLY  32   1.137  13.052  -3.834
  265    H    MET  33           H        MET  33   0.949  11.316  -1.817
  266    HA   MET  33           HA       MET  33   1.861   8.792  -2.779
  267   1HB   MET  33          2HB       MET  33   1.730   8.018  -0.638
  268   2HB   MET  33          1HB       MET  33   2.245   9.743  -0.564
  269   1HG   MET  33          2HG       MET  33   0.284  10.400   0.457
  270   2HG   MET  33          1HG       MET  33  -0.597   8.944  -0.054
  271   1HE   MET  33          1HE       MET  33  -0.474   8.872   3.784
  272   2HE   MET  33          2HE       MET  33  -0.425  10.305   2.732
  273   3HE   MET  33          3HE       MET  33  -1.458   8.920   2.303
  274    H    PHE  34           H        PHE  34  -1.380   9.945  -2.200
  275    HA   PHE  34           HA       PHE  34  -2.795   7.439  -2.143
  276   1HB   PHE  34          2HB       PHE  34  -3.305  10.189  -1.756
  277   2HB   PHE  34          1HB       PHE  34  -4.305   9.673  -3.126
  278    HD1  PHE  34           1HD      PHE  34  -3.624   9.270   0.457
  279    HD2  PHE  34           2HD      PHE  34  -5.940   7.858  -2.873
  280    HE1  PHE  34           1HE      PHE  34  -5.264   8.230   2.014
  281    HE2  PHE  34           2HE      PHE  34  -7.521   6.757  -1.303
  282    HZ   PHE  34           HZ       PHE  34  -7.167   6.941   1.144
  283    H    GLU  35           H        GLU  35  -1.357   9.331  -4.747
  284    HA   GLU  35           HA       GLU  35  -2.997   8.195  -6.900
  285   1HB   GLU  35          2HB       GLU  35  -1.828  10.571  -6.797
  286   2HB   GLU  35          1HB       GLU  35  -0.369   9.716  -7.183
  287   1HG   GLU  35          2HG       GLU  35  -1.100  10.286  -9.276
  288   2HG   GLU  35          1HG       GLU  35  -1.838   8.699  -9.156
  289    H    VAL  36           H        VAL  36   0.373   7.732  -5.607
  290    HA   VAL  36           HA       VAL  36   1.038   5.675  -7.598
  291    HB   VAL  36           HB       VAL  36   2.781   7.152  -6.974
  292   1HG1  VAL  36          1HG1      VAL  36   3.740   7.176  -4.785
  293   2HG1  VAL  36          2HG1      VAL  36   2.063   7.768  -4.718
  294   3HG1  VAL  36          3HG1      VAL  36   2.449   6.122  -4.163
  295   1HG2  VAL  36          1HG2      VAL  36   4.468   5.620  -6.453
  296   2HG2  VAL  36          2HG2      VAL  36   3.261   4.383  -6.029
  297   3HG2  VAL  36          3HG2      VAL  36   3.359   4.993  -7.697
  298    H    LEU  37           H        LEU  37  -0.204   5.804  -4.254
  299    HA   LEU  37           HA       LEU  37  -0.202   2.882  -3.939
  300   1HB   LEU  37          2HB       LEU  37   0.044   4.990  -2.237
  301   2HB   LEU  37          1HB       LEU  37  -1.649   4.492  -2.027
  302    HG   LEU  37           HG       LEU  37  -0.313   2.069  -2.207
  303   1HD1  LEU  37          1HD1      LEU  37   1.522   2.141  -0.607
  304   2HD1  LEU  37          2HD1      LEU  37   1.884   3.103  -2.059
  305   3HD1  LEU  37          3HD1      LEU  37   1.413   3.916  -0.549
  306   1HD2  LEU  37          1HD2      LEU  37  -0.752   1.962   0.228
  307   2HD2  LEU  37          2HD2      LEU  37  -0.970   3.728   0.260
  308   3HD2  LEU  37          3HD2      LEU  37  -2.113   2.705  -0.643
  309    H    GLU  38           H        GLU  38  -2.304   5.243  -5.400
  310    HA   GLU  38           HA       GLU  38  -4.907   4.228  -4.954
  311   1HB   GLU  38          2HB       GLU  38  -3.730   6.215  -6.591
  312   2HB   GLU  38          1HB       GLU  38  -4.527   5.126  -7.684
  313   1HG   GLU  38          2HG       GLU  38  -6.181   5.716  -5.337
  314   2HG   GLU  38          1HG       GLU  38  -5.715   7.147  -6.257
  315    HA   PRO  39           HA       PRO  39  -4.188   0.921  -8.393
  316   1HB   PRO  39          2HB       PRO  39  -1.826   0.474  -9.506
  317   2HB   PRO  39          1HB       PRO  39  -2.901   1.729 -10.119
  318   1HG   PRO  39          2HG       PRO  39  -0.492   2.040  -8.266
  319   2HG   PRO  39          1HG       PRO  39  -0.910   3.005  -9.678
  320   1HD   PRO  39          1HD       PRO  39  -1.606   3.785  -7.087
  321   2HD   PRO  39          2HD       PRO  39  -2.642   4.196  -8.512
  322    H    LEU  40           H        LEU  40  -1.880   1.431  -5.731
  323    HA   LEU  40           HA       LEU  40  -1.082  -1.340  -5.529
  324   1HB   LEU  40          2HB       LEU  40  -0.746   0.949  -3.549
  325   2HB   LEU  40          1HB       LEU  40  -0.050  -0.626  -3.388
  326    HG   LEU  40           HG       LEU  40   0.583   1.364  -5.593
  327   1HD1  LEU  40          1HD1      LEU  40   2.741   1.303  -4.441
  328   2HD1  LEU  40          2HD1      LEU  40   1.465   1.782  -3.297
  329   3HD1  LEU  40          3HD1      LEU  40   2.108   0.123  -3.269
  330   1HD2  LEU  40          1HD2      LEU  40   2.272  -0.169  -6.305
  331   2HD2  LEU  40          2HD2      LEU  40   1.711  -1.393  -5.141
  332   3HD2  LEU  40          3HD2      LEU  40   0.665  -0.908  -6.496
  333    H    HIS  41           H        HIS  41  -3.756   0.646  -4.308
  334    HA   HIS  41           HA       HIS  41  -4.865  -1.355  -2.529
  335   1HB   HIS  41          2HB       HIS  41  -5.425   0.823  -2.093
  336   2HB   HIS  41          1HB       HIS  41  -5.618   1.225  -3.842
  337    HD1  HIS  41           1HD      HIS  41  -7.857   2.128  -3.955
  338    HD2  HIS  41           2HD      HIS  41  -7.706  -1.363  -1.745
  339    HE1  HIS  41           1HE      HIS  41 -10.296   1.385  -3.650
  340    H    ALA  42           H        ALA  42  -5.471  -0.389  -5.951
  341    HA   ALA  42           HA       ALA  42  -7.740  -2.154  -6.338
  342   1HB   ALA  42          1HB       ALA  42  -7.498  -1.554  -8.659
  343   2HB   ALA  42          2HB       ALA  42  -7.476  -0.121  -7.603
  344   3HB   ALA  42          3HB       ALA  42  -5.960  -0.734  -8.302
  345    H    MET  43           H        MET  43  -4.233  -2.312  -7.153
  346    HA   MET  43           HA       MET  43  -4.176  -4.925  -8.199
  347   1HB   MET  43          2HB       MET  43  -2.078  -3.135  -6.995
  348   2HB   MET  43          1HB       MET  43  -1.717  -4.791  -7.478
  349   1HG   MET  43          2HG       MET  43  -3.101  -3.828  -9.695
  350   2HG   MET  43          1HG       MET  43  -2.205  -2.414  -9.164
  351   1HE   MET  43          1HE       MET  43  -0.149  -4.010 -12.154
  352   2HE   MET  43          2HE       MET  43  -1.911  -4.120 -11.925
  353   3HE   MET  43          3HE       MET  43  -1.066  -2.589 -11.598
  354    H    MET  44           H        MET  44  -4.885  -3.992  -4.963
  355    HA   MET  44           HA       MET  44  -3.964  -6.600  -3.848
  356   1HB   MET  44          2HB       MET  44  -3.181  -4.615  -2.704
  357   2HB   MET  44          1HB       MET  44  -4.879  -4.083  -2.484
  358   1HG   MET  44          2HG       MET  44  -4.118  -5.052  -0.449
  359   2HG   MET  44          1HG       MET  44  -5.294  -6.178  -1.212
  360   1HE   MET  44          1HE       MET  44  -3.091  -9.307  -2.017
  361   2HE   MET  44          2HE       MET  44  -4.745  -8.716  -1.726
  362   3HE   MET  44          3HE       MET  44  -3.818  -8.113  -3.119
  363    H    GLU  45           H        GLU  45  -6.804  -4.695  -4.796
  364    HA   GLU  45           HA       GLU  45  -8.682  -6.326  -3.202
  365   1HB   GLU  45          2HB       GLU  45  -8.770  -3.751  -3.743
  366   2HB   GLU  45          1HB       GLU  45  -9.551  -4.333  -5.224
  367   1HG   GLU  45          2HG       GLU  45 -11.305  -3.980  -3.505
  368   2HG   GLU  45          1HG       GLU  45 -11.155  -5.696  -3.754
  369    H    ARG  46           H        ARG  46  -7.735  -5.824  -6.641
  370    HA   ARG  46           HA       ARG  46  -9.493  -7.283  -8.101
  371   1HB   ARG  46          2HB       ARG  46  -7.120  -6.155  -8.605
  372   2HB   ARG  46          1HB       ARG  46  -6.570  -7.826  -8.507
  373   1HG   ARG  46          2HG       ARG  46  -8.970  -7.054 -10.155
  374   2HG   ARG  46          1HG       ARG  46  -7.293  -6.927 -10.780
  375   1HD   ARG  46          2HD       ARG  46  -7.832  -9.574  -9.641
  376   2HD   ARG  46          1HD       ARG  46  -8.964  -9.176 -10.935
  377    HE   ARG  46           HE       ARG  46  -6.311  -9.934 -11.241
  378   1HH1  ARG  46          2HH2      ARG  46  -8.481  -7.523 -12.538
  379   2HH1  ARG  46          1HH2      ARG  46  -7.664  -7.367 -14.060
  380   1HH2  ARG  46          1HH1      ARG  46  -5.218  -9.719 -13.245
  381   2HH2  ARG  46          2HH1      ARG  46  -5.809  -8.592 -14.426
  382    H    GLY  47           H        GLY  47  -6.932  -8.725  -5.989
  383   1HA   GLY  47          2HA       GLY  47  -7.656 -10.708  -4.728
  384   2HA   GLY  47          1HA       GLY  47  -8.379 -11.331  -6.198
  385    HA   PRO  48           HA       PRO  48  -3.815 -12.603  -5.733
  386   1HB   PRO  48          2HB       PRO  48  -4.131 -15.128  -4.964
  387   2HB   PRO  48          1HB       PRO  48  -3.915 -13.723  -3.817
  388   1HG   PRO  48          2HG       PRO  48  -6.385 -15.235  -4.637
  389   2HG   PRO  48          1HG       PRO  48  -5.883 -14.656  -2.975
  390   1HD   PRO  48          1HD       PRO  48  -7.691 -13.156  -4.663
  391   2HD   PRO  48          2HD       PRO  48  -6.558 -12.358  -3.480
  392    H    GLN  49           H        GLN  49  -2.894 -13.407  -7.482
  393    HA   GLN  49           HA       GLN  49  -4.565 -14.769  -9.507
  394   1HB   GLN  49          2HB       GLN  49  -3.452 -12.737 -10.190
  395   2HB   GLN  49          1HB       GLN  49  -1.888 -13.388  -9.745
  396   1HG   GLN  49          2HG       GLN  49  -1.700 -14.257 -11.745
  397   2HG   GLN  49          1HG       GLN  49  -3.115 -15.312 -11.415
  398   1HE2  GLN  49          2HE2      GLN  49  -2.398 -14.554 -13.945
  399   2HE2  GLN  49          1HE2      GLN  49  -3.596 -13.430 -14.536
  400    H    THR  50           H        THR  50  -1.321 -15.405 -10.004
  401    HA   THR  50           HA       THR  50  -1.170 -18.104 -10.006
  402    HB   THR  50           HB       THR  50   0.488 -17.199 -11.077
  403    HG1  THR  50           1HG      THR  50   2.408 -17.965 -10.026
  404   1HG2  THR  50          1HG2      THR  50   2.169 -15.620 -10.253
  405   2HG2  THR  50          2HG2      THR  50   0.534 -14.921 -10.160
  406   3HG2  THR  50          3HG2      THR  50   1.330 -15.524  -8.687
  407    H    LEU  51           H        LEU  51   0.595 -16.477  -7.505
  408    HA   LEU  51           HA       LEU  51  -0.310 -17.101  -4.994
  409   1HB   LEU  51          2HB       LEU  51   0.590 -19.618  -6.237
  410   2HB   LEU  51          1HB       LEU  51   1.151 -19.268  -4.607
  411    HG   LEU  51           HG       LEU  51  -1.739 -18.754  -5.159
  412   1HD1  LEU  51          1HD1      LEU  51  -2.292 -21.127  -4.860
  413   2HD1  LEU  51          2HD1      LEU  51  -1.359 -20.865  -6.353
  414   3HD1  LEU  51          3HD1      LEU  51  -0.563 -21.542  -4.912
  415   1HD2  LEU  51          1HD2      LEU  51  -1.915 -19.677  -2.877
  416   2HD2  LEU  51          2HD2      LEU  51  -0.177 -20.062  -2.892
  417   3HD2  LEU  51          3HD2      LEU  51  -0.715 -18.365  -2.939
  418    H    LYS  52           H        LYS  52   1.484 -15.279  -6.467
  419    HA   LYS  52           HA       LYS  52   3.972 -15.616  -4.831
  420   1HB   LYS  52          2HB       LYS  52   3.657 -14.332  -7.567
  421   2HB   LYS  52          1HB       LYS  52   5.113 -14.372  -6.632
  422   1HG   LYS  52          2HG       LYS  52   4.427 -17.063  -6.721
  423   2HG   LYS  52          1HG       LYS  52   3.916 -16.461  -8.283
  424   1HD   LYS  52          2HD       LYS  52   6.172 -17.101  -8.560
  425   2HD   LYS  52          1HD       LYS  52   6.234 -15.344  -8.450
  426   1HE   LYS  52          2HE       LYS  52   6.806 -15.554  -6.004
  427   2HE   LYS  52          1HE       LYS  52   6.832 -17.302  -6.184
  428   1HZ   LYS  52          1HZ       LYS  52   8.961 -16.415  -6.374
  429   2HZ   LYS  52          2HZ       LYS  52   8.532 -17.023  -7.829
  430   3HZ   LYS  52          3HZ       LYS  52   8.533 -15.405  -7.584
  431    H    GLU  53           H        GLU  53   1.820 -13.123  -6.298
  432    HA   GLU  53           HA       GLU  53   2.666 -11.081  -4.363
  433   1HB   GLU  53          2HB       GLU  53   1.310  -9.628  -5.658
  434   2HB   GLU  53          1HB       GLU  53   2.535 -10.511  -6.633
  435   1HG   GLU  53          2HG       GLU  53  -0.154 -11.773  -6.672
  436   2HG   GLU  53          1HG       GLU  53  -0.127 -10.173  -7.363
  437    H    THR  54           H        THR  54   1.681 -12.934  -2.722
  438    HA   THR  54           HA       THR  54  -0.714 -11.735  -1.568
  439    HB   THR  54           HB       THR  54  -1.028 -14.246  -3.062
  440    HG1  THR  54           1HG      THR  54  -1.699 -11.704  -3.390
  441   1HG2  THR  54          1HG2      THR  54  -3.189 -14.648  -2.022
  442   2HG2  THR  54          2HG2      THR  54  -1.863 -14.877  -0.858
  443   3HG2  THR  54          3HG2      THR  54  -2.851 -13.399  -0.800
  444    H    SER  55           H        SER  55   1.598 -11.638  -0.406
  445    HA   SER  55           HA       SER  55   1.741 -13.883   1.575
  446   1HB   SER  55          2HB       SER  55   3.777 -11.784   0.872
  447   2HB   SER  55          1HB       SER  55   3.895 -12.909   2.236
  448    HG   SER  55           HG       SER  55   4.958 -13.917   0.547
  449    H    PHE  56           H        PHE  56   1.509 -10.345   1.247
  450    HA   PHE  56           HA       PHE  56   1.321  -9.807   4.063
  451   1HB   PHE  56          2HB       PHE  56   0.431  -7.848   1.936
  452   2HB   PHE  56          1HB       PHE  56   1.244  -7.539   3.448
  453    HD1  PHE  56           1HD      PHE  56   1.667  -6.898   0.401
  454    HD2  PHE  56           2HD      PHE  56   3.579  -9.524   3.225
  455    HE1  PHE  56           1HE      PHE  56   3.822  -6.725  -0.828
  456    HE2  PHE  56           2HE      PHE  56   5.652  -9.463   1.885
  457    HZ   PHE  56           HZ       PHE  56   5.756  -8.055  -0.147
  458    H    ASN  57           H        ASN  57  -1.111  -9.556   1.319
  459    HA   ASN  57           HA       ASN  57  -3.408  -9.030   2.774
  460   1HB   ASN  57          2HB       ASN  57  -3.096  -9.337   0.226
  461   2HB   ASN  57          1HB       ASN  57  -3.215 -11.062   0.509
  462   1HD2  ASN  57          2HD2      ASN  57  -5.203 -11.883   1.563
  463   2HD2  ASN  57          1HD2      ASN  57  -6.658 -11.008   1.209
  464    H    GLN  58           H        GLN  58  -1.607 -12.073   2.679
  465    HA   GLN  58           HA       GLN  58  -3.654 -13.776   3.725
  466   1HB   GLN  58          2HB       GLN  58  -0.838 -13.976   2.920
  467   2HB   GLN  58          1HB       GLN  58  -1.270 -14.997   4.292
  468   1HG   GLN  58          2HG       GLN  58  -2.752 -14.893   1.634
  469   2HG   GLN  58          1HG       GLN  58  -1.632 -16.166   2.158
  470   1HE2  GLN  58          2HE2      GLN  58  -2.244 -17.499   4.011
  471   2HE2  GLN  58          1HE2      GLN  58  -3.931 -17.612   4.448
  472    H    ALA  59           H        ALA  59  -0.987 -11.910   5.188
  473    HA   ALA  59           HA       ALA  59  -1.906 -12.618   7.958
  474   1HB   ALA  59          1HB       ALA  59   0.358 -12.171   8.658
  475   2HB   ALA  59          2HB       ALA  59   0.284 -13.492   7.468
  476   3HB   ALA  59          3HB       ALA  59   0.839 -11.877   6.970
  477    H    TYR  60           H        TYR  60   0.062 -10.048   6.516
  478    HA   TYR  60           HA       TYR  60  -1.167  -7.840   7.930
  479   1HB   TYR  60          2HB       TYR  60   0.816  -8.058   5.612
  480   2HB   TYR  60          1HB       TYR  60   0.290  -6.515   6.227
  481    HD1  TYR  60           1HD      TYR  60   2.858  -8.732   6.356
  482    HD2  TYR  60           2HD      TYR  60   0.251  -6.584   9.023
  483    HE1  TYR  60           1HE      TYR  60   4.546  -8.911   8.159
  484    HE2  TYR  60           2HE      TYR  60   1.920  -6.762  10.815
  485    HH   TYR  60           HH       TYR  60   3.964  -7.278  11.301
  486    H    GLY  61           H        GLY  61  -3.284  -9.314   6.570
  487   1HA   GLY  61          2HA       GLY  61  -4.349  -7.954   4.276
  488   2HA   GLY  61          1HA       GLY  61  -5.254  -8.847   5.457
  489    H    ARG  62           H        ARG  62  -4.031  -6.914   7.591
  490    HA   ARG  62           HA       ARG  62  -6.038  -4.730   7.259
  491   1HB   ARG  62          2HB       ARG  62  -4.391  -5.665   9.613
  492   2HB   ARG  62          1HB       ARG  62  -5.616  -4.383   9.625
  493   1HG   ARG  62          2HG       ARG  62  -7.355  -5.854   9.522
  494   2HG   ARG  62          1HG       ARG  62  -6.470  -6.988   8.466
  495   1HD   ARG  62          2HD       ARG  62  -4.971  -7.197  10.699
  496   2HD   ARG  62          1HD       ARG  62  -6.550  -6.796  11.440
  497    HE   ARG  62           HE       ARG  62  -6.990  -8.739   9.455
  498   1HH1  ARG  62          2HH2      ARG  62  -5.369  -8.603  12.561
  499   2HH1  ARG  62          1HH2      ARG  62  -5.595 -10.289  12.898
  500   1HH2  ARG  62          1HH1      ARG  62  -7.252 -10.965   9.920
  501   2HH2  ARG  62          2HH1      ARG  62  -6.657 -11.593  11.416
  502    H    ASP  63           H        ASP  63  -2.912  -5.081   6.241
  503    HA   ASP  63           HA       ASP  63  -1.763  -2.630   7.329
  504   1HB   ASP  63          2HB       ASP  63  -0.586  -4.815   6.820
  505   2HB   ASP  63          1HB       ASP  63  -0.672  -4.322   5.115
  506    H    LEU  64           H        LEU  64  -0.649  -2.166   4.374
  507    HA   LEU  64           HA       LEU  64  -1.986  -0.044   3.380
  508   1HB   LEU  64          2HB       LEU  64  -0.938  -0.384   1.408
  509   2HB   LEU  64          1HB       LEU  64   0.122  -1.128   2.645
  510    HG   LEU  64           HG       LEU  64  -1.501  -3.239   1.749
  511   1HD1  LEU  64          1HD1      LEU  64  -1.363  -3.183  -0.653
  512   2HD1  LEU  64          2HD1      LEU  64  -2.395  -1.884  -0.007
  513   3HD1  LEU  64          3HD1      LEU  64  -0.754  -1.511  -0.591
  514   1HD2  LEU  64          1HD2      LEU  64   0.561  -4.059   0.734
  515   2HD2  LEU  64          2HD2      LEU  64   1.287  -2.438   0.851
  516   3HD2  LEU  64          3HD2      LEU  64   0.893  -3.346   2.330
  517    H    MET  65           H        MET  65  -3.044  -3.398   2.819
  518    HA   MET  65           HA       MET  65  -5.167  -3.169   1.090
  519   1HB   MET  65          2HB       MET  65  -4.262  -5.249   2.116
  520   2HB   MET  65          1HB       MET  65  -5.058  -4.827   3.628
  521   1HG   MET  65          2HG       MET  65  -7.289  -4.836   2.410
  522   2HG   MET  65          1HG       MET  65  -6.484  -5.330   0.958
  523   1HE   MET  65          1HE       MET  65  -8.592  -8.078   3.309
  524   2HE   MET  65          2HE       MET  65  -8.466  -6.369   3.787
  525   3HE   MET  65          3HE       MET  65  -8.896  -6.795   2.115
  526    H    GLU  66           H        GLU  66  -5.414  -2.671   4.698
  527    HA   GLU  66           HA       GLU  66  -8.085  -1.491   4.347
  528   1HB   GLU  66          2HB       GLU  66  -6.590  -2.355   6.804
  529   2HB   GLU  66          1HB       GLU  66  -8.002  -1.321   6.881
  530   1HG   GLU  66          2HG       GLU  66  -9.193  -3.146   5.428
  531   2HG   GLU  66          1HG       GLU  66  -7.847  -4.172   5.837
  532    H    ALA  67           H        ALA  67  -4.734  -0.505   4.874
  533    HA   ALA  67           HA       ALA  67  -5.064   2.112   5.991
  534   1HB   ALA  67          1HB       ALA  67  -2.859   2.496   5.055
  535   2HB   ALA  67          2HB       ALA  67  -2.929   0.914   5.863
  536   3HB   ALA  67          3HB       ALA  67  -2.986   1.009   4.087
  537    H    GLN  68           H        GLN  68  -5.412   0.846   2.695
  538    HA   GLN  68           HA       GLN  68  -6.165   3.547   1.788
  539   1HB   GLN  68          2HB       GLN  68  -4.390   2.352   0.648
  540   2HB   GLN  68          1HB       GLN  68  -5.581   1.079   0.200
  541   1HG   GLN  68          2HG       GLN  68  -6.735   2.544  -1.303
  542   2HG   GLN  68          1HG       GLN  68  -6.358   3.964  -0.376
  543   1HE2  GLN  68          2HE2      GLN  68  -5.875   5.054  -2.108
  544   2HE2  GLN  68          1HE2      GLN  68  -4.412   4.795  -3.024
  545    H    GLU  69           H        GLU  69  -7.518   0.119   1.715
  546    HA   GLU  69           HA       GLU  69  -9.952   0.466   0.531
  547   1HB   GLU  69          2HB       GLU  69  -9.040  -1.627   1.610
  548   2HB   GLU  69          1HB       GLU  69  -9.607  -1.015   3.143
  549   1HG   GLU  69          2HG       GLU  69 -11.926  -1.049   2.385
  550   2HG   GLU  69          1HG       GLU  69 -11.461  -1.354   0.742
  551    H    TRP  70           H        TRP  70  -9.037   1.918   3.632
  552    HA   TRP  70           HA       TRP  70 -11.730   2.946   4.187
  553   1HB   TRP  70          2HB       TRP  70  -9.036   3.281   5.541
  554   2HB   TRP  70          1HB       TRP  70 -10.505   4.069   6.066
  555    HD1  TRP  70           HD       TRP  70  -8.590   1.399   7.137
  556    HE1  TRP  70           1HE      TRP  70  -9.891  -0.551   8.106
  557    HE3  TRP  70           3HE      TRP  70 -13.109   2.475   5.166
  558    HZ2  TRP  70           2HZ      TRP  70 -12.563  -1.481   8.060
  559    HZ3  TRP  70           3HZ      TRP  70 -15.114   1.280   5.988
  560    HH2  TRP  70           HH       TRP  70 -14.833  -0.755   7.375
  561    H    CYS  71           H        CYS  71 -11.034   3.604   1.577
  562    HA   CYS  71           HA       CYS  71  -9.780   6.243   1.429
  563   1HB   CYS  71          2HB       CYS  71  -9.440   4.730  -0.429
  564   2HB   CYS  71          1HB       CYS  71 -11.168   4.699  -0.753
  565    HG   CYS  71           HG       CYS  71 -10.034   6.195  -2.518
  566    H    ARG  72           H        ARG  72 -13.071   5.140   0.317
  567    HA   ARG  72           HA       ARG  72 -14.502   7.486   0.404
  568   1HB   ARG  72          2HB       ARG  72 -15.070   4.679   0.428
  569   2HB   ARG  72          1HB       ARG  72 -16.102   5.461   1.620
  570   1HG   ARG  72          2HG       ARG  72 -16.195   7.228  -0.488
  571   2HG   ARG  72          1HG       ARG  72 -16.121   5.627  -1.289
  572   1HD   ARG  72          2HD       ARG  72 -17.908   4.965   0.578
  573   2HD   ARG  72          1HD       ARG  72 -18.207   6.706   0.639
  574    HE   ARG  72           HE       ARG  72 -18.202   5.904  -2.054
  575   1HH1  ARG  72          2HH2      ARG  72 -20.208   5.565   0.808
  576   2HH1  ARG  72          1HH2      ARG  72 -21.658   5.243  -0.088
  577   1HH2  ARG  72          1HH1      ARG  72 -20.136   5.460  -3.202
  578   2HH2  ARG  72          2HH1      ARG  72 -21.603   5.200  -2.323
  579    H    LYS  73           H        LYS  73 -13.459   5.626   3.243
  580    HA   LYS  73           HA       LYS  73 -14.761   7.309   5.251
  581   1HB   LYS  73          2HB       LYS  73 -12.907   5.011   5.313
  582   2HB   LYS  73          1HB       LYS  73 -12.980   6.112   6.682
  583   1HG   LYS  73          2HG       LYS  73 -15.662   5.543   5.774
  584   2HG   LYS  73          1HG       LYS  73 -14.765   4.030   6.039
  585   1HD   LYS  73          2HD       LYS  73 -14.037   4.979   8.308
  586   2HD   LYS  73          1HD       LYS  73 -15.154   6.313   8.043
  587   1HE   LYS  73          2HE       LYS  73 -17.032   4.680   7.851
  588   2HE   LYS  73          1HE       LYS  73 -15.898   3.366   8.179
  589   1HZ   LYS  73          1HZ       LYS  73 -16.942   4.025  10.150
  590   2HZ   LYS  73          2HZ       LYS  73 -15.379   4.489  10.251
  591   3HZ   LYS  73          3HZ       LYS  73 -16.538   5.593   9.945
  592    H    TYR  74           H        TYR  74 -11.301   6.910   4.296
  593    HA   TYR  74           HA       TYR  74 -10.270   9.123   5.708
  594   1HB   TYR  74          2HB       TYR  74  -8.683   7.733   4.930
  595   2HB   TYR  74          1HB       TYR  74  -9.492   7.509   3.344
  596    HD1  TYR  74           1HD      TYR  74  -9.011   8.881   1.493
  597    HD2  TYR  74           2HD      TYR  74  -7.414   9.835   5.355
  598    HE1  TYR  74           1HE      TYR  74  -7.596  10.627   0.458
  599    HE2  TYR  74           2HE      TYR  74  -6.049  11.632   4.347
  600    HH   TYR  74           HH       TYR  74  -5.222  12.412   2.447
  601    H    MET  75           H        MET  75 -12.119   9.162   2.735
  602    HA   MET  75           HA       MET  75 -11.560  11.583   1.570
  603   1HB   MET  75          2HB       MET  75 -13.781   9.646   1.648
  604   2HB   MET  75          1HB       MET  75 -14.277  11.290   1.233
  605   1HG   MET  75          2HG       MET  75 -11.840  10.106  -0.137
  606   2HG   MET  75          1HG       MET  75 -13.433   9.659  -0.687
  607   1HE   MET  75          1HE       MET  75 -14.568  12.352  -2.840
  608   2HE   MET  75          2HE       MET  75 -14.130  10.631  -2.728
  609   3HE   MET  75          3HE       MET  75 -15.233  11.347  -1.530
  610    H    LYS  76           H        LYS  76 -13.223  11.058   4.583
  611    HA   LYS  76           HA       LYS  76 -13.100  13.553   5.657
  612   1HB   LYS  76          2HB       LYS  76 -15.344  13.555   3.853
  613   2HB   LYS  76          1HB       LYS  76 -15.724  14.039   5.531
  614   1HG   LYS  76          2HG       LYS  76 -14.474  16.019   5.310
  615   2HG   LYS  76          1HG       LYS  76 -13.134  15.186   4.592
  616   1HD   LYS  76          2HD       LYS  76 -14.912  15.132   2.540
  617   2HD   LYS  76          1HD       LYS  76 -15.313  16.666   3.366
  618   1HE   LYS  76          2HE       LYS  76 -12.771  17.184   3.377
  619   2HE   LYS  76          1HE       LYS  76 -12.536  15.800   2.343
  620   1HZ   LYS  76          1HZ       LYS  76 -12.664  17.730   1.125
  621   2HZ   LYS  76          2HZ       LYS  76 -13.985  16.838   0.765
  622   3HZ   LYS  76          3HZ       LYS  76 -14.118  18.137   1.752
  623    H    SER  77           H        SER  77 -15.045  10.608   5.412
  624    HA   SER  77           HA       SER  77 -16.377  10.550   7.948
  625   1HB   SER  77          2HB       SER  77 -16.589   9.155   5.704
  626   2HB   SER  77          1HB       SER  77 -15.406   8.116   6.486
  627    HG   SER  77           HG       SER  77 -17.601   7.521   6.930
  628    H    GLY  78           H        GLY  78 -13.125   9.251   6.984
  629   1HA   GLY  78          2HA       GLY  78 -12.430   8.721   9.832
  630   2HA   GLY  78          1HA       GLY  78 -11.530   8.232   8.426
  631    H    ASN  79           H        ASN  79 -11.958  11.182   7.379
  632    HA   ASN  79           HA       ASN  79 -10.489  12.945   7.096
  633   1HB   ASN  79          2HB       ASN  79 -11.258  12.832   9.942
  634   2HB   ASN  79          1HB       ASN  79  -9.800  13.721   9.641
  635   1HD2  ASN  79          2HD2      ASN  79 -10.932  15.566  10.336
  636   2HD2  ASN  79          1HD2      ASN  79 -11.933  16.374   9.164
  637    H    VAL  80           H        VAL  80  -8.227  13.896   7.848
  638    HA   VAL  80           HA       VAL  80  -6.014  12.296   7.557
  639    HB   VAL  80           HB       VAL  80  -6.299  14.719   9.259
  640   1HG1  VAL  80          1HG1      VAL  80  -3.861  14.947   9.051
  641   2HG1  VAL  80          2HG1      VAL  80  -4.289  13.482   9.964
  642   3HG1  VAL  80          3HG1      VAL  80  -3.769  13.351   8.268
  643   1HG2  VAL  80          1HG2      VAL  80  -5.226  15.756   7.260
  644   2HG2  VAL  80          2HG2      VAL  80  -5.250  14.178   6.436
  645   3HG2  VAL  80          3HG2      VAL  80  -6.778  14.996   6.839
  646    H    LYS  81           H        LYS  81  -8.143  12.305  10.419
  647    HA   LYS  81           HA       LYS  81  -6.417  11.096  12.293
  648   1HB   LYS  81          2HB       LYS  81  -9.111  11.940  12.227
  649   2HB   LYS  81          1HB       LYS  81  -9.133  10.248  12.671
  650   1HG   LYS  81          2HG       LYS  81  -7.558  12.459  14.053
  651   2HG   LYS  81          1HG       LYS  81  -8.910  11.548  14.695
  652   1HD   LYS  81          2HD       LYS  81  -7.309   9.436  14.309
  653   2HD   LYS  81          1HD       LYS  81  -6.048  10.624  14.307
  654   1HE   LYS  81          2HE       LYS  81  -7.884  11.023  16.559
  655   2HE   LYS  81          1HE       LYS  81  -7.156   9.435  16.533
  656   1HZ   LYS  81          1HZ       LYS  81  -5.830  10.871  17.670
  657   2HZ   LYS  81          2HZ       LYS  81  -5.038  10.533  16.281
  658   3HZ   LYS  81          3HZ       LYS  81  -5.779  11.983  16.474
  659    H    ASP  82           H        ASP  82  -8.132   9.735   9.516
  660    HA   ASP  82           HA       ASP  82  -7.385   6.939  10.160
  661   1HB   ASP  82          2HB       ASP  82  -9.200   8.325   8.304
  662   2HB   ASP  82          1HB       ASP  82  -8.245   7.086   7.520
  663    H    LEU  83           H        LEU  83  -6.404   9.535   7.858
  664    HA   LEU  83           HA       LEU  83  -4.482   8.043   6.372
  665   1HB   LEU  83          2HB       LEU  83  -5.594  10.298   5.981
  666   2HB   LEU  83          1HB       LEU  83  -4.262  10.935   6.998
  667    HG   LEU  83           HG       LEU  83  -3.798  10.998   4.479
  668   1HD1  LEU  83          1HD1      LEU  83  -1.556  10.280   4.657
  669   2HD1  LEU  83          2HD1      LEU  83  -2.068  11.222   6.078
  670   3HD1  LEU  83          3HD1      LEU  83  -1.914   9.453   6.191
  671   1HD2  LEU  83          1HD2      LEU  83  -3.162   8.954   3.376
  672   2HD2  LEU  83          2HD2      LEU  83  -3.642   7.995   4.797
  673   3HD2  LEU  83          3HD2      LEU  83  -4.873   8.876   3.860
  674    H    THR  84           H        THR  84  -4.057   9.928   9.407
  675    HA   THR  84           HA       THR  84  -1.269   9.641   9.794
  676    HB   THR  84           HB       THR  84  -2.462  11.130  11.089
  677    HG1  THR  84           1HG      THR  84  -1.801  10.170  13.262
  678   1HG2  THR  84          1HG2      THR  84  -3.936  10.492  12.933
  679   2HG2  THR  84          2HG2      THR  84  -4.637  10.033  11.363
  680   3HG2  THR  84          3HG2      THR  84  -3.888   8.795  12.398
  681    H    GLN  85           H        GLN  85  -3.869   7.272  10.236
  682    HA   GLN  85           HA       GLN  85  -2.147   5.274  11.478
  683   1HB   GLN  85          2HB       GLN  85  -5.018   5.622  10.930
  684   2HB   GLN  85          1HB       GLN  85  -4.386   3.952  10.878
  685   1HG   GLN  85          2HG       GLN  85  -3.719   4.002  13.143
  686   2HG   GLN  85          1HG       GLN  85  -3.521   5.754  13.156
  687   1HE2  GLN  85          2HE2      GLN  85  -5.689   3.121  13.847
  688   2HE2  GLN  85          1HE2      GLN  85  -7.021   4.170  14.273
  689    H    ALA  86           H        ALA  86  -3.556   5.954   8.250
  690    HA   ALA  86           HA       ALA  86  -2.860   3.553   6.911
  691   1HB   ALA  86          1HB       ALA  86  -3.019   4.913   4.904
  692   2HB   ALA  86          2HB       ALA  86  -4.376   5.231   6.013
  693   3HB   ALA  86          3HB       ALA  86  -3.033   6.393   5.893
  694    H    TRP  87           H        TRP  87  -0.985   6.593   7.469
  695    HA   TRP  87           HA       TRP  87   1.465   5.850   6.234
  696   1HB   TRP  87          2HB       TRP  87   1.547   7.995   6.773
  697   2HB   TRP  87          1HB       TRP  87   0.479   7.794   8.202
  698    HD1  TRP  87           HD       TRP  87   1.580   8.099  10.422
  699    HE1  TRP  87           1HE      TRP  87   3.938   8.265  11.312
  700    HE3  TRP  87           3HE      TRP  87   4.045   7.198   6.137
  701    HZ2  TRP  87           2HZ      TRP  87   6.553   8.016  10.299
  702    HZ3  TRP  87           3HZ      TRP  87   6.508   6.841   6.174
  703    HH2  TRP  87           HH       TRP  87   7.769   7.327   8.253
  704    H    ASP  88           H        ASP  88   0.052   5.016   9.419
  705    HA   ASP  88           HA       ASP  88   2.484   3.998  10.571
  706   1HB   ASP  88          2HB       ASP  88   0.276   4.776  11.809
  707   2HB   ASP  88          1HB       ASP  88  -0.276   3.166  11.503
  708    H    LEU  89           H        LEU  89  -0.313   2.596   8.687
  709    HA   LEU  89           HA       LEU  89   0.564  -0.175   8.870
  710   1HB   LEU  89          2HB       LEU  89  -1.410   1.212   7.059
  711   2HB   LEU  89          1HB       LEU  89  -1.099  -0.510   7.082
  712    HG   LEU  89           HG       LEU  89  -1.956   1.041   9.556
  713   1HD1  LEU  89          1HD1      LEU  89  -4.175   0.143   9.149
  714   2HD1  LEU  89          2HD1      LEU  89  -3.672   1.217   7.824
  715   3HD1  LEU  89          3HD1      LEU  89  -3.632  -0.548   7.601
  716   1HD2  LEU  89          1HD2      LEU  89  -2.548  -1.179  10.386
  717   2HD2  LEU  89          2HD2      LEU  89  -1.942  -1.922   8.886
  718   3HD2  LEU  89          3HD2      LEU  89  -0.814  -1.103   9.992
  719    H    TYR  90           H        TYR  90   0.866   2.386   6.422
  720    HA   TYR  90           HA       TYR  90   2.467   0.979   4.454
  721   1HB   TYR  90          2HB       TYR  90   2.452   3.961   5.110
  722   2HB   TYR  90          1HB       TYR  90   3.055   3.240   3.659
  723    HD1  TYR  90           1HD      TYR  90   0.744   1.146   3.288
  724    HD2  TYR  90           2HD      TYR  90   0.864   5.314   4.316
  725    HE1  TYR  90           1HE      TYR  90  -1.457   1.491   2.239
  726    HE2  TYR  90           2HE      TYR  90  -1.328   5.652   3.223
  727    HH   TYR  90           HH       TYR  90  -3.174   4.599   2.389
  728    H    TYR  91           H        TYR  91   3.490   3.027   7.179
  729    HA   TYR  91           HA       TYR  91   6.330   2.585   6.777
  730   1HB   TYR  91          2HB       TYR  91   5.163   4.593   7.920
  731   2HB   TYR  91          1HB       TYR  91   4.912   3.575   9.308
  732    HD1  TYR  91           1HD      TYR  91   6.261   4.163  10.980
  733    HD2  TYR  91           2HD      TYR  91   7.808   4.129   6.975
  734    HE1  TYR  91           1HE      TYR  91   8.448   4.960  11.820
  735    HE2  TYR  91           2HE      TYR  91   9.980   4.942   7.792
  736    HH   TYR  91           HH       TYR  91  11.246   5.272   9.585
  737    H    HIS  92           H        HIS  92   3.936   1.136   9.050
  738    HA   HIS  92           HA       HIS  92   5.671  -0.460  10.585
  739   1HB   HIS  92          2HB       HIS  92   3.190  -0.013  11.096
  740   2HB   HIS  92          1HB       HIS  92   2.747  -1.037   9.775
  741    HD1  HIS  92           1HD      HIS  92   5.256  -1.720  12.575
  742    HD2  HIS  92           2HD      HIS  92   1.849  -3.154  10.716
  743    HE1  HIS  92           1HE      HIS  92   4.820  -4.041  13.583
  744    H    VAL  93           H        VAL  93   3.968  -1.032   7.484
  745    HA   VAL  93           HA       VAL  93   4.982  -3.743   7.152
  746    HB   VAL  93           HB       VAL  93   2.793  -2.737   6.328
  747   1HG1  VAL  93          1HG1      VAL  93   2.763  -2.228   3.939
  748   2HG1  VAL  93          2HG1      VAL  93   3.621  -0.965   4.854
  749   3HG1  VAL  93          3HG1      VAL  93   4.542  -2.165   3.916
  750   1HG2  VAL  93          1HG2      VAL  93   2.708  -4.536   4.729
  751   2HG2  VAL  93          2HG2      VAL  93   4.464  -4.754   4.914
  752   3HG2  VAL  93          3HG2      VAL  93   3.387  -4.981   6.312
  753    H    PHE  94           H        PHE  94   5.805  -0.438   5.868
  754    HA   PHE  94           HA       PHE  94   7.734  -0.778   4.055
  755   1HB   PHE  94          2HB       PHE  94   6.962   1.402   5.136
  756   2HB   PHE  94          1HB       PHE  94   8.062   1.093   6.432
  757    HD1  PHE  94           1HD      PHE  94  10.289   1.694   6.305
  758    HD2  PHE  94           2HD      PHE  94   7.880   1.394   2.759
  759    HE1  PHE  94           1HE      PHE  94  12.082   2.808   4.989
  760    HE2  PHE  94           2HE      PHE  94   9.664   2.510   1.445
  761    HZ   PHE  94           HZ       PHE  94  11.763   3.220   2.577
  762    H    ARG  95           H        ARG  95   8.271  -1.543   7.511
  763    HA   ARG  95           HA       ARG  95  10.961  -2.497   7.020
  764   1HB   ARG  95          2HB       ARG  95   9.227  -1.852   9.238
  765   2HB   ARG  95          1HB       ARG  95  10.042  -3.419   9.494
  766   1HG   ARG  95          2HG       ARG  95  12.184  -2.481   9.306
  767   2HG   ARG  95          1HG       ARG  95  11.576  -1.034   8.451
  768   1HD   ARG  95          2HD       ARG  95  11.300   0.058  10.432
  769   2HD   ARG  95          1HD       ARG  95  10.282  -1.252  11.044
  770    HE   ARG  95           HE       ARG  95  12.913  -2.156  11.184
  771   1HH1  ARG  95          2HH2      ARG  95  11.034   0.443  12.596
  772   2HH1  ARG  95          1HH2      ARG  95  11.933   0.480  14.077
  773   1HH2  ARG  95          1HH1      ARG  95  14.100  -2.081  13.152
  774   2HH2  ARG  95          2HH1      ARG  95  13.652  -0.934  14.370
  775    H    ARG  96           H        ARG  96   7.782  -4.063   7.405
  776    HA   ARG  96           HA       ARG  96   8.682  -6.816   7.656
  777   1HB   ARG  96          2HB       ARG  96   5.979  -5.598   6.930
  778   2HB   ARG  96          1HB       ARG  96   6.267  -7.287   7.235
  779   1HG   ARG  96          2HG       ARG  96   6.745  -5.071   9.248
  780   2HG   ARG  96          1HG       ARG  96   5.339  -6.129   9.178
  781   1HD   ARG  96          2HD       ARG  96   6.842  -8.090   9.450
  782   2HD   ARG  96          1HD       ARG  96   8.212  -6.952   9.647
  783    HE   ARG  96           HE       ARG  96   6.032  -7.494  11.507
  784   1HH1  ARG  96          2HH2      ARG  96   8.535  -5.201  10.692
  785   2HH1  ARG  96          1HH2      ARG  96   8.578  -4.443  12.252
  786   1HH2  ARG  96          1HH1      ARG  96   6.072  -6.482  13.579
  787   2HH2  ARG  96          2HH1      ARG  96   7.183  -5.187  13.872
  788    H    ILE  97           H        ILE  97   6.958  -5.099   5.020
  789    HA   ILE  97           HA       ILE  97   7.590  -6.998   2.902
  790    HB   ILE  97           HB       ILE  97   6.744  -5.313   1.407
  791   1HG1  ILE  97          2HG1      ILE  97   5.536  -3.555   3.391
  792   2HG1  ILE  97          1HG1      ILE  97   7.267  -3.426   3.426
  793   1HG2  ILE  97          1HG2      ILE  97   4.429  -5.464   2.215
  794   2HG2  ILE  97          2HG2      ILE  97   5.282  -7.008   2.450
  795   3HG2  ILE  97          3HG2      ILE  97   5.012  -5.919   3.833
  796   1HD1  ILE  97          1HD1      ILE  97   6.310  -1.855   1.908
  797   2HD1  ILE  97          2HD1      ILE  97   7.308  -3.029   1.018
  798   3HD1  ILE  97          3HD1      ILE  97   5.533  -3.162   0.982
  799    H    SER  98           H        SER  98   9.460  -4.463   4.457
  800    HA   SER  98           HA       SER  98  11.143  -3.562   2.415
  801   1HB   SER  98          2HB       SER  98  11.139  -3.265   5.176
  802   2HB   SER  98          1HB       SER  98  12.570  -4.261   4.908
  803    HG   SER  98           HG       SER  98  12.517  -1.736   4.718
  804    H    LYS  99           H        LYS  99  11.762  -6.336   4.661
  805    HA   LYS  99           HA       LYS  99  12.873  -8.091   2.639
  806   1HB   LYS  99          2HB       LYS  99  14.777  -6.338   3.982
  807   2HB   LYS  99          1HB       LYS  99  15.153  -8.082   3.845
  808   1HG   LYS  99          2HG       LYS  99  14.387  -7.882   1.408
  809   2HG   LYS  99          1HG       LYS  99  14.491  -6.103   1.649
  810   1HD   LYS  99          2HD       LYS  99  16.779  -6.193   1.967
  811   2HD   LYS  99          1HD       LYS  99  16.752  -8.012   2.014
  812   1HE   LYS  99          2HE       LYS  99  16.271  -8.172  -0.326
  813   2HE   LYS  99          1HE       LYS  99  15.532  -6.566  -0.374
  814   1HZ   LYS  99          1HZ       LYS  99  17.615  -6.658  -1.482
  815   2HZ   LYS  99          2HZ       LYS  99  17.657  -5.625  -0.217
  816   3HZ   LYS  99          3HZ       LYS  99  18.383  -7.087  -0.096
  817    H    GLN 100           H        GLN 100  10.816  -8.445   4.535
  818    HA   GLN 100           HA       GLN 100  11.325  -9.694   6.923
  819   1HB   GLN 100          2HB       GLN 100   9.172  -9.326   6.071
  820   2HB   GLN 100          1HB       GLN 100   9.446 -10.525   4.760
  821   1HG   GLN 100          2HG       GLN 100   9.716 -11.502   7.577
  822   2HG   GLN 100          1HG       GLN 100   8.092 -11.123   7.013
  823   1HE2  GLN 100          2HE2      GLN 100  10.522 -13.531   7.070
  824   2HE2  GLN 100          1HE2      GLN 100   9.814 -14.507   5.817
  Start of MODEL    3
    1   1H    GLU   1          1H        GLU   1   3.438  -9.786 -17.440
    2   2H    GLU   1          2H        GLU   1   2.021  -9.048 -17.963
    3    HA   GLU   1           HA       GLU   1   1.283  -9.910 -15.480
    4   1HB   GLU   1          2HB       GLU   1   0.714 -10.462 -18.236
    5   2HB   GLU   1          1HB       GLU   1   0.622 -11.939 -17.226
    6   1HG   GLU   1          2HG       GLU   1  -1.575 -11.036 -17.153
    7   2HG   GLU   1          1HG       GLU   1  -0.853 -10.509 -15.634
    8    H    LEU   2           H        LEU   2   3.809 -10.242 -14.857
    9    HA   LEU   2           HA       LEU   2   5.527 -11.720 -14.208
   10   1HB   LEU   2          2HB       LEU   2   4.726 -13.449 -12.762
   11   2HB   LEU   2          1HB       LEU   2   4.122 -11.796 -12.418
   12    HG   LEU   2           HG       LEU   2   2.198 -13.113 -14.086
   13   1HD1  LEU   2          1HD1      LEU   2   1.567 -15.009 -12.749
   14   2HD1  LEU   2          2HD1      LEU   2   3.168 -15.217 -13.498
   15   3HD1  LEU   2          3HD1      LEU   2   3.040 -14.823 -11.768
   16   1HD2  LEU   2          1HD2      LEU   2   0.753 -12.737 -12.136
   17   2HD2  LEU   2          2HD2      LEU   2   2.181 -12.412 -11.125
   18   3HD2  LEU   2          3HD2      LEU   2   1.762 -11.307 -12.456
   19    H    ILE   3           H        ILE   3   5.925 -12.021 -16.645
   20    HA   ILE   3           HA       ILE   3   5.061 -14.433 -17.972
   21    HB   ILE   3           HB       ILE   3   6.679 -13.869 -19.659
   22   1HG1  ILE   3          2HG1      ILE   3   7.316 -11.213 -18.606
   23   2HG1  ILE   3          1HG1      ILE   3   8.155 -12.545 -17.823
   24   1HG2  ILE   3          1HG2      ILE   3   5.484 -11.825 -20.368
   25   2HG2  ILE   3          2HG2      ILE   3   4.350 -13.015 -19.689
   26   3HG2  ILE   3          3HG2      ILE   3   4.854 -11.611 -18.718
   27   1HD1  ILE   3          1HD1      ILE   3   9.409 -11.723 -19.743
   28   2HD1  ILE   3          2HD1      ILE   3   8.876 -13.398 -20.022
   29   3HD1  ILE   3          3HD1      ILE   3   8.026 -12.049 -20.814
   30    H    ARG   4           H        ARG   4   7.882 -13.545 -16.110
   31    HA   ARG   4           HA       ARG   4   8.638 -16.247 -15.336
   32   1HB   ARG   4          2HB       ARG   4  10.849 -16.263 -16.349
   33   2HB   ARG   4          1HB       ARG   4   9.614 -16.254 -17.598
   34   1HG   ARG   4          2HG       ARG   4   9.889 -13.799 -17.815
   35   2HG   ARG   4          1HG       ARG   4  11.229 -13.892 -16.627
   36   1HD   ARG   4          2HD       ARG   4  12.503 -15.232 -18.066
   37   2HD   ARG   4          1HD       ARG   4  11.118 -15.357 -19.234
   38    HE   ARG   4           HE       ARG   4  11.910 -12.628 -18.513
   39   1HH1  ARG   4          2HH2      ARG   4  12.429 -15.171 -20.826
   40   2HH1  ARG   4          1HH2      ARG   4  13.047 -14.133 -22.069
   41   1HH2  ARG   4          1HH1      ARG   4  12.702 -11.224 -20.168
   42   2HH2  ARG   4          2HH1      ARG   4  13.184 -11.916 -21.678
   43    H    VAL   5           H        VAL   5   9.869 -12.868 -15.697
   44    HA   VAL   5           HA       VAL   5  11.538 -12.635 -13.527
   45    HB   VAL   5           HB       VAL   5  11.411 -11.029 -15.249
   46   1HG1  VAL   5          1HG1      VAL   5   9.683  -9.285 -15.328
   47   2HG1  VAL   5          2HG1      VAL   5   8.992 -10.886 -15.680
   48   3HG1  VAL   5          3HG1      VAL   5   8.745 -10.143 -14.083
   49   1HG2  VAL   5          1HG2      VAL   5  11.606  -9.014 -13.930
   50   2HG2  VAL   5          2HG2      VAL   5  10.911  -9.868 -12.531
   51   3HG2  VAL   5          3HG2      VAL   5  12.460 -10.405 -13.220
   52    H    ALA   6           H        ALA   6   8.056 -12.524 -13.570
   53    HA   ALA   6           HA       ALA   6   6.440 -12.778 -12.060
   54   1HB   ALA   6          1HB       ALA   6   6.889 -13.471  -9.767
   55   2HB   ALA   6          2HB       ALA   6   7.692 -14.486 -10.988
   56   3HB   ALA   6          3HB       ALA   6   8.633 -13.288 -10.068
   57    H    ILE   7           H        ILE   7   6.568 -10.460 -12.936
   58    HA   ILE   7           HA       ILE   7   7.317  -8.160 -11.880
   59    HB   ILE   7           HB       ILE   7   5.857  -8.445 -13.818
   60   1HG1  ILE   7          2HG1      ILE   7   6.714  -6.412 -13.149
   61   2HG1  ILE   7          1HG1      ILE   7   5.052  -6.294 -13.848
   62   1HG2  ILE   7          1HG2      ILE   7   3.448  -8.056 -13.584
   63   2HG2  ILE   7          2HG2      ILE   7   3.915  -9.623 -12.880
   64   3HG2  ILE   7          3HG2      ILE   7   3.578  -8.234 -11.819
   65   1HD1  ILE   7          1HD1      ILE   7   5.419  -4.643 -12.105
   66   2HD1  ILE   7          2HD1      ILE   7   4.167  -5.815 -11.631
   67   3HD1  ILE   7          3HD1      ILE   7   5.803  -5.932 -10.940
   68    H    LEU   8           H        LEU   8   4.551 -10.039 -10.559
   69    HA   LEU   8           HA       LEU   8   3.531 -10.090  -8.500
   70   1HB   LEU   8          2HB       LEU   8   6.374  -9.628  -8.006
   71   2HB   LEU   8          1HB       LEU   8   5.265  -9.171  -6.669
   72    HG   LEU   8           HG       LEU   8   6.201 -11.450  -6.480
   73   1HD1  LEU   8          1HD1      LEU   8   4.009 -12.459  -5.936
   74   2HD1  LEU   8          2HD1      LEU   8   4.122 -10.763  -5.407
   75   3HD1  LEU   8          3HD1      LEU   8   3.204 -11.178  -6.875
   76   1HD2  LEU   8          1HD2      LEU   8   5.307 -13.265  -7.863
   77   2HD2  LEU   8          2HD2      LEU   8   4.489 -12.079  -8.908
   78   3HD2  LEU   8          3HD2      LEU   8   6.267 -12.129  -8.840
   79    H    TRP   9           H        TRP   9   2.783  -8.779  -6.626
   80    HA   TRP   9           HA       TRP   9   2.409  -5.905  -7.451
   81   1HB   TRP   9          2HB       TRP   9   0.703  -7.607  -5.790
   82   2HB   TRP   9          1HB       TRP   9   0.617  -5.818  -5.912
   83    HD1  TRP   9           HD       TRP   9   1.325  -6.180  -9.256
   84    HE1  TRP   9           1HE      TRP   9  -0.815  -6.123 -10.608
   85    HE3  TRP   9           3HE      TRP   9  -1.946  -7.311  -5.622
   86    HZ2  TRP   9           2HZ      TRP   9  -3.544  -6.602 -10.169
   87    HZ3  TRP   9           3HZ      TRP   9  -4.276  -7.913  -6.160
   88    HH2  TRP   9           HH       TRP   9  -5.105  -7.455  -8.462
   89    H    HIS  10           H        HIS  10   3.517  -7.982  -4.764
   90    HA   HIS  10           HA       HIS  10   4.308  -6.109  -2.854
   91   1HB   HIS  10          2HB       HIS  10   4.494  -8.225  -2.191
   92   2HB   HIS  10          1HB       HIS  10   4.954  -8.815  -3.829
   93    HD1  HIS  10           1HD      HIS  10   6.394  -8.319  -0.500
   94    HD2  HIS  10           2HD      HIS  10   7.628  -8.316  -4.469
   95    HE1  HIS  10           1HE      HIS  10   8.987  -8.386  -0.489
   96    H    GLU  11           H        GLU  11   5.867  -6.856  -5.993
   97    HA   GLU  11           HA       GLU  11   8.437  -5.699  -5.414
   98   1HB   GLU  11          2HB       GLU  11   7.071  -6.293  -8.078
   99   2HB   GLU  11          1HB       GLU  11   8.737  -5.834  -7.890
  100   1HG   GLU  11          2HG       GLU  11   7.642  -8.298  -6.478
  101   2HG   GLU  11          1HG       GLU  11   8.235  -8.348  -8.103
  102    H    MET  12           H        MET  12   5.534  -4.516  -7.193
  103    HA   MET  12           HA       MET  12   6.522  -1.873  -7.685
  104   1HB   MET  12          2HB       MET  12   4.445  -1.479  -8.669
  105   2HB   MET  12          1HB       MET  12   4.572  -3.191  -8.870
  106   1HG   MET  12          2HG       MET  12   3.377  -3.147  -6.484
  107   2HG   MET  12          1HG       MET  12   2.797  -1.600  -7.193
  108   1HE   MET  12          1HE       MET  12  -0.294  -3.803  -7.515
  109   2HE   MET  12          2HE       MET  12   0.903  -3.768  -6.200
  110   3HE   MET  12          3HE       MET  12   0.402  -2.253  -6.987
  111    H    TRP  13           H        TRP  13   5.048  -3.493  -4.848
  112    HA   TRP  13           HA       TRP  13   4.200  -1.206  -3.436
  113   1HB   TRP  13          2HB       TRP  13   4.515  -4.077  -2.862
  114   2HB   TRP  13          1HB       TRP  13   4.760  -3.045  -1.481
  115    HD1  TRP  13           HD       TRP  13   2.165  -4.949  -2.576
  116    HE1  TRP  13           1HE      TRP  13  -0.108  -3.954  -2.014
  117    HE3  TRP  13           3HE      TRP  13   3.600  -0.182  -1.860
  118    HZ2  TRP  13           2HZ      TRP  13  -1.210  -1.338  -1.952
  119    HZ3  TRP  13           3HZ      TRP  13   1.897   1.597  -1.660
  120    HH2  TRP  13           HH       TRP  13  -0.480   0.943  -1.374
  121    H    HIS  14           H        HIS  14   7.407  -2.855  -3.558
  122    HA   HIS  14           HA       HIS  14   8.791  -1.644  -1.460
  123   1HB   HIS  14          2HB       HIS  14   9.448  -2.817  -4.103
  124   2HB   HIS  14          1HB       HIS  14  10.598  -1.625  -3.555
  125    HD1  HIS  14           1HD      HIS  14  10.756  -4.920  -3.624
  126    HD2  HIS  14           2HD      HIS  14  10.583  -2.226  -0.442
  127    HE1  HIS  14           1HE      HIS  14  12.159  -5.933  -1.698
  128    H    GLU  15           H        GLU  15   8.623  -0.365  -4.762
  129    HA   GLU  15           HA       GLU  15   9.461   2.363  -3.978
  130   1HB   GLU  15          2HB       GLU  15   8.871   1.021  -6.637
  131   2HB   GLU  15          1HB       GLU  15   9.294   2.701  -6.465
  132   1HG   GLU  15          2HG       GLU  15  11.045   0.614  -5.236
  133   2HG   GLU  15          1HG       GLU  15  11.092   0.953  -6.994
  134    H    GLY  16           H        GLY  16   6.346   0.799  -5.205
  135   1HA   GLY  16          2HA       GLY  16   4.812   3.121  -5.493
  136   2HA   GLY  16          1HA       GLY  16   4.206   1.559  -5.044
  137    H    LEU  17           H        LEU  17   5.825   1.482  -2.511
  138    HA   LEU  17           HA       LEU  17   4.151   3.170  -0.794
  139   1HB   LEU  17          2HB       LEU  17   5.845   0.852  -0.383
  140   2HB   LEU  17          1HB       LEU  17   5.916   2.103   0.871
  141    HG   LEU  17           HG       LEU  17   3.287   1.057  -0.260
  142   1HD1  LEU  17          1HD1      LEU  17   3.120  -0.338   1.733
  143   2HD1  LEU  17          2HD1      LEU  17   4.506  -0.815   0.722
  144   3HD1  LEU  17          3HD1      LEU  17   4.771   0.127   2.209
  145   1HD2  LEU  17          1HD2      LEU  17   2.380   2.016   1.815
  146   2HD2  LEU  17          2HD2      LEU  17   4.007   2.556   2.290
  147   3HD2  LEU  17          3HD2      LEU  17   3.217   3.261   0.858
  148    H    GLU  18           H        GLU  18   7.466   3.244  -2.195
  149    HA   GLU  18           HA       GLU  18   8.435   5.329  -0.343
  150   1HB   GLU  18          2HB       GLU  18   9.879   3.549  -1.391
  151   2HB   GLU  18          1HB       GLU  18   9.686   4.423  -2.909
  152   1HG   GLU  18          2HG       GLU  18  10.594   6.469  -1.878
  153   2HG   GLU  18          1HG       GLU  18  10.722   5.648  -0.317
  154    H    GLU  19           H        GLU  19   6.952   5.154  -3.644
  155    HA   GLU  19           HA       GLU  19   7.151   8.006  -4.193
  156   1HB   GLU  19          2HB       GLU  19   7.055   6.150  -5.891
  157   2HB   GLU  19          1HB       GLU  19   5.360   6.008  -5.536
  158   1HG   GLU  19          2HG       GLU  19   5.798   7.488  -7.466
  159   2HG   GLU  19          1HG       GLU  19   4.988   8.362  -6.191
  160    H    ALA  20           H        ALA  20   5.183   6.324  -1.980
  161    HA   ALA  20           HA       ALA  20   3.098   8.474  -1.942
  162   1HB   ALA  20          1HB       ALA  20   1.759   6.803  -0.753
  163   2HB   ALA  20          2HB       ALA  20   2.274   6.166  -2.333
  164   3HB   ALA  20          3HB       ALA  20   3.097   5.635  -0.847
  165    H    SER  21           H        SER  21   4.947   6.269   0.159
  166    HA   SER  21           HA       SER  21   4.588   7.494   2.656
  167   1HB   SER  21          2HB       SER  21   6.851   5.822   1.652
  168   2HB   SER  21          1HB       SER  21   6.514   6.270   3.350
  169    HG   SER  21           HG       SER  21   5.584   4.151   2.683
  170    H    ARG  22           H        ARG  22   6.968   8.211   0.014
  171    HA   ARG  22           HA       ARG  22   8.345  10.183   1.586
  172   1HB   ARG  22          2HB       ARG  22   9.390   8.970  -0.287
  173   2HB   ARG  22          1HB       ARG  22   8.348   9.826  -1.410
  174   1HG   ARG  22          2HG       ARG  22   9.239  11.977  -0.578
  175   2HG   ARG  22          1HG       ARG  22  10.341  11.070   0.491
  176   1HD   ARG  22          2HD       ARG  22  10.387  10.055  -2.244
  177   2HD   ARG  22          1HD       ARG  22  10.818  11.789  -2.169
  178    HE   ARG  22           HE       ARG  22  12.174  10.574  -0.076
  179   1HH1  ARG  22          2HH2      ARG  22  12.183  10.210  -3.554
  180   2HH1  ARG  22          1HH2      ARG  22  13.864   9.793  -3.652
  181   1HH2  ARG  22          1HH1      ARG  22  14.397  10.032  -0.217
  182   2HH2  ARG  22          2HH1      ARG  22  15.092   9.695  -1.765
  183    H    LEU  23           H        LEU  23   5.388  10.288  -0.399
  184    HA   LEU  23           HA       LEU  23   5.301  13.168  -0.893
  185   1HB   LEU  23          2HB       LEU  23   3.685  10.846  -1.431
  186   2HB   LEU  23          1HB       LEU  23   2.778  12.321  -0.944
  187    HG   LEU  23           HG       LEU  23   2.918  12.290  -3.383
  188   1HD1  LEU  23          1HD1      LEU  23   3.970  14.331  -3.872
  189   2HD1  LEU  23          2HD1      LEU  23   2.998  14.423  -2.383
  190   3HD1  LEU  23          3HD1      LEU  23   4.775  14.333  -2.285
  191   1HD2  LEU  23          1HD2      LEU  23   4.992  12.263  -4.584
  192   2HD2  LEU  23          2HD2      LEU  23   5.909  12.055  -3.074
  193   3HD2  LEU  23          3HD2      LEU  23   4.819  10.767  -3.640
  194    H    TYR  24           H        TYR  24   4.618  11.071   1.811
  195    HA   TYR  24           HA       TYR  24   3.472  13.443   3.334
  196   1HB   TYR  24          2HB       TYR  24   2.494  12.102   4.786
  197   2HB   TYR  24          1HB       TYR  24   2.330  11.169   3.258
  198    HD1  TYR  24           1HD      TYR  24   3.196   8.920   3.111
  199    HD2  TYR  24           2HD      TYR  24   4.408  11.487   6.324
  200    HE1  TYR  24           1HE      TYR  24   4.191   6.991   4.303
  201    HE2  TYR  24           2HE      TYR  24   5.716   9.667   7.297
  202    HH   TYR  24           HH       TYR  24   6.044   7.452   7.305
  203    H    PHE  25           H        PHE  25   6.189  11.071   3.341
  204    HA   PHE  25           HA       PHE  25   7.326  11.254   5.780
  205   1HB   PHE  25          2HB       PHE  25   8.050   9.855   3.919
  206   2HB   PHE  25          1HB       PHE  25   8.696  11.305   3.082
  207    HD1  PHE  25           1HD      PHE  25   9.292   8.751   5.621
  208    HD2  PHE  25           2HD      PHE  25  10.630  12.515   4.035
  209    HE1  PHE  25           1HE      PHE  25  11.471   8.476   6.784
  210    HE2  PHE  25           2HE      PHE  25  12.777  12.268   5.233
  211    HZ   PHE  25           HZ       PHE  25  13.201  10.246   6.609
  212    H    GLY  26           H        GLY  26   7.987  13.544   3.105
  213   1HA   GLY  26          2HA       GLY  26   8.288  15.794   4.977
  214   2HA   GLY  26          1HA       GLY  26   9.747  15.353   4.116
  215    H    GLU  27           H        GLU  27   6.473  14.984   2.728
  216    HA   GLU  27           HA       GLU  27   7.099  17.224   0.819
  217   1HB   GLU  27          2HB       GLU  27   6.391  14.486   0.240
  218   2HB   GLU  27          1HB       GLU  27   5.186  15.578  -0.370
  219   1HG   GLU  27          2HG       GLU  27   6.514  16.068  -2.069
  220   2HG   GLU  27          1HG       GLU  27   7.716  16.744  -0.971
  221    H    ARG  28           H        ARG  28   5.068  16.289   3.439
  222    HA   ARG  28           HA       ARG  28   2.901  16.646   4.029
  223   1HB   ARG  28          2HB       ARG  28   4.181  19.294   3.376
  224   2HB   ARG  28          1HB       ARG  28   2.561  19.232   4.034
  225   1HG   ARG  28          2HG       ARG  28   4.872  17.774   5.347
  226   2HG   ARG  28          1HG       ARG  28   4.457  19.451   5.705
  227   1HD   ARG  28          2HD       ARG  28   2.018  18.461   6.061
  228   2HD   ARG  28          1HD       ARG  28   2.898  16.942   6.291
  229    HE   ARG  28           HE       ARG  28   3.528  17.691   8.324
  230   1HH1  ARG  28          2HH2      ARG  28   2.874  20.592   6.440
  231   2HH1  ARG  28          1HH2      ARG  28   3.187  21.671   7.759
  232   1HH2  ARG  28          1HH1      ARG  28   3.949  19.158  10.028
  233   2HH2  ARG  28          2HH1      ARG  28   3.790  20.858   9.744
  234    H    ASN  29           H        ASN  29   3.052  15.814   1.227
  235    HA   ASN  29           HA       ASN  29   0.639  17.132   0.176
  236   1HB   ASN  29          2HB       ASN  29   2.931  17.579  -0.922
  237   2HB   ASN  29          1HB       ASN  29   2.819  15.904  -1.516
  238   1HD2  ASN  29          2HD2      ASN  29   0.846  18.849  -1.209
  239   2HD2  ASN  29          1HD2      ASN  29   0.066  18.696  -2.766
  240    H    VAL  30           H        VAL  30  -0.008  15.357   1.800
  241    HA   VAL  30           HA       VAL  30  -0.167  12.649   1.249
  242    HB   VAL  30           HB       VAL  30  -2.315  14.367   2.504
  243   1HG1  VAL  30          1HG1      VAL  30  -2.824  12.350   3.729
  244   2HG1  VAL  30          2HG1      VAL  30  -3.025  12.077   1.982
  245   3HG1  VAL  30          3HG1      VAL  30  -1.585  11.451   2.820
  246   1HG2  VAL  30          1HG2      VAL  30  -1.216  13.827   4.600
  247   2HG2  VAL  30          2HG2      VAL  30   0.094  12.991   3.733
  248   3HG2  VAL  30          3HG2      VAL  30  -0.108  14.750   3.556
  249    H    LYS  31           H        LYS  31  -1.575  15.310  -0.567
  250    HA   LYS  31           HA       LYS  31  -3.622  13.921  -2.070
  251   1HB   LYS  31          2HB       LYS  31  -4.095  15.836  -2.783
  252   2HB   LYS  31          1HB       LYS  31  -2.903  16.451  -1.569
  253   1HG   LYS  31          2HG       LYS  31  -2.515  17.711  -3.527
  254   2HG   LYS  31          1HG       LYS  31  -1.240  16.510  -3.529
  255   1HD   LYS  31          2HD       LYS  31  -2.416  15.168  -5.195
  256   2HD   LYS  31          1HD       LYS  31  -3.839  16.191  -5.090
  257   1HE   LYS  31          2HE       LYS  31  -2.721  18.035  -6.102
  258   2HE   LYS  31          1HE       LYS  31  -1.130  17.295  -5.883
  259   1HZ   LYS  31          1HZ       LYS  31  -2.032  17.089  -8.104
  260   2HZ   LYS  31          2HZ       LYS  31  -1.689  15.653  -7.417
  261   3HZ   LYS  31          3HZ       LYS  31  -3.239  16.135  -7.546
  262    H    GLY  32           H        GLY  32  -0.042  14.372  -2.478
  263   1HA   GLY  32          2HA       GLY  32   0.146  13.297  -5.140
  264   2HA   GLY  32          1HA       GLY  32   1.445  13.544  -3.996
  265    H    MET  33           H        MET  33   1.184  11.882  -1.958
  266    HA   MET  33           HA       MET  33   1.586   9.244  -2.657
  267   1HB   MET  33          2HB       MET  33   1.301   8.649  -0.502
  268   2HB   MET  33          1HB       MET  33   1.877  10.358  -0.450
  269   1HG   MET  33          2HG       MET  33  -0.513  11.018   0.096
  270   2HG   MET  33          1HG       MET  33  -0.896   9.330   0.259
  271   1HE   MET  33          1HE       MET  33   0.714   8.204   3.465
  272   2HE   MET  33          2HE       MET  33  -0.622   7.999   2.308
  273   3HE   MET  33          3HE       MET  33   1.061   7.787   1.770
  274    H    PHE  34           H        PHE  34  -1.513  10.854  -2.318
  275    HA   PHE  34           HA       PHE  34  -3.238   8.535  -2.291
  276   1HB   PHE  34          2HB       PHE  34  -3.534  11.033  -1.488
  277   2HB   PHE  34          1HB       PHE  34  -4.048  11.282  -3.151
  278    HD1  PHE  34           1HD      PHE  34  -6.312  11.595  -2.975
  279    HD2  PHE  34           2HD      PHE  34  -4.509   8.275  -0.940
  280    HE1  PHE  34           1HE      PHE  34  -8.560  10.755  -2.336
  281    HE2  PHE  34           2HE      PHE  34  -6.747   7.382  -0.399
  282    HZ   PHE  34           HZ       PHE  34  -8.761   8.716  -0.933
  283    H    GLU  35           H        GLU  35  -1.541  10.241  -4.848
  284    HA   GLU  35           HA       GLU  35  -3.239   9.277  -7.038
  285   1HB   GLU  35          2HB       GLU  35  -1.876  11.508  -6.965
  286   2HB   GLU  35          1HB       GLU  35  -0.460  10.530  -7.189
  287   1HG   GLU  35          2HG       GLU  35  -0.841  10.752  -9.365
  288   2HG   GLU  35          1HG       GLU  35  -2.156   9.587  -9.175
  289    H    VAL  36           H        VAL  36  -0.142   8.297  -5.429
  290    HA   VAL  36           HA       VAL  36   0.304   6.183  -7.456
  291    HB   VAL  36           HB       VAL  36   2.210   7.523  -6.742
  292   1HG1  VAL  36          1HG1      VAL  36   3.231   7.097  -4.620
  293   2HG1  VAL  36          2HG1      VAL  36   1.639   7.861  -4.387
  294   3HG1  VAL  36          3HG1      VAL  36   1.839   6.115  -4.104
  295   1HG2  VAL  36          1HG2      VAL  36   3.702   5.724  -6.549
  296   2HG2  VAL  36          2HG2      VAL  36   2.357   4.599  -6.246
  297   3HG2  VAL  36          3HG2      VAL  36   2.476   5.444  -7.809
  298    H    LEU  37           H        LEU  37  -0.889   6.589  -4.101
  299    HA   LEU  37           HA       LEU  37  -1.217   3.805  -3.594
  300   1HB   LEU  37          2HB       LEU  37  -1.313   6.192  -2.077
  301   2HB   LEU  37          1HB       LEU  37  -2.877   5.464  -1.913
  302    HG   LEU  37           HG       LEU  37  -1.387   4.645  -0.177
  303   1HD1  LEU  37          1HD1      LEU  37  -1.683   2.291  -0.467
  304   2HD1  LEU  37          2HD1      LEU  37  -3.135   3.192  -0.963
  305   3HD1  LEU  37          3HD1      LEU  37  -2.040   2.522  -2.196
  306   1HD2  LEU  37          1HD2      LEU  37   0.543   3.293  -0.645
  307   2HD2  LEU  37          2HD2      LEU  37   0.351   3.558  -2.395
  308   3HD2  LEU  37          3HD2      LEU  37   0.761   4.922  -1.328
  309    H    GLU  38           H        GLU  38  -3.370   6.280  -5.098
  310    HA   GLU  38           HA       GLU  38  -5.833   4.950  -5.133
  311   1HB   GLU  38          2HB       GLU  38  -4.535   6.961  -6.735
  312   2HB   GLU  38          1HB       GLU  38  -5.672   5.909  -7.634
  313   1HG   GLU  38          2HG       GLU  38  -7.172   6.399  -5.495
  314   2HG   GLU  38          1HG       GLU  38  -6.161   7.884  -5.478
  315    HA   PRO  39           HA       PRO  39  -4.639   2.124  -8.790
  316   1HB   PRO  39          2HB       PRO  39  -2.169   1.936  -9.791
  317   2HB   PRO  39          1HB       PRO  39  -3.280   3.192 -10.332
  318   1HG   PRO  39          2HG       PRO  39  -1.026   3.412  -8.282
  319   2HG   PRO  39          1HG       PRO  39  -1.409   4.516  -9.599
  320   1HD   PRO  39          1HD       PRO  39  -2.328   4.944  -7.003
  321   2HD   PRO  39          2HD       PRO  39  -3.295   5.449  -8.443
  322    H    LEU  40           H        LEU  40  -1.909   2.449  -6.354
  323    HA   LEU  40           HA       LEU  40  -1.454  -0.290  -6.082
  324   1HB   LEU  40          2HB       LEU  40  -1.053   2.039  -4.190
  325   2HB   LEU  40          1HB       LEU  40  -0.514   0.413  -3.837
  326    HG   LEU  40           HG       LEU  40   0.300   1.867  -6.384
  327   1HD1  LEU  40          1HD1      LEU  40   2.357   2.369  -5.163
  328   2HD1  LEU  40          2HD1      LEU  40   0.961   3.129  -4.364
  329   3HD1  LEU  40          3HD1      LEU  40   1.676   1.649  -3.685
  330   1HD2  LEU  40          1HD2      LEU  40   2.108   0.265  -6.394
  331   2HD2  LEU  40          2HD2      LEU  40   1.475  -0.505  -4.919
  332   3HD2  LEU  40          3HD2      LEU  40   0.542  -0.577  -6.432
  333    H    HIS  41           H        HIS  41  -4.155   1.593  -4.816
  334    HA   HIS  41           HA       HIS  41  -5.220  -0.463  -3.043
  335   1HB   HIS  41          2HB       HIS  41  -5.539   1.736  -2.463
  336   2HB   HIS  41          1HB       HIS  41  -6.097   2.180  -4.111
  337    HD1  HIS  41           1HD      HIS  41  -8.576   2.470  -4.191
  338    HD2  HIS  41           2HD      HIS  41  -7.386  -0.274  -1.343
  339    HE1  HIS  41           1HE      HIS  41 -10.736   1.546  -3.160
  340    H    ALA  42           H        ALA  42  -5.639   0.376  -6.486
  341    HA   ALA  42           HA       ALA  42  -8.022  -1.373  -6.796
  342   1HB   ALA  42          1HB       ALA  42  -8.004  -0.552  -9.062
  343   2HB   ALA  42          2HB       ALA  42  -8.000   0.785  -7.889
  344   3HB   ALA  42          3HB       ALA  42  -6.502   0.350  -8.745
  345    H    MET  43           H        MET  43  -4.612  -1.168  -7.867
  346    HA   MET  43           HA       MET  43  -4.401  -3.738  -9.180
  347   1HB   MET  43          2HB       MET  43  -2.416  -1.692  -8.070
  348   2HB   MET  43          1HB       MET  43  -1.922  -3.171  -8.842
  349   1HG   MET  43          2HG       MET  43  -2.779  -2.504 -10.942
  350   2HG   MET  43          1HG       MET  43  -3.768  -1.232 -10.242
  351   1HE   MET  43          1HE       MET  43  -1.117   0.652 -12.367
  352   2HE   MET  43          2HE       MET  43  -1.812  -0.955 -12.692
  353   3HE   MET  43          3HE       MET  43  -2.846   0.351 -12.064
  354    H    MET  44           H        MET  44  -4.743  -3.003  -5.795
  355    HA   MET  44           HA       MET  44  -3.668  -5.734  -5.178
  356   1HB   MET  44          2HB       MET  44  -3.362  -5.031  -3.057
  357   2HB   MET  44          1HB       MET  44  -2.797  -3.675  -4.082
  358   1HG   MET  44          2HG       MET  44  -4.898  -2.465  -3.625
  359   2HG   MET  44          1HG       MET  44  -5.461  -3.808  -2.616
  360   1HE   MET  44          1HE       MET  44  -2.818  -3.848   0.265
  361   2HE   MET  44          2HE       MET  44  -4.300  -4.575  -0.403
  362   3HE   MET  44          3HE       MET  44  -2.756  -4.747  -1.270
  363    H    GLU  45           H        GLU  45  -6.648  -3.991  -5.556
  364    HA   GLU  45           HA       GLU  45  -8.210  -5.789  -3.826
  365   1HB   GLU  45          2HB       GLU  45  -8.557  -3.253  -4.045
  366   2HB   GLU  45          1HB       GLU  45  -9.285  -3.608  -5.598
  367   1HG   GLU  45          2HG       GLU  45 -10.277  -5.264  -3.287
  368   2HG   GLU  45          1HG       GLU  45 -10.723  -3.586  -3.295
  369    H    ARG  46           H        ARG  46  -7.657  -5.188  -7.362
  370    HA   ARG  46           HA       ARG  46  -9.650  -6.739  -8.514
  371   1HB   ARG  46          2HB       ARG  46  -7.841  -5.288  -9.562
  372   2HB   ARG  46          1HB       ARG  46  -6.804  -6.727  -9.464
  373   1HG   ARG  46          2HG       ARG  46  -8.052  -7.898 -11.036
  374   2HG   ARG  46          1HG       ARG  46  -9.568  -7.106 -10.584
  375   1HD   ARG  46          2HD       ARG  46  -8.016  -5.024 -11.532
  376   2HD   ARG  46          1HD       ARG  46  -7.608  -6.403 -12.611
  377    HE   ARG  46           HE       ARG  46 -10.427  -6.271 -12.098
  378   1HH1  ARG  46          2HH2      ARG  46  -8.005  -4.697 -14.068
  379   2HH1  ARG  46          1HH2      ARG  46  -9.127  -4.192 -15.292
  380   1HH2  ARG  46          1HH1      ARG  46 -11.895  -5.599 -13.729
  381   2HH2  ARG  46          2HH1      ARG  46 -11.302  -4.707 -15.087
  382    H    GLY  47           H        GLY  47  -6.673  -7.876  -6.887
  383   1HA   GLY  47          2HA       GLY  47  -6.807  -9.928  -5.659
  384   2HA   GLY  47          1HA       GLY  47  -7.802 -10.620  -6.950
  385    HA   PRO  48           HA       PRO  48  -3.127 -11.234  -7.799
  386   1HB   PRO  48          2HB       PRO  48  -2.624 -13.572  -6.690
  387   2HB   PRO  48          1HB       PRO  48  -2.392 -11.968  -5.843
  388   1HG   PRO  48          2HG       PRO  48  -4.701 -13.992  -5.540
  389   2HG   PRO  48          1HG       PRO  48  -3.848 -13.155  -4.244
  390   1HD   PRO  48          1HD       PRO  48  -6.236 -12.154  -5.358
  391   2HD   PRO  48          2HD       PRO  48  -4.936 -11.030  -4.745
  392    H    GLN  49           H        GLN  49  -2.335 -13.658  -8.613
  393    HA   GLN  49           HA       GLN  49  -4.519 -14.764 -10.319
  394   1HB   GLN  49          2HB       GLN  49  -3.256 -13.243 -11.718
  395   2HB   GLN  49          1HB       GLN  49  -1.737 -13.963 -11.228
  396   1HG   GLN  49          2HG       GLN  49  -1.966 -15.329 -13.038
  397   2HG   GLN  49          1HG       GLN  49  -3.222 -16.168 -12.173
  398   1HE2  GLN  49          2HE2      GLN  49  -2.482 -14.942 -14.961
  399   2HE2  GLN  49          1HE2      GLN  49  -4.058 -14.409 -15.499
  400    H    THR  50           H        THR  50  -1.105 -15.555 -10.263
  401    HA   THR  50           HA       THR  50  -1.259 -18.329 -10.107
  402    HB   THR  50           HB       THR  50   0.604 -17.587 -11.055
  403    HG1  THR  50           1HG      THR  50   2.336 -18.373  -9.688
  404   1HG2  THR  50          1HG2      THR  50   2.271 -16.058 -10.102
  405   2HG2  THR  50          2HG2      THR  50   0.689 -15.259 -10.264
  406   3HG2  THR  50          3HG2      THR  50   1.245 -15.817  -8.668
  407    H    LEU  51           H        LEU  51   0.732 -17.108  -7.641
  408    HA   LEU  51           HA       LEU  51  -0.892 -17.166  -5.254
  409   1HB   LEU  51          2HB       LEU  51  -0.620 -19.696  -6.229
  410   2HB   LEU  51          1HB       LEU  51   0.889 -19.585  -5.369
  411    HG   LEU  51           HG       LEU  51  -0.313 -18.924  -3.335
  412   1HD1  LEU  51          1HD1      LEU  51  -2.754 -19.212  -3.209
  413   2HD1  LEU  51          2HD1      LEU  51  -2.306 -17.888  -4.312
  414   3HD1  LEU  51          3HD1      LEU  51  -2.815 -19.462  -4.970
  415   1HD2  LEU  51          1HD2      LEU  51  -1.288 -21.201  -2.984
  416   2HD2  LEU  51          2HD2      LEU  51  -1.269 -21.465  -4.743
  417   3HD2  LEU  51          3HD2      LEU  51   0.261 -21.285  -3.855
  418    H    LYS  52           H        LYS  52   1.138 -15.524  -6.557
  419    HA   LYS  52           HA       LYS  52   3.345 -15.692  -4.564
  420   1HB   LYS  52          2HB       LYS  52   3.433 -14.360  -7.307
  421   2HB   LYS  52          1HB       LYS  52   4.754 -14.546  -6.207
  422   1HG   LYS  52          2HG       LYS  52   4.505 -17.053  -6.428
  423   2HG   LYS  52          1HG       LYS  52   3.314 -16.755  -7.681
  424   1HD   LYS  52          2HD       LYS  52   5.078 -15.296  -8.830
  425   2HD   LYS  52          1HD       LYS  52   6.237 -15.980  -7.677
  426   1HE   LYS  52          2HE       LYS  52   5.387 -18.302  -8.434
  427   2HE   LYS  52          1HE       LYS  52   4.582 -17.463  -9.761
  428   1HZ   LYS  52          1HZ       LYS  52   6.691 -18.182 -10.429
  429   2HZ   LYS  52          2HZ       LYS  52   6.760 -16.550 -10.330
  430   3HZ   LYS  52          3HZ       LYS  52   7.429 -17.473  -9.167
  431    H    GLU  53           H        GLU  53   1.078 -13.424  -6.291
  432    HA   GLU  53           HA       GLU  53   1.572 -11.204  -4.476
  433   1HB   GLU  53          2HB       GLU  53   1.125 -10.647  -6.695
  434   2HB   GLU  53          1HB       GLU  53  -0.364 -11.535  -6.715
  435   1HG   GLU  53          2HG       GLU  53  -0.360  -9.015  -6.382
  436   2HG   GLU  53          1HG       GLU  53  -1.468 -10.039  -5.410
  437    H    THR  54           H        THR  54   1.364 -12.639  -2.556
  438    HA   THR  54           HA       THR  54  -1.258 -12.097  -1.318
  439    HB   THR  54           HB       THR  54  -0.429 -14.992  -1.407
  440    HG1  THR  54           1HG      THR  54  -2.381 -15.069  -2.872
  441   1HG2  THR  54          1HG2      THR  54  -2.736 -15.307  -0.699
  442   2HG2  THR  54          2HG2      THR  54  -1.872 -14.258   0.451
  443   3HG2  THR  54          3HG2      THR  54  -3.008 -13.549  -0.721
  444    H    SER  55           H        SER  55   1.293 -10.957  -0.823
  445    HA   SER  55           HA       SER  55   2.141 -12.130   1.807
  446   1HB   SER  55          2HB       SER  55   3.532 -11.099  -0.440
  447   2HB   SER  55          1HB       SER  55   3.808 -10.054   0.988
  448    HG   SER  55           HG       SER  55   5.307 -11.809   1.066
  449    H    PHE  56           H        PHE  56  -0.319 -10.566   1.350
  450    HA   PHE  56           HA       PHE  56   0.131  -8.344   3.299
  451   1HB   PHE  56          2HB       PHE  56  -1.534  -8.066   0.757
  452   2HB   PHE  56          1HB       PHE  56  -1.245  -6.838   1.962
  453    HD1  PHE  56           1HD      PHE  56   0.331  -8.912  -0.643
  454    HD2  PHE  56           2HD      PHE  56   0.826  -5.595   2.037
  455    HE1  PHE  56           1HE      PHE  56   2.359  -8.219  -1.885
  456    HE2  PHE  56           2HE      PHE  56   2.759  -4.816   0.698
  457    HZ   PHE  56           HZ       PHE  56   3.617  -6.199  -1.149
  458    H    ASN  57           H        ASN  57  -2.529 -10.008   1.441
  459    HA   ASN  57           HA       ASN  57  -4.361  -9.859   3.598
  460   1HB   ASN  57          2HB       ASN  57  -4.395 -11.510   1.045
  461   2HB   ASN  57          1HB       ASN  57  -5.756 -11.323   2.135
  462   1HD2  ASN  57          2HD2      ASN  57  -5.045 -10.452  -0.723
  463   2HD2  ASN  57          1HD2      ASN  57  -5.479  -8.767  -0.710
  464    H    GLN  58           H        GLN  58  -1.818 -12.114   2.931
  465    HA   GLN  58           HA       GLN  58  -2.907 -14.090   4.839
  466   1HB   GLN  58          2HB       GLN  58  -1.341 -14.399   2.309
  467   2HB   GLN  58          1HB       GLN  58  -1.052 -15.542   3.617
  468   1HG   GLN  58          2HG       GLN  58  -3.766 -14.914   2.376
  469   2HG   GLN  58          1HG       GLN  58  -2.812 -16.377   2.123
  470   1HE2  GLN  58          2HE2      GLN  58  -2.342 -17.721   4.075
  471   2HE2  GLN  58          1HE2      GLN  58  -3.563 -17.729   5.321
  472    H    ALA  59           H        ALA  59  -0.869 -11.573   4.794
  473    HA   ALA  59           HA       ALA  59   1.108 -12.797   6.645
  474   1HB   ALA  59          1HB       ALA  59   2.706 -11.107   5.889
  475   2HB   ALA  59          2HB       ALA  59   2.204 -12.183   4.563
  476   3HB   ALA  59          3HB       ALA  59   1.535 -10.537   4.677
  477    H    TYR  60           H        TYR  60  -0.889  -9.996   5.699
  478    HA   TYR  60           HA       TYR  60  -1.233  -9.179   8.552
  479   1HB   TYR  60          2HB       TYR  60  -0.266  -7.110   6.605
  480   2HB   TYR  60          1HB       TYR  60  -0.255  -7.100   8.404
  481    HD1  TYR  60           1HD      TYR  60   1.373  -8.628   9.573
  482    HD2  TYR  60           2HD      TYR  60   1.634  -7.803   5.369
  483    HE1  TYR  60           1HE      TYR  60   3.755  -9.277   9.601
  484    HE2  TYR  60           2HE      TYR  60   4.010  -8.457   5.378
  485    HH   TYR  60           HH       TYR  60   5.643  -9.446   6.551
  486    H    GLY  61           H        GLY  61  -3.452  -9.923   7.934
  487   1HA   GLY  61          2HA       GLY  61  -4.996  -8.636   5.941
  488   2HA   GLY  61          1HA       GLY  61  -5.575  -9.552   7.367
  489    H    ARG  62           H        ARG  62  -3.724  -7.347   8.725
  490    HA   ARG  62           HA       ARG  62  -5.849  -5.316   9.256
  491   1HB   ARG  62          2HB       ARG  62  -3.426  -6.259  10.846
  492   2HB   ARG  62          1HB       ARG  62  -4.460  -4.920  11.308
  493   1HG   ARG  62          2HG       ARG  62  -5.702  -7.637  10.774
  494   2HG   ARG  62          1HG       ARG  62  -4.942  -7.298  12.308
  495   1HD   ARG  62          2HD       ARG  62  -6.755  -5.183  11.410
  496   2HD   ARG  62          1HD       ARG  62  -7.513  -6.787  11.666
  497    HE   ARG  62           HE       ARG  62  -5.666  -6.111  13.764
  498   1HH1  ARG  62          2HH2      ARG  62  -8.960  -5.413  12.774
  499   2HH1  ARG  62          1HH2      ARG  62  -9.518  -5.127  14.389
  500   1HH2  ARG  62          1HH1      ARG  62  -6.441  -5.733  15.882
  501   2HH2  ARG  62          2HH1      ARG  62  -8.099  -5.296  16.108
  502    H    ASP  63           H        ASP  63  -2.712  -5.740   7.732
  503    HA   ASP  63           HA       ASP  63  -1.748  -3.028   8.026
  504   1HB   ASP  63          2HB       ASP  63  -0.456  -5.223   7.692
  505   2HB   ASP  63          1HB       ASP  63  -0.899  -5.080   5.991
  506    H    LEU  64           H        LEU  64  -1.127  -2.985   4.948
  507    HA   LEU  64           HA       LEU  64  -2.554  -1.364   3.679
  508   1HB   LEU  64          2HB       LEU  64  -1.354  -3.885   2.892
  509   2HB   LEU  64          1HB       LEU  64  -2.556  -3.249   1.741
  510    HG   LEU  64           HG       LEU  64  -0.555  -1.375   2.978
  511   1HD1  LEU  64          1HD1      LEU  64   1.026  -1.820   1.132
  512   2HD1  LEU  64          2HD1      LEU  64   0.814  -3.247   2.173
  513   3HD1  LEU  64          3HD1      LEU  64   0.005  -3.173   0.590
  514   1HD2  LEU  64          1HD2      LEU  64  -0.890  -0.246   0.770
  515   2HD2  LEU  64          2HD2      LEU  64  -1.937  -1.589   0.256
  516   3HD2  LEU  64          3HD2      LEU  64  -2.441  -0.530   1.595
  517    H    MET  65           H        MET  65  -3.999  -4.640   4.084
  518    HA   MET  65           HA       MET  65  -6.480  -4.402   2.841
  519   1HB   MET  65          2HB       MET  65  -5.548  -6.433   3.902
  520   2HB   MET  65          1HB       MET  65  -5.809  -5.739   5.482
  521   1HG   MET  65          2HG       MET  65  -8.106  -5.981   5.366
  522   2HG   MET  65          1HG       MET  65  -8.158  -5.859   3.614
  523   1HE   MET  65          1HE       MET  65  -8.939  -9.541   5.627
  524   2HE   MET  65          2HE       MET  65  -8.462  -8.089   6.537
  525   3HE   MET  65          3HE       MET  65  -9.754  -7.991   5.318
  526    H    GLU  66           H        GLU  66  -5.757  -3.303   6.218
  527    HA   GLU  66           HA       GLU  66  -8.356  -1.838   6.399
  528   1HB   GLU  66          2HB       GLU  66  -6.294  -2.430   8.448
  529   2HB   GLU  66          1HB       GLU  66  -7.698  -1.376   8.652
  530   1HG   GLU  66          2HG       GLU  66  -8.999  -3.537   7.663
  531   2HG   GLU  66          1HG       GLU  66  -7.614  -4.376   8.323
  532    H    ALA  67           H        ALA  67  -4.851  -1.194   6.049
  533    HA   ALA  67           HA       ALA  67  -4.841   1.590   6.457
  534   1HB   ALA  67          1HB       ALA  67  -2.817   1.564   5.061
  535   2HB   ALA  67          2HB       ALA  67  -2.814   0.265   6.277
  536   3HB   ALA  67          3HB       ALA  67  -3.179  -0.109   4.576
  537    H    GLN  68           H        GLN  68  -6.034  -0.273   3.716
  538    HA   GLN  68           HA       GLN  68  -6.771   2.189   2.180
  539   1HB   GLN  68          2HB       GLN  68  -6.751   0.807   0.278
  540   2HB   GLN  68          1HB       GLN  68  -5.389   0.208   1.176
  541   1HG   GLN  68          2HG       GLN  68  -7.415  -1.422   2.154
  542   2HG   GLN  68          1HG       GLN  68  -7.921  -1.162   0.514
  543   1HE2  GLN  68          2HE2      GLN  68  -7.568  -3.203  -0.080
  544   2HE2  GLN  68          1HE2      GLN  68  -5.952  -3.852  -0.233
  545    H    GLU  69           H        GLU  69  -8.262  -0.651   3.874
  546    HA   GLU  69           HA       GLU  69 -10.823  -0.610   2.836
  547   1HB   GLU  69          2HB       GLU  69  -9.728  -2.098   4.687
  548   2HB   GLU  69          1HB       GLU  69 -10.362  -0.893   5.802
  549   1HG   GLU  69          2HG       GLU  69 -12.649  -1.238   4.873
  550   2HG   GLU  69          1HG       GLU  69 -12.015  -2.445   3.759
  551    H    TRP  70           H        TRP  70  -9.331   1.715   5.018
  552    HA   TRP  70           HA       TRP  70 -11.741   3.279   5.454
  553   1HB   TRP  70          2HB       TRP  70  -8.860   4.048   5.906
  554   2HB   TRP  70          1HB       TRP  70 -10.329   4.615   6.762
  555    HD1  TRP  70           HD       TRP  70  -7.502   2.994   7.712
  556    HE1  TRP  70           1HE      TRP  70  -7.754   1.032   9.292
  557    HE3  TRP  70           3HE      TRP  70 -12.343   1.908   6.766
  558    HZ2  TRP  70           2HZ      TRP  70  -9.742  -0.879   9.887
  559    HZ3  TRP  70           3HZ      TRP  70 -13.494   0.189   8.110
  560    HH2  TRP  70           HH       TRP  70 -12.191  -1.214   9.686
  561    H    CYS  71           H        CYS  71 -10.884   2.745   2.547
  562    HA   CYS  71           HA       CYS  71  -9.894   5.192   1.436
  563   1HB   CYS  71          2HB       CYS  71  -9.731   3.017   0.234
  564   2HB   CYS  71          1HB       CYS  71 -11.455   3.024   0.003
  565    HG   CYS  71           HG       CYS  71 -10.360   3.645  -2.177
  566    H    ARG  72           H        ARG  72 -13.243   3.827   1.608
  567    HA   ARG  72           HA       ARG  72 -14.706   6.032   0.535
  568   1HB   ARG  72          2HB       ARG  72 -16.579   4.991   1.753
  569   2HB   ARG  72          1HB       ARG  72 -15.667   3.824   0.812
  570   1HG   ARG  72          2HG       ARG  72 -14.341   3.531   3.146
  571   2HG   ARG  72          1HG       ARG  72 -15.868   4.107   3.789
  572   1HD   ARG  72          2HD       ARG  72 -16.152   2.017   1.702
  573   2HD   ARG  72          1HD       ARG  72 -15.337   1.498   3.172
  574    HE   ARG  72           HE       ARG  72 -18.089   2.109   2.836
  575   1HH1  ARG  72          2HH2      ARG  72 -15.568   2.273   5.293
  576   2HH1  ARG  72          1HH2      ARG  72 -16.683   2.132   6.614
  577   1HH2  ARG  72          1HH1      ARG  72 -19.501   1.895   4.601
  578   2HH2  ARG  72          2HH1      ARG  72 -18.870   1.918   6.212
  579    H    LYS  73           H        LYS  73 -13.010   5.710   3.512
  580    HA   LYS  73           HA       LYS  73 -14.397   7.942   4.883
  581   1HB   LYS  73          2HB       LYS  73 -12.702   5.681   5.760
  582   2HB   LYS  73          1HB       LYS  73 -12.663   7.210   6.668
  583   1HG   LYS  73          2HG       LYS  73 -15.390   6.587   5.969
  584   2HG   LYS  73          1HG       LYS  73 -14.638   5.168   6.759
  585   1HD   LYS  73          2HD       LYS  73 -14.134   6.419   8.756
  586   2HD   LYS  73          1HD       LYS  73 -14.264   7.962   7.942
  587   1HE   LYS  73          2HE       LYS  73 -16.735   7.508   7.665
  588   2HE   LYS  73          1HE       LYS  73 -16.505   6.105   8.737
  589   1HZ   LYS  73          1HZ       LYS  73 -17.117   8.121   9.904
  590   2HZ   LYS  73          2HZ       LYS  73 -15.667   7.549  10.388
  591   3HZ   LYS  73          3HZ       LYS  73 -15.746   8.850   9.403
  592    H    TYR  74           H        TYR  74 -11.071   6.886   3.935
  593    HA   TYR  74           HA       TYR  74  -9.843   9.453   4.298
  594   1HB   TYR  74          2HB       TYR  74  -8.726   7.302   4.230
  595   2HB   TYR  74          1HB       TYR  74  -9.088   7.180   2.474
  596    HD1  TYR  74           1HD      TYR  74  -8.073  10.448   3.905
  597    HD2  TYR  74           2HD      TYR  74  -6.863   6.857   1.877
  598    HE1  TYR  74           1HE      TYR  74  -5.994  11.553   3.222
  599    HE2  TYR  74           2HE      TYR  74  -4.713   7.923   1.292
  600    HH   TYR  74           HH       TYR  74  -3.711   9.866   1.000
  601    H    MET  75           H        MET  75 -11.885   8.365   1.676
  602    HA   MET  75           HA       MET  75 -11.136  10.413  -0.263
  603   1HB   MET  75          2HB       MET  75 -13.009   8.109  -0.060
  604   2HB   MET  75          1HB       MET  75 -13.465   9.425  -1.131
  605   1HG   MET  75          2HG       MET  75 -10.647   8.796  -1.492
  606   2HG   MET  75          1HG       MET  75 -11.636   7.350  -1.669
  607   1HE   MET  75          1HE       MET  75 -14.100   8.277  -4.521
  608   2HE   MET  75          2HE       MET  75 -13.448   6.992  -3.476
  609   3HE   MET  75          3HE       MET  75 -14.372   8.336  -2.763
  610    H    LYS  76           H        LYS  76 -14.229   9.808   1.520
  611    HA   LYS  76           HA       LYS  76 -15.161  12.548   0.922
  612   1HB   LYS  76          2HB       LYS  76 -16.319  10.020   1.585
  613   2HB   LYS  76          1HB       LYS  76 -16.928  11.360   2.606
  614   1HG   LYS  76          2HG       LYS  76 -16.896  12.646   0.239
  615   2HG   LYS  76          1HG       LYS  76 -17.093  10.991  -0.382
  616   1HD   LYS  76          2HD       LYS  76 -19.155  10.688   0.746
  617   2HD   LYS  76          1HD       LYS  76 -18.847  12.027   1.867
  618   1HE   LYS  76          2HE       LYS  76 -18.736  13.279  -0.602
  619   2HE   LYS  76          1HE       LYS  76 -20.011  12.059  -0.838
  620   1HZ   LYS  76          1HZ       LYS  76 -20.860  14.101   0.072
  621   2HZ   LYS  76          2HZ       LYS  76 -21.060  12.873   1.135
  622   3HZ   LYS  76          3HZ       LYS  76 -19.877  13.974   1.368
  623    H    SER  77           H        SER  77 -14.208  10.664   3.817
  624    HA   SER  77           HA       SER  77 -14.768  12.875   5.640
  625   1HB   SER  77          2HB       SER  77 -14.947  10.296   6.144
  626   2HB   SER  77          1HB       SER  77 -13.220  10.345   6.317
  627    HG   SER  77           HG       SER  77 -14.515  10.630   8.236
  628    H    GLY  78           H        GLY  78 -11.933  11.318   3.925
  629   1HA   GLY  78          2HA       GLY  78  -9.740  11.952   3.669
  630   2HA   GLY  78          1HA       GLY  78 -10.336  13.590   3.636
  631    H    ASN  79           H        ASN  79 -10.729  11.517   6.440
  632    HA   ASN  79           HA       ASN  79  -9.565  13.590   8.039
  633   1HB   ASN  79          2HB       ASN  79 -11.596  11.626   8.388
  634   2HB   ASN  79          1HB       ASN  79 -10.352  11.200   9.540
  635   1HD2  ASN  79          2HD2      ASN  79 -11.948  11.781  11.175
  636   2HD2  ASN  79          1HD2      ASN  79 -12.117  13.476  11.546
  637    H    VAL  80           H        VAL  80  -7.412  13.644   8.239
  638    HA   VAL  80           HA       VAL  80  -5.453  11.757   7.912
  639    HB   VAL  80           HB       VAL  80  -5.332  13.967   9.956
  640   1HG1  VAL  80          1HG1      VAL  80  -2.952  13.768   9.683
  641   2HG1  VAL  80          2HG1      VAL  80  -3.616  12.249  10.329
  642   3HG1  VAL  80          3HG1      VAL  80  -3.153  12.359   8.615
  643   1HG2  VAL  80          1HG2      VAL  80  -4.199  15.146   8.174
  644   2HG2  VAL  80          2HG2      VAL  80  -4.485  13.792   7.053
  645   3HG2  VAL  80          3HG2      VAL  80  -5.858  14.738   7.677
  646    H    LYS  81           H        LYS  81  -7.808  11.796  10.612
  647    HA   LYS  81           HA       LYS  81  -6.711   9.982  12.364
  648   1HB   LYS  81          2HB       LYS  81  -9.566  10.397  11.529
  649   2HB   LYS  81          1HB       LYS  81  -9.110   9.246  12.752
  650   1HG   LYS  81          2HG       LYS  81  -8.635  12.245  12.814
  651   2HG   LYS  81          1HG       LYS  81  -9.659  11.289  13.865
  652   1HD   LYS  81          2HD       LYS  81  -7.340  10.053  14.440
  653   2HD   LYS  81          1HD       LYS  81  -6.670  11.576  13.898
  654   1HE   LYS  81          2HE       LYS  81  -8.315  12.719  15.487
  655   2HE   LYS  81          1HE       LYS  81  -8.615  11.107  16.155
  656   1HZ   LYS  81          1HZ       LYS  81  -6.912  12.096  17.354
  657   2HZ   LYS  81          2HZ       LYS  81  -6.185  10.954  16.436
  658   3HZ   LYS  81          3HZ       LYS  81  -6.085  12.532  16.021
  659    H    ASP  82           H        ASP  82  -7.702   9.263   9.060
  660    HA   ASP  82           HA       ASP  82  -7.455   6.318   9.391
  661   1HB   ASP  82          2HB       ASP  82  -8.084   8.032   6.947
  662   2HB   ASP  82          1HB       ASP  82  -8.034   6.300   6.972
  663    H    LEU  83           H        LEU  83  -5.549   9.121   8.374
  664    HA   LEU  83           HA       LEU  83  -3.500   7.578   6.882
  665   1HB   LEU  83          2HB       LEU  83  -4.556  10.024   6.529
  666   2HB   LEU  83          1HB       LEU  83  -3.063  10.372   7.462
  667    HG   LEU  83           HG       LEU  83  -2.637  10.474   5.021
  668   1HD1  LEU  83          1HD1      LEU  83  -0.747   9.034   4.847
  669   2HD1  LEU  83          2HD1      LEU  83  -0.802   9.873   6.417
  670   3HD1  LEU  83          3HD1      LEU  83  -1.254   8.154   6.309
  671   1HD2  LEU  83          1HD2      LEU  83  -2.775   8.452   3.656
  672   2HD2  LEU  83          2HD2      LEU  83  -3.468   7.551   5.027
  673   3HD2  LEU  83          3HD2      LEU  83  -4.380   8.888   4.287
  674    H    THR  84           H        THR  84  -3.735   9.489   9.953
  675    HA   THR  84           HA       THR  84  -1.204   9.080  11.086
  676    HB   THR  84           HB       THR  84  -2.897  10.508  11.996
  677    HG1  THR  84           1HG      THR  84  -2.540   9.677  14.264
  678   1HG2  THR  84          1HG2      THR  84  -4.614   9.644  13.513
  679   2HG2  THR  84          2HG2      THR  84  -4.917   9.123  11.839
  680   3HG2  THR  84          3HG2      THR  84  -4.230   7.979  13.016
  681    H    GLN  85           H        GLN  85  -3.695   6.673  10.524
  682    HA   GLN  85           HA       GLN  85  -2.208   4.577  12.060
  683   1HB   GLN  85          2HB       GLN  85  -4.945   5.264  11.634
  684   2HB   GLN  85          1HB       GLN  85  -4.593   3.638  10.976
  685   1HG   GLN  85          2HG       GLN  85  -3.923   2.798  13.111
  686   2HG   GLN  85          1HG       GLN  85  -3.447   4.367  13.701
  687   1HE2  GLN  85          2HE2      GLN  85  -4.592   3.535  15.574
  688   2HE2  GLN  85          1HE2      GLN  85  -6.303   3.881  15.633
  689    H    ALA  86           H        ALA  86  -3.507   5.337   8.767
  690    HA   ALA  86           HA       ALA  86  -2.566   3.023   7.448
  691   1HB   ALA  86          1HB       ALA  86  -2.737   4.334   5.435
  692   2HB   ALA  86          2HB       ALA  86  -4.171   4.531   6.470
  693   3HB   ALA  86          3HB       ALA  86  -2.944   5.817   6.399
  694    H    TRP  87           H        TRP  87  -0.875   6.084   8.363
  695    HA   TRP  87           HA       TRP  87   1.584   5.654   7.039
  696   1HB   TRP  87          2HB       TRP  87   1.908   7.625   7.824
  697   2HB   TRP  87          1HB       TRP  87   0.420   7.489   8.827
  698    HD1  TRP  87           HD       TRP  87   0.818   7.848  11.323
  699    HE1  TRP  87           1HE      TRP  87   2.757   7.643  12.933
  700    HE3  TRP  87           3HE      TRP  87   4.262   6.358   8.024
  701    HZ2  TRP  87           2HZ      TRP  87   5.543   7.093  12.749
  702    HZ3  TRP  87           3HZ      TRP  87   6.605   5.972   8.754
  703    HH2  TRP  87           HH       TRP  87   7.220   6.222  11.136
  704    H    ASP  88           H        ASP  88   0.269   4.431  10.155
  705    HA   ASP  88           HA       ASP  88   2.768   3.355  11.123
  706   1HB   ASP  88          2HB       ASP  88   0.715   4.020  12.549
  707   2HB   ASP  88          1HB       ASP  88   0.047   2.469  12.075
  708    H    LEU  89           H        LEU  89  -0.170   2.067   9.367
  709    HA   LEU  89           HA       LEU  89   0.768  -0.690   9.216
  710   1HB   LEU  89          2HB       LEU  89  -1.404   0.768   7.704
  711   2HB   LEU  89          1HB       LEU  89  -1.088  -0.943   7.637
  712    HG   LEU  89           HG       LEU  89  -1.755   0.528  10.215
  713   1HD1  LEU  89          1HD1      LEU  89  -3.966  -0.416   9.931
  714   2HD1  LEU  89          2HD1      LEU  89  -3.572   0.695   8.599
  715   3HD1  LEU  89          3HD1      LEU  89  -3.508  -1.064   8.338
  716   1HD2  LEU  89          1HD2      LEU  89  -2.204  -1.703  11.065
  717   2HD2  LEU  89          2HD2      LEU  89  -1.691  -2.423   9.521
  718   3HD2  LEU  89          3HD2      LEU  89  -0.507  -1.572  10.545
  719    H    TYR  90           H        TYR  90   0.842   2.075   6.995
  720    HA   TYR  90           HA       TYR  90   2.142   0.832   4.729
  721   1HB   TYR  90          2HB       TYR  90   1.967   3.712   5.678
  722   2HB   TYR  90          1HB       TYR  90   2.885   3.267   4.277
  723    HD1  TYR  90           1HD      TYR  90   1.181   1.128   3.064
  724    HD2  TYR  90           2HD      TYR  90   0.200   4.897   4.880
  725    HE1  TYR  90           1HE      TYR  90  -0.616   1.481   1.427
  726    HE2  TYR  90           2HE      TYR  90  -1.727   5.130   3.359
  727    HH   TYR  90           HH       TYR  90  -3.066   4.062   1.928
  728    H    TYR  91           H        TYR  91   3.486   2.572   7.519
  729    HA   TYR  91           HA       TYR  91   6.265   2.137   6.724
  730   1HB   TYR  91          2HB       TYR  91   5.298   4.068   8.119
  731   2HB   TYR  91          1HB       TYR  91   5.173   2.938   9.460
  732    HD1  TYR  91           1HD      TYR  91   7.635   4.084   6.897
  733    HD2  TYR  91           2HD      TYR  91   6.881   2.923  10.959
  734    HE1  TYR  91           1HE      TYR  91   9.908   4.823   7.519
  735    HE2  TYR  91           2HE      TYR  91   9.151   3.649  11.596
  736    HH   TYR  91           HH       TYR  91  11.160   4.254  10.842
  737    H    HIS  92           H        HIS  92   4.163   0.691   9.291
  738    HA   HIS  92           HA       HIS  92   5.942  -1.126  10.424
  739   1HB   HIS  92          2HB       HIS  92   3.588  -0.632  11.249
  740   2HB   HIS  92          1HB       HIS  92   2.950  -1.556   9.925
  741    HD1  HIS  92           1HD      HIS  92   5.728  -2.464  12.415
  742    HD2  HIS  92           2HD      HIS  92   2.149  -3.743  10.773
  743    HE1  HIS  92           1HE      HIS  92   5.351  -4.841  13.312
  744    H    VAL  93           H        VAL  93   4.023  -1.329   7.396
  745    HA   VAL  93           HA       VAL  93   4.958  -4.051   6.729
  746    HB   VAL  93           HB       VAL  93   2.647  -3.003   6.391
  747   1HG1  VAL  93          1HG1      VAL  93   2.222  -2.369   4.069
  748   2HG1  VAL  93          2HG1      VAL  93   3.222  -1.150   4.895
  749   3HG1  VAL  93          3HG1      VAL  93   3.972  -2.294   3.755
  750   1HG2  VAL  93          1HG2      VAL  93   2.294  -4.716   4.734
  751   2HG2  VAL  93          2HG2      VAL  93   4.057  -4.930   4.613
  752   3HG2  VAL  93          3HG2      VAL  93   3.226  -5.240   6.156
  753    H    PHE  94           H        PHE  94   5.771  -0.686   5.926
  754    HA   PHE  94           HA       PHE  94   7.186  -0.869   3.577
  755   1HB   PHE  94          2HB       PHE  94   6.684   1.233   4.849
  756   2HB   PHE  94          1HB       PHE  94   7.830   0.787   6.070
  757    HD1  PHE  94           1HD      PHE  94   7.467   1.550   2.483
  758    HD2  PHE  94           2HD      PHE  94  10.115   1.143   5.838
  759    HE1  PHE  94           1HE      PHE  94   9.272   2.662   1.186
  760    HE2  PHE  94           2HE      PHE  94  11.922   2.257   4.552
  761    HZ   PHE  94           HZ       PHE  94  11.497   3.018   2.229
  762    H    ARG  95           H        ARG  95   8.216  -1.971   6.793
  763    HA   ARG  95           HA       ARG  95  10.733  -3.010   5.704
  764   1HB   ARG  95          2HB       ARG  95   9.710  -2.332   8.352
  765   2HB   ARG  95          1HB       ARG  95  10.701  -3.813   8.275
  766   1HG   ARG  95          2HG       ARG  95  12.371  -2.406   6.849
  767   2HG   ARG  95          1HG       ARG  95  11.476  -0.990   7.386
  768   1HD   ARG  95          2HD       ARG  95  12.629  -3.013   9.345
  769   2HD   ARG  95          1HD       ARG  95  13.527  -1.608   8.773
  770    HE   ARG  95           HE       ARG  95  11.293  -0.440   9.601
  771   1HH1  ARG  95          2HH2      ARG  95  13.148  -2.945  11.222
  772   2HH1  ARG  95          1HH2      ARG  95  12.815  -2.343  12.814
  773   1HH2  ARG  95          1HH1      ARG  95  10.876   0.322  11.708
  774   2HH2  ARG  95          2HH1      ARG  95  11.538  -0.518  13.071
  775    H    ARG  96           H        ARG  96   7.557  -4.232   6.485
  776    HA   ARG  96           HA       ARG  96   8.241  -7.011   7.037
  777   1HB   ARG  96          2HB       ARG  96   5.637  -5.615   6.361
  778   2HB   ARG  96          1HB       ARG  96   5.818  -7.322   6.878
  779   1HG   ARG  96          2HG       ARG  96   6.725  -5.026   8.649
  780   2HG   ARG  96          1HG       ARG  96   5.073  -5.604   8.675
  781   1HD   ARG  96          2HD       ARG  96   5.619  -7.458   9.823
  782   2HD   ARG  96          1HD       ARG  96   7.060  -7.769   8.852
  783    HE   ARG  96           HE       ARG  96   7.581  -5.502  10.403
  784   1HH1  ARG  96          2HH2      ARG  96   6.828  -8.859  10.911
  785   2HH1  ARG  96          1HH2      ARG  96   7.809  -9.050  12.328
  786   1HH2  ARG  96          1HH1      ARG  96   8.945  -5.750  12.292
  787   2HH2  ARG  96          2HH1      ARG  96   8.975  -7.284  13.095
  788    H    ILE  97           H        ILE  97   6.356  -5.375   4.434
  789    HA   ILE  97           HA       ILE  97   6.589  -7.571   2.510
  790    HB   ILE  97           HB       ILE  97   5.540  -6.078   0.983
  791   1HG1  ILE  97          2HG1      ILE  97   4.284  -4.105   2.445
  792   2HG1  ILE  97          1HG1      ILE  97   5.940  -3.966   2.936
  793   1HG2  ILE  97          1HG2      ILE  97   3.344  -6.316   2.194
  794   2HG2  ILE  97          2HG2      ILE  97   4.366  -7.759   2.396
  795   3HG2  ILE  97          3HG2      ILE  97   4.234  -6.569   3.713
  796   1HD1  ILE  97          1HD1      ILE  97   5.482  -2.593   1.039
  797   2HD1  ILE  97          2HD1      ILE  97   6.651  -3.860   0.597
  798   3HD1  ILE  97          3HD1      ILE  97   4.950  -4.005   0.092
  799    H    SER  98           H        SER  98   8.601  -4.897   3.486
  800    HA   SER  98           HA       SER  98  10.103  -4.500   1.096
  801   1HB   SER  98          2HB       SER  98  10.238  -3.647   3.679
  802   2HB   SER  98          1HB       SER  98  11.731  -4.651   3.424
  803    HG   SER  98           HG       SER  98  10.700  -2.596   1.641
  804    H    LYS  99           H        LYS  99  10.493  -7.020   3.717
  805    HA   LYS  99           HA       LYS  99  11.742  -8.976   3.710
  806   1HB   LYS  99          2HB       LYS  99  11.119  -8.770   0.779
  807   2HB   LYS  99          1HB       LYS  99  12.182 -10.013   1.401
  808   1HG   LYS  99          2HG       LYS  99  10.214 -10.279   3.164
  809   2HG   LYS  99          1HG       LYS  99   9.293  -9.606   1.777
  810   1HD   LYS  99          2HD       LYS  99  10.057 -11.364   0.307
  811   2HD   LYS  99          1HD       LYS  99  11.298 -11.889   1.462
  812   1HE   LYS  99          2HE       LYS  99   9.518 -12.624   3.033
  813   2HE   LYS  99          1HE       LYS  99   8.282 -12.107   1.872
  814   1HZ   LYS  99          1HZ       LYS  99   8.753 -14.414   1.706
  815   2HZ   LYS  99          2HZ       LYS  99   9.183 -13.653   0.323
  816   3HZ   LYS  99          3HZ       LYS  99  10.330 -14.133   1.383
  817    H    GLN 100           H        GLN 100  13.113  -6.403   3.854
  818    HA   GLN 100           HA       GLN 100  15.477  -5.938   2.608
  819   1HB   GLN 100          2HB       GLN 100  14.787  -4.718   4.557
  820   2HB   GLN 100          1HB       GLN 100  15.058  -6.109   5.587
  821   1HG   GLN 100          2HG       GLN 100  17.334  -5.750   5.642
  822   2HG   GLN 100          1HG       GLN 100  17.438  -5.400   3.940
  823   1HE2  GLN 100          2HE2      GLN 100  16.539  -3.256   3.247
  824   2HE2  GLN 100          1HE2      GLN 100  16.947  -1.945   4.324
  Start of MODEL    4
    1   1H    GLU   1          1H        GLU   1  11.445 -10.481 -20.364
    2   2H    GLU   1          2H        GLU   1  10.103  -9.468 -20.361
    3    HA   GLU   1           HA       GLU   1  10.996 -11.385 -18.367
    4   1HB   GLU   1          2HB       GLU   1   9.505  -9.001 -17.395
    5   2HB   GLU   1          1HB       GLU   1  10.286 -10.343 -16.485
    6   1HG   GLU   1          2HG       GLU   1  11.724  -8.611 -16.044
    7   2HG   GLU   1          1HG       GLU   1  12.485  -9.300 -17.492
    8    H    LEU   2           H        LEU   2   8.231 -10.730 -17.055
    9    HA   LEU   2           HA       LEU   2   6.034 -11.475 -17.197
   10   1HB   LEU   2          2HB       LEU   2   6.457 -10.349 -19.897
   11   2HB   LEU   2          1HB       LEU   2   5.258 -11.604 -19.832
   12    HG   LEU   2           HG       LEU   2   4.748 -10.023 -17.586
   13   1HD1  LEU   2          1HD1      LEU   2   4.518  -7.781 -18.548
   14   2HD1  LEU   2          2HD1      LEU   2   6.219  -8.298 -18.458
   15   3HD1  LEU   2          3HD1      LEU   2   5.362  -8.327 -20.017
   16   1HD2  LEU   2          1HD2      LEU   2   2.711  -9.494 -18.923
   17   2HD2  LEU   2          2HD2      LEU   2   3.521 -10.104 -20.386
   18   3HD2  LEU   2          3HD2      LEU   2   3.138 -11.217 -19.051
   19    H    ILE   3           H        ILE   3   4.653 -13.340 -17.953
   20    HA   ILE   3           HA       ILE   3   4.444 -15.586 -17.857
   21    HB   ILE   3           HB       ILE   3   5.016 -14.758 -20.248
   22   1HG1  ILE   3          2HG1      ILE   3   3.233 -15.937 -19.874
   23   2HG1  ILE   3          1HG1      ILE   3   4.218 -16.880 -21.047
   24   1HG2  ILE   3          1HG2      ILE   3   6.423 -16.346 -21.453
   25   2HG2  ILE   3          2HG2      ILE   3   7.390 -15.342 -20.346
   26   3HG2  ILE   3          3HG2      ILE   3   7.002 -17.024 -19.913
   27   1HD1  ILE   3          1HD1      ILE   3   3.063 -18.338 -19.467
   28   2HD1  ILE   3          2HD1      ILE   3   4.827 -18.442 -19.265
   29   3HD1  ILE   3          3HD1      ILE   3   3.853 -17.509 -18.104
   30    H    ARG   4           H        ARG   4   6.652 -14.463 -16.168
   31    HA   ARG   4           HA       ARG   4   7.986 -16.969 -15.268
   32   1HB   ARG   4          2HB       ARG   4  10.229 -15.917 -15.409
   33   2HB   ARG   4          1HB       ARG   4   9.547 -16.189 -16.980
   34   1HG   ARG   4          2HG       ARG   4   8.694 -13.637 -16.556
   35   2HG   ARG   4          1HG       ARG   4  10.187 -13.653 -15.620
   36   1HD   ARG   4          2HD       ARG   4  10.397 -14.972 -18.256
   37   2HD   ARG   4          1HD       ARG   4  10.038 -13.236 -18.312
   38    HE   ARG   4           HE       ARG   4  12.050 -13.554 -16.427
   39   1HH1  ARG   4          2HH2      ARG   4  11.687 -14.223 -19.853
   40   2HH1  ARG   4          1HH2      ARG   4  13.367 -13.999 -20.211
   41   1HH2  ARG   4          2HH1      ARG   4  14.249 -13.259 -16.918
   42   2HH2  ARG   4          1HH1      ARG   4  14.797 -13.450 -18.549
   43    H    VAL   5           H        VAL   5   8.020 -13.438 -14.819
   44    HA   VAL   5           HA       VAL   5   7.957 -13.701 -11.889
   45    HB   VAL   5           HB       VAL   5   9.682 -12.382 -12.789
   46   1HG1  VAL   5          1HG1      VAL   5   9.309 -10.245 -13.938
   47   2HG1  VAL   5          2HG1      VAL   5   8.728 -11.610 -14.921
   48   3HG1  VAL   5          3HG1      VAL   5   7.566 -10.593 -14.037
   49   1HG2  VAL   5          1HG2      VAL   5   9.362 -10.333 -11.553
   50   2HG2  VAL   5          2HG2      VAL   5   7.637 -10.726 -11.360
   51   3HG2  VAL   5          3HG2      VAL   5   8.876 -11.788 -10.649
   52    H    ALA   6           H        ALA   6   6.082 -12.151 -14.545
   53    HA   ALA   6           HA       ALA   6   3.896 -11.539 -14.782
   54   1HB   ALA   6          1HB       ALA   6   2.165 -12.460 -13.407
   55   2HB   ALA   6          2HB       ALA   6   3.266 -13.706 -14.041
   56   3HB   ALA   6          3HB       ALA   6   3.385 -13.195 -12.341
   57    H    ILE   7           H        ILE   7   5.713  -9.737 -13.801
   58    HA   ILE   7           HA       ILE   7   6.256  -8.053 -12.284
   59    HB   ILE   7           HB       ILE   7   5.160  -7.171 -14.182
   60   1HG1  ILE   7          2HG1      ILE   7   6.314  -5.802 -12.905
   61   2HG1  ILE   7          1HG1      ILE   7   4.781  -5.015 -13.443
   62   1HG2  ILE   7          1HG2      ILE   7   2.888  -6.255 -14.053
   63   2HG2  ILE   7          2HG2      ILE   7   2.866  -8.033 -13.982
   64   3HG2  ILE   7          3HG2      ILE   7   2.631  -7.080 -12.497
   65   1HD1  ILE   7          1HD1      ILE   7   5.450  -4.270 -11.232
   66   2HD1  ILE   7          2HD1      ILE   7   3.918  -5.174 -11.171
   67   3HD1  ILE   7          3HD1      ILE   7   5.430  -5.949 -10.641
   68    H    LEU   8           H        LEU   8   6.357  -9.363 -10.308
   69    HA   LEU   8           HA       LEU   8   4.263 -10.009  -8.576
   70   1HB   LEU   8          2HB       LEU   8   7.132  -9.698  -8.499
   71   2HB   LEU   8          1HB       LEU   8   6.343  -9.206  -6.962
   72    HG   LEU   8           HG       LEU   8   6.967 -11.557  -6.759
   73   1HD1  LEU   8          1HD1      LEU   8   4.877 -12.557  -6.307
   74   2HD1  LEU   8          2HD1      LEU   8   4.952 -10.881  -5.714
   75   3HD1  LEU   8          3HD1      LEU   8   4.034 -11.263  -7.190
   76   1HD2  LEU   8          1HD2      LEU   8   6.197 -13.263  -8.248
   77   2HD2  LEU   8          2HD2      LEU   8   5.438 -12.052  -9.307
   78   3HD2  LEU   8          3HD2      LEU   8   7.208 -12.097  -9.134
   79    H    TRP   9           H        TRP   9   3.432  -9.082  -6.665
   80    HA   TRP   9           HA       TRP   9   2.853  -6.158  -6.962
   81   1HB   TRP   9          2HB       TRP   9   1.418  -8.234  -5.376
   82   2HB   TRP   9          1HB       TRP   9   1.146  -6.523  -5.251
   83    HD1  TRP   9           HD       TRP   9   1.560  -6.219  -8.649
   84    HE1  TRP   9           1HE      TRP   9  -0.682  -6.410  -9.812
   85    HE3  TRP   9           3HE      TRP   9  -0.767  -9.056  -5.204
   86    HZ2  TRP   9           2HZ      TRP   9  -3.189  -7.604  -9.279
   87    HZ3  TRP   9           3HZ      TRP   9  -3.107  -9.713  -5.541
   88    HH2  TRP   9           HH       TRP   9  -4.273  -9.131  -7.665
   89    H    HIS  10           H        HIS  10   4.084  -8.412  -4.434
   90    HA   HIS  10           HA       HIS  10   4.778  -6.679  -2.396
   91   1HB   HIS  10          2HB       HIS  10   5.229  -8.747  -1.842
   92   2HB   HIS  10          1HB       HIS  10   5.619  -9.230  -3.533
   93    HD1  HIS  10           1HD      HIS  10   7.322  -8.792  -0.293
   94    HD2  HIS  10           2HD      HIS  10   8.177  -8.574  -4.326
   95    HE1  HIS  10           1HE      HIS  10   9.861  -8.579  -0.458
   96    H    GLU  11           H        GLU  11   6.421  -7.052  -5.518
   97    HA   GLU  11           HA       GLU  11   8.766  -5.468  -5.079
   98   1HB   GLU  11          2HB       GLU  11   7.290  -6.126  -7.669
   99   2HB   GLU  11          1HB       GLU  11   8.911  -5.515  -7.543
  100   1HG   GLU  11          2HG       GLU  11   7.974  -8.115  -6.366
  101   2HG   GLU  11          1HG       GLU  11   8.784  -7.892  -7.953
  102    H    MET  12           H        MET  12   5.581  -4.653  -6.569
  103    HA   MET  12           HA       MET  12   6.215  -1.881  -7.049
  104   1HB   MET  12          2HB       MET  12   4.038  -1.751  -7.900
  105   2HB   MET  12          1HB       MET  12   4.448  -3.407  -8.233
  106   1HG   MET  12          2HG       MET  12   3.364  -3.991  -6.035
  107   2HG   MET  12          1HG       MET  12   2.719  -2.306  -6.071
  108   1HE   MET  12          1HE       MET  12   0.517  -2.483  -9.297
  109   2HE   MET  12          2HE       MET  12   1.189  -1.434  -8.027
  110   3HE   MET  12          3HE       MET  12   2.264  -2.152  -9.250
  111    H    TRP  13           H        TRP  13   5.263  -3.770  -4.195
  112    HA   TRP  13           HA       TRP  13   4.044  -1.679  -2.610
  113   1HB   TRP  13          2HB       TRP  13   4.872  -4.434  -2.272
  114   2HB   TRP  13          1HB       TRP  13   4.912  -3.367  -0.832
  115    HD1  TRP  13           HD       TRP  13   2.931  -4.745   0.224
  116    HE1  TRP  13           1HE      TRP  13   0.422  -4.703  -0.126
  117    HE3  TRP  13           3HE      TRP  13   2.745  -1.947  -3.993
  118    HZ2  TRP  13           2HZ      TRP  13  -1.377  -3.553  -1.983
  119    HZ3  TRP  13           3HZ      TRP  13   0.709  -2.021  -5.363
  120    HH2  TRP  13           HH       TRP  13  -1.392  -2.756  -4.339
  121    H    HIS  14           H        HIS  14   7.412  -2.868  -2.956
  122    HA   HIS  14           HA       HIS  14   8.702  -1.372  -0.964
  123   1HB   HIS  14          2HB       HIS  14   9.531  -2.574  -3.567
  124   2HB   HIS  14          1HB       HIS  14  10.538  -1.305  -2.968
  125    HD1  HIS  14           1HD      HIS  14  11.645  -4.067  -3.070
  126    HD2  HIS  14           2HD      HIS  14   9.808  -2.357   0.220
  127    HE1  HIS  14           1HE      HIS  14  12.691  -5.184  -1.019
  128    H    GLU  15           H        GLU  15   8.552  -0.351  -4.389
  129    HA   GLU  15           HA       GLU  15   9.041   2.469  -3.840
  130   1HB   GLU  15          2HB       GLU  15   8.812   2.791  -6.190
  131   2HB   GLU  15          1HB       GLU  15   9.792   1.380  -5.935
  132   1HG   GLU  15          2HG       GLU  15   7.908  -0.091  -6.464
  133   2HG   GLU  15          1HG       GLU  15   6.825   1.284  -6.582
  134    H    GLY  16           H        GLY  16   5.929   0.622  -4.690
  135   1HA   GLY  16          2HA       GLY  16   4.305   2.865  -4.931
  136   2HA   GLY  16          1HA       GLY  16   3.792   1.285  -4.393
  137    H    LEU  17           H        LEU  17   5.410   1.202  -1.932
  138    HA   LEU  17           HA       LEU  17   4.022   3.124  -0.196
  139   1HB   LEU  17          2HB       LEU  17   5.662   0.719   0.215
  140   2HB   LEU  17          1HB       LEU  17   5.599   1.966   1.468
  141    HG   LEU  17           HG       LEU  17   3.124   0.805   0.138
  142   1HD1  LEU  17          1HD1      LEU  17   2.893  -0.531   2.208
  143   2HD1  LEU  17          2HD1      LEU  17   4.388  -0.950   1.339
  144   3HD1  LEU  17          3HD1      LEU  17   4.460   0.087   2.783
  145   1HD2  LEU  17          1HD2      LEU  17   2.001   1.804   2.104
  146   2HD2  LEU  17          2HD2      LEU  17   3.566   2.423   2.686
  147   3HD2  LEU  17          3HD2      LEU  17   2.870   3.043   1.169
  148    H    GLU  18           H        GLU  18   7.219   2.952  -1.801
  149    HA   GLU  18           HA       GLU  18   8.438   4.907   0.038
  150   1HB   GLU  18          2HB       GLU  18   9.644   3.050  -1.104
  151   2HB   GLU  18          1HB       GLU  18   9.493   4.000  -2.591
  152   1HG   GLU  18          2HG       GLU  18  10.832   5.721  -1.794
  153   2HG   GLU  18          1HG       GLU  18  10.473   5.353  -0.089
  154    H    GLU  19           H        GLU  19   7.323   4.989  -3.401
  155    HA   GLU  19           HA       GLU  19   7.598   7.845  -3.783
  156   1HB   GLU  19          2HB       GLU  19   7.557   5.893  -5.522
  157   2HB   GLU  19          1HB       GLU  19   5.824   5.972  -5.361
  158   1HG   GLU  19          2HG       GLU  19   6.619   7.354  -7.227
  159   2HG   GLU  19          1HG       GLU  19   5.853   8.366  -6.018
  160    H    ALA  20           H        ALA  20   5.396   6.029  -1.877
  161    HA   ALA  20           HA       ALA  20   3.242   8.091  -2.042
  162   1HB   ALA  20          1HB       ALA  20   1.898   6.493  -0.828
  163   2HB   ALA  20          2HB       ALA  20   2.511   5.784  -2.341
  164   3HB   ALA  20          3HB       ALA  20   3.258   5.346  -0.787
  165    H    SER  21           H        SER  21   4.985   6.101   0.436
  166    HA   SER  21           HA       SER  21   4.355   7.677   2.690
  167   1HB   SER  21          2HB       SER  21   6.729   5.890   2.249
  168   2HB   SER  21          1HB       SER  21   6.210   6.600   3.787
  169    HG   SER  21           HG       SER  21   5.453   4.340   3.196
  170    H    ARG  22           H        ARG  22   6.869   8.137   0.127
  171    HA   ARG  22           HA       ARG  22   8.263  10.194   1.507
  172   1HB   ARG  22          2HB       ARG  22   9.219   8.906  -0.340
  173   2HB   ARG  22          1HB       ARG  22   8.094   9.664  -1.461
  174   1HG   ARG  22          2HG       ARG  22   8.979  11.867  -0.889
  175   2HG   ARG  22          1HG       ARG  22  10.124  11.097   0.257
  176   1HD   ARG  22          2HD       ARG  22  11.376  10.134  -1.427
  177   2HD   ARG  22          1HD       ARG  22   9.985  10.058  -2.551
  178    HE   ARG  22           HE       ARG  22  10.614  12.772  -1.980
  179   1HH1  ARG  22          2HH2      ARG  22  11.867  10.066  -3.798
  180   2HH1  ARG  22          1HH2      ARG  22  12.644  11.039  -5.006
  181   1HH2  ARG  22          2HH1      ARG  22  11.630  14.060  -3.581
  182   2HH2  ARG  22          1HH1      ARG  22  12.505  13.291  -4.864
  183    H    LEU  23           H        LEU  23   5.380  10.320  -0.666
  184    HA   LEU  23           HA       LEU  23   5.255  13.185  -1.059
  185   1HB   LEU  23          2HB       LEU  23   3.570  10.844  -1.478
  186   2HB   LEU  23          1HB       LEU  23   2.734  12.400  -1.141
  187    HG   LEU  23           HG       LEU  23   2.919  12.111  -3.577
  188   1HD1  LEU  23          1HD1      LEU  23   4.019  14.089  -4.207
  189   2HD1  LEU  23          2HD1      LEU  23   3.012  14.324  -2.759
  190   3HD1  LEU  23          3HD1      LEU  23   4.781  14.215  -2.604
  191   1HD2  LEU  23          1HD2      LEU  23   5.016  11.950  -4.716
  192   2HD2  LEU  23          2HD2      LEU  23   5.895  11.866  -3.170
  193   3HD2  LEU  23          3HD2      LEU  23   4.800  10.545  -3.644
  194    H    TYR  24           H        TYR  24   4.547  11.081   1.597
  195    HA   TYR  24           HA       TYR  24   3.320  13.377   3.086
  196   1HB   TYR  24          2HB       TYR  24   2.097  11.176   2.964
  197   2HB   TYR  24          1HB       TYR  24   3.388  10.465   3.926
  198    HD1  TYR  24           1HD      TYR  24   1.924  13.915   4.253
  199    HD2  TYR  24           2HD      TYR  24   2.322   9.995   5.929
  200    HE1  TYR  24           1HE      TYR  24   0.750  14.661   6.278
  201    HE2  TYR  24           2HE      TYR  24   1.195  10.714   7.960
  202    HH   TYR  24           HH       TYR  24   0.003  12.319   8.894
  203    H    PHE  25           H        PHE  25   6.160  11.260   3.052
  204    HA   PHE  25           HA       PHE  25   7.274  11.449   5.556
  205   1HB   PHE  25          2HB       PHE  25   8.074  10.074   3.696
  206   2HB   PHE  25          1HB       PHE  25   8.532  11.551   2.788
  207    HD1  PHE  25           1HD      PHE  25   9.397   9.252   5.495
  208    HD2  PHE  25           2HD      PHE  25  10.512  12.829   3.389
  209    HE1  PHE  25           1HE      PHE  25  11.635   9.191   6.571
  210    HE2  PHE  25           2HE      PHE  25  12.727  12.799   4.499
  211    HZ   PHE  25           HZ       PHE  25  13.292  10.972   6.080
  212    H    GLY  26           H        GLY  26   7.925  13.654   2.770
  213   1HA   GLY  26          2HA       GLY  26   8.079  16.023   4.547
  214   2HA   GLY  26          1HA       GLY  26   9.556  15.577   3.740
  215    H    GLU  27           H        GLU  27   6.335  15.080   2.266
  216    HA   GLU  27           HA       GLU  27   6.914  17.365   0.378
  217   1HB   GLU  27          2HB       GLU  27   6.134  14.634  -0.180
  218   2HB   GLU  27          1HB       GLU  27   4.991  15.785  -0.806
  219   1HG   GLU  27          2HG       GLU  27   6.433  15.976  -2.550
  220   2HG   GLU  27          1HG       GLU  27   7.423  16.957  -1.517
  221    H    ARG  28           H        ARG  28   5.003  16.638   3.079
  222    HA   ARG  28           HA       ARG  28   2.768  17.019   3.735
  223   1HB   ARG  28          2HB       ARG  28   4.404  19.248   3.404
  224   2HB   ARG  28          1HB       ARG  28   2.794  19.700   2.810
  225   1HG   ARG  28          2HG       ARG  28   2.097  19.862   4.937
  226   2HG   ARG  28          1HG       ARG  28   2.381  18.115   5.134
  227   1HD   ARG  28          2HD       ARG  28   4.292  18.469   6.352
  228   2HD   ARG  28          1HD       ARG  28   4.876  19.705   5.231
  229    HE   ARG  28           HE       ARG  28   3.653  20.130   7.720
  230   1HH1  ARG  28          2HH2      ARG  28   3.526  21.537   4.498
  231   2HH1  ARG  28          1HH2      ARG  28   3.075  23.111   5.064
  232   1HH2  ARG  28          2HH1      ARG  28   3.027  22.216   8.418
  233   2HH2  ARG  28          1HH1      ARG  28   2.783  23.464   7.243
  234    H    ASN  29           H        ASN  29   2.916  15.892   1.002
  235    HA   ASN  29           HA       ASN  29   0.379  16.999  -0.015
  236   1HB   ASN  29          2HB       ASN  29   2.648  17.430  -1.317
  237   2HB   ASN  29          1HB       ASN  29   2.546  15.750  -1.773
  238   1HD2  ASN  29          2HD2      ASN  29   2.502  17.958  -3.494
  239   2HD2  ASN  29          1HD2      ASN  29   0.941  17.985  -4.269
  240    H    VAL  30           H        VAL  30  -0.148  15.276   1.751
  241    HA   VAL  30           HA       VAL  30  -0.233  12.542   1.433
  242    HB   VAL  30           HB       VAL  30  -2.169  14.572   2.425
  243   1HG1  VAL  30          1HG1      VAL  30  -3.597  12.841   3.387
  244   2HG1  VAL  30          2HG1      VAL  30  -3.663  12.813   1.608
  245   3HG1  VAL  30          3HG1      VAL  30  -2.710  11.590   2.482
  246   1HG2  VAL  30          1HG2      VAL  30  -1.640  13.323   4.547
  247   2HG2  VAL  30          2HG2      VAL  30  -0.653  12.179   3.609
  248   3HG2  VAL  30          3HG2      VAL  30  -0.152  13.881   3.748
  249    H    LYS  31           H        LYS  31  -1.902  14.986  -0.539
  250    HA   LYS  31           HA       LYS  31  -3.749  13.285  -1.950
  251   1HB   LYS  31          2HB       LYS  31  -4.041  15.632  -1.582
  252   2HB   LYS  31          1HB       LYS  31  -2.517  15.980  -2.474
  253   1HG   LYS  31          2HG       LYS  31  -4.860  14.641  -3.846
  254   2HG   LYS  31          1HG       LYS  31  -4.777  16.388  -3.687
  255   1HD   LYS  31          2HD       LYS  31  -2.208  15.624  -4.621
  256   2HD   LYS  31          1HD       LYS  31  -3.349  14.655  -5.536
  257   1HE   LYS  31          2HE       LYS  31  -4.645  16.775  -5.980
  258   2HE   LYS  31          1HE       LYS  31  -3.260  17.654  -5.276
  259   1HZ   LYS  31          1HZ       LYS  31  -3.054  17.394  -7.645
  260   2HZ   LYS  31          2HZ       LYS  31  -1.862  16.569  -6.883
  261   3HZ   LYS  31          3HZ       LYS  31  -3.140  15.768  -7.505
  262    H    GLY  32           H        GLY  32  -0.247  13.990  -2.249
  263   1HA   GLY  32          2HA       GLY  32   0.085  13.137  -5.005
  264   2HA   GLY  32          1HA       GLY  32   1.333  13.424  -3.812
  265    H    MET  33           H        MET  33   0.880  11.621  -1.779
  266    HA   MET  33           HA       MET  33   1.754   9.119  -2.755
  267   1HB   MET  33          2HB       MET  33   1.596   8.327  -0.679
  268   2HB   MET  33          1HB       MET  33   1.873  10.093  -0.444
  269   1HG   MET  33          2HG       MET  33  -0.355  10.403   0.308
  270   2HG   MET  33          1HG       MET  33  -0.816   8.758  -0.155
  271   1HE   MET  33          1HE       MET  33  -0.705   9.498   3.730
  272   2HE   MET  33          2HE       MET  33  -0.639  10.742   2.458
  273   3HE   MET  33          3HE       MET  33  -1.733   9.348   2.285
  274    H    PHE  34           H        PHE  34  -1.473  10.392  -2.358
  275    HA   PHE  34           HA       PHE  34  -3.042   7.979  -2.548
  276   1HB   PHE  34          2HB       PHE  34  -3.505  10.903  -2.675
  277   2HB   PHE  34          1HB       PHE  34  -4.685   9.826  -3.433
  278    HD1  PHE  34           1HD      PHE  34  -5.071   7.573  -1.917
  279    HD2  PHE  34           2HD      PHE  34  -4.017  11.486  -0.496
  280    HE1  PHE  34           1HE      PHE  34  -6.173   7.076   0.251
  281    HE2  PHE  34           2HE      PHE  34  -5.132  10.990   1.668
  282    HZ   PHE  34           HZ       PHE  34  -6.138   8.783   2.056
  283    H    GLU  35           H        GLU  35  -1.282   9.875  -4.962
  284    HA   GLU  35           HA       GLU  35  -2.782   8.805  -7.253
  285   1HB   GLU  35          2HB       GLU  35  -1.703  11.125  -7.035
  286   2HB   GLU  35          1HB       GLU  35  -0.160  10.302  -7.240
  287   1HG   GLU  35          2HG       GLU  35  -0.499  10.090  -9.480
  288   2HG   GLU  35          1HG       GLU  35  -2.093   9.398  -9.256
  289    H    VAL  36           H        VAL  36   0.388   8.152  -5.624
  290    HA   VAL  36           HA       VAL  36   1.094   6.095  -7.628
  291    HB   VAL  36           HB       VAL  36   2.796   7.622  -6.793
  292   1HG1  VAL  36          1HG1      VAL  36   3.718   7.264  -4.590
  293   2HG1  VAL  36          2HG1      VAL  36   2.041   7.846  -4.468
  294   3HG1  VAL  36          3HG1      VAL  36   2.408   6.126  -4.194
  295   1HG2  VAL  36          1HG2      VAL  36   4.470   5.979  -6.525
  296   2HG2  VAL  36          2HG2      VAL  36   3.232   4.719  -6.315
  297   3HG2  VAL  36          3HG2      VAL  36   3.355   5.596  -7.858
  298    H    LEU  37           H        LEU  37  -0.290   6.292  -4.332
  299    HA   LEU  37           HA       LEU  37  -0.487   3.396  -3.970
  300   1HB   LEU  37          2HB       LEU  37  -0.225   5.468  -2.283
  301   2HB   LEU  37          1HB       LEU  37  -1.972   5.239  -2.254
  302    HG   LEU  37           HG       LEU  37  -0.910   2.636  -2.203
  303   1HD1  LEU  37          1HD1      LEU  37   0.587   2.652  -0.274
  304   2HD1  LEU  37          2HD1      LEU  37   1.302   3.518  -1.656
  305   3HD1  LEU  37          3HD1      LEU  37   0.609   4.431  -0.293
  306   1HD2  LEU  37          1HD2      LEU  37  -1.825   2.664   0.089
  307   2HD2  LEU  37          2HD2      LEU  37  -1.889   4.443   0.040
  308   3HD2  LEU  37          3HD2      LEU  37  -2.919   3.484  -1.050
  309    H    GLU  38           H        GLU  38  -2.380   5.744  -5.690
  310    HA   GLU  38           HA       GLU  38  -5.020   4.713  -5.495
  311   1HB   GLU  38          2HB       GLU  38  -3.614   6.647  -7.133
  312   2HB   GLU  38          1HB       GLU  38  -4.561   5.613  -8.154
  313   1HG   GLU  38          2HG       GLU  38  -6.041   6.515  -5.749
  314   2HG   GLU  38          1HG       GLU  38  -5.530   7.794  -6.810
  315    HA   PRO  39           HA       PRO  39  -3.918   1.511  -8.938
  316   1HB   PRO  39          2HB       PRO  39  -1.385   0.971  -9.608
  317   2HB   PRO  39          1HB       PRO  39  -2.292   2.255 -10.405
  318   1HG   PRO  39          2HG       PRO  39  -0.267   2.501  -8.130
  319   2HG   PRO  39          1HG       PRO  39  -0.378   3.470  -9.597
  320   1HD   PRO  39          1HD       PRO  39  -1.529   4.310  -7.197
  321   2HD   PRO  39          2HD       PRO  39  -2.306   4.694  -8.791
  322    H    LEU  40           H        LEU  40  -1.884   1.914  -6.020
  323    HA   LEU  40           HA       LEU  40  -1.394  -0.947  -5.637
  324   1HB   LEU  40          2HB       LEU  40  -1.231   1.240  -3.611
  325   2HB   LEU  40          1HB       LEU  40  -0.306  -0.293  -3.739
  326    HG   LEU  40           HG       LEU  40  -0.016   2.165  -5.454
  327   1HD1  LEU  40          1HD1      LEU  40   2.159   2.220  -4.164
  328   2HD1  LEU  40          2HD1      LEU  40   0.733   2.297  -3.103
  329   3HD1  LEU  40          3HD1      LEU  40   1.625   0.768  -3.284
  330   1HD2  LEU  40          1HD2      LEU  40   2.003   1.195  -6.406
  331   2HD2  LEU  40          2HD2      LEU  40   1.679  -0.340  -5.567
  332   3HD2  LEU  40          3HD2      LEU  40   0.567   0.236  -6.831
  333    H    HIS  41           H        HIS  41  -4.015   1.272  -5.001
  334    HA   HIS  41           HA       HIS  41  -5.422  -0.390  -3.092
  335   1HB   HIS  41          2HB       HIS  41  -5.774   1.921  -3.067
  336   2HB   HIS  41          1HB       HIS  41  -5.944   1.999  -4.850
  337    HD1  HIS  41           1HD      HIS  41  -8.010   0.124  -2.140
  338    HD2  HIS  41           2HD      HIS  41  -8.262   2.459  -5.555
  339    HE1  HIS  41           1HE      HIS  41 -10.489   0.192  -2.770
  340    H    ALA  42           H        ALA  42  -5.398  -0.035  -6.644
  341    HA   ALA  42           HA       ALA  42  -7.761  -1.768  -7.024
  342   1HB   ALA  42          1HB       ALA  42  -7.445  -1.221  -9.353
  343   2HB   ALA  42          2HB       ALA  42  -7.514   0.243  -8.343
  344   3HB   ALA  42          3HB       ALA  42  -5.950  -0.338  -8.962
  345    H    MET  43           H        MET  43  -4.235  -1.813  -7.771
  346    HA   MET  43           HA       MET  43  -4.026  -4.528  -8.718
  347   1HB   MET  43          2HB       MET  43  -1.976  -2.624  -7.586
  348   2HB   MET  43          1HB       MET  43  -1.630  -4.190  -8.273
  349   1HG   MET  43          2HG       MET  43  -3.241  -2.851 -10.213
  350   2HG   MET  43          1HG       MET  43  -2.074  -1.688  -9.645
  351   1HE   MET  43          1HE       MET  43  -0.086  -2.538 -12.686
  352   2HE   MET  43          2HE       MET  43  -1.786  -2.069 -12.455
  353   3HE   MET  43          3HE       MET  43  -0.514  -1.316 -11.465
  354    H    MET  44           H        MET  44  -4.617  -3.359  -5.481
  355    HA   MET  44           HA       MET  44  -3.758  -5.996  -4.331
  356   1HB   MET  44          2HB       MET  44  -3.709  -4.989  -2.224
  357   2HB   MET  44          1HB       MET  44  -2.992  -3.791  -3.243
  358   1HG   MET  44          2HG       MET  44  -5.128  -2.613  -3.376
  359   2HG   MET  44          1HG       MET  44  -5.823  -3.836  -2.263
  360   1HE   MET  44          1HE       MET  44  -5.704  -0.718  -0.050
  361   2HE   MET  44          2HE       MET  44  -6.049  -0.817  -1.792
  362   3HE   MET  44          3HE       MET  44  -6.664  -2.072  -0.691
  363    H    GLU  45           H        GLU  45  -6.621  -4.143  -5.248
  364    HA   GLU  45           HA       GLU  45  -8.453  -5.706  -3.543
  365   1HB   GLU  45          2HB       GLU  45  -8.633  -3.163  -3.941
  366   2HB   GLU  45          1HB       GLU  45  -9.213  -3.554  -5.522
  367   1HG   GLU  45          2HG       GLU  45 -10.421  -4.760  -3.061
  368   2HG   GLU  45          1HG       GLU  45 -10.888  -3.164  -3.730
  369    H    ARG  46           H        ARG  46  -7.503  -5.495  -7.026
  370    HA   ARG  46           HA       ARG  46  -9.440  -6.888  -8.348
  371   1HB   ARG  46          2HB       ARG  46  -6.966  -6.052  -9.004
  372   2HB   ARG  46          1HB       ARG  46  -6.600  -7.761  -8.780
  373   1HG   ARG  46          2HG       ARG  46  -7.189  -7.692 -11.018
  374   2HG   ARG  46          1HG       ARG  46  -8.740  -8.135 -10.270
  375   1HD   ARG  46          2HD       ARG  46  -8.689  -5.297 -10.190
  376   2HD   ARG  46          1HD       ARG  46  -8.054  -5.702 -11.775
  377    HE   ARG  46           HE       ARG  46 -10.405  -7.210 -11.119
  378   1HH1  ARG  46          2HH2      ARG  46  -9.321  -4.078 -12.277
  379   2HH1  ARG  46          1HH2      ARG  46 -10.812  -3.709 -13.084
  380   1HH2  ARG  46          2HH1      ARG  46 -12.366  -6.687 -12.207
  381   2HH2  ARG  46          1HH1      ARG  46 -12.497  -5.177 -13.041
  382    H    GLY  47           H        GLY  47  -6.950  -8.333  -6.191
  383   1HA   GLY  47          2HA       GLY  47  -8.139 -10.030  -4.713
  384   2HA   GLY  47          1HA       GLY  47  -8.385 -10.914  -6.231
  385    HA   PRO  48           HA       PRO  48  -4.162 -12.089  -4.750
  386   1HB   PRO  48          2HB       PRO  48  -4.452 -14.793  -4.707
  387   2HB   PRO  48          1HB       PRO  48  -5.002 -13.796  -3.361
  388   1HG   PRO  48          2HG       PRO  48  -6.651 -14.937  -5.669
  389   2HG   PRO  48          1HG       PRO  48  -7.029 -14.954  -3.947
  390   1HD   PRO  48          1HD       PRO  48  -8.003 -12.958  -5.696
  391   2HD   PRO  48          2HD       PRO  48  -7.649 -12.600  -3.941
  392    H    GLN  49           H        GLN  49  -2.999 -14.330  -6.026
  393    HA   GLN  49           HA       GLN  49  -3.634 -14.165  -8.878
  394   1HB   GLN  49          2HB       GLN  49  -1.744 -12.359  -7.920
  395   2HB   GLN  49          1HB       GLN  49  -0.724 -13.711  -8.311
  396   1HG   GLN  49          2HG       GLN  49  -0.742 -12.588 -10.331
  397   2HG   GLN  49          1HG       GLN  49  -2.076 -13.672 -10.619
  398   1HE2  GLN  49          2HE2      GLN  49  -2.046 -11.601 -12.156
  399   2HE2  GLN  49          1HE2      GLN  49  -3.228 -10.429 -11.618
  400    H    THR  50           H        THR  50  -1.048 -15.346  -9.556
  401    HA   THR  50           HA       THR  50  -1.191 -18.056  -9.583
  402    HB   THR  50           HB       THR  50   0.412 -17.312 -10.852
  403    HG1  THR  50           1HG      THR  50   2.390 -18.263  -9.999
  404   1HG2  THR  50          1HG2      THR  50   2.348 -15.942 -10.238
  405   2HG2  THR  50          2HG2      THR  50   0.825 -15.070  -9.939
  406   3HG2  THR  50          3HG2      THR  50   1.724 -15.783  -8.579
  407    H    LEU  51           H        LEU  51   1.340 -17.108  -7.444
  408    HA   LEU  51           HA       LEU  51   0.181 -17.615  -4.825
  409   1HB   LEU  51          2HB       LEU  51   0.652 -19.939  -6.279
  410   2HB   LEU  51          1HB       LEU  51   2.174 -19.734  -5.467
  411    HG   LEU  51           HG       LEU  51   0.958 -19.505  -3.317
  412   1HD1  LEU  51          1HD1      LEU  51  -1.363 -20.286  -3.186
  413   2HD1  LEU  51          2HD1      LEU  51  -1.228 -18.777  -4.121
  414   3HD1  LEU  51          3HD1      LEU  51  -1.452 -20.329  -4.963
  415   1HD2  LEU  51          1HD2      LEU  51   0.468 -21.951  -3.230
  416   2HD2  LEU  51          2HD2      LEU  51   0.472 -22.005  -5.009
  417   3HD2  LEU  51          3HD2      LEU  51   1.970 -21.623  -4.125
  418    H    LYS  52           H        LYS  52   1.783 -15.557  -6.206
  419    HA   LYS  52           HA       LYS  52   4.285 -15.640  -4.541
  420   1HB   LYS  52          2HB       LYS  52   3.913 -14.556  -7.339
  421   2HB   LYS  52          1HB       LYS  52   5.296 -14.235  -6.335
  422   1HG   LYS  52          2HG       LYS  52   4.984 -17.037  -6.248
  423   2HG   LYS  52          1HG       LYS  52   4.700 -16.557  -7.921
  424   1HD   LYS  52          2HD       LYS  52   6.897 -16.241  -8.214
  425   2HD   LYS  52          1HD       LYS  52   6.920 -15.030  -6.918
  426   1HE   LYS  52          2HE       LYS  52   7.231 -16.813  -5.225
  427   2HE   LYS  52          1HE       LYS  52   7.106 -18.053  -6.465
  428   1HZ   LYS  52          1HZ       LYS  52   9.325 -17.586  -5.929
  429   2HZ   LYS  52          2HZ       LYS  52   9.046 -17.143  -7.475
  430   3HZ   LYS  52          3HZ       LYS  52   9.173 -16.006  -6.307
  431    H    GLU  53           H        GLU  53   2.105 -13.286  -6.195
  432    HA   GLU  53           HA       GLU  53   2.473 -11.209  -4.164
  433   1HB   GLU  53          2HB       GLU  53   0.935  -9.977  -5.450
  434   2HB   GLU  53          1HB       GLU  53   2.422 -10.524  -6.297
  435   1HG   GLU  53          2HG       GLU  53   0.002 -12.180  -6.650
  436   2HG   GLU  53          1HG       GLU  53  -0.015 -10.546  -7.388
  437    H    THR  54           H        THR  54   1.818 -13.050  -2.551
  438    HA   THR  54           HA       THR  54  -0.827 -12.312  -1.469
  439    HB   THR  54           HB       THR  54  -0.270 -15.057  -2.456
  440    HG1  THR  54           1HG      THR  54  -1.703 -12.790  -3.221
  441   1HG2  THR  54          1HG2      THR  54  -2.432 -15.750  -1.568
  442   2HG2  THR  54          2HG2      THR  54  -1.301 -15.336  -0.257
  443   3HG2  THR  54          3HG2      THR  54  -2.592 -14.198  -0.710
  444    H    SER  55           H        SER  55   1.809 -11.634  -0.570
  445    HA   SER  55           HA       SER  55   2.252 -13.316   1.832
  446   1HB   SER  55          2HB       SER  55   4.197 -11.973   2.222
  447   2HB   SER  55          1HB       SER  55   4.217 -12.503   0.554
  448    HG   SER  55           HG       SER  55   4.732 -10.233   1.070
  449    H    PHE  56           H        PHE  56   1.214 -10.033   0.937
  450    HA   PHE  56           HA       PHE  56   0.634  -9.062   3.575
  451   1HB   PHE  56          2HB       PHE  56  -0.369  -7.184   2.436
  452   2HB   PHE  56          1HB       PHE  56   1.167  -7.549   1.720
  453    HD1  PHE  56           1HD      PHE  56   1.357  -8.511  -0.484
  454    HD2  PHE  56           2HD      PHE  56  -2.469  -7.660   1.283
  455    HE1  PHE  56           1HE      PHE  56   0.266  -8.756  -2.706
  456    HE2  PHE  56           2HE      PHE  56  -3.553  -7.908  -0.928
  457    HZ   PHE  56           HZ       PHE  56  -2.179  -8.441  -2.925
  458    H    ASN  57           H        ASN  57  -1.679 -10.053   0.926
  459    HA   ASN  57           HA       ASN  57  -4.013 -10.118   2.472
  460   1HB   ASN  57          2HB       ASN  57  -3.311 -10.620  -0.150
  461   2HB   ASN  57          1HB       ASN  57  -3.899 -12.175   0.429
  462   1HD2  ASN  57          2HD2      ASN  57  -5.139 -10.356  -1.470
  463   2HD2  ASN  57          1HD2      ASN  57  -6.668  -9.932  -0.749
  464    H    GLN  58           H        GLN  58  -1.342 -12.235   2.834
  465    HA   GLN  58           HA       GLN  58  -2.815 -14.587   3.769
  466   1HB   GLN  58          2HB       GLN  58  -0.449 -14.469   2.544
  467   2HB   GLN  58          1HB       GLN  58   0.154 -14.120   4.135
  468   1HG   GLN  58          2HG       GLN  58  -1.364 -16.615   3.295
  469   2HG   GLN  58          1HG       GLN  58   0.298 -16.493   3.801
  470   1HE2  GLN  58          2HE2      GLN  58  -2.836 -17.178   4.756
  471   2HE2  GLN  58          1HE2      GLN  58  -2.567 -17.058   6.473
  472    H    ALA  59           H        ALA  59  -0.642 -12.044   5.203
  473    HA   ALA  59           HA       ALA  59  -1.805 -12.642   7.922
  474   1HB   ALA  59          1HB       ALA  59   0.355 -12.105   8.841
  475   2HB   ALA  59          2HB       ALA  59   0.457 -13.493   7.732
  476   3HB   ALA  59          3HB       ALA  59   1.024 -11.889   7.207
  477    H    TYR  60           H        TYR  60  -0.121 -10.231   5.998
  478    HA   TYR  60           HA       TYR  60  -1.034  -7.868   7.488
  479   1HB   TYR  60          2HB       TYR  60   0.029  -7.852   4.694
  480   2HB   TYR  60          1HB       TYR  60   0.328  -6.721   6.065
  481    HD1  TYR  60           1HD      TYR  60   1.156  -9.060   8.027
  482    HD2  TYR  60           2HD      TYR  60   2.305  -7.982   4.040
  483    HE1  TYR  60           1HE      TYR  60   3.251 -10.273   8.317
  484    HE2  TYR  60           2HE      TYR  60   4.523  -9.010   4.410
  485    HH   TYR  60           HH       TYR  60   5.729 -10.402   5.725
  486    H    GLY  61           H        GLY  61  -3.335  -9.553   6.696
  487   1HA   GLY  61          2HA       GLY  61  -4.813  -8.531   4.469
  488   2HA   GLY  61          1HA       GLY  61  -5.490  -9.245   5.895
  489    H    ARG  62           H        ARG  62  -3.926  -6.990   7.399
  490    HA   ARG  62           HA       ARG  62  -6.055  -4.950   7.168
  491   1HB   ARG  62          2HB       ARG  62  -4.263  -5.799   9.492
  492   2HB   ARG  62          1HB       ARG  62  -5.160  -4.314   9.528
  493   1HG   ARG  62          2HG       ARG  62  -6.931  -5.402  10.228
  494   2HG   ARG  62          1HG       ARG  62  -6.976  -6.354   8.730
  495   1HD   ARG  62          2HD       ARG  62  -5.774  -8.120   9.653
  496   2HD   ARG  62          1HD       ARG  62  -4.970  -7.084  10.855
  497    HE   ARG  62           HE       ARG  62  -7.828  -7.206  11.211
  498   1HH1  ARG  62          2HH2      ARG  62  -4.867  -8.942  11.953
  499   2HH1  ARG  62          1HH2      ARG  62  -5.511  -9.696  13.375
  500   1HH2  ARG  62          2HH1      ARG  62  -8.642  -8.220  13.105
  501   2HH2  ARG  62          1HH1      ARG  62  -7.619  -9.291  13.999
  502    H    ASP  63           H        ASP  63  -2.945  -5.412   6.082
  503    HA   ASP  63           HA       ASP  63  -1.619  -2.899   6.582
  504   1HB   ASP  63          2HB       ASP  63  -0.007  -3.736   5.200
  505   2HB   ASP  63          1HB       ASP  63  -0.740  -5.210   5.933
  506    H    LEU  64           H        LEU  64  -0.992  -2.480   3.608
  507    HA   LEU  64           HA       LEU  64  -2.313  -0.520   2.558
  508   1HB   LEU  64          2HB       LEU  64  -1.466  -3.051   1.199
  509   2HB   LEU  64          1HB       LEU  64  -2.234  -1.749   0.292
  510    HG   LEU  64           HG       LEU  64  -0.332  -0.450   1.908
  511   1HD1  LEU  64          1HD1      LEU  64   1.736  -1.625   1.484
  512   2HD1  LEU  64          2HD1      LEU  64   0.638  -2.551   2.535
  513   3HD1  LEU  64          3HD1      LEU  64   0.826  -3.004   0.824
  514   1HD2  LEU  64          1HD2      LEU  64   0.792  -0.064  -0.247
  515   2HD2  LEU  64          2HD2      LEU  64  -0.163  -1.369  -0.989
  516   3HD2  LEU  64          3HD2      LEU  64  -0.972   0.108  -0.415
  517    H    MET  65           H        MET  65  -3.812  -3.806   2.209
  518    HA   MET  65           HA       MET  65  -6.240  -3.406   1.078
  519   1HB   MET  65          2HB       MET  65  -5.062  -5.462   2.324
  520   2HB   MET  65          1HB       MET  65  -6.058  -4.978   3.651
  521   1HG   MET  65          2HG       MET  65  -7.114  -5.494   0.896
  522   2HG   MET  65          1HG       MET  65  -6.983  -6.704   2.214
  523   1HE   MET  65          1HE       MET  65 -10.639  -6.618   2.668
  524   2HE   MET  65          2HE       MET  65  -9.569  -6.976   1.292
  525   3HE   MET  65          3HE       MET  65  -9.106  -7.483   2.934
  526    H    GLU  66           H        GLU  66  -5.775  -2.878   4.640
  527    HA   GLU  66           HA       GLU  66  -8.279  -1.346   4.765
  528   1HB   GLU  66          2HB       GLU  66  -6.485  -2.413   6.921
  529   2HB   GLU  66          1HB       GLU  66  -7.701  -1.187   7.233
  530   1HG   GLU  66          2HG       GLU  66  -9.387  -2.822   6.070
  531   2HG   GLU  66          1HG       GLU  66  -8.147  -4.030   6.245
  532    H    ALA  67           H        ALA  67  -4.793  -0.796   4.653
  533    HA   ALA  67           HA       ALA  67  -4.608   1.822   5.857
  534   1HB   ALA  67          1HB       ALA  67  -2.504   1.905   4.746
  535   2HB   ALA  67          2HB       ALA  67  -2.738   0.360   5.600
  536   3HB   ALA  67          3HB       ALA  67  -2.902   0.432   3.830
  537    H    GLN  68           H        GLN  68  -5.729   0.716   2.716
  538    HA   GLN  68           HA       GLN  68  -6.293   3.519   1.815
  539   1HB   GLN  68          2HB       GLN  68  -4.948   2.134   0.263
  540   2HB   GLN  68          1HB       GLN  68  -6.155   0.878   0.298
  541   1HG   GLN  68          2HG       GLN  68  -6.993   1.857  -1.467
  542   2HG   GLN  68          1HG       GLN  68  -7.649   3.088  -0.341
  543   1HE2  GLN  68          2HE2      GLN  68  -7.618   4.740  -1.885
  544   2HE2  GLN  68          1HE2      GLN  68  -6.100   5.362  -2.486
  545    H    GLU  69           H        GLU  69  -7.940   0.286   2.329
  546    HA   GLU  69           HA       GLU  69 -10.502   0.706   1.526
  547   1HB   GLU  69          2HB       GLU  69  -9.565  -1.304   2.802
  548   2HB   GLU  69          1HB       GLU  69  -9.930  -0.434   4.263
  549   1HG   GLU  69          2HG       GLU  69 -12.285  -0.292   2.615
  550   2HG   GLU  69          1HG       GLU  69 -11.723  -1.941   2.610
  551    H    TRP  70           H        TRP  70  -9.068   2.373   4.334
  552    HA   TRP  70           HA       TRP  70 -11.369   3.832   5.224
  553   1HB   TRP  70          2HB       TRP  70  -8.422   4.471   5.266
  554   2HB   TRP  70          1HB       TRP  70  -9.712   5.226   6.255
  555    HD1  TRP  70           HD       TRP  70  -7.022   3.102   6.832
  556    HE1  TRP  70           1HE      TRP  70  -7.409   1.278   8.550
  557    HE3  TRP  70           3HE      TRP  70 -12.039   3.389   7.081
  558    HZ2  TRP  70           2HZ      TRP  70  -9.622   0.104   9.849
  559    HZ3  TRP  70           3HZ      TRP  70 -13.315   1.675   8.334
  560    HH2  TRP  70           HH       TRP  70 -12.098   0.074   9.784
  561    H    CYS  71           H        CYS  71 -11.574   3.815   2.406
  562    HA   CYS  71           HA       CYS  71 -10.681   6.345   1.270
  563   1HB   CYS  71          2HB       CYS  71 -11.268   3.993   0.155
  564   2HB   CYS  71          1HB       CYS  71 -12.840   4.769  -0.010
  565    HG   CYS  71           HG       CYS  71 -11.562   5.055  -2.211
  566    H    ARG  72           H        ARG  72 -13.984   5.038   2.162
  567    HA   ARG  72           HA       ARG  72 -15.392   7.415   2.096
  568   1HB   ARG  72          2HB       ARG  72 -15.719   4.803   3.345
  569   2HB   ARG  72          1HB       ARG  72 -16.487   6.123   4.253
  570   1HG   ARG  72          2HG       ARG  72 -17.562   6.897   2.069
  571   2HG   ARG  72          1HG       ARG  72 -16.913   5.469   1.287
  572   1HD   ARG  72          2HD       ARG  72 -18.738   5.345   3.715
  573   2HD   ARG  72          1HD       ARG  72 -19.299   5.259   2.047
  574    HE   ARG  72           HE       ARG  72 -17.240   3.366   2.429
  575   1HH1  ARG  72          2HH2      ARG  72 -20.570   3.879   3.411
  576   2HH1  ARG  72          1HH2      ARG  72 -20.925   2.187   3.539
  577   1HH2  ARG  72          2HH1      ARG  72 -17.746   1.140   2.609
  578   2HH2  ARG  72          1HH1      ARG  72 -19.340   0.675   3.091
  579    H    LYS  73           H        LYS  73 -12.861   6.593   4.293
  580    HA   LYS  73           HA       LYS  73 -13.616   8.615   6.340
  581   1HB   LYS  73          2HB       LYS  73 -11.866   6.253   6.421
  582   2HB   LYS  73          1HB       LYS  73 -11.317   7.687   7.263
  583   1HG   LYS  73          2HG       LYS  73 -12.631   6.836   8.943
  584   2HG   LYS  73          1HG       LYS  73 -13.925   7.651   8.099
  585   1HD   LYS  73          2HD       LYS  73 -14.588   5.606   6.982
  586   2HD   LYS  73          1HD       LYS  73 -13.164   4.758   7.569
  587   1HE   LYS  73          2HE       LYS  73 -14.662   4.074   9.208
  588   2HE   LYS  73          1HE       LYS  73 -14.188   5.567   9.971
  589   1HZ   LYS  73          1HZ       LYS  73 -16.464   5.361   9.918
  590   2HZ   LYS  73          2HZ       LYS  73 -16.081   6.594   8.917
  591   3HZ   LYS  73          3HZ       LYS  73 -16.513   5.141   8.307
  592    H    TYR  74           H        TYR  74 -10.832   7.769   4.141
  593    HA   TYR  74           HA       TYR  74  -9.517  10.291   4.419
  594   1HB   TYR  74          2HB       TYR  74  -9.472   8.229   2.222
  595   2HB   TYR  74          1HB       TYR  74  -8.484   9.688   2.177
  596    HD1  TYR  74           1HD      TYR  74  -8.013   6.495   2.634
  597    HD2  TYR  74           2HD      TYR  74  -7.717  10.073   5.014
  598    HE1  TYR  74           1HE      TYR  74  -6.138   5.508   3.886
  599    HE2  TYR  74           2HE      TYR  74  -5.855   9.083   6.253
  600    HH   TYR  74           HH       TYR  74  -4.863   5.677   5.651
  601    H    MET  75           H        MET  75 -12.302   9.504   2.451
  602    HA   MET  75           HA       MET  75 -12.343  12.025   0.918
  603   1HB   MET  75          2HB       MET  75 -13.845   9.440   0.961
  604   2HB   MET  75          1HB       MET  75 -14.589  10.875   0.264
  605   1HG   MET  75          2HG       MET  75 -11.777  10.029  -0.531
  606   2HG   MET  75          1HG       MET  75 -13.199   9.370  -1.319
  607   1HE   MET  75          1HE       MET  75 -14.094  11.784  -3.890
  608   2HE   MET  75          2HE       MET  75 -13.445  10.157  -3.571
  609   3HE   MET  75          3HE       MET  75 -14.896  10.722  -2.708
  610    H    LYS  76           H        LYS  76 -14.611  10.484   3.330
  611    HA   LYS  76           HA       LYS  76 -16.131  12.997   3.495
  612   1HB   LYS  76          2HB       LYS  76 -16.722  10.291   3.922
  613   2HB   LYS  76          1HB       LYS  76 -16.817  11.083   5.503
  614   1HG   LYS  76          2HG       LYS  76 -18.880  11.752   4.834
  615   2HG   LYS  76          1HG       LYS  76 -18.027  12.946   3.839
  616   1HD   LYS  76          2HD       LYS  76 -18.982  11.978   2.045
  617   2HD   LYS  76          1HD       LYS  76 -17.925  10.577   2.332
  618   1HE   LYS  76          2HE       LYS  76 -19.861  10.005   4.147
  619   2HE   LYS  76          1HE       LYS  76 -20.837  10.940   3.017
  620   1HZ   LYS  76          1HZ       LYS  76 -20.855   8.692   2.454
  621   2HZ   LYS  76          2HZ       LYS  76 -20.032   9.485   1.283
  622   3HZ   LYS  76          3HZ       LYS  76 -19.228   8.604   2.401
  623    H    SER  77           H        SER  77 -13.967  11.075   5.633
  624    HA   SER  77           HA       SER  77 -14.213  12.953   7.863
  625   1HB   SER  77          2HB       SER  77 -13.797  10.342   7.962
  626   2HB   SER  77          1HB       SER  77 -12.133  10.765   7.677
  627    HG   SER  77           HG       SER  77 -12.819  10.579   9.900
  628    H    GLY  78           H        GLY  78 -11.873  12.120   5.183
  629   1HA   GLY  78          2HA       GLY  78 -10.011  13.178   4.355
  630   2HA   GLY  78          1HA       GLY  78 -10.905  14.650   4.609
  631    H    ASN  79           H        ASN  79  -9.750  12.412   7.124
  632    HA   ASN  79           HA       ASN  79  -8.204  14.676   8.229
  633   1HB   ASN  79          2HB       ASN  79 -10.535  13.399   9.260
  634   2HB   ASN  79          1HB       ASN  79  -9.200  12.794  10.235
  635   1HD2  ASN  79          2HD2      ASN  79 -11.471  15.105  10.128
  636   2HD2  ASN  79          1HD2      ASN  79 -10.659  16.347  11.039
  637    H    VAL  80           H        VAL  80  -6.194  14.256   8.770
  638    HA   VAL  80           HA       VAL  80  -4.700  11.935   8.281
  639    HB   VAL  80           HB       VAL  80  -4.203  14.229  10.094
  640   1HG1  VAL  80          1HG1      VAL  80  -1.852  13.526  10.142
  641   2HG1  VAL  80          2HG1      VAL  80  -2.893  12.331  10.951
  642   3HG1  VAL  80          3HG1      VAL  80  -2.277  12.011   9.313
  643   1HG2  VAL  80          1HG2      VAL  80  -2.609  14.774   8.248
  644   2HG2  VAL  80          2HG2      VAL  80  -3.141  13.319   7.372
  645   3HG2  VAL  80          3HG2      VAL  80  -4.280  14.659   7.647
  646    H    LYS  81           H        LYS  81  -6.992  12.480  10.942
  647    HA   LYS  81           HA       LYS  81  -6.209  10.670  12.826
  648   1HB   LYS  81          2HB       LYS  81  -9.076  11.103  11.920
  649   2HB   LYS  81          1HB       LYS  81  -8.545  10.574  13.478
  650   1HG   LYS  81          2HG       LYS  81  -8.186  13.262  12.215
  651   2HG   LYS  81          1HG       LYS  81  -9.070  12.798  13.702
  652   1HD   LYS  81          2HD       LYS  81  -6.833  12.297  14.796
  653   2HD   LYS  81          1HD       LYS  81  -6.019  12.869  13.368
  654   1HE   LYS  81          2HE       LYS  81  -8.002  14.750  14.412
  655   2HE   LYS  81          1HE       LYS  81  -6.656  14.350  15.525
  656   1HZ   LYS  81          1HZ       LYS  81  -6.129  16.198  14.261
  657   2HZ   LYS  81          2HZ       LYS  81  -5.168  14.987  13.750
  658   3HZ   LYS  81          3HZ       LYS  81  -6.443  15.478  12.840
  659    H    ASP  82           H        ASP  82  -7.262   9.868   9.561
  660    HA   ASP  82           HA       ASP  82  -7.327   6.937  10.119
  661   1HB   ASP  82          2HB       ASP  82  -7.762   8.349   7.457
  662   2HB   ASP  82          1HB       ASP  82  -8.139   6.709   7.854
  663    H    LEU  83           H        LEU  83  -5.243   9.454   8.751
  664    HA   LEU  83           HA       LEU  83  -3.413   7.694   7.285
  665   1HB   LEU  83          2HB       LEU  83  -4.088  10.284   7.028
  666   2HB   LEU  83          1HB       LEU  83  -2.577  10.388   7.991
  667    HG   LEU  83           HG       LEU  83  -1.953  10.558   5.679
  668   1HD1  LEU  83          1HD1      LEU  83  -0.518   8.716   5.266
  669   2HD1  LEU  83          2HD1      LEU  83  -0.405   9.304   6.942
  670   3HD1  LEU  83          3HD1      LEU  83  -1.284   7.798   6.585
  671   1HD2  LEU  83          1HD2      LEU  83  -2.588   8.869   4.015
  672   2HD2  LEU  83          2HD2      LEU  83  -3.563   8.016   5.236
  673   3HD2  LEU  83          3HD2      LEU  83  -4.032   9.648   4.703
  674    H    THR  84           H        THR  84  -3.293   9.601  10.371
  675    HA   THR  84           HA       THR  84  -0.814   8.942  11.430
  676    HB   THR  84           HB       THR  84  -2.304  10.450  12.479
  677    HG1  THR  84           1HG      THR  84  -2.050   9.473  14.689
  678   1HG2  THR  84          1HG2      THR  84  -4.124   9.725  13.947
  679   2HG2  THR  84          2HG2      THR  84  -4.483   9.349  12.244
  680   3HG2  THR  84          3HG2      THR  84  -3.956   8.057  13.348
  681    H    GLN  85           H        GLN  85  -3.646   6.805  11.173
  682    HA   GLN  85           HA       GLN  85  -2.367   4.572  12.641
  683   1HB   GLN  85          2HB       GLN  85  -5.031   5.394  11.906
  684   2HB   GLN  85          1HB       GLN  85  -4.678   3.728  11.382
  685   1HG   GLN  85          2HG       GLN  85  -3.537   3.893  13.970
  686   2HG   GLN  85          1HG       GLN  85  -5.048   4.762  14.129
  687   1HE2  GLN  85          2HE2      GLN  85  -4.564   2.436  15.472
  688   2HE2  GLN  85          1HE2      GLN  85  -5.619   1.209  14.814
  689    H    ALA  86           H        ALA  86  -3.473   5.336   9.269
  690    HA   ALA  86           HA       ALA  86  -2.528   2.939   8.056
  691   1HB   ALA  86          1HB       ALA  86  -2.567   4.171   6.003
  692   2HB   ALA  86          2HB       ALA  86  -4.050   4.437   6.949
  693   3HB   ALA  86          3HB       ALA  86  -2.792   5.695   6.895
  694    H    TRP  87           H        TRP  87  -0.782   5.894   9.105
  695    HA   TRP  87           HA       TRP  87   1.677   5.452   7.810
  696   1HB   TRP  87          2HB       TRP  87   0.655   7.414   9.353
  697   2HB   TRP  87          1HB       TRP  87   1.670   6.605  10.548
  698    HD1  TRP  87           HD       TRP  87   3.903   7.849  10.639
  699    HE1  TRP  87           1HE      TRP  87   5.476   8.942   8.968
  700    HE3  TRP  87           3HE      TRP  87   1.218   7.018   6.462
  701    HZ2  TRP  87           2HZ      TRP  87   5.528   9.386   6.160
  702    HZ3  TRP  87           3HZ      TRP  87   2.208   7.469   4.238
  703    HH2  TRP  87           HH       TRP  87   4.280   8.791   4.125
  704    H    ASP  88           H        ASP  88   0.340   4.154  10.889
  705    HA   ASP  88           HA       ASP  88   2.736   2.728  11.672
  706   1HB   ASP  88          2HB       ASP  88   0.951   3.344  13.329
  707   2HB   ASP  88          1HB       ASP  88  -0.115   2.183  12.566
  708    H    LEU  89           H        LEU  89  -0.333   1.918   9.845
  709    HA   LEU  89           HA       LEU  89   0.252  -0.908   9.486
  710   1HB   LEU  89          2HB       LEU  89  -1.680   0.973   8.127
  711   2HB   LEU  89          1HB       LEU  89  -1.552  -0.731   7.781
  712    HG   LEU  89           HG       LEU  89  -2.044   0.303  10.589
  713   1HD1  LEU  89          1HD1      LEU  89  -4.404  -0.157  10.142
  714   2HD1  LEU  89          2HD1      LEU  89  -3.794   1.125   9.069
  715   3HD1  LEU  89          3HD1      LEU  89  -4.025  -0.525   8.443
  716   1HD2  LEU  89          1HD2      LEU  89  -2.907  -1.957  10.932
  717   2HD2  LEU  89          2HD2      LEU  89  -2.509  -2.385   9.251
  718   3HD2  LEU  89          3HD2      LEU  89  -1.208  -2.014  10.408
  719    H    TYR  90           H        TYR  90   0.751   1.950   7.483
  720    HA   TYR  90           HA       TYR  90   1.946   0.691   5.159
  721   1HB   TYR  90          2HB       TYR  90   2.003   3.551   6.205
  722   2HB   TYR  90          1HB       TYR  90   2.836   3.075   4.765
  723    HD1  TYR  90           1HD      TYR  90   0.901   1.115   3.572
  724    HD2  TYR  90           2HD      TYR  90   0.327   4.915   5.495
  725    HE1  TYR  90           1HE      TYR  90  -0.948   1.619   2.026
  726    HE2  TYR  90           2HE      TYR  90  -1.597   5.375   4.022
  727    HH   TYR  90           HH       TYR  90  -3.070   4.459   2.587
  728    H    TYR  91           H        TYR  91   3.366   2.263   8.024
  729    HA   TYR  91           HA       TYR  91   6.187   1.703   7.354
  730   1HB   TYR  91          2HB       TYR  91   5.201   3.570   8.832
  731   2HB   TYR  91          1HB       TYR  91   4.990   2.345  10.064
  732    HD1  TYR  91           1HD      TYR  91   7.474   3.965   7.863
  733    HD2  TYR  91           2HD      TYR  91   6.762   1.639  11.403
  734    HE1  TYR  91           1HE      TYR  91   9.776   4.448   8.635
  735    HE2  TYR  91           2HE      TYR  91   9.048   2.128  12.194
  736    HH   TYR  91           HH       TYR  91  11.048   2.913  11.626
  737    H    HIS  92           H        HIS  92   3.865   0.124   9.641
  738    HA   HIS  92           HA       HIS  92   5.542  -1.885  10.617
  739   1HB   HIS  92          2HB       HIS  92   3.187  -1.314  11.456
  740   2HB   HIS  92          1HB       HIS  92   2.530  -2.112  10.064
  741    HD1  HIS  92           1HD      HIS  92   5.438  -3.577  12.000
  742    HD2  HIS  92           2HD      HIS  92   1.363  -3.973  11.405
  743    HE1  HIS  92           1HE      HIS  92   4.794  -5.835  13.035
  744    H    VAL  93           H        VAL  93   3.496  -1.781   7.649
  745    HA   VAL  93           HA       VAL  93   4.222  -4.485   6.777
  746    HB   VAL  93           HB       VAL  93   2.044  -3.287   6.471
  747   1HG1  VAL  93          1HG1      VAL  93   1.717  -2.390   4.223
  748   2HG1  VAL  93          2HG1      VAL  93   2.766  -1.329   5.191
  749   3HG1  VAL  93          3HG1      VAL  93   3.476  -2.392   3.953
  750   1HG2  VAL  93          1HG2      VAL  93   1.694  -4.807   4.593
  751   2HG2  VAL  93          2HG2      VAL  93   3.456  -5.032   4.473
  752   3HG2  VAL  93          3HG2      VAL  93   2.592  -5.536   5.945
  753    H    PHE  94           H        PHE  94   5.298  -1.131   6.011
  754    HA   PHE  94           HA       PHE  94   6.941  -1.457   3.842
  755   1HB   PHE  94          2HB       PHE  94   6.382   0.620   4.950
  756   2HB   PHE  94          1HB       PHE  94   7.367   0.139   6.368
  757    HD1  PHE  94           1HD      PHE  94   9.598   0.695   6.495
  758    HD2  PHE  94           2HD      PHE  94   7.609   0.757   2.687
  759    HE1  PHE  94           1HE      PHE  94  11.636   1.651   5.448
  760    HE2  PHE  94           2HE      PHE  94   9.647   1.709   1.634
  761    HZ   PHE  94           HZ       PHE  94  11.652   2.170   3.020
  762    H    ARG  95           H        ARG  95   7.657  -2.474   7.178
  763    HA   ARG  95           HA       ARG  95  10.247  -3.576   6.398
  764   1HB   ARG  95          2HB       ARG  95   8.739  -3.457   9.035
  765   2HB   ARG  95          1HB       ARG  95  10.298  -4.246   8.844
  766   1HG   ARG  95          2HG       ARG  95  11.311  -2.108   8.099
  767   2HG   ARG  95          1HG       ARG  95   9.753  -1.309   8.209
  768   1HD   ARG  95          2HD       ARG  95  10.892  -0.780  10.247
  769   2HD   ARG  95          1HD       ARG  95   9.733  -2.006  10.708
  770    HE   ARG  95           HE       ARG  95  11.415  -3.445  11.161
  771   1HH1  ARG  95          2HH2      ARG  95  12.831  -0.804   9.333
  772   2HH1  ARG  95          1HH2      ARG  95  14.464  -1.245   9.714
  773   1HH2  ARG  95          2HH1      ARG  95  13.591  -3.993  11.647
  774   2HH2  ARG  95          1HH1      ARG  95  14.869  -3.026  10.997
  775    H    ARG  96           H        ARG  96   6.957  -4.802   6.886
  776    HA   ARG  96           HA       ARG  96   7.648  -7.625   7.211
  777   1HB   ARG  96          2HB       ARG  96   5.041  -6.141   6.628
  778   2HB   ARG  96          1HB       ARG  96   5.152  -7.860   6.865
  779   1HG   ARG  96          2HG       ARG  96   5.796  -7.664   9.050
  780   2HG   ARG  96          1HG       ARG  96   6.177  -5.903   8.855
  781   1HD   ARG  96          2HD       ARG  96   3.976  -5.363   9.229
  782   2HD   ARG  96          1HD       ARG  96   3.502  -6.442   7.888
  783    HE   ARG  96           HE       ARG  96   4.141  -7.911  10.263
  784   1HH1  ARG  96          2HH2      ARG  96   1.605  -5.816   9.066
  785   2HH1  ARG  96          1HH2      ARG  96   0.350  -6.599   9.976
  786   1HH2  ARG  96          2HH1      ARG  96   2.502  -8.846  11.515
  787   2HH2  ARG  96          1HH1      ARG  96   0.871  -8.292  11.357
  788    H    ILE  97           H        ILE  97   6.010  -5.750   4.606
  789    HA   ILE  97           HA       ILE  97   6.230  -7.828   2.566
  790    HB   ILE  97           HB       ILE  97   5.548  -6.118   0.981
  791   1HG1  ILE  97          2HG1      ILE  97   4.397  -4.067   1.978
  792   2HG1  ILE  97          1HG1      ILE  97   5.644  -4.159   3.171
  793   1HG2  ILE  97          1HG2      ILE  97   3.243  -6.084   1.775
  794   2HG2  ILE  97          2HG2      ILE  97   3.975  -7.682   2.051
  795   3HG2  ILE  97          3HG2      ILE  97   3.779  -6.546   3.408
  796   1HD1  ILE  97          1HD1      ILE  97   6.275  -2.739   1.369
  797   2HD1  ILE  97          2HD1      ILE  97   7.353  -4.154   1.422
  798   3HD1  ILE  97          3HD1      ILE  97   6.068  -4.059   0.193
  799    H    SER  98           H        SER  98   8.531  -5.594   3.960
  800    HA   SER  98           HA       SER  98   9.984  -4.684   1.738
  801   1HB   SER  98          2HB       SER  98  11.754  -4.210   3.079
  802   2HB   SER  98          1HB       SER  98  10.319  -4.017   4.135
  803    HG   SER  98           HG       SER  98  12.082  -5.094   5.218
  804    H    LYS  99           H        LYS  99  10.593  -7.512   3.787
  805    HA   LYS  99           HA       LYS  99  11.223  -9.509   1.806
  806   1HB   LYS  99          2HB       LYS  99  13.623  -9.580   2.082
  807   2HB   LYS  99          1HB       LYS  99  13.017  -8.193   1.122
  808   1HG   LYS  99          2HG       LYS  99  13.903  -6.692   2.528
  809   2HG   LYS  99          1HG       LYS  99  13.394  -7.605   3.977
  810   1HD   LYS  99          2HD       LYS  99  15.465  -8.613   4.163
  811   2HD   LYS  99          1HD       LYS  99  15.504  -9.015   2.454
  812   1HE   LYS  99          2HE       LYS  99  17.175  -7.478   2.320
  813   2HE   LYS  99          1HE       LYS  99  15.924  -6.257   2.418
  814   1HZ   LYS  99          1HZ       LYS  99  17.618  -5.952   3.981
  815   2HZ   LYS  99          2HZ       LYS  99  16.203  -6.226   4.754
  816   3HZ   LYS  99          3HZ       LYS  99  17.333  -7.404   4.677
  817    H    GLN 100           H        GLN 100   9.662  -9.553   4.209
  818    HA   GLN 100           HA       GLN 100  10.923 -10.641   6.462
  819   1HB   GLN 100          2HB       GLN 100   8.586 -10.020   6.232
  820   2HB   GLN 100          1HB       GLN 100   8.325 -11.490   5.237
  821   1HG   GLN 100          2HG       GLN 100   9.388 -11.658   8.093
  822   2HG   GLN 100          1HG       GLN 100   7.677 -11.648   7.750
  823   1HE2  GLN 100          2HE2      GLN 100   9.982 -13.678   8.582
  824   2HE2  GLN 100          1HE2      GLN 100   9.431 -15.077   7.707
  Start of MODEL    5
    1   1H    GLU   1          1H        GLU   1  12.453  -9.613 -14.300
    2   2H    GLU   1          2H        GLU   1  13.549  -9.524 -15.571
    3    HA   GLU   1           HA       GLU   1  10.958  -8.803 -16.504
    4   1HB   GLU   1          2HB       GLU   1  11.363 -10.595 -18.079
    5   2HB   GLU   1          1HB       GLU   1  12.689  -9.391 -17.986
    6   1HG   GLU   1          2HG       GLU   1  14.219 -10.971 -17.339
    7   2HG   GLU   1          1HG       GLU   1  13.081 -11.812 -16.299
    8    H    LEU   2           H        LEU   2   8.968  -9.883 -16.457
    9    HA   LEU   2           HA       LEU   2   8.046 -11.445 -14.395
   10   1HB   LEU   2          2HB       LEU   2   7.352 -11.544 -17.391
   11   2HB   LEU   2          1HB       LEU   2   6.415 -12.374 -16.174
   12    HG   LEU   2           HG       LEU   2   6.905  -9.529 -15.584
   13   1HD1  LEU   2          1HD1      LEU   2   5.234  -8.791 -17.255
   14   2HD1  LEU   2          2HD1      LEU   2   6.681  -9.461 -18.047
   15   3HD1  LEU   2          3HD1      LEU   2   5.193 -10.433 -17.939
   16   1HD2  LEU   2          1HD2      LEU   2   4.489  -9.692 -15.043
   17   2HD2  LEU   2          2HD2      LEU   2   4.448 -11.337 -15.722
   18   3HD2  LEU   2          3HD2      LEU   2   5.408 -11.000 -14.261
   19    H    ILE   3           H        ILE   3   7.960 -13.588 -13.827
   20    HA   ILE   3           HA       ILE   3   8.485 -15.882 -13.792
   21    HB   ILE   3           HB       ILE   3   8.534 -15.595 -16.354
   22   1HG1  ILE   3          2HG1      ILE   3   7.515 -17.259 -15.213
   23   2HG1  ILE   3          1HG1      ILE   3   8.626 -17.938 -16.455
   24   1HG2  ILE   3          1HG2      ILE   3  10.486 -16.753 -17.261
   25   2HG2  ILE   3          2HG2      ILE   3  10.926 -15.148 -16.630
   26   3HG2  ILE   3          3HG2      ILE   3  11.316 -16.609 -15.693
   27   1HD1  ILE   3          1HD1      ILE   3   8.583 -19.312 -14.439
   28   2HD1  ILE   3          2HD1      ILE   3  10.190 -18.586 -14.688
   29   3HD1  ILE   3          3HD1      ILE   3   9.090 -17.915 -13.459
   30    H    ARG   4           H        ARG   4  10.606 -13.182 -13.748
   31    HA   ARG   4           HA       ARG   4  12.589 -14.619 -12.019
   32   1HB   ARG   4          2HB       ARG   4  13.178 -12.377 -13.963
   33   2HB   ARG   4          1HB       ARG   4  14.323 -13.341 -13.026
   34   1HG   ARG   4          2HG       ARG   4  12.918 -15.319 -14.449
   35   2HG   ARG   4          1HG       ARG   4  12.985 -14.028 -15.599
   36   1HD   ARG   4          2HD       ARG   4  15.447 -14.936 -14.140
   37   2HD   ARG   4          1HD       ARG   4  14.846 -15.709 -15.610
   38    HE   ARG   4           HE       ARG   4  15.004 -12.868 -15.901
   39   1HH1  ARG   4          2HH2      ARG   4  16.958 -15.753 -15.841
   40   2HH1  ARG   4          1HH2      ARG   4  18.209 -15.126 -16.863
   41   1HH2  ARG   4          1HH1      ARG   4  16.661 -12.031 -17.304
   42   2HH2  ARG   4          2HH1      ARG   4  18.018 -13.038 -17.674
   43    H    VAL   5           H        VAL   5  11.390 -11.339 -12.894
   44    HA   VAL   5           HA       VAL   5  12.078 -10.126 -10.348
   45    HB   VAL   5           HB       VAL   5  12.076  -8.940 -12.434
   46   1HG1  VAL   5          1HG1      VAL   5  10.024  -7.902 -13.269
   47   2HG1  VAL   5          2HG1      VAL   5   9.992  -9.666 -13.505
   48   3HG1  VAL   5          3HG1      VAL   5   9.050  -8.927 -12.188
   49   1HG2  VAL   5          1HG2      VAL   5  11.207  -6.889 -11.465
   50   2HG2  VAL   5          2HG2      VAL   5  10.432  -7.838 -10.176
   51   3HG2  VAL   5          3HG2      VAL   5  12.205  -7.837 -10.337
   52    H    ALA   6           H        ALA   6   9.011 -11.117 -11.806
   53    HA   ALA   6           HA       ALA   6   7.008 -11.831 -11.038
   54   1HB   ALA   6          1HB       ALA   6   6.653 -12.528  -8.749
   55   2HB   ALA   6          2HB       ALA   6   8.077 -13.296  -9.491
   56   3HB   ALA   6          3HB       ALA   6   8.289 -11.969  -8.324
   57    H    ILE   7           H        ILE   7   6.966  -9.409 -11.843
   58    HA   ILE   7           HA       ILE   7   6.717  -7.109 -10.528
   59    HB   ILE   7           HB       ILE   7   6.278  -7.516 -12.900
   60   1HG1  ILE   7          2HG1      ILE   7   6.378  -5.422 -12.033
   61   2HG1  ILE   7          1HG1      ILE   7   5.046  -5.563 -13.242
   62   1HG2  ILE   7          1HG2      ILE   7   3.960  -7.589 -13.688
   63   2HG2  ILE   7          2HG2      ILE   7   4.402  -9.099 -12.856
   64   3HG2  ILE   7          3HG2      ILE   7   3.392  -7.890 -12.028
   65   1HD1  ILE   7          1HD1      ILE   7   4.480  -4.020 -11.452
   66   2HD1  ILE   7          2HD1      ILE   7   3.411  -5.444 -11.436
   67   3HD1  ILE   7          3HD1      ILE   7   4.726  -5.304 -10.245
   68    H    LEU   8           H        LEU   8   4.207  -9.608 -10.475
   69    HA   LEU   8           HA       LEU   8   2.125  -9.707  -9.446
   70   1HB   LEU   8          2HB       LEU   8   4.021  -9.550  -7.123
   71   2HB   LEU   8          1HB       LEU   8   2.478 -10.461  -7.258
   72    HG   LEU   8           HG       LEU   8   5.088 -11.039  -8.662
   73   1HD1  LEU   8          1HD1      LEU   8   5.048 -13.063  -7.282
   74   2HD1  LEU   8          2HD1      LEU   8   5.111 -11.565  -6.324
   75   3HD1  LEU   8          3HD1      LEU   8   3.581 -12.463  -6.471
   76   1HD2  LEU   8          1HD2      LEU   8   4.024 -13.068  -9.547
   77   2HD2  LEU   8          2HD2      LEU   8   2.458 -12.546  -8.880
   78   3HD2  LEU   8          3HD2      LEU   8   3.233 -11.603 -10.175
   79    H    TRP   9           H        TRP   9   1.927  -8.641  -6.574
   80    HA   TRP   9           HA       TRP   9   1.532  -5.697  -7.068
   81   1HB   TRP   9          2HB       TRP   9  -0.259  -7.545  -5.539
   82   2HB   TRP   9          1HB       TRP   9  -0.336  -5.803  -5.519
   83    HD1  TRP   9           HD       TRP   9   0.332  -5.668  -8.853
   84    HE1  TRP   9           1HE      TRP   9  -1.769  -5.710 -10.236
   85    HE3  TRP   9           3HE      TRP   9  -2.747  -7.644  -5.451
   86    HZ2  TRP   9           2HZ      TRP   9  -4.425  -6.524  -9.896
   87    HZ3  TRP   9           3HZ      TRP   9  -5.018  -8.364  -6.081
   88    HH2  TRP   9           HH       TRP   9  -5.889  -7.695  -8.302
   89    H    HIS  10           H        HIS  10   3.475  -7.911  -5.520
   90    HA   HIS  10           HA       HIS  10   3.843  -6.537  -2.957
   91   1HB   HIS  10          2HB       HIS  10   4.084  -8.736  -2.623
   92   2HB   HIS  10          1HB       HIS  10   4.653  -9.047  -4.299
   93    HD1  HIS  10           1HD      HIS  10   6.049  -8.717  -0.832
   94    HD2  HIS  10           2HD      HIS  10   7.242  -8.439  -4.774
   95    HE1  HIS  10           1HE      HIS  10   8.586  -9.006  -0.828
   96    H    GLU  11           H        GLU  11   5.566  -7.043  -6.130
   97    HA   GLU  11           HA       GLU  11   7.953  -5.633  -5.381
   98   1HB   GLU  11          2HB       GLU  11   6.810  -6.281  -8.093
   99   2HB   GLU  11          1HB       GLU  11   8.451  -5.650  -7.751
  100   1HG   GLU  11          2HG       GLU  11   7.327  -8.288  -6.796
  101   2HG   GLU  11          1HG       GLU  11   8.451  -8.053  -8.178
  102    H    MET  12           H        MET  12   4.951  -4.761  -7.111
  103    HA   MET  12           HA       MET  12   5.660  -2.042  -7.699
  104   1HB   MET  12          2HB       MET  12   3.562  -1.780  -8.457
  105   2HB   MET  12          1HB       MET  12   3.886  -3.521  -8.747
  106   1HG   MET  12          2HG       MET  12   2.571  -4.101  -6.791
  107   2HG   MET  12          1HG       MET  12   2.261  -2.360  -6.478
  108   1HE   MET  12          1HE       MET  12   0.216  -1.704  -9.975
  109   2HE   MET  12          2HE       MET  12   1.111  -0.869  -8.682
  110   3HE   MET  12          3HE       MET  12   1.990  -1.833  -9.893
  111    H    TRP  13           H        TRP  13   4.510  -3.724  -4.757
  112    HA   TRP  13           HA       TRP  13   3.467  -1.399  -3.342
  113   1HB   TRP  13          2HB       TRP  13   3.627  -4.274  -2.845
  114   2HB   TRP  13          1HB       TRP  13   4.001  -3.302  -1.460
  115    HD1  TRP  13           HD       TRP  13   1.304  -5.041  -2.229
  116    HE1  TRP  13           1HE      TRP  13  -0.924  -3.894  -1.800
  117    HE3  TRP  13           3HE      TRP  13   2.935  -0.297  -1.943
  118    HZ2  TRP  13           2HZ      TRP  13  -1.921  -1.245  -1.831
  119    HZ3  TRP  13           3HZ      TRP  13   1.324   1.564  -1.818
  120    HH2  TRP  13           HH       TRP  13  -1.071   1.033  -1.440
  121    H    HIS  14           H        HIS  14   6.634  -3.101  -3.534
  122    HA   HIS  14           HA       HIS  14   8.040  -1.964  -1.438
  123   1HB   HIS  14          2HB       HIS  14   8.637  -3.166  -4.045
  124   2HB   HIS  14          1HB       HIS  14   9.766  -1.881  -3.676
  125    HD1  HIS  14           1HD      HIS  14   9.532  -5.332  -3.277
  126    HD2  HIS  14           2HD      HIS  14  10.583  -2.136  -0.814
  127    HE1  HIS  14           1HE      HIS  14  11.204  -6.250  -1.542
  128    H    GLU  15           H        GLU  15   7.825  -0.561  -4.719
  129    HA   GLU  15           HA       GLU  15   8.626   2.138  -3.777
  130   1HB   GLU  15          2HB       GLU  15   8.852   2.730  -5.927
  131   2HB   GLU  15          1HB       GLU  15   9.533   1.072  -5.782
  132   1HG   GLU  15          2HG       GLU  15   8.408   0.948  -7.846
  133   2HG   GLU  15          1HG       GLU  15   7.166   0.359  -6.775
  134    H    GLY  16           H        GLY  16   5.539   0.519  -4.911
  135   1HA   GLY  16          2HA       GLY  16   4.029   2.827  -5.351
  136   2HA   GLY  16          1HA       GLY  16   3.415   1.249  -4.898
  137    H    LEU  17           H        LEU  17   4.956   1.193  -2.387
  138    HA   LEU  17           HA       LEU  17   3.266   2.809  -0.609
  139   1HB   LEU  17          2HB       LEU  17   5.132   0.626  -0.225
  140   2HB   LEU  17          1HB       LEU  17   4.989   1.869   1.044
  141    HG   LEU  17           HG       LEU  17   2.647   0.329  -0.216
  142   1HD1  LEU  17          1HD1      LEU  17   2.428  -0.673   1.959
  143   2HD1  LEU  17          2HD1      LEU  17   4.010  -1.040   1.233
  144   3HD1  LEU  17          3HD1      LEU  17   3.884   0.181   2.522
  145   1HD2  LEU  17          1HD2      LEU  17   1.261   1.433   1.430
  146   2HD2  LEU  17          2HD2      LEU  17   2.650   2.388   2.002
  147   3HD2  LEU  17          3HD2      LEU  17   2.019   2.636   0.357
  148    H    GLU  18           H        GLU  18   6.553   3.017  -2.007
  149    HA   GLU  18           HA       GLU  18   7.441   5.090  -0.122
  150   1HB   GLU  18          2HB       GLU  18   8.975   3.427  -1.100
  151   2HB   GLU  18          1HB       GLU  18   8.699   4.153  -2.681
  152   1HG   GLU  18          2HG       GLU  18   9.923   6.072  -2.147
  153   2HG   GLU  18          1HG       GLU  18   9.439   6.065  -0.475
  154    H    GLU  19           H        GLU  19   6.298   4.977  -3.584
  155    HA   GLU  19           HA       GLU  19   6.372   7.832  -4.010
  156   1HB   GLU  19          2HB       GLU  19   6.281   5.780  -5.675
  157   2HB   GLU  19          1HB       GLU  19   4.557   5.951  -5.493
  158   1HG   GLU  19          2HG       GLU  19   5.087   7.298  -7.341
  159   2HG   GLU  19          1HG       GLU  19   4.920   8.467  -6.046
  160    H    ALA  20           H        ALA  20   4.436   6.113  -1.859
  161    HA   ALA  20           HA       ALA  20   2.198   8.106  -1.913
  162   1HB   ALA  20          1HB       ALA  20   0.940   6.387  -0.721
  163   2HB   ALA  20          2HB       ALA  20   1.513   5.753  -2.282
  164   3HB   ALA  20          3HB       ALA  20   2.342   5.291  -0.777
  165    H    SER  21           H        SER  21   4.005   5.979   0.319
  166    HA   SER  21           HA       SER  21   3.356   7.287   2.727
  167   1HB   SER  21          2HB       SER  21   5.029   5.924   3.748
  168   2HB   SER  21          1HB       SER  21   4.233   4.934   2.532
  169    HG   SER  21           HG       SER  21   6.469   4.662   2.387
  170    H    ARG  22           H        ARG  22   6.045   7.800   0.289
  171    HA   ARG  22           HA       ARG  22   7.442   9.846   1.790
  172   1HB   ARG  22          2HB       ARG  22   8.490   8.557  -0.050
  173   2HB   ARG  22          1HB       ARG  22   7.452   9.337  -1.188
  174   1HG   ARG  22          2HG       ARG  22   8.323  11.505  -0.542
  175   2HG   ARG  22          1HG       ARG  22   9.407  10.691   0.631
  176   1HD   ARG  22          2HD       ARG  22  10.838  10.100  -1.028
  177   2HD   ARG  22          1HD       ARG  22   9.509   9.359  -1.953
  178    HE   ARG  22           HE       ARG  22   9.240  12.123  -2.226
  179   1HH1  ARG  22          2HH2      ARG  22  11.654   9.736  -3.073
  180   2HH1  ARG  22          1HH2      ARG  22  12.232  10.599  -4.462
  181   1HH2  ARG  22          1HH1      ARG  22  10.014  13.251  -4.079
  182   2HH2  ARG  22          2HH1      ARG  22  11.301  12.567  -5.011
  183    H    LEU  23           H        LEU  23   4.654  10.020  -0.499
  184    HA   LEU  23           HA       LEU  23   4.601  12.918  -0.758
  185   1HB   LEU  23          2HB       LEU  23   2.851  10.706  -1.467
  186   2HB   LEU  23          1HB       LEU  23   2.160  12.347  -1.216
  187    HG   LEU  23           HG       LEU  23   2.633  12.058  -3.605
  188   1HD1  LEU  23          1HD1      LEU  23   4.056  13.874  -4.056
  189   2HD1  LEU  23          2HD1      LEU  23   2.910  14.243  -2.745
  190   3HD1  LEU  23          3HD1      LEU  23   4.615  13.898  -2.368
  191   1HD2  LEU  23          1HD2      LEU  23   4.827  11.630  -4.465
  192   2HD2  LEU  23          2HD2      LEU  23   5.475  11.430  -2.819
  193   3HD2  LEU  23          3HD2      LEU  23   4.293  10.264  -3.460
  194    H    TYR  24           H        TYR  24   3.837  10.739   1.762
  195    HA   TYR  24           HA       TYR  24   2.420  12.888   3.394
  196   1HB   TYR  24          2HB       TYR  24   1.148  10.824   3.115
  197   2HB   TYR  24          1HB       TYR  24   2.535   9.846   3.542
  198    HD1  TYR  24           1HD      TYR  24   0.170  12.377   4.845
  199    HD2  TYR  24           2HD      TYR  24   3.219   9.523   5.778
  200    HE1  TYR  24           1HE      TYR  24  -0.460  12.517   7.224
  201    HE2  TYR  24           2HE      TYR  24   2.706   9.779   8.173
  202    HH   TYR  24           HH       TYR  24   1.145  10.376   9.634
  203    H    PHE  25           H        PHE  25   5.159  10.577   3.491
  204    HA   PHE  25           HA       PHE  25   6.095  10.699   6.020
  205   1HB   PHE  25          2HB       PHE  25   6.976   9.289   4.240
  206   2HB   PHE  25          1HB       PHE  25   7.649  10.729   3.412
  207    HD1  PHE  25           1HD      PHE  25   7.710   9.776   7.021
  208    HD2  PHE  25           2HD      PHE  25   9.965  10.582   3.464
  209    HE1  PHE  25           1HE      PHE  25   9.801   9.408   8.286
  210    HE2  PHE  25           2HE      PHE  25  12.068  10.342   4.755
  211    HZ   PHE  25           HZ       PHE  25  11.991   9.739   7.160
  212    H    GLY  26           H        GLY  26   7.197  12.876   3.387
  213   1HA   GLY  26          2HA       GLY  26   7.418  15.155   5.261
  214   2HA   GLY  26          1HA       GLY  26   8.899  14.616   4.489
  215    H    GLU  27           H        GLU  27   5.676  14.454   2.935
  216    HA   GLU  27           HA       GLU  27   6.553  16.649   1.060
  217   1HB   GLU  27          2HB       GLU  27   5.878  13.976   0.403
  218   2HB   GLU  27          1HB       GLU  27   4.580  14.999  -0.140
  219   1HG   GLU  27          2HG       GLU  27   6.129  14.941  -1.921
  220   2HG   GLU  27          1HG       GLU  27   6.394  16.509  -1.192
  221    H    ARG  28           H        ARG  28   4.320  15.863   3.536
  222    HA   ARG  28           HA       ARG  28   2.067  16.379   3.999
  223   1HB   ARG  28          2HB       ARG  28   3.368  18.992   3.281
  224   2HB   ARG  28          1HB       ARG  28   1.884  18.782   4.216
  225   1HG   ARG  28          2HG       ARG  28   3.002  17.793   6.020
  226   2HG   ARG  28          1HG       ARG  28   4.411  17.348   5.031
  227   1HD   ARG  28          2HD       ARG  28   4.784  19.857   4.692
  228   2HD   ARG  28          1HD       ARG  28   3.586  20.103   5.992
  229    HE   ARG  28           HE       ARG  28   5.353  18.239   6.996
  230   1HH1  ARG  28          2HH2      ARG  28   5.774  21.495   5.757
  231   2HH1  ARG  28          1HH2      ARG  28   7.134  21.845   6.774
  232   1HH2  ARG  28          1HH1      ARG  28   7.162  18.725   8.302
  233   2HH2  ARG  28          2HH1      ARG  28   7.896  20.288   8.193
  234    H    ASN  29           H        ASN  29   2.421  15.473   1.213
  235    HA   ASN  29           HA       ASN  29   0.147  16.897  -0.008
  236   1HB   ASN  29          2HB       ASN  29   2.650  17.066  -0.990
  237   2HB   ASN  29          1HB       ASN  29   2.275  15.510  -1.673
  238   1HD2  ASN  29          2HD2      ASN  29  -0.643  16.169  -2.015
  239   2HD2  ASN  29          1HD2      ASN  29  -0.616  17.271  -3.372
  240    H    VAL  30           H        VAL  30  -0.765  15.179   1.569
  241    HA   VAL  30           HA       VAL  30  -1.069  12.473   0.985
  242    HB   VAL  30           HB       VAL  30  -3.157  14.392   2.068
  243   1HG1  VAL  30          1HG1      VAL  30  -4.214  12.450   2.982
  244   2HG1  VAL  30          2HG1      VAL  30  -4.207  12.353   1.205
  245   3HG1  VAL  30          3HG1      VAL  30  -3.059  11.378   2.153
  246   1HG2  VAL  30          1HG2      VAL  30  -2.443  13.498   4.190
  247   2HG2  VAL  30          2HG2      VAL  30  -1.198  12.508   3.393
  248   3HG2  VAL  30          3HG2      VAL  30  -1.074  14.283   3.368
  249    H    LYS  31           H        LYS  31  -2.389  15.276  -0.804
  250    HA   LYS  31           HA       LYS  31  -4.159  13.974  -2.606
  251   1HB   LYS  31          2HB       LYS  31  -4.186  16.259  -2.344
  252   2HB   LYS  31          1HB       LYS  31  -2.443  16.404  -2.768
  253   1HG   LYS  31          2HG       LYS  31  -4.480  15.442  -4.776
  254   2HG   LYS  31          1HG       LYS  31  -4.196  17.168  -4.493
  255   1HD   LYS  31          2HD       LYS  31  -1.628  16.160  -4.674
  256   2HD   LYS  31          1HD       LYS  31  -2.533  15.180  -5.870
  257   1HE   LYS  31          2HE       LYS  31  -2.706  18.206  -5.865
  258   2HE   LYS  31          1HE       LYS  31  -1.402  17.366  -6.697
  259   1HZ   LYS  31          1HZ       LYS  31  -3.245  17.817  -8.076
  260   2HZ   LYS  31          2HZ       LYS  31  -2.995  16.208  -7.955
  261   3HZ   LYS  31          3HZ       LYS  31  -4.239  16.899  -7.153
  262    H    GLY  32           H        GLY  32  -0.508  14.347  -2.814
  263   1HA   GLY  32          2HA       GLY  32  -0.208  13.252  -5.428
  264   2HA   GLY  32          1HA       GLY  32   1.024  13.405  -4.193
  265    H    MET  33           H        MET  33   0.547  11.755  -2.218
  266    HA   MET  33           HA       MET  33   0.857   9.103  -2.929
  267   1HB   MET  33          2HB       MET  33   0.593   8.562  -0.797
  268   2HB   MET  33          1HB       MET  33   1.020  10.310  -0.691
  269   1HG   MET  33          2HG       MET  33  -1.331  10.839  -0.138
  270   2HG   MET  33          1HG       MET  33  -1.786   9.171  -0.300
  271   1HE   MET  33          1HE       MET  33   0.152   7.514   2.680
  272   2HE   MET  33          2HE       MET  33  -0.934   7.231   1.300
  273   3HE   MET  33          3HE       MET  33   0.761   7.697   1.018
  274    H    PHE  34           H        PHE  34  -2.227  10.823  -2.574
  275    HA   PHE  34           HA       PHE  34  -4.063   8.677  -2.789
  276   1HB   PHE  34          2HB       PHE  34  -4.025  11.507  -2.620
  277   2HB   PHE  34          1HB       PHE  34  -4.922  11.091  -4.090
  278    HD1  PHE  34           1HD      PHE  34  -4.765  10.717  -0.417
  279    HD2  PHE  34           2HD      PHE  34  -6.931   9.777  -4.012
  280    HE1  PHE  34           1HE      PHE  34  -6.789  10.208   0.926
  281    HE2  PHE  34           2HE      PHE  34  -8.937   9.220  -2.653
  282    HZ   PHE  34           HZ       PHE  34  -8.850   9.483  -0.201
  283    H    GLU  35           H        GLU  35  -2.061  10.199  -5.299
  284    HA   GLU  35           HA       GLU  35  -3.623   9.115  -7.545
  285   1HB   GLU  35          2HB       GLU  35  -2.213  11.337  -7.454
  286   2HB   GLU  35          1HB       GLU  35  -0.836  10.287  -7.675
  287   1HG   GLU  35          2HG       GLU  35  -1.492  10.968  -9.858
  288   2HG   GLU  35          1HG       GLU  35  -2.067   9.321  -9.731
  289    H    VAL  36           H        VAL  36  -0.766   8.143  -5.590
  290    HA   VAL  36           HA       VAL  36  -0.106   6.019  -7.549
  291    HB   VAL  36           HB       VAL  36   1.678   7.445  -6.569
  292   1HG1  VAL  36          1HG1      VAL  36   2.483   6.864  -4.374
  293   2HG1  VAL  36          2HG1      VAL  36   0.850   7.563  -4.267
  294   3HG1  VAL  36          3HG1      VAL  36   1.077   5.804  -4.107
  295   1HG2  VAL  36          1HG2      VAL  36   3.208   5.656  -6.356
  296   2HG2  VAL  36          2HG2      VAL  36   1.869   4.488  -6.270
  297   3HG2  VAL  36          3HG2      VAL  36   2.121   5.444  -7.749
  298    H    LEU  37           H        LEU  37  -1.471   6.468  -4.241
  299    HA   LEU  37           HA       LEU  37  -2.020   3.676  -3.711
  300   1HB   LEU  37          2HB       LEU  37  -2.062   6.120  -2.349
  301   2HB   LEU  37          1HB       LEU  37  -3.666   5.329  -2.234
  302    HG   LEU  37           HG       LEU  37  -2.075   4.670  -0.354
  303   1HD1  LEU  37          1HD1      LEU  37  -2.504   2.318  -0.474
  304   2HD1  LEU  37          2HD1      LEU  37  -3.935   3.245  -0.985
  305   3HD1  LEU  37          3HD1      LEU  37  -2.910   2.448  -2.202
  306   1HD2  LEU  37          1HD2      LEU  37  -0.281   3.148  -0.806
  307   2HD2  LEU  37          2HD2      LEU  37  -0.540   3.303  -2.560
  308   3HD2  LEU  37          3HD2      LEU  37   0.024   4.702  -1.617
  309    H    GLU  38           H        GLU  38  -3.901   6.263  -5.414
  310    HA   GLU  38           HA       GLU  38  -6.417   5.109  -5.619
  311   1HB   GLU  38          2HB       GLU  38  -4.785   6.906  -7.178
  312   2HB   GLU  38          1HB       GLU  38  -5.930   5.927  -8.148
  313   1HG   GLU  38          2HG       GLU  38  -7.130   7.075  -5.729
  314   2HG   GLU  38          1HG       GLU  38  -6.512   8.297  -6.862
  315    HA   PRO  39           HA       PRO  39  -5.198   1.919  -8.951
  316   1HB   PRO  39          2HB       PRO  39  -2.697   1.500  -9.785
  317   2HB   PRO  39          1HB       PRO  39  -3.701   2.765 -10.491
  318   1HG   PRO  39          2HG       PRO  39  -1.547   3.037  -8.344
  319   2HG   PRO  39          1HG       PRO  39  -1.792   4.039  -9.770
  320   1HD   PRO  39          1HD       PRO  39  -2.819   4.752  -7.274
  321   2HD   PRO  39          2HD       PRO  39  -3.689   5.172  -8.805
  322    H    LEU  40           H        LEU  40  -2.528   2.234  -6.451
  323    HA   LEU  40           HA       LEU  40  -2.285  -0.500  -5.963
  324   1HB   LEU  40          2HB       LEU  40  -1.772   1.946  -4.228
  325   2HB   LEU  40          1HB       LEU  40  -1.259   0.334  -3.805
  326    HG   LEU  40           HG       LEU  40  -0.459   1.594  -6.453
  327   1HD1  LEU  40          1HD1      LEU  40   1.584   2.246  -5.290
  328   2HD1  LEU  40          2HD1      LEU  40   0.172   3.056  -4.570
  329   3HD1  LEU  40          3HD1      LEU  40   0.913   1.663  -3.748
  330   1HD2  LEU  40          1HD2      LEU  40   1.367   0.026  -6.320
  331   2HD2  LEU  40          2HD2      LEU  40   0.751  -0.614  -4.778
  332   3HD2  LEU  40          3HD2      LEU  40  -0.186  -0.841  -6.275
  333    H    HIS  41           H        HIS  41  -4.822   1.680  -4.836
  334    HA   HIS  41           HA       HIS  41  -6.095  -0.047  -2.912
  335   1HB   HIS  41          2HB       HIS  41  -6.438   2.162  -2.622
  336   2HB   HIS  41          1HB       HIS  41  -6.622   2.482  -4.384
  337    HD1  HIS  41           1HD      HIS  41  -8.907   3.319  -4.762
  338    HD2  HIS  41           2HD      HIS  41  -8.777   0.346  -1.889
  339    HE1  HIS  41           1HE      HIS  41 -11.349   2.722  -4.254
  340    H    ALA  42           H        ALA  42  -6.419   0.380  -6.448
  341    HA   ALA  42           HA       ALA  42  -8.828  -1.354  -6.570
  342   1HB   ALA  42          1HB       ALA  42  -8.807  -0.785  -8.917
  343   2HB   ALA  42          2HB       ALA  42  -8.787   0.671  -7.892
  344   3HB   ALA  42          3HB       ALA  42  -7.295   0.130  -8.699
  345    H    MET  43           H        MET  43  -5.392  -1.316  -7.551
  346    HA   MET  43           HA       MET  43  -5.218  -3.964  -8.684
  347   1HB   MET  43          2HB       MET  43  -3.214  -1.918  -7.660
  348   2HB   MET  43          1HB       MET  43  -2.737  -3.497  -8.236
  349   1HG   MET  43          2HG       MET  43  -3.391  -3.033 -10.448
  350   2HG   MET  43          1HG       MET  43  -4.477  -1.739  -9.974
  351   1HE   MET  43          1HE       MET  43  -1.286  -0.407 -12.117
  352   2HE   MET  43          2HE       MET  43  -1.797  -2.111 -12.075
  353   3HE   MET  43          3HE       MET  43  -3.013  -0.821 -12.235
  354    H    MET  44           H        MET  44  -5.493  -2.872  -5.313
  355    HA   MET  44           HA       MET  44  -4.516  -5.542  -4.397
  356   1HB   MET  44          2HB       MET  44  -4.519  -4.640  -2.216
  357   2HB   MET  44          1HB       MET  44  -3.745  -3.459  -3.236
  358   1HG   MET  44          2HG       MET  44  -5.849  -2.194  -3.368
  359   2HG   MET  44          1HG       MET  44  -6.595  -3.390  -2.262
  360   1HE   MET  44          1HE       MET  44  -5.079  -2.767   1.107
  361   2HE   MET  44          2HE       MET  44  -6.453  -3.381   0.159
  362   3HE   MET  44          3HE       MET  44  -4.831  -4.072  -0.077
  363    H    GLU  45           H        GLU  45  -7.500  -3.945  -5.201
  364    HA   GLU  45           HA       GLU  45  -9.148  -5.707  -3.461
  365   1HB   GLU  45          2HB       GLU  45  -9.419  -3.121  -3.625
  366   2HB   GLU  45          1HB       GLU  45 -10.144  -3.425  -5.172
  367   1HG   GLU  45          2HG       GLU  45 -11.197  -5.010  -2.823
  368   2HG   GLU  45          1HG       GLU  45 -11.628  -3.343  -2.969
  369    H    ARG  46           H        ARG  46  -8.470  -5.032  -6.949
  370    HA   ARG  46           HA       ARG  46 -10.436  -6.466  -8.242
  371   1HB   ARG  46          2HB       ARG  46  -8.266  -5.163  -8.979
  372   2HB   ARG  46          1HB       ARG  46  -7.612  -6.830  -9.070
  373   1HG   ARG  46          2HG       ARG  46  -8.791  -7.194 -11.016
  374   2HG   ARG  46          1HG       ARG  46 -10.296  -6.805 -10.187
  375   1HD   ARG  46          2HD       ARG  46 -10.355  -5.104 -11.730
  376   2HD   ARG  46          1HD       ARG  46  -9.326  -4.277 -10.566
  377    HE   ARG  46           HE       ARG  46  -7.686  -4.317 -12.091
  378   1HH1  ARG  46          2HH2      ARG  46  -9.737  -7.056 -12.864
  379   2HH1  ARG  46          1HH2      ARG  46  -8.877  -7.473 -14.310
  380   1HH2  ARG  46          1HH1      ARG  46  -6.549  -4.909 -14.004
  381   2HH2  ARG  46          2HH1      ARG  46  -7.091  -6.280 -14.912
  382    H    GLY  47           H        GLY  47  -7.759  -7.786  -6.320
  383   1HA   GLY  47          2HA       GLY  47  -7.944  -9.899  -5.285
  384   2HA   GLY  47          1HA       GLY  47  -8.936 -10.486  -6.613
  385    HA   PRO  48           HA       PRO  48  -4.266 -11.403  -7.260
  386   1HB   PRO  48          2HB       PRO  48  -4.105 -13.855  -6.296
  387   2HB   PRO  48          1HB       PRO  48  -3.752 -12.358  -5.303
  388   1HG   PRO  48          2HG       PRO  48  -6.308 -14.098  -5.326
  389   2HG   PRO  48          1HG       PRO  48  -5.455 -13.494  -3.907
  390   1HD   PRO  48          1HD       PRO  48  -7.609 -12.082  -5.046
  391   2HD   PRO  48          2HD       PRO  48  -6.191 -11.178  -4.322
  392    H    GLN  49           H        GLN  49  -3.735 -12.359  -9.075
  393    HA   GLN  49           HA       GLN  49  -5.661 -13.886 -10.615
  394   1HB   GLN  49          2HB       GLN  49  -4.247 -12.214 -11.711
  395   2HB   GLN  49          1HB       GLN  49  -2.801 -13.039 -11.221
  396   1HG   GLN  49          2HG       GLN  49  -2.933 -14.042 -13.251
  397   2HG   GLN  49          1HG       GLN  49  -4.156 -15.066 -12.564
  398   1HE2  GLN  49          2HE2      GLN  49  -5.960 -15.227 -13.747
  399   2HE2  GLN  49          1HE2      GLN  49  -6.473 -13.966 -14.833
  400    H    THR  50           H        THR  50  -2.264 -14.758 -10.389
  401    HA   THR  50           HA       THR  50  -2.579 -17.553 -10.602
  402    HB   THR  50           HB       THR  50  -0.707 -16.871 -11.504
  403    HG1  THR  50           1HG      THR  50   0.992 -17.868 -10.239
  404   1HG2  THR  50          1HG2      THR  50   1.077 -15.529 -10.495
  405   2HG2  THR  50          2HG2      THR  50  -0.450 -14.615 -10.568
  406   3HG2  THR  50          3HG2      THR  50   0.098 -15.313  -9.024
  407    H    LEU  51           H        LEU  51  -0.506 -16.718  -8.046
  408    HA   LEU  51           HA       LEU  51  -2.105 -16.904  -5.660
  409   1HB   LEU  51          2HB       LEU  51  -2.044 -19.336  -6.893
  410   2HB   LEU  51          1HB       LEU  51  -0.528 -19.433  -6.034
  411    HG   LEU  51           HG       LEU  51  -1.740 -18.802  -3.937
  412   1HD1  LEU  51          1HD1      LEU  51  -4.173 -19.058  -3.880
  413   2HD1  LEU  51          2HD1      LEU  51  -3.679 -17.685  -4.900
  414   3HD1  LEU  51          3HD1      LEU  51  -4.203 -19.211  -5.653
  415   1HD2  LEU  51          1HD2      LEU  51  -2.731 -21.073  -3.710
  416   2HD2  LEU  51          2HD2      LEU  51  -2.681 -21.265  -5.478
  417   3HD2  LEU  51          3HD2      LEU  51  -1.165 -21.135  -4.554
  418    H    LYS  52           H        LYS  52  -0.081 -15.206  -6.644
  419    HA   LYS  52           HA       LYS  52   2.262 -15.822  -4.865
  420   1HB   LYS  52          2HB       LYS  52   2.382 -14.537  -7.559
  421   2HB   LYS  52          1HB       LYS  52   3.726 -14.797  -6.400
  422   1HG   LYS  52          2HG       LYS  52   3.273 -17.256  -6.602
  423   2HG   LYS  52          1HG       LYS  52   2.171 -16.856  -7.959
  424   1HD   LYS  52          2HD       LYS  52   4.290 -15.432  -8.813
  425   2HD   LYS  52          1HD       LYS  52   5.202 -16.537  -7.805
  426   1HE   LYS  52          2HE       LYS  52   4.829 -18.301  -9.123
  427   2HE   LYS  52          1HE       LYS  52   3.194 -17.733  -9.617
  428   1HZ   LYS  52          1HZ       LYS  52   4.768 -17.464 -11.420
  429   2HZ   LYS  52          2HZ       LYS  52   4.300 -15.995 -10.862
  430   3HZ   LYS  52          3HZ       LYS  52   5.767 -16.594 -10.467
  431    H    GLU  53           H        GLU  53   0.494 -13.169  -6.592
  432    HA   GLU  53           HA       GLU  53   1.155 -11.098  -4.681
  433   1HB   GLU  53          2HB       GLU  53  -0.399  -9.765  -5.992
  434   2HB   GLU  53          1HB       GLU  53   0.696 -10.600  -7.040
  435   1HG   GLU  53          2HG       GLU  53  -1.071 -12.359  -7.345
  436   2HG   GLU  53          1HG       GLU  53  -2.173 -11.239  -6.484
  437    H    THR  54           H        THR  54   0.499 -12.988  -2.955
  438    HA   THR  54           HA       THR  54  -1.898 -11.974  -1.550
  439    HB   THR  54           HB       THR  54  -1.820 -14.844  -2.350
  440    HG1  THR  54           1HG      THR  54  -2.820 -12.416  -3.437
  441   1HG2  THR  54          1HG2      THR  54  -4.115 -14.938  -1.529
  442   2HG2  THR  54          2HG2      THR  54  -2.981 -14.516  -0.223
  443   3HG2  THR  54          3HG2      THR  54  -3.995 -13.254  -0.964
  444    H    SER  55           H        SER  55   0.943 -11.872  -1.089
  445    HA   SER  55           HA       SER  55   1.168 -13.442   1.474
  446   1HB   SER  55          2HB       SER  55   3.036 -13.072  -0.731
  447   2HB   SER  55          1HB       SER  55   3.678 -12.712   0.900
  448    HG   SER  55           HG       SER  55   3.901 -14.971   0.532
  449    H    PHE  56           H        PHE  56   0.077 -10.658   0.626
  450    HA   PHE  56           HA       PHE  56   1.546  -9.032   2.668
  451   1HB   PHE  56          2HB       PHE  56   1.380  -7.147   1.257
  452   2HB   PHE  56          1HB       PHE  56   2.226  -8.475   0.390
  453    HD1  PHE  56           1HD      PHE  56  -0.454  -6.082   0.319
  454    HD2  PHE  56           2HD      PHE  56   0.918  -9.807  -1.328
  455    HE1  PHE  56           1HE      PHE  56  -2.085  -5.857  -1.544
  456    HE2  PHE  56           2HE      PHE  56  -0.666  -9.519  -3.206
  457    HZ   PHE  56           HZ       PHE  56  -2.216  -7.620  -3.280
  458    H    ASN  57           H        ASN  57  -1.444  -9.185   0.666
  459    HA   ASN  57           HA       ASN  57  -3.180  -7.874   2.557
  460   1HB   ASN  57          2HB       ASN  57  -4.834  -8.390   0.984
  461   2HB   ASN  57          1HB       ASN  57  -3.366  -7.844   0.112
  462   1HD2  ASN  57          2HD2      ASN  57  -5.853  -9.760  -0.220
  463   2HD2  ASN  57          1HD2      ASN  57  -5.148 -11.102  -1.065
  464    H    GLN  58           H        GLN  58  -2.161 -11.213   2.096
  465    HA   GLN  58           HA       GLN  58  -4.289 -12.256   3.883
  466   1HB   GLN  58          2HB       GLN  58  -3.330 -13.204   1.517
  467   2HB   GLN  58          1HB       GLN  58  -2.246 -14.024   2.643
  468   1HG   GLN  58          2HG       GLN  58  -4.002 -15.544   2.655
  469   2HG   GLN  58          1HG       GLN  58  -4.579 -14.494   3.938
  470   1HE2  GLN  58          2HE2      GLN  58  -5.447 -16.064   1.244
  471   2HE2  GLN  58          1HE2      GLN  58  -6.788 -15.065   0.744
  472    H    ALA  59           H        ALA  59  -0.858 -11.444   3.865
  473    HA   ALA  59           HA       ALA  59  -0.247 -13.087   6.232
  474   1HB   ALA  59          1HB       ALA  59   1.987 -12.134   5.971
  475   2HB   ALA  59          2HB       ALA  59   1.429 -12.903   4.466
  476   3HB   ALA  59          3HB       ALA  59   1.411 -11.130   4.620
  477    H    TYR  60           H        TYR  60  -0.897  -9.766   5.184
  478    HA   TYR  60           HA       TYR  60  -1.134  -8.933   8.077
  479   1HB   TYR  60          2HB       TYR  60   0.023  -6.957   6.232
  480   2HB   TYR  60          1HB       TYR  60   0.371  -7.309   7.962
  481    HD1  TYR  60           1HD      TYR  60   1.842  -9.328   8.479
  482    HD2  TYR  60           2HD      TYR  60   1.459  -7.646   4.550
  483    HE1  TYR  60           1HE      TYR  60   4.001 -10.348   7.836
  484    HE2  TYR  60           2HE      TYR  60   3.554  -8.759   3.861
  485    HH   TYR  60           HH       TYR  60   5.145 -10.197   4.429
  486    H    GLY  61           H        GLY  61  -3.441  -9.483   7.303
  487   1HA   GLY  61          2HA       GLY  61  -4.917  -7.814   5.523
  488   2HA   GLY  61          1HA       GLY  61  -5.571  -8.742   6.848
  489    H    ARG  62           H        ARG  62  -3.958  -7.414   8.898
  490    HA   ARG  62           HA       ARG  62  -5.610  -5.077   9.346
  491   1HB   ARG  62          2HB       ARG  62  -3.471  -6.459  10.975
  492   2HB   ARG  62          1HB       ARG  62  -4.268  -4.969  11.488
  493   1HG   ARG  62          2HG       ARG  62  -5.931  -6.247  12.329
  494   2HG   ARG  62          1HG       ARG  62  -6.370  -6.688  10.677
  495   1HD   ARG  62          2HD       ARG  62  -4.989  -8.644  10.730
  496   2HD   ARG  62          1HD       ARG  62  -4.208  -8.131  12.245
  497    HE   ARG  62           HE       ARG  62  -6.665  -9.535  11.974
  498   1HH1  ARG  62          2HH2      ARG  62  -5.263  -7.021  14.004
  499   2HH1  ARG  62          1HH2      ARG  62  -6.304  -7.359  15.348
  500   1HH2  ARG  62          1HH1      ARG  62  -8.019  -9.925  13.762
  501   2HH2  ARG  62          2HH1      ARG  62  -7.836  -8.970  15.194
  502    H    ASP  63           H        ASP  63  -2.648  -5.565   7.694
  503    HA   ASP  63           HA       ASP  63  -1.347  -3.074   8.512
  504   1HB   ASP  63          2HB       ASP  63  -0.332  -5.462   7.796
  505   2HB   ASP  63          1HB       ASP  63  -0.498  -4.836   6.190
  506    H    LEU  64           H        LEU  64  -0.483  -2.504   5.653
  507    HA   LEU  64           HA       LEU  64  -1.876  -0.677   4.527
  508   1HB   LEU  64          2HB       LEU  64   0.042  -1.563   3.403
  509   2HB   LEU  64          1HB       LEU  64  -0.678  -3.157   3.229
  510    HG   LEU  64           HG       LEU  64  -2.439  -1.335   1.953
  511   1HD1  LEU  64          1HD1      LEU  64  -1.054  -0.208   0.369
  512   2HD1  LEU  64          2HD1      LEU  64  -0.836   0.355   2.043
  513   3HD1  LEU  64          3HD1      LEU  64   0.389  -0.695   1.291
  514   1HD2  LEU  64          1HD2      LEU  64  -1.761  -2.656  -0.033
  515   2HD2  LEU  64          2HD2      LEU  64  -0.369  -3.299   0.872
  516   3HD2  LEU  64          3HD2      LEU  64  -2.025  -3.710   1.378
  517    H    MET  65           H        MET  65  -3.010  -4.081   4.185
  518    HA   MET  65           HA       MET  65  -5.253  -3.851   2.528
  519   1HB   MET  65          2HB       MET  65  -4.086  -5.625   4.491
  520   2HB   MET  65          1HB       MET  65  -5.845  -5.580   4.655
  521   1HG   MET  65          2HG       MET  65  -4.516  -5.839   1.968
  522   2HG   MET  65          1HG       MET  65  -4.833  -7.254   3.022
  523   1HE   MET  65          1HE       MET  65  -8.560  -7.767   2.958
  524   2HE   MET  65          2HE       MET  65  -6.946  -8.496   3.128
  525   3HE   MET  65          3HE       MET  65  -7.458  -7.199   4.235
  526    H    GLU  66           H        GLU  66  -5.156  -3.253   6.060
  527    HA   GLU  66           HA       GLU  66  -7.908  -2.122   6.066
  528   1HB   GLU  66          2HB       GLU  66  -6.473  -3.672   7.824
  529   2HB   GLU  66          1HB       GLU  66  -6.445  -2.027   8.519
  530   1HG   GLU  66          2HG       GLU  66  -8.948  -1.886   8.134
  531   2HG   GLU  66          1HG       GLU  66  -8.934  -3.560   7.584
  532    H    ALA  67           H        ALA  67  -4.492  -1.055   6.467
  533    HA   ALA  67           HA       ALA  67  -4.906   1.610   7.170
  534   1HB   ALA  67          1HB       ALA  67  -2.717   2.008   6.067
  535   2HB   ALA  67          2HB       ALA  67  -2.688   0.524   7.047
  536   3HB   ALA  67          3HB       ALA  67  -2.833   0.418   5.277
  537    H    GLN  68           H        GLN  68  -5.391   0.065   4.080
  538    HA   GLN  68           HA       GLN  68  -5.995   2.609   2.667
  539   1HB   GLN  68          2HB       GLN  68  -4.422   1.265   1.570
  540   2HB   GLN  68          1HB       GLN  68  -5.449  -0.194   1.757
  541   1HG   GLN  68          2HG       GLN  68  -5.481   0.862  -0.607
  542   2HG   GLN  68          1HG       GLN  68  -7.046   0.656   0.095
  543   1HE2  GLN  68          2HE2      GLN  68  -8.361   2.284  -0.279
  544   2HE2  GLN  68          1HE2      GLN  68  -7.810   3.920  -0.511
  545    H    GLU  69           H        GLU  69  -7.563  -0.538   3.623
  546    HA   GLU  69           HA       GLU  69  -9.961  -0.401   2.248
  547   1HB   GLU  69          2HB       GLU  69  -8.955  -2.030   4.127
  548   2HB   GLU  69          1HB       GLU  69 -10.084  -1.117   5.128
  549   1HG   GLU  69          2HG       GLU  69 -11.922  -1.653   3.424
  550   2HG   GLU  69          1HG       GLU  69 -10.799  -2.657   2.569
  551    H    TRP  70           H        TRP  70  -8.980   1.634   4.951
  552    HA   TRP  70           HA       TRP  70 -11.483   2.983   5.405
  553   1HB   TRP  70          2HB       TRP  70  -8.593   3.551   6.067
  554   2HB   TRP  70          1HB       TRP  70 -10.008   4.459   6.692
  555    HD1  TRP  70           HD       TRP  70 -10.145   0.587   6.565
  556    HE1  TRP  70           1HE      TRP  70  -9.962  -0.329   8.880
  557    HE3  TRP  70           3HE      TRP  70  -9.016   4.880   8.979
  558    HZ2  TRP  70           2HZ      TRP  70  -9.446   0.632  11.448
  559    HZ3  TRP  70           3HZ      TRP  70  -9.053   4.907  11.462
  560    HH2  TRP  70           HH       TRP  70  -9.201   2.761  12.701
  561    H    CYS  71           H        CYS  71 -11.284   2.840   2.737
  562    HA   CYS  71           HA       CYS  71 -10.183   5.186   1.443
  563   1HB   CYS  71          2HB       CYS  71 -11.407   4.455  -0.476
  564   2HB   CYS  71          1HB       CYS  71 -10.406   3.155   0.244
  565    HG   CYS  71           HG       CYS  71 -12.620   2.240  -0.830
  566    H    ARG  72           H        ARG  72 -13.402   4.193   2.706
  567    HA   ARG  72           HA       ARG  72 -14.752   6.622   1.961
  568   1HB   ARG  72          2HB       ARG  72 -16.563   5.700   3.392
  569   2HB   ARG  72          1HB       ARG  72 -15.957   4.491   2.293
  570   1HG   ARG  72          2HG       ARG  72 -15.655   3.157   4.027
  571   2HG   ARG  72          1HG       ARG  72 -14.372   4.234   4.610
  572   1HD   ARG  72          2HD       ARG  72 -15.673   5.119   6.214
  573   2HD   ARG  72          1HD       ARG  72 -17.098   5.220   5.131
  574    HE   ARG  72           HE       ARG  72 -16.493   3.138   7.010
  575   1HH1  ARG  72          2HH2      ARG  72 -17.998   3.577   3.853
  576   2HH1  ARG  72          1HH2      ARG  72 -18.911   2.107   3.948
  577   1HH2  ARG  72          1HH1      ARG  72 -17.708   1.210   7.078
  578   2HH2  ARG  72          2HH1      ARG  72 -18.740   0.803   5.749
  579    H    LYS  73           H        LYS  73 -12.250   6.284   4.034
  580    HA   LYS  73           HA       LYS  73 -13.160   8.296   6.044
  581   1HB   LYS  73          2HB       LYS  73 -11.874   5.701   6.386
  582   2HB   LYS  73          1HB       LYS  73 -10.968   7.025   7.118
  583   1HG   LYS  73          2HG       LYS  73 -13.961   6.854   7.527
  584   2HG   LYS  73          1HG       LYS  73 -12.870   5.858   8.494
  585   1HD   LYS  73          2HD       LYS  73 -11.642   7.918   9.200
  586   2HD   LYS  73          1HD       LYS  73 -12.780   8.898   8.268
  587   1HE   LYS  73          2HE       LYS  73 -14.437   8.675   9.827
  588   2HE   LYS  73          1HE       LYS  73 -14.058   6.976  10.142
  589   1HZ   LYS  73          1HZ       LYS  73 -13.574   8.345  11.994
  590   2HZ   LYS  73          2HZ       LYS  73 -12.204   7.683  11.415
  591   3HZ   LYS  73          3HZ       LYS  73 -12.525   9.260  11.136
  592    H    TYR  74           H        TYR  74 -10.319   7.034   4.189
  593    HA   TYR  74           HA       TYR  74  -8.882   9.575   4.507
  594   1HB   TYR  74          2HB       TYR  74  -7.114   8.595   3.733
  595   2HB   TYR  74          1HB       TYR  74  -8.063   7.125   4.173
  596    HD1  TYR  74           1HD      TYR  74  -9.804   6.992   1.671
  597    HD2  TYR  74           2HD      TYR  74  -5.677   7.893   2.185
  598    HE1  TYR  74           1HE      TYR  74  -9.455   6.681  -0.740
  599    HE2  TYR  74           2HE      TYR  74  -5.302   7.491  -0.206
  600    HH   TYR  74           HH       TYR  74  -6.168   6.791  -2.110
  601    H    MET  75           H        MET  75 -11.282   8.467   2.217
  602    HA   MET  75           HA       MET  75 -10.599  10.509   0.160
  603   1HB   MET  75          2HB       MET  75 -10.866   8.029  -0.269
  604   2HB   MET  75          1HB       MET  75 -12.612   8.294   0.051
  605   1HG   MET  75          2HG       MET  75 -11.811  10.253  -1.868
  606   2HG   MET  75          1HG       MET  75 -11.143   8.728  -2.403
  607   1HE   MET  75          1HE       MET  75 -15.134  10.194  -3.249
  608   2HE   MET  75          2HE       MET  75 -14.161  10.929  -1.953
  609   3HE   MET  75          3HE       MET  75 -13.470  10.728  -3.578
  610    H    LYS  76           H        LYS  76 -13.064   9.780   2.609
  611    HA   LYS  76           HA       LYS  76 -14.767  11.988   1.556
  612   1HB   LYS  76          2HB       LYS  76 -15.950   9.887   1.783
  613   2HB   LYS  76          1HB       LYS  76 -15.446   9.726   3.446
  614   1HG   LYS  76          2HG       LYS  76 -17.116  11.108   4.166
  615   2HG   LYS  76          1HG       LYS  76 -16.770  12.323   2.978
  616   1HD   LYS  76          2HD       LYS  76 -18.023   9.913   1.840
  617   2HD   LYS  76          1HD       LYS  76 -18.994  10.774   3.034
  618   1HE   LYS  76          2HE       LYS  76 -18.268  12.918   1.699
  619   2HE   LYS  76          1HE       LYS  76 -17.912  11.755   0.403
  620   1HZ   LYS  76          1HZ       LYS  76 -20.161  12.562   0.320
  621   2HZ   LYS  76          2HZ       LYS  76 -20.137  10.952   0.600
  622   3HZ   LYS  76          3HZ       LYS  76 -20.455  11.989   1.821
  623    H    SER  77           H        SER  77 -13.238  10.759   4.625
  624    HA   SER  77           HA       SER  77 -13.754  13.327   5.969
  625   1HB   SER  77          2HB       SER  77 -14.020  11.162   7.211
  626   2HB   SER  77          1HB       SER  77 -12.324  10.854   7.019
  627    HG   SER  77           HG       SER  77 -13.170  11.880   9.003
  628    H    GLY  78           H        GLY  78 -11.072  11.484   4.389
  629   1HA   GLY  78          2HA       GLY  78  -8.910  11.989   3.871
  630   2HA   GLY  78          1HA       GLY  78  -9.439  13.641   3.661
  631    H    ASN  79           H        ASN  79  -9.828  12.087   6.770
  632    HA   ASN  79           HA       ASN  79  -8.358  14.171   8.006
  633   1HB   ASN  79          2HB       ASN  79 -10.373  12.344   8.735
  634   2HB   ASN  79          1HB       ASN  79  -8.991  11.916   9.759
  635   1HD2  ASN  79          2HD2      ASN  79 -11.632  13.976   9.417
  636   2HD2  ASN  79          1HD2      ASN  79 -11.149  15.162  10.601
  637    H    VAL  80           H        VAL  80  -6.222  14.200   8.326
  638    HA   VAL  80           HA       VAL  80  -4.331  12.226   7.784
  639    HB   VAL  80           HB       VAL  80  -4.041  14.552   9.686
  640   1HG1  VAL  80          1HG1      VAL  80  -1.679  14.245   9.414
  641   2HG1  VAL  80          2HG1      VAL  80  -2.387  12.811  10.196
  642   3HG1  VAL  80          3HG1      VAL  80  -1.938  12.757   8.474
  643   1HG2  VAL  80          1HG2      VAL  80  -2.896  15.517   7.781
  644   2HG2  VAL  80          2HG2      VAL  80  -3.246  14.073   6.800
  645   3HG2  VAL  80          3HG2      VAL  80  -4.576  15.124   7.345
  646    H    LYS  81           H        LYS  81  -6.423  12.536  10.681
  647    HA   LYS  81           HA       LYS  81  -5.279  10.738  12.411
  648   1HB   LYS  81          2HB       LYS  81  -7.856  11.895  12.030
  649   2HB   LYS  81          1HB       LYS  81  -8.030  10.198  12.462
  650   1HG   LYS  81          2HG       LYS  81  -6.433  12.303  13.984
  651   2HG   LYS  81          1HG       LYS  81  -7.909  11.501  14.508
  652   1HD   LYS  81          2HD       LYS  81  -6.468   9.311  14.133
  653   2HD   LYS  81          1HD       LYS  81  -5.116  10.466  14.369
  654   1HE   LYS  81          2HE       LYS  81  -7.382  10.031  16.384
  655   2HE   LYS  81          1HE       LYS  81  -5.801   9.317  16.515
  656   1HZ   LYS  81          1HZ       LYS  81  -6.033  11.220  17.775
  657   2HZ   LYS  81          2HZ       LYS  81  -4.883  11.466  16.644
  658   3HZ   LYS  81          3HZ       LYS  81  -6.356  12.155  16.473
  659    H    ASP  82           H        ASP  82  -6.642   9.900   9.267
  660    HA   ASP  82           HA       ASP  82  -6.498   6.981   9.800
  661   1HB   ASP  82          2HB       ASP  82  -8.388   7.914   8.574
  662   2HB   ASP  82          1HB       ASP  82  -7.247   8.557   7.344
  663    H    LEU  83           H        LEU  83  -4.706   9.631   8.191
  664    HA   LEU  83           HA       LEU  83  -2.921   7.911   6.603
  665   1HB   LEU  83          2HB       LEU  83  -3.687  10.594   6.432
  666   2HB   LEU  83          1HB       LEU  83  -2.033  10.622   6.950
  667    HG   LEU  83           HG       LEU  83  -1.984  10.599   4.600
  668   1HD1  LEU  83          1HD1      LEU  83  -0.831   8.607   3.988
  669   2HD1  LEU  83          2HD1      LEU  83  -0.284   9.244   5.558
  670   3HD1  LEU  83          3HD1      LEU  83  -1.350   7.819   5.497
  671   1HD2  LEU  83          1HD2      LEU  83  -3.137   8.944   3.225
  672   2HD2  LEU  83          2HD2      LEU  83  -3.846   8.200   4.678
  673   3HD2  LEU  83          3HD2      LEU  83  -4.306   9.855   4.212
  674    H    THR  84           H        THR  84  -2.643   9.823   9.661
  675    HA   THR  84           HA       THR  84  -0.058   9.198  10.491
  676    HB   THR  84           HB       THR  84  -1.468  10.760  11.575
  677    HG1  THR  84           1HG      THR  84  -0.934   9.865  13.796
  678   1HG2  THR  84          1HG2      THR  84  -3.070  10.074  13.297
  679   2HG2  THR  84          2HG2      THR  84  -3.620   9.584  11.678
  680   3HG2  THR  84          3HG2      THR  84  -2.914   8.378  12.779
  681    H    GLN  85           H        GLN  85  -2.887   7.039  10.536
  682    HA   GLN  85           HA       GLN  85  -1.402   4.800  11.792
  683   1HB   GLN  85          2HB       GLN  85  -4.108   5.578  11.491
  684   2HB   GLN  85          1HB       GLN  85  -3.834   3.991  10.710
  685   1HG   GLN  85          2HG       GLN  85  -3.931   3.130  12.865
  686   2HG   GLN  85          1HG       GLN  85  -2.313   3.793  13.050
  687   1HE2  GLN  85          2HE2      GLN  85  -5.505   3.853  14.094
  688   2HE2  GLN  85          1HE2      GLN  85  -5.376   5.247  15.142
  689    H    ALA  86           H        ALA  86  -2.735   5.659   8.549
  690    HA   ALA  86           HA       ALA  86  -2.037   3.268   7.194
  691   1HB   ALA  86          1HB       ALA  86  -2.239   4.587   5.191
  692   2HB   ALA  86          2HB       ALA  86  -3.593   4.879   6.308
  693   3HB   ALA  86          3HB       ALA  86  -2.290   6.080   6.158
  694    H    TRP  87           H        TRP  87  -0.126   6.164   8.049
  695    HA   TRP  87           HA       TRP  87   2.246   5.574   6.540
  696   1HB   TRP  87          2HB       TRP  87   1.932   7.770   7.237
  697   2HB   TRP  87          1HB       TRP  87   1.526   7.274   8.911
  698    HD1  TRP  87           HD       TRP  87   3.344   7.520  10.591
  699    HE1  TRP  87           1HE      TRP  87   5.874   7.752  10.595
  700    HE3  TRP  87           3HE      TRP  87   4.126   7.175   5.614
  701    HZ2  TRP  87           2HZ      TRP  87   7.947   7.731   8.687
  702    HZ3  TRP  87           3HZ      TRP  87   6.450   6.946   4.758
  703    HH2  TRP  87           HH       TRP  87   8.349   7.229   6.298
  704    H    ASP  88           H        ASP  88   1.005   4.612   9.764
  705    HA   ASP  88           HA       ASP  88   3.467   3.506  10.732
  706   1HB   ASP  88          2HB       ASP  88   1.724   4.030  12.392
  707   2HB   ASP  88          1HB       ASP  88   0.577   2.985  11.600
  708    H    LEU  89           H        LEU  89   0.376   2.112   9.290
  709    HA   LEU  89           HA       LEU  89   1.365  -0.563   9.047
  710   1HB   LEU  89          2HB       LEU  89  -0.927   0.667   7.573
  711   2HB   LEU  89          1HB       LEU  89  -0.598  -1.016   7.828
  712    HG   LEU  89           HG       LEU  89  -1.314   1.008   9.994
  713   1HD1  LEU  89          1HD1      LEU  89  -3.244  -0.360  10.244
  714   2HD1  LEU  89          2HD1      LEU  89  -3.143   0.291   8.589
  715   3HD1  LEU  89          3HD1      LEU  89  -2.717  -1.408   8.906
  716   1HD2  LEU  89          1HD2      LEU  89  -1.290  -0.794  11.553
  717   2HD2  LEU  89          2HD2      LEU  89  -0.638  -1.906  10.327
  718   3HD2  LEU  89          3HD2      LEU  89   0.348  -0.542  10.902
  719    H    TYR  90           H        TYR  90   1.516   2.186   6.829
  720    HA   TYR  90           HA       TYR  90   2.592   0.782   4.495
  721   1HB   TYR  90          2HB       TYR  90   2.619   3.649   5.388
  722   2HB   TYR  90          1HB       TYR  90   3.265   3.054   3.824
  723    HD1  TYR  90           1HD      TYR  90   0.303   1.140   4.718
  724    HD2  TYR  90           2HD      TYR  90   1.662   4.879   3.068
  725    HE1  TYR  90           1HE      TYR  90  -1.845   1.424   3.603
  726    HE2  TYR  90           2HE      TYR  90  -0.509   5.137   1.924
  727    HH   TYR  90           HH       TYR  90  -2.496   4.156   1.416
  728    H    TYR  91           H        TYR  91   4.128   2.655   7.090
  729    HA   TYR  91           HA       TYR  91   6.919   2.121   6.262
  730   1HB   TYR  91          2HB       TYR  91   5.904   4.115   7.590
  731   2HB   TYR  91          1HB       TYR  91   5.910   3.032   8.970
  732    HD1  TYR  91           1HD      TYR  91   7.991   2.246   9.954
  733    HD2  TYR  91           2HD      TYR  91   7.942   4.785   6.507
  734    HE1  TYR  91           1HE      TYR  91  10.311   2.958  10.453
  735    HE2  TYR  91           2HE      TYR  91  10.207   5.613   7.059
  736    HH   TYR  91           HH       TYR  91  12.053   5.169   8.214
  737    H    HIS  92           H        HIS  92   4.792   0.761   8.849
  738    HA   HIS  92           HA       HIS  92   6.643  -1.086   9.935
  739   1HB   HIS  92          2HB       HIS  92   4.430  -0.354  10.950
  740   2HB   HIS  92          1HB       HIS  92   3.611  -1.356   9.778
  741    HD1  HIS  92           1HD      HIS  92   6.482  -1.978  12.236
  742    HD2  HIS  92           2HD      HIS  92   3.030  -3.651  10.669
  743    HE1  HIS  92           1HE      HIS  92   6.157  -4.201  13.466
  744    H    VAL  93           H        VAL  93   4.355  -1.344   7.165
  745    HA   VAL  93           HA       VAL  93   5.084  -4.126   6.563
  746    HB   VAL  93           HB       VAL  93   2.816  -3.083   6.354
  747   1HG1  VAL  93          1HG1      VAL  93   2.205  -2.417   4.090
  748   2HG1  VAL  93          2HG1      VAL  93   3.280  -1.217   4.845
  749   3HG1  VAL  93          3HG1      VAL  93   3.924  -2.350   3.633
  750   1HG2  VAL  93          1HG2      VAL  93   2.292  -4.720   4.659
  751   2HG2  VAL  93          2HG2      VAL  93   4.031  -4.944   4.359
  752   3HG2  VAL  93          3HG2      VAL  93   3.347  -5.334   5.954
  753    H    PHE  94           H        PHE  94   6.159  -0.884   5.587
  754    HA   PHE  94           HA       PHE  94   7.310  -1.224   3.130
  755   1HB   PHE  94          2HB       PHE  94   7.181   0.817   4.547
  756   2HB   PHE  94          1HB       PHE  94   8.494   0.144   5.565
  757    HD1  PHE  94           1HD      PHE  94   7.636   1.918   2.527
  758    HD2  PHE  94           2HD      PHE  94  10.749  -0.217   4.577
  759    HE1  PHE  94           1HE      PHE  94   9.326   2.891   0.983
  760    HE2  PHE  94           2HE      PHE  94  12.431   0.723   3.022
  761    HZ   PHE  94           HZ       PHE  94  11.724   2.317   1.253
  762    H    ARG  95           H        ARG  95   8.511  -2.445   6.233
  763    HA   ARG  95           HA       ARG  95  10.809  -3.766   4.989
  764   1HB   ARG  95          2HB       ARG  95  11.428  -4.284   7.338
  765   2HB   ARG  95          1HB       ARG  95  11.152  -2.575   7.113
  766   1HG   ARG  95          2HG       ARG  95   9.499  -2.539   8.576
  767   2HG   ARG  95          1HG       ARG  95   8.714  -3.981   7.870
  768   1HD   ARG  95          2HD       ARG  95  10.621  -5.341   8.964
  769   2HD   ARG  95          1HD       ARG  95  10.990  -3.875   9.891
  770    HE   ARG  95           HE       ARG  95   8.202  -4.552  10.006
  771   1HH1  ARG  95          2HH2      ARG  95  11.329  -5.389  11.371
  772   2HH1  ARG  95          1HH2      ARG  95  10.668  -6.042  12.835
  773   1HH2  ARG  95          1HH1      ARG  95   7.363  -5.515  11.958
  774   2HH2  ARG  95          2HH1      ARG  95   8.468  -6.018  13.179
  775    H    ARG  96           H        ARG  96   7.568  -4.623   6.039
  776    HA   ARG  96           HA       ARG  96   7.958  -7.453   6.578
  777   1HB   ARG  96          2HB       ARG  96   5.486  -5.798   6.007
  778   2HB   ARG  96          1HB       ARG  96   5.521  -7.506   6.568
  779   1HG   ARG  96          2HG       ARG  96   6.659  -5.232   8.208
  780   2HG   ARG  96          1HG       ARG  96   4.970  -5.730   8.315
  781   1HD   ARG  96          2HD       ARG  96   5.788  -8.079   8.754
  782   2HD   ARG  96          1HD       ARG  96   7.427  -7.395   8.889
  783    HE   ARG  96           HE       ARG  96   5.990  -5.794  10.530
  784   1HH1  ARG  96          2HH2      ARG  96   5.988  -9.295  10.331
  785   2HH1  ARG  96          1HH2      ARG  96   5.501  -9.521  11.978
  786   1HH2  ARG  96          1HH1      ARG  96   5.439  -6.142  12.722
  787   2HH2  ARG  96          2HH1      ARG  96   5.417  -7.756  13.352
  788    H    ILE  97           H        ILE  97   6.144  -5.605   4.073
  789    HA   ILE  97           HA       ILE  97   5.933  -7.786   2.143
  790    HB   ILE  97           HB       ILE  97   5.187  -6.055   0.595
  791   1HG1  ILE  97          2HG1      ILE  97   4.349  -3.982   2.260
  792   2HG1  ILE  97          1HG1      ILE  97   6.059  -4.138   2.533
  793   1HG2  ILE  97          1HG2      ILE  97   3.001  -5.858   1.716
  794   2HG2  ILE  97          2HG2      ILE  97   3.676  -7.493   1.917
  795   3HG2  ILE  97          3HG2      ILE  97   3.747  -6.330   3.262
  796   1HD1  ILE  97          1HD1      ILE  97   5.599  -2.625   0.732
  797   2HD1  ILE  97          2HD1      ILE  97   6.470  -4.051   0.119
  798   3HD1  ILE  97          3HD1      ILE  97   4.720  -3.890  -0.159
  799    H    SER  98           H        SER  98   8.506  -5.742   3.111
  800    HA   SER  98           HA       SER  98   9.849  -5.312   0.598
  801   1HB   SER  98          2HB       SER  98  10.439  -3.883   2.436
  802   2HB   SER  98          1HB       SER  98  10.787  -5.228   3.483
  803    HG   SER  98           HG       SER  98  12.692  -4.488   2.771
  804    H    LYS  99           H        LYS  99  11.272  -7.171   3.211
  805    HA   LYS  99           HA       LYS  99  11.318  -9.773   1.888
  806   1HB   LYS  99          2HB       LYS  99  13.782  -9.782   1.543
  807   2HB   LYS  99          1HB       LYS  99  13.020  -8.595   0.534
  808   1HG   LYS  99          2HG       LYS  99  13.716  -6.788   2.097
  809   2HG   LYS  99          1HG       LYS  99  14.435  -7.963   3.158
  810   1HD   LYS  99          2HD       LYS  99  16.231  -7.203   1.917
  811   2HD   LYS  99          1HD       LYS  99  15.821  -8.687   1.065
  812   1HE   LYS  99          2HE       LYS  99  14.510  -7.386  -0.576
  813   2HE   LYS  99          1HE       LYS  99  14.951  -5.889   0.279
  814   1HZ   LYS  99          1HZ       LYS  99  16.424  -6.296  -1.510
  815   2HZ   LYS  99          2HZ       LYS  99  17.248  -6.477  -0.104
  816   3HZ   LYS  99          3HZ       LYS  99  16.787  -7.791  -0.959
  817    H    GLN 100           H        GLN 100  10.219  -9.073   4.387
  818    HA   GLN 100           HA       GLN 100  11.842  -9.482   6.667
  819   1HB   GLN 100          2HB       GLN 100   9.504  -8.772   6.638
  820   2HB   GLN 100          1HB       GLN 100   9.021 -10.398   6.192
  821   1HG   GLN 100          2HG       GLN 100   9.311 -11.187   8.246
  822   2HG   GLN 100          1HG       GLN 100  10.860 -10.309   8.472
  823   1HE2  GLN 100          2HE2      GLN 100  10.680  -7.981   8.985
  824   2HE2  GLN 100          1HE2      GLN 100   9.371  -7.527  10.046
  Start of MODEL    6
    1   1H    GLU   1          1H        GLU   1   5.498 -19.988 -17.851
    2   2H    GLU   1          2H        GLU   1   4.346 -19.249 -16.874
    3    HA   GLU   1           HA       GLU   1   6.152 -18.529 -15.687
    4   1HB   GLU   1          2HB       GLU   1   7.550 -19.370 -18.169
    5   2HB   GLU   1          1HB       GLU   1   8.321 -18.098 -17.219
    6   1HG   GLU   1          2HG       GLU   1   8.946 -19.570 -15.627
    7   2HG   GLU   1          1HG       GLU   1   7.310 -20.228 -15.489
    8    H    LEU   2           H        LEU   2   6.805 -16.567 -15.064
    9    HA   LEU   2           HA       LEU   2   6.628 -14.314 -14.885
   10   1HB   LEU   2          2HB       LEU   2   7.686 -14.262 -17.711
   11   2HB   LEU   2          1HB       LEU   2   8.006 -13.120 -16.363
   12    HG   LEU   2           HG       LEU   2   9.028 -15.995 -16.396
   13   1HD1  LEU   2          1HD1      LEU   2  11.149 -15.041 -17.088
   14   2HD1  LEU   2          2HD1      LEU   2   9.897 -14.767 -18.322
   15   3HD1  LEU   2          3HD1      LEU   2  10.397 -13.436 -17.251
   16   1HD2  LEU   2          1HD2      LEU   2  10.547 -15.192 -14.697
   17   2HD2  LEU   2          2HD2      LEU   2   9.814 -13.572 -14.765
   18   3HD2  LEU   2          3HD2      LEU   2   8.862 -14.954 -14.175
   19    H    ILE   3           H        ILE   3   4.152 -14.974 -15.167
   20    HA   ILE   3           HA       ILE   3   2.553 -14.571 -17.383
   21    HB   ILE   3           HB       ILE   3   0.769 -13.904 -15.876
   22   1HG1  ILE   3          2HG1      ILE   3   2.472 -14.307 -13.454
   23   2HG1  ILE   3          1HG1      ILE   3   2.363 -12.729 -14.176
   24   1HG2  ILE   3          1HG2      ILE   3   0.731 -16.112 -14.739
   25   2HG2  ILE   3          2HG2      ILE   3   1.301 -16.271 -16.417
   26   3HG2  ILE   3          3HG2      ILE   3   2.467 -16.314 -15.072
   27   1HD1  ILE   3          1HD1      ILE   3   0.726 -13.007 -12.442
   28   2HD1  ILE   3          2HD1      ILE   3  -0.085 -12.800 -14.013
   29   3HD1  ILE   3          3HD1      ILE   3   0.026 -14.415 -13.275
   30    H    ARG   4           H        ARG   4   4.283 -12.162 -15.623
   31    HA   ARG   4           HA       ARG   4   3.402  -9.995 -17.408
   32   1HB   ARG   4          2HB       ARG   4   3.246  -9.929 -14.345
   33   2HB   ARG   4          1HB       ARG   4   3.112  -8.513 -15.364
   34   1HG   ARG   4          2HG       ARG   4   1.221 -10.069 -16.528
   35   2HG   ARG   4          1HG       ARG   4   1.158 -10.682 -14.878
   36   1HD   ARG   4          2HD       ARG   4   0.383  -8.803 -14.035
   37   2HD   ARG   4          1HD       ARG   4   1.353  -7.771 -15.176
   38    HE   ARG   4           HE       ARG   4  -0.329  -7.985 -16.792
   39   1HH1  ARG   4          2HH2      ARG   4  -1.125 -10.270 -14.240
   40   2HH1  ARG   4          1HH2      ARG   4  -2.684 -10.643 -14.901
   41   1HH2  ARG   4          1HH1      ARG   4  -2.363  -8.501 -17.617
   42   2HH2  ARG   4          2HH1      ARG   4  -3.368  -9.642 -16.793
   43    H    VAL   5           H        VAL   5   5.918 -11.339 -17.675
   44    HA   VAL   5           HA       VAL   5   8.172 -11.159 -17.486
   45    HB   VAL   5           HB       VAL   5   7.491  -9.190 -18.753
   46   1HG1  VAL   5          1HG1      VAL   5   8.041  -6.965 -17.909
   47   2HG1  VAL   5          2HG1      VAL   5   6.656  -7.659 -17.033
   48   3HG1  VAL   5          3HG1      VAL   5   8.263  -7.626 -16.272
   49   1HG2  VAL   5          1HG2      VAL   5   9.737  -8.314 -18.866
   50   2HG2  VAL   5          2HG2      VAL   5  10.151  -9.224 -17.394
   51   3HG2  VAL   5          3HG2      VAL   5   9.652 -10.092 -18.865
   52    H    ALA   6           H        ALA   6   6.887 -11.731 -14.911
   53    HA   ALA   6           HA       ALA   6   7.120 -11.676 -12.579
   54   1HB   ALA   6          1HB       ALA   6   9.284 -11.608 -11.683
   55   2HB   ALA   6          2HB       ALA   6   9.173 -12.701 -13.084
   56   3HB   ALA   6          3HB       ALA   6   9.955 -11.111 -13.255
   57    H    ILE   7           H        ILE   7   6.187  -9.156 -13.944
   58    HA   ILE   7           HA       ILE   7   7.098  -7.050 -12.164
   59    HB   ILE   7           HB       ILE   7   6.655  -6.793 -14.570
   60   1HG1  ILE   7          2HG1      ILE   7   7.423  -5.137 -13.165
   61   2HG1  ILE   7          1HG1      ILE   7   6.154  -4.495 -14.270
   62   1HG2  ILE   7          1HG2      ILE   7   4.511  -5.829 -15.209
   63   2HG2  ILE   7          2HG2      ILE   7   4.348  -7.559 -14.828
   64   3HG2  ILE   7          3HG2      ILE   7   3.802  -6.335 -13.657
   65   1HD1  ILE   7          1HD1      ILE   7   6.043  -3.456 -12.068
   66   2HD1  ILE   7          2HD1      ILE   7   4.581  -4.416 -12.400
   67   3HD1  ILE   7          3HD1      ILE   7   5.836  -5.051 -11.308
   68    H    LEU   8           H        LEU   8   6.386  -8.898 -10.480
   69    HA   LEU   8           HA       LEU   8   3.693  -9.037  -9.623
   70   1HB   LEU   8          2HB       LEU   8   6.152  -9.028  -7.900
   71   2HB   LEU   8          1HB       LEU   8   4.524  -9.674  -7.505
   72    HG   LEU   8           HG       LEU   8   6.566 -10.752  -9.441
   73   1HD1  LEU   8          1HD1      LEU   8   6.352 -12.731  -7.972
   74   2HD1  LEU   8          2HD1      LEU   8   6.876 -11.273  -7.096
   75   3HD1  LEU   8          3HD1      LEU   8   5.190 -11.832  -6.966
   76   1HD2  LEU   8          1HD2      LEU   8   5.012 -12.549 -10.041
   77   2HD2  LEU   8          2HD2      LEU   8   3.711 -11.741  -9.135
   78   3HD2  LEU   8          3HD2      LEU   8   4.402 -10.967 -10.580
   79    H    TRP   9           H        TRP   9   2.875  -8.034  -7.532
   80    HA   TRP   9           HA       TRP   9   2.994  -5.114  -7.787
   81   1HB   TRP   9          2HB       TRP   9   1.298  -6.931  -6.086
   82   2HB   TRP   9          1HB       TRP   9   1.205  -5.197  -6.091
   83    HD1  TRP   9           HD       TRP   9   1.481  -4.774  -9.279
   84    HE1  TRP   9           1HE      TRP   9  -0.601  -5.256 -10.650
   85    HE3  TRP   9           3HE      TRP   9  -0.806  -7.848  -6.008
   86    HZ2  TRP   9           2HZ      TRP   9  -2.926  -6.845 -10.378
   87    HZ3  TRP   9           3HZ      TRP   9  -3.085  -8.660  -6.483
   88    HH2  TRP   9           HH       TRP   9  -4.157  -8.123  -8.660
   89    H    HIS  10           H        HIS  10   3.991  -7.560  -5.292
   90    HA   HIS  10           HA       HIS  10   4.853  -5.969  -3.199
   91   1HB   HIS  10          2HB       HIS  10   5.093  -8.015  -2.626
   92   2HB   HIS  10          1HB       HIS  10   5.362  -8.573  -4.318
   93    HD1  HIS  10           1HD      HIS  10   7.194  -8.495  -1.163
   94    HD2  HIS  10           2HD      HIS  10   7.969  -8.200  -5.199
   95    HE1  HIS  10           1HE      HIS  10   9.733  -8.575  -1.384
   96    H    GLU  11           H        GLU  11   6.282  -6.217  -6.365
   97    HA   GLU  11           HA       GLU  11   8.909  -5.153  -5.857
   98   1HB   GLU  11          2HB       GLU  11   7.235  -5.396  -8.380
   99   2HB   GLU  11          1HB       GLU  11   8.996  -5.073  -8.294
  100   1HG   GLU  11          2HG       GLU  11   7.685  -7.589  -7.243
  101   2HG   GLU  11          1HG       GLU  11   8.364  -7.422  -8.894
  102    H    MET  12           H        MET  12   5.853  -3.866  -7.305
  103    HA   MET  12           HA       MET  12   6.798  -1.104  -7.466
  104   1HB   MET  12          2HB       MET  12   4.706  -0.518  -8.198
  105   2HB   MET  12          1HB       MET  12   5.224  -1.996  -9.072
  106   1HG   MET  12          2HG       MET  12   3.705  -3.344  -7.872
  107   2HG   MET  12          1HG       MET  12   3.356  -2.030  -6.701
  108   1HE   MET  12          1HE       MET  12   1.824  -2.196 -11.059
  109   2HE   MET  12          2HE       MET  12   3.541  -1.972 -10.651
  110   3HE   MET  12          3HE       MET  12   2.723  -3.502 -10.251
  111    H    TRP  13           H        TRP  13   5.359  -3.160  -4.950
  112    HA   TRP  13           HA       TRP  13   4.135  -1.082  -3.361
  113   1HB   TRP  13          2HB       TRP  13   4.473  -3.949  -3.201
  114   2HB   TRP  13          1HB       TRP  13   4.824  -3.163  -1.670
  115    HD1  TRP  13           HD       TRP  13   2.771  -1.021  -1.246
  116    HE1  TRP  13           1HE      TRP  13   0.263  -1.418  -1.329
  117    HE3  TRP  13           3HE      TRP  13   2.775  -5.227  -3.919
  118    HZ2  TRP  13           2HZ      TRP  13  -1.484  -3.332  -2.398
  119    HZ3  TRP  13           3HZ      TRP  13   0.682  -6.574  -4.184
  120    HH2  TRP  13           HH       TRP  13  -1.436  -5.584  -3.541
  121    H    HIS  14           H        HIS  14   7.417  -2.553  -3.444
  122    HA   HIS  14           HA       HIS  14   8.560  -1.491  -1.138
  123   1HB   HIS  14          2HB       HIS  14   9.419  -2.630  -3.686
  124   2HB   HIS  14          1HB       HIS  14  10.458  -1.291  -3.264
  125    HD1  HIS  14           1HD      HIS  14  10.625  -4.646  -3.008
  126    HD2  HIS  14           2HD      HIS  14  10.869  -1.576  -0.200
  127    HE1  HIS  14           1HE      HIS  14  12.206  -5.475  -1.145
  128    H    GLU  15           H        GLU  15   8.650  -0.004  -4.382
  129    HA   GLU  15           HA       GLU  15   9.460   2.636  -3.324
  130   1HB   GLU  15          2HB       GLU  15   9.060   1.593  -6.131
  131   2HB   GLU  15          1HB       GLU  15   9.455   3.256  -5.735
  132   1HG   GLU  15          2HG       GLU  15  11.255   1.450  -4.337
  133   2HG   GLU  15          1HG       GLU  15  11.246   1.122  -6.071
  134    H    GLY  16           H        GLY  16   6.432   1.144  -4.856
  135   1HA   GLY  16          2HA       GLY  16   4.939   3.491  -5.096
  136   2HA   GLY  16          1HA       GLY  16   4.296   1.909  -4.755
  137    H    LEU  17           H        LEU  17   5.725   1.638  -2.130
  138    HA   LEU  17           HA       LEU  17   3.995   3.305  -0.415
  139   1HB   LEU  17          2HB       LEU  17   5.523   0.889  -0.004
  140   2HB   LEU  17          1HB       LEU  17   5.503   2.067   1.310
  141    HG   LEU  17           HG       LEU  17   3.037   0.981  -0.127
  142   1HD1  LEU  17          1HD1      LEU  17   2.590  -0.106   2.021
  143   2HD1  LEU  17          2HD1      LEU  17   4.139  -0.660   1.346
  144   3HD1  LEU  17          3HD1      LEU  17   4.121   0.526   2.674
  145   1HD2  LEU  17          1HD2      LEU  17   1.780   2.172   1.605
  146   2HD2  LEU  17          2HD2      LEU  17   3.289   2.849   2.258
  147   3HD2  LEU  17          3HD2      LEU  17   2.738   3.312   0.631
  148    H    GLU  18           H        GLU  18   7.345   3.303  -1.549
  149    HA   GLU  18           HA       GLU  18   8.341   5.179   0.454
  150   1HB   GLU  18          2HB       GLU  18   9.806   3.439  -0.696
  151   2HB   GLU  18          1HB       GLU  18   9.652   4.354  -2.164
  152   1HG   GLU  18          2HG       GLU  18  11.602   5.241  -1.332
  153   2HG   GLU  18          1HG       GLU  18  10.484   6.376  -0.613
  154    H    GLU  19           H        GLU  19   7.508   5.350  -3.097
  155    HA   GLU  19           HA       GLU  19   7.952   8.138  -3.500
  156   1HB   GLU  19          2HB       GLU  19   7.893   6.591  -5.298
  157   2HB   GLU  19          1HB       GLU  19   6.209   6.121  -4.890
  158   1HG   GLU  19          2HG       GLU  19   6.405   7.716  -6.903
  159   2HG   GLU  19          1HG       GLU  19   5.374   8.311  -5.652
  160    H    ALA  20           H        ALA  20   5.017   6.280  -2.489
  161    HA   ALA  20           HA       ALA  20   3.279   8.561  -2.173
  162   1HB   ALA  20          1HB       ALA  20   1.928   7.040  -0.888
  163   2HB   ALA  20          2HB       ALA  20   2.473   6.267  -2.395
  164   3HB   ALA  20          3HB       ALA  20   3.251   5.851  -0.850
  165    H    SER  21           H        SER  21   4.825   6.538   0.393
  166    HA   SER  21           HA       SER  21   4.317   8.218   2.571
  167   1HB   SER  21          2HB       SER  21   5.889   7.061   3.801
  168   2HB   SER  21          1HB       SER  21   5.151   5.893   2.714
  169    HG   SER  21           HG       SER  21   7.168   6.710   1.298
  170    H    ARG  22           H        ARG  22   6.928   8.550   0.131
  171    HA   ARG  22           HA       ARG  22   8.361  10.664   1.530
  172   1HB   ARG  22          2HB       ARG  22   9.441   9.014  -0.023
  173   2HB   ARG  22          1HB       ARG  22   8.551   9.702  -1.349
  174   1HG   ARG  22          2HG       ARG  22   9.584  11.858  -0.982
  175   2HG   ARG  22          1HG       ARG  22  10.461  11.198   0.430
  176   1HD   ARG  22          2HD       ARG  22  11.979  10.149  -0.889
  177   2HD   ARG  22          1HD       ARG  22  10.701   9.492  -1.946
  178    HE   ARG  22           HE       ARG  22  11.007  12.292  -2.381
  179   1HH1  ARG  22          2HH2      ARG  22  12.658   9.281  -3.069
  180   2HH1  ARG  22          1HH2      ARG  22  13.414   9.860  -4.519
  181   1HH2  ARG  22          1HH1      ARG  22  12.014  13.040  -4.303
  182   2HH2  ARG  22          2HH1      ARG  22  13.048  11.974  -5.194
  183    H    LEU  23           H        LEU  23   5.613  10.508  -0.760
  184    HA   LEU  23           HA       LEU  23   5.578  13.303  -1.509
  185   1HB   LEU  23          2HB       LEU  23   3.870  10.966  -1.796
  186   2HB   LEU  23          1HB       LEU  23   3.035  12.522  -1.624
  187    HG   LEU  23           HG       LEU  23   5.432  12.380  -3.428
  188   1HD1  LEU  23          1HD1      LEU  23   4.030  11.662  -5.312
  189   2HD1  LEU  23          2HD1      LEU  23   4.148  10.397  -4.066
  190   3HD1  LEU  23          3HD1      LEU  23   2.671  11.380  -4.196
  191   1HD2  LEU  23          1HD2      LEU  23   4.086  14.066  -4.664
  192   2HD2  LEU  23          2HD2      LEU  23   2.743  13.830  -3.518
  193   3HD2  LEU  23          3HD2      LEU  23   4.281  14.529  -2.956
  194    H    TYR  24           H        TYR  24   4.591  11.496   1.365
  195    HA   TYR  24           HA       TYR  24   3.420  14.011   2.508
  196   1HB   TYR  24          2HB       TYR  24   2.006  12.000   2.652
  197   2HB   TYR  24          1HB       TYR  24   3.264  11.139   3.513
  198    HD1  TYR  24           1HD      TYR  24   2.674  10.835   5.686
  199    HD2  TYR  24           2HD      TYR  24   1.703  14.549   3.818
  200    HE1  TYR  24           1HE      TYR  24   1.547  11.554   7.740
  201    HE2  TYR  24           2HE      TYR  24   0.581  15.297   5.845
  202    HH   TYR  24           HH       TYR  24   0.182  14.878   7.982
  203    H    PHE  25           H        PHE  25   5.820  11.439   3.453
  204    HA   PHE  25           HA       PHE  25   6.768  12.821   5.752
  205   1HB   PHE  25          2HB       PHE  25   7.043  10.251   4.667
  206   2HB   PHE  25          1HB       PHE  25   8.656  10.915   4.570
  207    HD1  PHE  25           1HD      PHE  25   8.222  12.829   7.124
  208    HD2  PHE  25           2HD      PHE  25   7.567   8.658   6.282
  209    HE1  PHE  25           1HE      PHE  25   8.579  12.303   9.489
  210    HE2  PHE  25           2HE      PHE  25   7.929   8.131   8.674
  211    HZ   PHE  25           HZ       PHE  25   8.470   9.951  10.279
  212    H    GLY  26           H        GLY  26   7.297  13.459   2.422
  213   1HA   GLY  26          2HA       GLY  26   9.787  15.030   2.982
  214   2HA   GLY  26          1HA       GLY  26   9.435  14.266   1.451
  215    H    GLU  27           H        GLU  27   6.686  14.940   1.079
  216    HA   GLU  27           HA       GLU  27   6.976  17.870   0.790
  217   1HB   GLU  27          2HB       GLU  27   5.017  16.449  -0.867
  218   2HB   GLU  27          1HB       GLU  27   6.179  17.772  -1.257
  219   1HG   GLU  27          2HG       GLU  27   6.678  14.806  -1.213
  220   2HG   GLU  27          1HG       GLU  27   6.641  15.915  -2.630
  221    H    ARG  28           H        ARG  28   5.366  15.899   2.889
  222    HA   ARG  28           HA       ARG  28   3.374  15.714   3.881
  223   1HB   ARG  28          2HB       ARG  28   3.988  18.594   3.914
  224   2HB   ARG  28          1HB       ARG  28   2.471  17.991   4.609
  225   1HG   ARG  28          2HG       ARG  28   3.752  16.349   5.964
  226   2HG   ARG  28          1HG       ARG  28   5.267  16.975   5.279
  227   1HD   ARG  28          2HD       ARG  28   5.083  19.027   6.420
  228   2HD   ARG  28          1HD       ARG  28   3.330  18.893   6.599
  229    HE   ARG  28           HE       ARG  28   3.636  17.794   8.530
  230   1HH1  ARG  28          2HH2      ARG  28   6.713  17.450   6.850
  231   2HH1  ARG  28          1HH2      ARG  28   7.484  16.672   8.193
  232   1HH2  ARG  28          1HH1      ARG  28   4.678  16.759  10.240
  233   2HH2  ARG  28          2HH1      ARG  28   6.336  16.289  10.077
  234    H    ASN  29           H        ASN  29   3.155  15.499   1.020
  235    HA   ASN  29           HA       ASN  29   0.539  16.738   0.489
  236   1HB   ASN  29          2HB       ASN  29   2.719  17.263  -0.870
  237   2HB   ASN  29          1HB       ASN  29   2.453  15.679  -1.608
  238   1HD2  ASN  29          2HD2      ASN  29   2.251  18.511  -2.623
  239   2HD2  ASN  29          1HD2      ASN  29   0.653  18.606  -3.310
  240    H    VAL  30           H        VAL  30  -0.200  14.934   1.872
  241    HA   VAL  30           HA       VAL  30  -0.303  12.221   1.150
  242    HB   VAL  30           HB       VAL  30  -2.695  13.599   2.286
  243   1HG1  VAL  30          1HG1      VAL  30  -2.930  11.389   3.364
  244   2HG1  VAL  30          2HG1      VAL  30  -2.888  11.231   1.591
  245   3HG1  VAL  30          3HG1      VAL  30  -1.446  10.833   2.555
  246   1HG2  VAL  30          1HG2      VAL  30  -1.820  13.133   4.499
  247   2HG2  VAL  30          2HG2      VAL  30  -0.269  12.609   3.800
  248   3HG2  VAL  30          3HG2      VAL  30  -0.785  14.307   3.649
  249    H    LYS  31           H        LYS  31  -1.681  15.008  -0.506
  250    HA   LYS  31           HA       LYS  31  -3.762  13.684  -2.028
  251   1HB   LYS  31          2HB       LYS  31  -4.045  15.912  -1.766
  252   2HB   LYS  31          1HB       LYS  31  -2.321  16.282  -2.119
  253   1HG   LYS  31          2HG       LYS  31  -3.963  16.996  -3.943
  254   2HG   LYS  31          1HG       LYS  31  -2.689  15.946  -4.505
  255   1HD   LYS  31          2HD       LYS  31  -4.277  14.582  -5.351
  256   2HD   LYS  31          1HD       LYS  31  -4.818  14.203  -3.743
  257   1HE   LYS  31          2HE       LYS  31  -6.017  16.569  -4.033
  258   2HE   LYS  31          1HE       LYS  31  -5.924  16.028  -5.741
  259   1HZ   LYS  31          1HZ       LYS  31  -7.868  15.127  -4.729
  260   2HZ   LYS  31          2HZ       LYS  31  -6.812  13.891  -4.947
  261   3HZ   LYS  31          3HZ       LYS  31  -7.015  14.544  -3.467
  262    H    GLY  32           H        GLY  32  -0.236  14.451  -2.557
  263   1HA   GLY  32          2HA       GLY  32  -0.084  13.398  -5.226
  264   2HA   GLY  32          1HA       GLY  32   1.254  13.696  -4.131
  265    H    MET  33           H        MET  33   0.843  12.001  -2.019
  266    HA   MET  33           HA       MET  33   1.713   9.451  -2.866
  267   1HB   MET  33          2HB       MET  33   1.604   8.793  -0.739
  268   2HB   MET  33          1HB       MET  33   1.872  10.574  -0.628
  269   1HG   MET  33          2HG       MET  33  -0.368  10.902   0.196
  270   2HG   MET  33          1HG       MET  33  -0.816   9.250  -0.131
  271   1HE   MET  33          1HE       MET  33  -0.193   7.446   2.921
  272   2HE   MET  33          2HE       MET  33  -1.441   8.097   1.829
  273   3HE   MET  33          3HE       MET  33  -0.050   7.207   1.163
  274    H    PHE  34           H        PHE  34  -1.546  10.652  -2.274
  275    HA   PHE  34           HA       PHE  34  -3.049   8.269  -2.464
  276   1HB   PHE  34          2HB       PHE  34  -3.463  10.917  -1.904
  277   2HB   PHE  34          1HB       PHE  34  -4.218  10.747  -3.499
  278    HD1  PHE  34           1HD      PHE  34  -3.954   8.900  -0.235
  279    HD2  PHE  34           2HD      PHE  34  -6.392   9.983  -3.603
  280    HE1  PHE  34           1HE      PHE  34  -5.905   7.802   0.828
  281    HE2  PHE  34           2HE      PHE  34  -8.354   8.908  -2.523
  282    HZ   PHE  34           HZ       PHE  34  -8.099   7.790  -0.329
  283    H    GLU  35           H        GLU  35  -1.393  10.097  -5.034
  284    HA   GLU  35           HA       GLU  35  -2.976   8.930  -7.224
  285   1HB   GLU  35          2HB       GLU  35  -1.773  11.249  -7.181
  286   2HB   GLU  35          1HB       GLU  35  -0.304  10.346  -7.432
  287   1HG   GLU  35          2HG       GLU  35  -0.881  10.730  -9.620
  288   2HG   GLU  35          1HG       GLU  35  -1.755   9.228  -9.412
  289    H    VAL  36           H        VAL  36   0.260   8.316  -5.708
  290    HA   VAL  36           HA       VAL  36   0.850   6.084  -7.537
  291    HB   VAL  36           HB       VAL  36   2.610   7.601  -6.915
  292   1HG1  VAL  36          1HG1      VAL  36   3.609   7.477  -4.746
  293   2HG1  VAL  36          2HG1      VAL  36   1.958   8.124  -4.615
  294   3HG1  VAL  36          3HG1      VAL  36   2.292   6.438  -4.153
  295   1HG2  VAL  36          1HG2      VAL  36   4.247   5.984  -6.519
  296   2HG2  VAL  36          2HG2      VAL  36   3.003   4.769  -6.136
  297   3HG2  VAL  36          3HG2      VAL  36   3.090   5.473  -7.769
  298    H    LEU  37           H        LEU  37  -0.545   6.470  -4.276
  299    HA   LEU  37           HA       LEU  37  -0.629   3.565  -3.739
  300   1HB   LEU  37          2HB       LEU  37  -0.640   5.900  -2.208
  301   2HB   LEU  37          1HB       LEU  37  -2.183   5.011  -1.956
  302    HG   LEU  37           HG       LEU  37  -0.489   4.322  -0.274
  303   1HD1  LEU  37          1HD1      LEU  37  -0.520   1.970  -0.534
  304   2HD1  LEU  37          2HD1      LEU  37  -2.106   2.682  -0.908
  305   3HD1  LEU  37          3HD1      LEU  37  -1.045   2.129  -2.226
  306   1HD2  LEU  37          1HD2      LEU  37   1.503   3.134  -0.911
  307   2HD2  LEU  37          2HD2      LEU  37   1.162   3.416  -2.634
  308   3HD2  LEU  37          3HD2      LEU  37   1.540   4.788  -1.566
  309    H    GLU  38           H        GLU  38  -2.781   6.022  -5.190
  310    HA   GLU  38           HA       GLU  38  -5.280   4.773  -5.044
  311   1HB   GLU  38          2HB       GLU  38  -4.004   6.743  -6.700
  312   2HB   GLU  38          1HB       GLU  38  -5.086   5.665  -7.635
  313   1HG   GLU  38          2HG       GLU  38  -6.268   6.611  -5.102
  314   2HG   GLU  38          1HG       GLU  38  -5.888   7.914  -6.231
  315    HA   PRO  39           HA       PRO  39  -4.275   1.854  -8.682
  316   1HB   PRO  39          2HB       PRO  39  -1.830   1.519  -9.700
  317   2HB   PRO  39          1HB       PRO  39  -2.907   2.787 -10.278
  318   1HG   PRO  39          2HG       PRO  39  -0.604   3.018  -8.288
  319   2HG   PRO  39          1HG       PRO  39  -0.997   4.090  -9.630
  320   1HD   PRO  39          1HD       PRO  39  -1.824   4.608  -7.008
  321   2HD   PRO  39          2HD       PRO  39  -2.796   5.134  -8.438
  322    H    LEU  40           H        LEU  40  -1.779   2.207  -6.063
  323    HA   LEU  40           HA       LEU  40  -1.182  -0.586  -5.899
  324   1HB   LEU  40          2HB       LEU  40  -0.790   1.708  -3.964
  325   2HB   LEU  40          1HB       LEU  40  -0.221   0.072  -3.679
  326    HG   LEU  40           HG       LEU  40   0.523   1.637  -6.178
  327   1HD1  LEU  40          1HD1      LEU  40   2.634   2.067  -4.969
  328   2HD1  LEU  40          2HD1      LEU  40   1.267   2.782  -4.083
  329   3HD1  LEU  40          3HD1      LEU  40   1.986   1.251  -3.527
  330   1HD2  LEU  40          1HD2      LEU  40   2.347   0.031  -6.281
  331   2HD2  LEU  40          2HD2      LEU  40   1.742  -0.782  -4.819
  332   3HD2  LEU  40          3HD2      LEU  40   0.778  -0.807  -6.315
  333    H    HIS  41           H        HIS  41  -3.781   1.402  -4.620
  334    HA   HIS  41           HA       HIS  41  -4.962  -0.488  -2.792
  335   1HB   HIS  41          2HB       HIS  41  -5.339   1.796  -2.515
  336   2HB   HIS  41          1HB       HIS  41  -5.820   2.004  -4.229
  337    HD1  HIS  41           1HD      HIS  41  -7.336  -0.788  -2.206
  338    HD2  HIS  41           2HD      HIS  41  -8.209   2.893  -3.852
  339    HE1  HIS  41           1HE      HIS  41  -9.889  -0.592  -2.155
  340    H    ALA  42           H        ALA  42  -5.437   0.198  -6.289
  341    HA   ALA  42           HA       ALA  42  -7.699  -1.705  -6.502
  342   1HB   ALA  42          1HB       ALA  42  -7.775  -0.959  -8.785
  343   2HB   ALA  42          2HB       ALA  42  -7.807   0.413  -7.651
  344   3HB   ALA  42          3HB       ALA  42  -6.312   0.024  -8.535
  345    H    MET  43           H        MET  43  -4.309  -1.407  -7.602
  346    HA   MET  43           HA       MET  43  -3.962  -3.933  -8.880
  347   1HB   MET  43          2HB       MET  43  -2.003  -2.024  -7.543
  348   2HB   MET  43          1HB       MET  43  -1.523  -3.495  -8.329
  349   1HG   MET  43          2HG       MET  43  -2.987  -1.206  -9.706
  350   2HG   MET  43          1HG       MET  43  -1.294  -1.565  -9.831
  351   1HE   MET  43          1HE       MET  43  -2.543  -2.418 -13.338
  352   2HE   MET  43          2HE       MET  43  -3.086  -1.110 -12.260
  353   3HE   MET  43          3HE       MET  43  -1.359  -1.534 -12.343
  354    H    MET  44           H        MET  44  -4.567  -3.270  -5.474
  355    HA   MET  44           HA       MET  44  -3.256  -5.843  -4.705
  356   1HB   MET  44          2HB       MET  44  -3.324  -5.138  -2.593
  357   2HB   MET  44          1HB       MET  44  -3.066  -3.599  -3.485
  358   1HG   MET  44          2HG       MET  44  -4.670  -2.881  -2.020
  359   2HG   MET  44          1HG       MET  44  -5.751  -3.529  -3.242
  360   1HE   MET  44          1HE       MET  44  -7.724  -4.593  -0.193
  361   2HE   MET  44          2HE       MET  44  -6.893  -3.059  -0.547
  362   3HE   MET  44          3HE       MET  44  -7.745  -3.930  -1.845
  363    H    GLU  45           H        GLU  45  -6.327  -4.561  -5.645
  364    HA   GLU  45           HA       GLU  45  -7.886  -6.553  -4.086
  365   1HB   GLU  45          2HB       GLU  45  -8.438  -4.014  -4.068
  366   2HB   GLU  45          1HB       GLU  45  -9.054  -4.271  -5.679
  367   1HG   GLU  45          2HG       GLU  45  -9.902  -6.087  -3.456
  368   2HG   GLU  45          1HG       GLU  45 -10.617  -4.455  -3.661
  369    H    ARG  46           H        ARG  46  -7.214  -5.401  -7.472
  370    HA   ARG  46           HA       ARG  46  -8.751  -6.884  -9.120
  371   1HB   ARG  46          2HB       ARG  46  -6.743  -5.397  -9.636
  372   2HB   ARG  46          1HB       ARG  46  -5.757  -6.850  -9.434
  373   1HG   ARG  46          2HG       ARG  46  -6.936  -7.992 -11.224
  374   2HG   ARG  46          1HG       ARG  46  -8.167  -6.733 -11.302
  375   1HD   ARG  46          2HD       ARG  46  -6.295  -5.114 -11.870
  376   2HD   ARG  46          1HD       ARG  46  -5.264  -6.561 -12.088
  377    HE   ARG  46           HE       ARG  46  -7.474  -7.190 -13.527
  378   1HH1  ARG  46          2HH2      ARG  46  -5.557  -4.261 -13.593
  379   2HH1  ARG  46          1HH2      ARG  46  -5.878  -3.925 -15.265
  380   1HH2  ARG  46          1HH1      ARG  46  -7.796  -6.781 -15.762
  381   2HH2  ARG  46          2HH1      ARG  46  -7.194  -5.312 -16.447
  382    H    GLY  47           H        GLY  47  -6.065  -8.306  -7.195
  383   1HA   GLY  47          2HA       GLY  47  -6.848 -10.468  -6.186
  384   2HA   GLY  47          1HA       GLY  47  -7.126 -11.016  -7.839
  385    HA   PRO  48           HA       PRO  48  -2.451 -11.328  -6.520
  386   1HB   PRO  48          2HB       PRO  48  -2.320 -13.623  -5.124
  387   2HB   PRO  48          1HB       PRO  48  -2.518 -12.056  -4.338
  388   1HG   PRO  48          2HG       PRO  48  -4.532 -14.145  -5.030
  389   2HG   PRO  48          1HG       PRO  48  -4.312 -13.176  -3.491
  390   1HD   PRO  48          1HD       PRO  48  -6.241 -12.436  -5.511
  391   2HD   PRO  48          2HD       PRO  48  -5.375 -11.197  -4.489
  392    H    GLN  49           H        GLN  49  -4.998 -13.456  -7.714
  393    HA   GLN  49           HA       GLN  49  -5.126 -15.002  -9.362
  394   1HB   GLN  49          2HB       GLN  49  -4.380 -13.339 -10.849
  395   2HB   GLN  49          1HB       GLN  49  -2.722 -13.495 -10.364
  396   1HG   GLN  49          2HG       GLN  49  -2.387 -15.098 -11.900
  397   2HG   GLN  49          1HG       GLN  49  -3.680 -16.084 -11.274
  398   1HE2  GLN  49          2HE2      GLN  49  -2.665 -15.203 -13.966
  399   2HE2  GLN  49          1HE2      GLN  49  -4.144 -14.736 -14.770
  400    H    THR  50           H        THR  50  -1.643 -15.104  -9.410
  401    HA   THR  50           HA       THR  50  -1.273 -17.893  -9.072
  402    HB   THR  50           HB       THR  50   0.324 -16.977 -10.280
  403    HG1  THR  50           1HG      THR  50   2.284 -17.241  -9.049
  404   1HG2  THR  50          1HG2      THR  50   1.761 -15.075  -9.726
  405   2HG2  THR  50          2HG2      THR  50   0.052 -14.585  -9.808
  406   3HG2  THR  50          3HG2      THR  50   0.840 -14.801  -8.228
  407    H    LEU  51           H        LEU  51   0.766 -16.276  -6.954
  408    HA   LEU  51           HA       LEU  51  -0.571 -16.059  -4.411
  409   1HB   LEU  51          2HB       LEU  51   0.105 -18.724  -5.272
  410   2HB   LEU  51          1HB       LEU  51   1.131 -18.251  -3.903
  411    HG   LEU  51           HG       LEU  51  -1.750 -17.504  -3.698
  412   1HD1  LEU  51          1HD1      LEU  51  -2.406 -19.767  -2.993
  413   2HD1  LEU  51          2HD1      LEU  51  -1.916 -19.736  -4.703
  414   3HD1  LEU  51          3HD1      LEU  51  -0.806 -20.383  -3.472
  415   1HD2  LEU  51          1HD2      LEU  51  -1.340 -18.207  -1.357
  416   2HD2  LEU  51          2HD2      LEU  51   0.276 -18.795  -1.816
  417   3HD2  LEU  51          3HD2      LEU  51  -0.096 -17.058  -1.904
  418    H    LYS  52           H        LYS  52   1.260 -14.548  -6.066
  419    HA   LYS  52           HA       LYS  52   3.760 -14.579  -4.413
  420   1HB   LYS  52          2HB       LYS  52   3.349 -13.650  -7.250
  421   2HB   LYS  52          1HB       LYS  52   4.891 -13.776  -6.337
  422   1HG   LYS  52          2HG       LYS  52   3.579 -16.387  -6.483
  423   2HG   LYS  52          1HG       LYS  52   3.785 -15.732  -8.082
  424   1HD   LYS  52          2HD       LYS  52   5.875 -16.533  -7.972
  425   2HD   LYS  52          1HD       LYS  52   6.252 -15.204  -6.891
  426   1HE   LYS  52          2HE       LYS  52   5.545 -16.652  -4.953
  427   2HE   LYS  52          1HE       LYS  52   5.351 -17.991  -6.089
  428   1HZ   LYS  52          1HZ       LYS  52   7.476 -18.026  -5.125
  429   2HZ   LYS  52          2HZ       LYS  52   7.657 -17.663  -6.708
  430   3HZ   LYS  52          3HZ       LYS  52   7.798 -16.496  -5.574
  431    H    GLU  53           H        GLU  53   1.446 -12.432  -6.200
  432    HA   GLU  53           HA       GLU  53   2.400 -10.044  -4.795
  433   1HB   GLU  53          2HB       GLU  53  -0.023 -10.238  -6.528
  434   2HB   GLU  53          1HB       GLU  53   1.077  -8.841  -6.204
  435   1HG   GLU  53          2HG       GLU  53   1.711  -9.238  -8.368
  436   2HG   GLU  53          1HG       GLU  53   2.728 -10.453  -7.660
  437    H    THR  54           H        THR  54   1.747 -11.480  -2.761
  438    HA   THR  54           HA       THR  54  -0.430 -10.187  -1.373
  439    HB   THR  54           HB       THR  54  -1.054 -12.766  -2.540
  440    HG1  THR  54           1HG      THR  54  -3.003 -11.592  -2.779
  441   1HG2  THR  54          1HG2      THR  54  -2.865 -13.214  -0.999
  442   2HG2  THR  54          2HG2      THR  54  -1.282 -13.420  -0.211
  443   3HG2  THR  54          3HG2      THR  54  -2.253 -11.965   0.112
  444    H    SER  55           H        SER  55   2.146  -9.998  -0.672
  445    HA   SER  55           HA       SER  55   2.895 -12.020   1.300
  446   1HB   SER  55          2HB       SER  55   4.698 -10.358   1.765
  447   2HB   SER  55          1HB       SER  55   4.670 -11.072   0.143
  448    HG   SER  55           HG       SER  55   4.998  -8.765   0.149
  449    H    PHE  56           H        PHE  56   1.872  -8.577   1.413
  450    HA   PHE  56           HA       PHE  56   1.535  -8.545   4.297
  451   1HB   PHE  56          2HB       PHE  56   0.625  -6.345   4.023
  452   2HB   PHE  56          1HB       PHE  56   2.071  -6.482   3.045
  453    HD1  PHE  56           1HD      PHE  56   1.994  -6.465   0.639
  454    HD2  PHE  56           2HD      PHE  56  -1.611  -6.408   2.985
  455    HE1  PHE  56           1HE      PHE  56   0.688  -5.919  -1.339
  456    HE2  PHE  56           2HE      PHE  56  -2.938  -5.926   0.952
  457    HZ   PHE  56           HZ       PHE  56  -1.796  -5.693  -1.223
  458    H    ASN  57           H        ASN  57  -0.747  -8.837   1.458
  459    HA   ASN  57           HA       ASN  57  -3.151  -8.823   2.958
  460   1HB   ASN  57          2HB       ASN  57  -2.910  -8.446   0.518
  461   2HB   ASN  57          1HB       ASN  57  -2.638 -10.174   0.316
  462   1HD2  ASN  57          2HD2      ASN  57  -4.340 -11.643   0.719
  463   2HD2  ASN  57          1HD2      ASN  57  -5.977 -11.063   0.793
  464    H    GLN  58           H        GLN  58  -0.697 -11.296   2.682
  465    HA   GLN  58           HA       GLN  58  -2.271 -13.629   3.314
  466   1HB   GLN  58          2HB       GLN  58   0.128 -13.410   2.230
  467   2HB   GLN  58          1HB       GLN  58   0.691 -13.271   3.863
  468   1HG   GLN  58          2HG       GLN  58  -0.886 -15.616   2.740
  469   2HG   GLN  58          1HG       GLN  58   0.806 -15.585   3.150
  470   1HE2  GLN  58          2HE2      GLN  58  -2.029 -16.726   4.138
  471   2HE2  GLN  58          1HE2      GLN  58  -1.768 -16.673   5.860
  472    H    ALA  59           H        ALA  59  -0.107 -11.503   5.319
  473    HA   ALA  59           HA       ALA  59  -1.471 -12.506   7.831
  474   1HB   ALA  59          1HB       ALA  59   0.638 -12.301   8.927
  475   2HB   ALA  59          2HB       ALA  59   0.732 -13.462   7.582
  476   3HB   ALA  59          3HB       ALA  59   1.423 -11.831   7.401
  477    H    TYR  60           H        TYR  60   0.403  -9.854   6.477
  478    HA   TYR  60           HA       TYR  60  -0.511  -7.763   8.362
  479   1HB   TYR  60          2HB       TYR  60   0.838  -7.513   5.674
  480   2HB   TYR  60          1HB       TYR  60   0.866  -6.371   7.061
  481    HD1  TYR  60           1HD      TYR  60   3.113  -7.863   5.316
  482    HD2  TYR  60           2HD      TYR  60   1.481  -8.391   9.261
  483    HE1  TYR  60           1HE      TYR  60   5.155  -9.067   6.002
  484    HE2  TYR  60           2HE      TYR  60   3.508  -9.582   9.949
  485    HH   TYR  60           HH       TYR  60   5.659  -9.984   9.414
  486    H    GLY  61           H        GLY  61  -2.745  -9.182   7.106
  487   1HA   GLY  61          2HA       GLY  61  -4.100  -7.644   5.091
  488   2HA   GLY  61          1HA       GLY  61  -4.834  -8.710   6.245
  489    H    ARG  62           H        ARG  62  -3.267  -6.775   8.280
  490    HA   ARG  62           HA       ARG  62  -5.496  -4.784   8.561
  491   1HB   ARG  62          2HB       ARG  62  -3.544  -6.097  10.451
  492   2HB   ARG  62          1HB       ARG  62  -4.459  -4.640  10.870
  493   1HG   ARG  62          2HG       ARG  62  -6.500  -5.739  10.825
  494   2HG   ARG  62          1HG       ARG  62  -5.917  -7.002   9.711
  495   1HD   ARG  62          2HD       ARG  62  -4.582  -8.022  11.471
  496   2HD   ARG  62          1HD       ARG  62  -4.928  -6.678  12.579
  497    HE   ARG  62           HE       ARG  62  -7.385  -7.723  11.760
  498   1HH1  ARG  62          2HH2      ARG  62  -4.604  -8.938  13.521
  499   2HH1  ARG  62          1HH2      ARG  62  -5.538  -9.974  14.549
  500   1HH2  ARG  62          1HH1      ARG  62  -8.594  -9.101  13.144
  501   2HH2  ARG  62          2HH1      ARG  62  -7.765 -10.059  14.322
  502    H    ASP  63           H        ASP  63  -2.516  -4.910   7.139
  503    HA   ASP  63           HA       ASP  63  -1.504  -2.394   8.256
  504   1HB   ASP  63          2HB       ASP  63  -0.272  -4.394   6.353
  505   2HB   ASP  63          1HB       ASP  63   0.531  -2.920   7.002
  506    H    LEU  64           H        LEU  64  -0.199  -2.261   5.286
  507    HA   LEU  64           HA       LEU  64  -1.481  -0.379   3.964
  508   1HB   LEU  64          2HB       LEU  64   0.123  -0.809   2.614
  509   2HB   LEU  64          1HB       LEU  64   0.416  -2.352   3.499
  510    HG   LEU  64           HG       LEU  64  -1.262  -3.342   1.872
  511   1HD1  LEU  64          1HD1      LEU  64  -1.336  -2.271  -0.352
  512   2HD1  LEU  64          2HD1      LEU  64  -2.124  -1.276   0.895
  513   3HD1  LEU  64          3HD1      LEU  64  -0.497  -0.849   0.314
  514   1HD2  LEU  64          1HD2      LEU  64   0.639  -3.685   0.258
  515   2HD2  LEU  64          2HD2      LEU  64   1.480  -2.300   0.994
  516   3HD2  LEU  64          3HD2      LEU  64   1.184  -3.771   1.950
  517    H    MET  65           H        MET  65  -2.491  -3.826   3.618
  518    HA   MET  65           HA       MET  65  -4.593  -3.815   1.897
  519   1HB   MET  65          2HB       MET  65  -3.657  -5.759   3.205
  520   2HB   MET  65          1HB       MET  65  -4.573  -5.244   4.579
  521   1HG   MET  65          2HG       MET  65  -5.934  -5.670   1.959
  522   2HG   MET  65          1HG       MET  65  -5.490  -7.027   3.040
  523   1HE   MET  65          1HE       MET  65  -9.481  -5.935   3.153
  524   2HE   MET  65          2HE       MET  65  -8.370  -5.369   1.883
  525   3HE   MET  65          3HE       MET  65  -8.363  -7.080   2.376
  526    H    GLU  66           H        GLU  66  -4.993  -2.944   5.397
  527    HA   GLU  66           HA       GLU  66  -7.641  -1.815   4.887
  528   1HB   GLU  66          2HB       GLU  66  -6.076  -2.512   7.307
  529   2HB   GLU  66          1HB       GLU  66  -7.360  -1.280   7.407
  530   1HG   GLU  66          2HG       GLU  66  -9.034  -2.865   6.559
  531   2HG   GLU  66          1HG       GLU  66  -7.812  -4.036   6.128
  532    H    ALA  67           H        ALA  67  -4.314  -0.721   5.394
  533    HA   ALA  67           HA       ALA  67  -4.672   2.019   6.103
  534   1HB   ALA  67          1HB       ALA  67  -2.432   2.246   5.271
  535   2HB   ALA  67          2HB       ALA  67  -2.595   0.798   6.291
  536   3HB   ALA  67          3HB       ALA  67  -2.521   0.634   4.521
  537    H    GLN  68           H        GLN  68  -4.980   0.379   2.979
  538    HA   GLN  68           HA       GLN  68  -5.750   2.939   1.629
  539   1HB   GLN  68          2HB       GLN  68  -5.180   1.903  -0.372
  540   2HB   GLN  68          1HB       GLN  68  -3.965   1.271   0.710
  541   1HG   GLN  68          2HG       GLN  68  -5.807  -0.616   1.075
  542   2HG   GLN  68          1HG       GLN  68  -6.257  -0.065  -0.573
  543   1HE2  GLN  68          2HE2      GLN  68  -5.223  -2.570   0.457
  544   2HE2  GLN  68          1HE2      GLN  68  -3.764  -2.856  -0.460
  545    H    GLU  69           H        GLU  69  -7.095  -0.342   2.469
  546    HA   GLU  69           HA       GLU  69  -9.503  -0.291   1.117
  547   1HB   GLU  69          2HB       GLU  69  -8.492  -2.094   2.535
  548   2HB   GLU  69          1HB       GLU  69  -9.234  -1.251   3.933
  549   1HG   GLU  69          2HG       GLU  69 -10.809  -2.178   1.527
  550   2HG   GLU  69          1HG       GLU  69 -10.528  -3.195   2.976
  551    H    TRP  70           H        TRP  70  -8.521   1.771   3.791
  552    HA   TRP  70           HA       TRP  70 -11.203   2.740   4.435
  553   1HB   TRP  70          2HB       TRP  70  -8.418   3.645   5.295
  554   2HB   TRP  70          1HB       TRP  70  -9.906   4.306   5.892
  555    HD1  TRP  70           HD       TRP  70  -7.428   2.264   7.060
  556    HE1  TRP  70           1HE      TRP  70  -8.158   0.343   8.540
  557    HE3  TRP  70           3HE      TRP  70 -12.287   2.084   5.708
  558    HZ2  TRP  70           2HZ      TRP  70 -10.549  -1.052   9.095
  559    HZ3  TRP  70           3HZ      TRP  70 -13.869   0.712   7.023
  560    HH2  TRP  70           HH       TRP  70 -12.989  -0.918   8.672
  561    H    CYS  71           H        CYS  71 -10.805   2.799   1.652
  562    HA   CYS  71           HA       CYS  71  -9.932   5.455   0.792
  563   1HB   CYS  71          2HB       CYS  71  -9.528   3.593  -0.746
  564   2HB   CYS  71          1HB       CYS  71 -11.239   3.233  -0.811
  565    HG   CYS  71           HG       CYS  71 -10.573   4.353  -3.012
  566    H    ARG  72           H        ARG  72 -13.070   3.581   0.673
  567    HA   ARG  72           HA       ARG  72 -14.853   5.714   0.226
  568   1HB   ARG  72          2HB       ARG  72 -14.960   3.031   0.569
  569   2HB   ARG  72          1HB       ARG  72 -15.796   3.671   2.022
  570   1HG   ARG  72          2HG       ARG  72 -17.054   5.264   0.412
  571   2HG   ARG  72          1HG       ARG  72 -16.411   4.303  -0.918
  572   1HD   ARG  72          2HD       ARG  72 -17.569   2.390  -0.265
  573   2HD   ARG  72          1HD       ARG  72 -17.916   3.062   1.369
  574    HE   ARG  72           HE       ARG  72 -18.900   4.671  -0.851
  575   1HH1  ARG  72          2HH2      ARG  72 -19.801   2.147   1.411
  576   2HH1  ARG  72          1HH2      ARG  72 -21.504   2.415   1.231
  577   1HH2  ARG  72          1HH1      ARG  72 -21.152   5.007  -1.054
  578   2HH2  ARG  72          2HH1      ARG  72 -22.244   4.012  -0.154
  579    H    LYS  73           H        LYS  73 -13.092   4.982   3.145
  580    HA   LYS  73           HA       LYS  73 -14.672   6.785   4.875
  581   1HB   LYS  73          2HB       LYS  73 -13.008   4.505   5.261
  582   2HB   LYS  73          1HB       LYS  73 -12.340   5.882   6.135
  583   1HG   LYS  73          2HG       LYS  73 -15.312   5.384   6.269
  584   2HG   LYS  73          1HG       LYS  73 -14.214   4.389   7.235
  585   1HD   LYS  73          2HD       LYS  73 -13.776   6.142   8.700
  586   2HD   LYS  73          1HD       LYS  73 -13.591   7.300   7.418
  587   1HE   LYS  73          2HE       LYS  73 -15.422   8.153   8.290
  588   2HE   LYS  73          1HE       LYS  73 -16.252   6.920   7.287
  589   1HZ   LYS  73          1HZ       LYS  73 -17.033   7.018   9.513
  590   2HZ   LYS  73          2HZ       LYS  73 -16.398   5.555   9.175
  591   3HZ   LYS  73          3HZ       LYS  73 -15.566   6.614  10.104
  592    H    TYR  74           H        TYR  74 -11.308   6.590   3.540
  593    HA   TYR  74           HA       TYR  74 -10.580   9.244   4.447
  594   1HB   TYR  74          2HB       TYR  74  -8.995   7.311   3.891
  595   2HB   TYR  74          1HB       TYR  74  -9.280   7.607   2.211
  596    HD1  TYR  74           1HD      TYR  74  -8.452   9.530   1.095
  597    HD2  TYR  74           2HD      TYR  74  -7.823   8.956   5.295
  598    HE1  TYR  74           1HE      TYR  74  -6.406  10.917   0.965
  599    HE2  TYR  74           2HE      TYR  74  -5.896  10.499   5.215
  600    HH   TYR  74           HH       TYR  74  -4.758  11.944   3.978
  601    H    MET  75           H        MET  75 -12.405   8.208   1.660
  602    HA   MET  75           HA       MET  75 -12.159  10.590  -0.002
  603   1HB   MET  75          2HB       MET  75 -13.771   8.043  -0.008
  604   2HB   MET  75          1HB       MET  75 -14.264   9.383  -1.003
  605   1HG   MET  75          2HG       MET  75 -11.374   8.594  -1.159
  606   2HG   MET  75          1HG       MET  75 -12.563   7.529  -1.874
  607   1HE   MET  75          1HE       MET  75 -10.824  11.187  -3.713
  608   2HE   MET  75          2HE       MET  75 -10.896  11.049  -1.941
  609   3HE   MET  75          3HE       MET  75 -10.101   9.778  -2.900
  610    H    LYS  76           H        LYS  76 -14.746   9.394   2.224
  611    HA   LYS  76           HA       LYS  76 -16.223  11.974   1.876
  612   1HB   LYS  76          2HB       LYS  76 -17.008   9.237   2.544
  613   2HB   LYS  76          1HB       LYS  76 -17.760  10.513   3.500
  614   1HG   LYS  76          2HG       LYS  76 -18.404  11.692   1.411
  615   2HG   LYS  76          1HG       LYS  76 -17.664  10.392   0.460
  616   1HD   LYS  76          2HD       LYS  76 -19.247   8.768   1.730
  617   2HD   LYS  76          1HD       LYS  76 -20.091  10.187   2.309
  618   1HE   LYS  76          2HE       LYS  76 -19.668  10.094  -0.665
  619   2HE   LYS  76          1HE       LYS  76 -20.758   8.919  -0.016
  620   1HZ   LYS  76          1HZ       LYS  76 -21.807  10.844  -0.651
  621   2HZ   LYS  76          2HZ       LYS  76 -21.987  10.643   0.956
  622   3HZ   LYS  76          3HZ       LYS  76 -20.960  11.777   0.388
  623    H    SER  77           H        SER  77 -14.817   9.936   4.499
  624    HA   SER  77           HA       SER  77 -15.331  11.883   6.577
  625   1HB   SER  77          2HB       SER  77 -14.988   9.339   6.758
  626   2HB   SER  77          1HB       SER  77 -13.243   9.717   6.616
  627    HG   SER  77           HG       SER  77 -14.278   9.503   8.815
  628    H    GLY  78           H        GLY  78 -12.541  11.072   4.324
  629   1HA   GLY  78          2HA       GLY  78 -10.520  12.132   3.982
  630   2HA   GLY  78          1HA       GLY  78 -11.434  13.603   4.170
  631    H    ASN  79           H        ASN  79 -10.949  11.196   6.693
  632    HA   ASN  79           HA       ASN  79  -9.790  13.302   8.353
  633   1HB   ASN  79          2HB       ASN  79 -11.601  11.007   8.870
  634   2HB   ASN  79          1HB       ASN  79 -10.323  11.135  10.048
  635   1HD2  ASN  79          2HD2      ASN  79 -11.334  11.950  11.813
  636   2HD2  ASN  79          1HD2      ASN  79 -12.218  13.450  11.739
  637    H    VAL  80           H        VAL  80  -7.661  13.313   8.421
  638    HA   VAL  80           HA       VAL  80  -5.756  11.392   7.832
  639    HB   VAL  80           HB       VAL  80  -5.575  13.565   9.861
  640   1HG1  VAL  80          1HG1      VAL  80  -3.142  13.393   9.551
  641   2HG1  VAL  80          2HG1      VAL  80  -3.804  11.900  10.261
  642   3HG1  VAL  80          3HG1      VAL  80  -3.365  11.947   8.537
  643   1HG2  VAL  80          1HG2      VAL  80  -4.383  14.702   7.992
  644   2HG2  VAL  80          2HG2      VAL  80  -4.713  13.304   6.940
  645   3HG2  VAL  80          3HG2      VAL  80  -6.057  14.302   7.542
  646    H    LYS  81           H        LYS  81  -8.044  11.229  10.482
  647    HA   LYS  81           HA       LYS  81  -6.794   9.530  12.390
  648   1HB   LYS  81          2HB       LYS  81  -9.684   9.575  11.572
  649   2HB   LYS  81          1HB       LYS  81  -9.001   8.976  13.050
  650   1HG   LYS  81          2HG       LYS  81  -9.117  11.865  12.136
  651   2HG   LYS  81          1HG       LYS  81  -9.876  11.133  13.532
  652   1HD   LYS  81          2HD       LYS  81  -7.555  10.737  14.517
  653   2HD   LYS  81          1HD       LYS  81  -6.871  11.588  13.175
  654   1HE   LYS  81          2HE       LYS  81  -8.057  13.581  13.748
  655   2HE   LYS  81          1HE       LYS  81  -8.880  12.712  15.089
  656   1HZ   LYS  81          1HZ       LYS  81  -6.959  13.733  15.986
  657   2HZ   LYS  81          2HZ       LYS  81  -6.603  12.143  15.843
  658   3HZ   LYS  81          3HZ       LYS  81  -6.002  13.218  14.773
  659    H    ASP  82           H        ASP  82  -8.001   8.742   9.130
  660    HA   ASP  82           HA       ASP  82  -7.380   5.846   9.367
  661   1HB   ASP  82          2HB       ASP  82  -8.328   7.543   7.063
  662   2HB   ASP  82          1HB       ASP  82  -7.837   5.893   6.900
  663    H    LEU  83           H        LEU  83  -5.734   8.781   8.165
  664    HA   LEU  83           HA       LEU  83  -3.615   7.333   6.712
  665   1HB   LEU  83          2HB       LEU  83  -4.752   9.731   6.385
  666   2HB   LEU  83          1HB       LEU  83  -3.285  10.135   7.338
  667    HG   LEU  83           HG       LEU  83  -2.842  10.295   4.901
  668   1HD1  LEU  83          1HD1      LEU  83  -0.880   8.988   4.724
  669   2HD1  LEU  83          2HD1      LEU  83  -1.002   9.818   6.294
  670   3HD1  LEU  83          3HD1      LEU  83  -1.331   8.073   6.182
  671   1HD2  LEU  83          1HD2      LEU  83  -2.867   8.298   3.503
  672   2HD2  LEU  83          2HD2      LEU  83  -3.530   7.337   4.846
  673   3HD2  LEU  83          3HD2      LEU  83  -4.500   8.641   4.121
  674    H    THR  84           H        THR  84  -3.848   9.222   9.798
  675    HA   THR  84           HA       THR  84  -1.217   8.976  10.763
  676    HB   THR  84           HB       THR  84  -2.865  10.391  11.745
  677    HG1  THR  84           1HG      THR  84  -2.350   9.684  14.004
  678   1HG2  THR  84          1HG2      THR  84  -4.484   9.571  13.385
  679   2HG2  THR  84          2HG2      THR  84  -4.881   8.995  11.748
  680   3HG2  THR  84          3HG2      THR  84  -4.122   7.891  12.919
  681    H    GLN  85           H        GLN  85  -3.801   6.566  10.679
  682    HA   GLN  85           HA       GLN  85  -2.360   4.559  12.288
  683   1HB   GLN  85          2HB       GLN  85  -5.033   5.180  11.555
  684   2HB   GLN  85          1HB       GLN  85  -4.623   3.545  10.961
  685   1HG   GLN  85          2HG       GLN  85  -3.636   4.208  13.716
  686   2HG   GLN  85          1HG       GLN  85  -5.383   4.051  13.567
  687   1HE2  GLN  85          2HE2      GLN  85  -6.283   2.112  13.358
  688   2HE2  GLN  85          1HE2      GLN  85  -5.374   0.622  13.286
  689    H    ALA  86           H        ALA  86  -3.502   4.962   8.883
  690    HA   ALA  86           HA       ALA  86  -2.192   2.850   7.615
  691   1HB   ALA  86          1HB       ALA  86  -2.307   4.273   5.650
  692   2HB   ALA  86          2HB       ALA  86  -3.826   4.347   6.574
  693   3HB   ALA  86          3HB       ALA  86  -2.660   5.689   6.670
  694    H    TRP  87           H        TRP  87  -0.783   5.907   8.848
  695    HA   TRP  87           HA       TRP  87   1.715   5.786   7.540
  696   1HB   TRP  87          2HB       TRP  87   0.465   7.635   8.987
  697   2HB   TRP  87          1HB       TRP  87   1.468   6.948  10.273
  698    HD1  TRP  87           HD       TRP  87   3.591   8.403  10.467
  699    HE1  TRP  87           1HE      TRP  87   5.214   9.508   8.850
  700    HE3  TRP  87           3HE      TRP  87   1.446   6.910   6.148
  701    HZ2  TRP  87           2HZ      TRP  87   5.465   9.760   6.045
  702    HZ3  TRP  87           3HZ      TRP  87   2.226   7.846   3.994
  703    HH2  TRP  87           HH       TRP  87   4.222   9.294   3.975
  704    H    ASP  88           H        ASP  88   0.689   4.635  10.800
  705    HA   ASP  88           HA       ASP  88   3.226   3.433  11.463
  706   1HB   ASP  88          2HB       ASP  88   1.237   4.147  13.037
  707   2HB   ASP  88          1HB       ASP  88   0.691   2.506  12.733
  708    H    LEU  89           H        LEU  89   0.209   2.296   9.801
  709    HA   LEU  89           HA       LEU  89   0.932  -0.516   9.688
  710   1HB   LEU  89          2HB       LEU  89  -1.072   1.093   8.087
  711   2HB   LEU  89          1HB       LEU  89  -0.917  -0.639   8.081
  712    HG   LEU  89           HG       LEU  89  -1.542   0.994  10.573
  713   1HD1  LEU  89          1HD1      LEU  89  -3.795   0.183  10.247
  714   2HD1  LEU  89          2HD1      LEU  89  -3.272   1.194   8.877
  715   3HD1  LEU  89          3HD1      LEU  89  -3.319  -0.577   8.710
  716   1HD2  LEU  89          1HD2      LEU  89  -2.155  -1.139  11.537
  717   2HD2  LEU  89          2HD2      LEU  89  -1.634  -1.989  10.063
  718   3HD2  LEU  89          3HD2      LEU  89  -0.436  -1.147  11.073
  719    H    TYR  90           H        TYR  90   1.059   2.089   7.271
  720    HA   TYR  90           HA       TYR  90   2.474   0.719   5.159
  721   1HB   TYR  90          2HB       TYR  90   2.312   3.673   5.842
  722   2HB   TYR  90          1HB       TYR  90   3.113   3.046   4.434
  723    HD1  TYR  90           1HD      TYR  90   0.527   4.832   4.997
  724    HD2  TYR  90           2HD      TYR  90   1.288   0.844   3.611
  725    HE1  TYR  90           1HE      TYR  90  -1.459   4.961   3.530
  726    HE2  TYR  90           2HE      TYR  90  -0.621   1.004   2.081
  727    HH   TYR  90           HH       TYR  90  -2.476   2.113   1.575
  728    H    TYR  91           H        TYR  91   3.703   2.596   7.930
  729    HA   TYR  91           HA       TYR  91   6.563   2.269   7.258
  730   1HB   TYR  91          2HB       TYR  91   5.359   4.097   8.732
  731   2HB   TYR  91          1HB       TYR  91   5.422   2.912   9.999
  732    HD1  TYR  91           1HD      TYR  91   7.832   1.741  10.312
  733    HD2  TYR  91           2HD      TYR  91   7.048   5.566   8.515
  734    HE1  TYR  91           1HE      TYR  91  10.172   2.388  10.682
  735    HE2  TYR  91           2HE      TYR  91   9.385   6.241   8.936
  736    HH   TYR  91           HH       TYR  91  11.281   5.732  10.001
  737    H    HIS  92           H        HIS  92   4.365   0.617   9.617
  738    HA   HIS  92           HA       HIS  92   6.281  -1.120  10.766
  739   1HB   HIS  92          2HB       HIS  92   4.039  -0.592  11.678
  740   2HB   HIS  92          1HB       HIS  92   3.306  -1.524  10.334
  741    HD1  HIS  92           1HD      HIS  92   5.951  -2.360  12.999
  742    HD2  HIS  92           2HD      HIS  92   2.598  -3.840  11.071
  743    HE1  HIS  92           1HE      HIS  92   5.603  -4.737  13.905
  744    H    VAL  93           H        VAL  93   4.135  -1.419   7.923
  745    HA   VAL  93           HA       VAL  93   5.099  -4.084   7.177
  746    HB   VAL  93           HB       VAL  93   2.790  -3.181   6.936
  747   1HG1  VAL  93          1HG1      VAL  93   2.229  -2.405   4.686
  748   2HG1  VAL  93          2HG1      VAL  93   3.194  -1.193   5.561
  749   3HG1  VAL  93          3HG1      VAL  93   3.957  -2.202   4.312
  750   1HG2  VAL  93          1HG2      VAL  93   2.480  -4.778   5.138
  751   2HG2  VAL  93          2HG2      VAL  93   4.245  -4.836   4.910
  752   3HG2  VAL  93          3HG2      VAL  93   3.530  -5.363   6.452
  753    H    PHE  94           H        PHE  94   5.774  -0.673   6.037
  754    HA   PHE  94           HA       PHE  94   7.302  -0.833   3.877
  755   1HB   PHE  94          2HB       PHE  94   6.983   1.180   5.056
  756   2HB   PHE  94          1HB       PHE  94   7.870   0.552   6.489
  757    HD1  PHE  94           1HD      PHE  94   8.108   2.474   3.455
  758    HD2  PHE  94           2HD      PHE  94  10.333   0.078   6.241
  759    HE1  PHE  94           1HE      PHE  94  10.228   3.390   2.577
  760    HE2  PHE  94           2HE      PHE  94  12.447   0.881   5.264
  761    HZ   PHE  94           HZ       PHE  94  12.404   2.606   3.474
  762    H    ARG  95           H        ARG  95   8.383  -2.052   7.022
  763    HA   ARG  95           HA       ARG  95  10.972  -2.908   5.969
  764   1HB   ARG  95          2HB       ARG  95   9.798  -2.257   8.504
  765   2HB   ARG  95          1HB       ARG  95  10.572  -3.874   8.561
  766   1HG   ARG  95          2HG       ARG  95  12.456  -2.554   7.141
  767   2HG   ARG  95          1HG       ARG  95  11.802  -1.171   8.044
  768   1HD   ARG  95          2HD       ARG  95  12.600  -3.755   9.476
  769   2HD   ARG  95          1HD       ARG  95  13.771  -2.492   9.166
  770    HE   ARG  95           HE       ARG  95  11.718  -1.180  10.364
  771   1HH1  ARG  95          2HH2      ARG  95  13.918  -3.751  11.089
  772   2HH1  ARG  95          1HH2      ARG  95  13.860  -3.566  12.816
  773   1HH2  ARG  95          1HH1      ARG  95  11.826  -0.770  12.708
  774   2HH2  ARG  95          2HH1      ARG  95  12.617  -1.955  13.692
  775    H    ARG  96           H        ARG  96   7.914  -4.356   7.001
  776    HA   ARG  96           HA       ARG  96   8.632  -7.163   6.981
  777   1HB   ARG  96          2HB       ARG  96   6.246  -5.455   7.314
  778   2HB   ARG  96          1HB       ARG  96   5.986  -7.086   6.687
  779   1HG   ARG  96          2HG       ARG  96   5.876  -7.026   9.121
  780   2HG   ARG  96          1HG       ARG  96   7.249  -8.028   8.553
  781   1HD   ARG  96          2HD       ARG  96   8.446  -5.622   8.881
  782   2HD   ARG  96          1HD       ARG  96   7.198  -5.582  10.176
  783    HE   ARG  96           HE       ARG  96   9.478  -7.422   9.925
  784   1HH1  ARG  96          2HH2      ARG  96   6.275  -7.222  11.291
  785   2HH1  ARG  96          1HH2      ARG  96   6.592  -8.358  12.565
  786   1HH2  ARG  96          1HH1      ARG  96   9.935  -8.787  11.638
  787   2HH2  ARG  96          2HH1      ARG  96   8.685  -9.246  12.756
  788    H    ILE  97           H        ILE  97   6.576  -5.313   4.687
  789    HA   ILE  97           HA       ILE  97   6.613  -7.298   2.554
  790    HB   ILE  97           HB       ILE  97   6.019  -5.363   1.113
  791   1HG1  ILE  97          2HG1      ILE  97   5.379  -3.925   3.608
  792   2HG1  ILE  97          1HG1      ILE  97   6.872  -3.662   2.649
  793   1HG2  ILE  97          1HG2      ILE  97   3.675  -5.581   1.921
  794   2HG2  ILE  97          2HG2      ILE  97   4.506  -7.156   1.928
  795   3HG2  ILE  97          3HG2      ILE  97   4.271  -6.267   3.452
  796   1HD1  ILE  97          1HD1      ILE  97   5.153  -2.018   2.099
  797   2HD1  ILE  97          2HD1      ILE  97   5.512  -3.065   0.704
  798   3HD1  ILE  97          3HD1      ILE  97   4.030  -3.325   1.654
  799    H    SER  98           H        SER  98   8.979  -5.002   3.680
  800    HA   SER  98           HA       SER  98  10.447  -4.475   1.293
  801   1HB   SER  98          2HB       SER  98  10.587  -3.515   3.747
  802   2HB   SER  98          1HB       SER  98  11.814  -4.818   3.902
  803    HG   SER  98           HG       SER  98  11.654  -2.778   1.886
  804    H    LYS  99           H        LYS  99  11.090  -6.835   3.966
  805    HA   LYS  99           HA       LYS  99  11.782  -9.064   2.269
  806   1HB   LYS  99          2HB       LYS  99  14.115  -9.238   2.661
  807   2HB   LYS  99          1HB       LYS  99  13.671  -7.875   1.584
  808   1HG   LYS  99          2HG       LYS  99  14.569  -6.299   3.052
  809   2HG   LYS  99          1HG       LYS  99  14.058  -7.151   4.473
  810   1HD   LYS  99          2HD       LYS  99  16.259  -8.282   2.803
  811   2HD   LYS  99          1HD       LYS  99  16.539  -6.909   3.919
  812   1HE   LYS  99          2HE       LYS  99  16.982  -8.516   5.418
  813   2HE   LYS  99          1HE       LYS  99  15.199  -8.654   5.530
  814   1HZ   LYS  99          1HZ       LYS  99  16.211 -10.747   5.288
  815   2HZ   LYS  99          2HZ       LYS  99  15.326 -10.428   3.962
  816   3HZ   LYS  99          3HZ       LYS  99  16.961 -10.310   3.904
  817    H    GLN 100           H        GLN 100  10.024  -8.974   4.392
  818    HA   GLN 100           HA       GLN 100  10.931  -9.442   6.914
  819   1HB   GLN 100          2HB       GLN 100   8.665  -9.164   6.372
  820   2HB   GLN 100          1HB       GLN 100   8.629 -10.738   5.516
  821   1HG   GLN 100          2HG       GLN 100   7.595 -10.728   7.794
  822   2HG   GLN 100          1HG       GLN 100   8.898 -11.936   7.547
  823   1HE2  GLN 100          2HE2      GLN 100   9.062 -12.128   9.830
  824   2HE2  GLN 100          1HE2      GLN 100   9.878 -10.878  10.733
  Start of MODEL    7
    1   1H    GLU   1          1H        GLU   1   9.294  -6.503 -17.251
    2   2H    GLU   1          2H        GLU   1   9.459  -6.342 -18.917
    3    HA   GLU   1           HA       GLU   1  10.444  -8.363 -19.108
    4   1HB   GLU   1          2HB       GLU   1  10.794  -7.527 -16.411
    5   2HB   GLU   1          1HB       GLU   1  10.696  -9.289 -16.521
    6   1HG   GLU   1          2HG       GLU   1  12.260  -8.643 -18.735
    7   2HG   GLU   1          1HG       GLU   1  12.786  -7.462 -17.535
    8    H    LEU   2           H        LEU   2   8.208  -8.960 -16.359
    9    HA   LEU   2           HA       LEU   2   7.076 -10.996 -15.813
   10   1HB   LEU   2          2HB       LEU   2   5.064 -11.062 -16.990
   11   2HB   LEU   2          1HB       LEU   2   5.531  -9.382 -16.570
   12    HG   LEU   2           HG       LEU   2   6.354 -10.193 -19.298
   13   1HD1  LEU   2          1HD1      LEU   2   4.122 -10.133 -20.244
   14   2HD1  LEU   2          2HD1      LEU   2   4.323 -11.524 -19.152
   15   3HD1  LEU   2          3HD1      LEU   2   3.414 -10.093 -18.612
   16   1HD2  LEU   2          1HD2      LEU   2   5.365  -8.036 -19.850
   17   2HD2  LEU   2          2HD2      LEU   2   4.691  -7.900 -18.208
   18   3HD2  LEU   2          3HD2      LEU   2   6.454  -7.879 -18.449
   19    H    ILE   3           H        ILE   3   9.119 -12.289 -16.312
   20    HA   ILE   3           HA       ILE   3   8.808 -13.968 -18.734
   21    HB   ILE   3           HB       ILE   3  10.864 -12.851 -18.493
   22   1HG1  ILE   3          2HG1      ILE   3  10.719 -14.595 -19.879
   23   2HG1  ILE   3          1HG1      ILE   3  12.313 -14.554 -19.035
   24   1HG2  ILE   3          1HG2      ILE   3  12.580 -13.570 -16.899
   25   2HG2  ILE   3          2HG2      ILE   3  11.221 -12.778 -16.064
   26   3HG2  ILE   3          3HG2      ILE   3  11.377 -14.550 -16.028
   27   1HD1  ILE   3          1HD1      ILE   3  11.579 -16.829 -19.467
   28   2HD1  ILE   3          2HD1      ILE   3  11.655 -16.497 -17.720
   29   3HD1  ILE   3          3HD1      ILE   3  10.080 -16.538 -18.553
   30    H    ARG   4           H        ARG   4   9.501 -14.370 -15.268
   31    HA   ARG   4           HA       ARG   4   7.955 -16.929 -15.128
   32   1HB   ARG   4          2HB       ARG   4   9.635 -17.842 -13.728
   33   2HB   ARG   4          1HB       ARG   4  10.276 -17.424 -15.354
   34   1HG   ARG   4          2HG       ARG   4  12.042 -16.737 -13.970
   35   2HG   ARG   4          1HG       ARG   4  11.141 -15.244 -14.090
   36   1HD   ARG   4          2HD       ARG   4   9.959 -15.911 -11.911
   37   2HD   ARG   4          1HD       ARG   4  11.136 -17.209 -11.776
   38    HE   ARG   4           HE       ARG   4  11.543 -14.481 -11.190
   39   1HH1  ARG   4          2HH2      ARG   4  13.221 -17.279 -12.434
   40   2HH1  ARG   4          1HH2      ARG   4  14.794 -16.717 -11.974
   41   1HH2  ARG   4          1HH1      ARG   4  13.640 -13.727 -10.613
   42   2HH2  ARG   4          2HH1      ARG   4  15.005 -14.724 -10.969
   43    H    VAL   5           H        VAL   5   9.384 -14.195 -13.297
   44    HA   VAL   5           HA       VAL   5   7.978 -14.516 -10.892
   45    HB   VAL   5           HB       VAL   5   9.977 -13.283 -11.003
   46   1HG1  VAL   5          1HG1      VAL   5  10.111 -11.002 -11.902
   47   2HG1  VAL   5          2HG1      VAL   5   9.815 -12.186 -13.198
   48   3HG1  VAL   5          3HG1      VAL   5   8.482 -11.171 -12.597
   49   1HG2  VAL   5          1HG2      VAL   5   9.373 -11.376  -9.652
   50   2HG2  VAL   5          2HG2      VAL   5   7.663 -11.623 -10.080
   51   3HG2  VAL   5          3HG2      VAL   5   8.542 -12.875  -9.172
   52    H    ALA   6           H        ALA   6   7.122 -12.984 -13.956
   53    HA   ALA   6           HA       ALA   6   5.237 -12.099 -14.856
   54   1HB   ALA   6          1HB       ALA   6   3.092 -12.876 -14.091
   55   2HB   ALA   6          2HB       ALA   6   4.261 -14.202 -14.304
   56   3HB   ALA   6          3HB       ALA   6   3.861 -13.624 -12.670
   57    H    ILE   7           H        ILE   7   6.810 -10.498 -13.167
   58    HA   ILE   7           HA       ILE   7   6.917  -8.756 -11.645
   59    HB   ILE   7           HB       ILE   7   6.722  -7.869 -13.809
   60   1HG1  ILE   7          2HG1      ILE   7   7.323  -6.567 -12.043
   61   2HG1  ILE   7          1HG1      ILE   7   6.418  -5.690 -13.335
   62   1HG2  ILE   7          1HG2      ILE   7   4.667  -6.788 -14.604
   63   2HG2  ILE   7          2HG2      ILE   7   4.469  -8.555 -14.517
   64   3HG2  ILE   7          3HG2      ILE   7   3.752  -7.515 -13.263
   65   1HD1  ILE   7          1HD1      ILE   7   5.943  -4.789 -11.130
   66   2HD1  ILE   7          2HD1      ILE   7   4.491  -5.521 -11.853
   67   3HD1  ILE   7          3HD1      ILE   7   5.384  -6.386 -10.580
   68    H    LEU   8           H        LEU   8   6.148  -9.935  -9.717
   69    HA   LEU   8           HA       LEU   8   3.367 -10.126  -9.028
   70   1HB   LEU   8          2HB       LEU   8   5.796 -10.194  -7.319
   71   2HB   LEU   8          1HB       LEU   8   4.112 -10.557  -6.815
   72    HG   LEU   8           HG       LEU   8   5.909 -12.103  -8.671
   73   1HD1  LEU   8          1HD1      LEU   8   5.411 -13.881  -7.007
   74   2HD1  LEU   8          2HD1      LEU   8   6.159 -12.447  -6.265
   75   3HD1  LEU   8          3HD1      LEU   8   4.410 -12.724  -6.098
   76   1HD2  LEU   8          1HD2      LEU   8   4.067 -13.676  -9.080
   77   2HD2  LEU   8          2HD2      LEU   8   2.940 -12.592  -8.230
   78   3HD2  LEU   8          3HD2      LEU   8   3.699 -12.070  -9.754
   79    H    TRP   9           H        TRP   9   2.540  -9.112  -6.929
   80    HA   TRP   9           HA       TRP   9   2.574  -6.228  -7.276
   81   1HB   TRP   9          2HB       TRP   9   0.880  -8.011  -5.567
   82   2HB   TRP   9          1HB       TRP   9   0.791  -6.250  -5.546
   83    HD1  TRP   9           HD       TRP   9   1.273  -5.969  -8.817
   84    HE1  TRP   9           1HE      TRP   9  -0.900  -6.018 -10.116
   85    HE3  TRP   9           3HE      TRP   9  -1.302  -8.915  -5.679
   86    HZ2  TRP   9           2HZ      TRP   9  -3.453  -7.173  -9.777
   87    HZ3  TRP   9           3HZ      TRP   9  -3.677  -9.405  -6.140
   88    HH2  TRP   9           HH       TRP   9  -4.709  -8.625  -8.249
   89    H    HIS  10           H        HIS  10   3.430  -8.492  -4.608
   90    HA   HIS  10           HA       HIS  10   4.473  -6.883  -2.636
   91   1HB   HIS  10          2HB       HIS  10   4.587  -8.984  -2.053
   92   2HB   HIS  10          1HB       HIS  10   4.872  -9.554  -3.737
   93    HD1  HIS  10           1HD      HIS  10   6.670  -9.342  -0.527
   94    HD2  HIS  10           2HD      HIS  10   7.469  -9.410  -4.574
   95    HE1  HIS  10           1HE      HIS  10   9.203  -9.591  -0.735
   96    H    GLU  11           H        GLU  11   5.870  -7.417  -5.834
   97    HA   GLU  11           HA       GLU  11   8.546  -6.486  -5.328
   98   1HB   GLU  11          2HB       GLU  11   6.969  -6.790  -7.952
   99   2HB   GLU  11          1HB       GLU  11   8.672  -6.519  -7.845
  100   1HG   GLU  11          2HG       GLU  11   7.299  -8.890  -6.623
  101   2HG   GLU  11          1HG       GLU  11   7.990  -8.820  -8.277
  102    H    MET  12           H        MET  12   5.591  -5.042  -6.858
  103    HA   MET  12           HA       MET  12   6.805  -2.439  -7.236
  104   1HB   MET  12          2HB       MET  12   4.839  -1.614  -7.948
  105   2HB   MET  12          1HB       MET  12   4.923  -3.284  -8.591
  106   1HG   MET  12          2HG       MET  12   3.369  -4.051  -6.926
  107   2HG   MET  12          1HG       MET  12   3.358  -2.434  -6.147
  108   1HE   MET  12          1HE       MET  12   1.518  -3.454 -10.230
  109   2HE   MET  12          2HE       MET  12   3.269  -3.399  -9.924
  110   3HE   MET  12          3HE       MET  12   2.265  -4.629  -9.123
  111    H    TRP  13           H        TRP  13   4.581  -3.929  -4.737
  112    HA   TRP  13           HA       TRP  13   3.838  -2.003  -3.142
  113   1HB   TRP  13          2HB       TRP  13   4.657  -4.740  -2.719
  114   2HB   TRP  13          1HB       TRP  13   4.725  -3.712  -1.251
  115    HD1  TRP  13           HD       TRP  13   2.728  -4.882  -0.123
  116    HE1  TRP  13           1HE      TRP  13   0.220  -4.773  -0.430
  117    HE3  TRP  13           3HE      TRP  13   2.574  -2.408  -4.506
  118    HZ2  TRP  13           2HZ      TRP  13  -1.570  -3.714  -2.340
  119    HZ3  TRP  13           3HZ      TRP  13   0.481  -2.210  -5.741
  120    HH2  TRP  13           HH       TRP  13  -1.617  -2.961  -4.697
  121    H    HIS  14           H        HIS  14   7.222  -3.180  -3.075
  122    HA   HIS  14           HA       HIS  14   8.438  -1.517  -1.161
  123   1HB   HIS  14          2HB       HIS  14   9.233  -3.124  -3.465
  124   2HB   HIS  14          1HB       HIS  14  10.175  -1.668  -3.356
  125    HD1  HIS  14           1HD      HIS  14  11.208  -4.563  -2.739
  126    HD2  HIS  14           2HD      HIS  14  10.059  -1.633  -0.005
  127    HE1  HIS  14           1HE      HIS  14  12.543  -4.998  -0.576
  128    H    GLU  15           H        GLU  15   8.409  -0.707  -4.658
  129    HA   GLU  15           HA       GLU  15   9.022   2.142  -4.230
  130   1HB   GLU  15          2HB       GLU  15   8.999   2.354  -6.590
  131   2HB   GLU  15          1HB       GLU  15   9.841   0.880  -6.253
  132   1HG   GLU  15          2HG       GLU  15   7.793  -0.427  -6.820
  133   2HG   GLU  15          1HG       GLU  15   6.941   1.053  -7.152
  134    H    GLY  16           H        GLY  16   6.026   0.232  -4.984
  135   1HA   GLY  16          2HA       GLY  16   4.360   2.372  -5.714
  136   2HA   GLY  16          1HA       GLY  16   3.854   0.832  -5.001
  137    H    LEU  17           H        LEU  17   5.287   1.046  -2.520
  138    HA   LEU  17           HA       LEU  17   3.808   3.064  -0.965
  139   1HB   LEU  17          2HB       LEU  17   5.378   0.626  -0.391
  140   2HB   LEU  17          1HB       LEU  17   5.274   1.906   0.828
  141    HG   LEU  17           HG       LEU  17   2.806   0.906  -0.606
  142   1HD1  LEU  17          1HD1      LEU  17   2.470  -0.633   1.311
  143   2HD1  LEU  17          2HD1      LEU  17   3.948  -1.048   0.413
  144   3HD1  LEU  17          3HD1      LEU  17   4.062  -0.172   1.958
  145   1HD2  LEU  17          1HD2      LEU  17   1.729   1.745   1.469
  146   2HD2  LEU  17          2HD2      LEU  17   3.327   2.193   2.114
  147   3HD2  LEU  17          3HD2      LEU  17   2.681   3.024   0.680
  148    H    GLU  18           H        GLU  18   7.126   2.626  -2.238
  149    HA   GLU  18           HA       GLU  18   8.374   4.581  -0.512
  150   1HB   GLU  18          2HB       GLU  18   9.550   2.705  -1.782
  151   2HB   GLU  18          1HB       GLU  18   9.392   3.711  -3.211
  152   1HG   GLU  18          2HG       GLU  18  11.506   4.296  -2.342
  153   2HG   GLU  18          1HG       GLU  18  10.484   5.596  -1.756
  154    H    GLU  19           H        GLU  19   7.186   4.686  -3.941
  155    HA   GLU  19           HA       GLU  19   7.706   7.472  -4.451
  156   1HB   GLU  19          2HB       GLU  19   7.518   5.778  -6.159
  157   2HB   GLU  19          1HB       GLU  19   5.788   5.566  -5.739
  158   1HG   GLU  19          2HG       GLU  19   6.220   7.074  -7.785
  159   2HG   GLU  19          1HG       GLU  19   5.269   7.827  -6.543
  160    H    ALA  20           H        ALA  20   5.240   5.820  -2.597
  161    HA   ALA  20           HA       ALA  20   3.405   8.150  -2.476
  162   1HB   ALA  20          1HB       ALA  20   2.097   6.636  -1.111
  163   2HB   ALA  20          2HB       ALA  20   2.529   5.861  -2.653
  164   3HB   ALA  20          3HB       ALA  20   3.397   5.423  -1.164
  165    H    SER  21           H        SER  21   4.927   6.062   0.002
  166    HA   SER  21           HA       SER  21   4.690   7.774   2.224
  167   1HB   SER  21          2HB       SER  21   6.184   6.336   3.340
  168   2HB   SER  21          1HB       SER  21   5.220   5.327   2.293
  169    HG   SER  21           HG       SER  21   7.233   5.844   0.749
  170    H    ARG  22           H        ARG  22   7.097   7.883  -0.447
  171    HA   ARG  22           HA       ARG  22   8.890   9.785   0.804
  172   1HB   ARG  22          2HB       ARG  22   9.409   8.207  -1.182
  173   2HB   ARG  22          1HB       ARG  22   8.489   9.309  -2.170
  174   1HG   ARG  22          2HG       ARG  22   9.998  11.168  -1.508
  175   2HG   ARG  22          1HG       ARG  22  10.931  10.048  -0.524
  176   1HD   ARG  22          2HD       ARG  22  12.127  10.063  -2.557
  177   2HD   ARG  22          1HD       ARG  22  11.133   8.642  -2.759
  178    HE   ARG  22           HE       ARG  22   9.878  11.021  -3.765
  179   1HH1  ARG  22          2HH2      ARG  22  12.166   8.480  -4.506
  180   2HH1  ARG  22          1HH2      ARG  22  12.073   8.704  -6.224
  181   1HH2  ARG  22          1HH1      ARG  22   9.785  11.309  -6.061
  182   2HH2  ARG  22          2HH1      ARG  22  10.747  10.286  -7.069
  183    H    LEU  23           H        LEU  23   5.752  10.075  -0.880
  184    HA   LEU  23           HA       LEU  23   6.110  12.906  -1.548
  185   1HB   LEU  23          2HB       LEU  23   3.609  11.177  -1.655
  186   2HB   LEU  23          1HB       LEU  23   3.753  12.802  -2.243
  187    HG   LEU  23           HG       LEU  23   5.379  10.459  -3.321
  188   1HD1  LEU  23          1HD1      LEU  23   3.891  10.622  -5.201
  189   2HD1  LEU  23          2HD1      LEU  23   2.985  10.234  -3.720
  190   3HD1  LEU  23          3HD1      LEU  23   2.943  11.886  -4.381
  191   1HD2  LEU  23          1HD2      LEU  23   5.928  11.923  -5.129
  192   2HD2  LEU  23          2HD2      LEU  23   5.074  13.276  -4.349
  193   3HD2  LEU  23          3HD2      LEU  23   6.539  12.598  -3.600
  194    H    TYR  24           H        TYR  24   4.503  10.871   0.942
  195    HA   TYR  24           HA       TYR  24   3.588  13.188   2.583
  196   1HB   TYR  24          2HB       TYR  24   2.286  11.233   2.732
  197   2HB   TYR  24          1HB       TYR  24   3.664  10.206   2.995
  198    HD1  TYR  24           1HD      TYR  24   3.944   9.417   5.033
  199    HD2  TYR  24           2HD      TYR  24   2.445  13.415   4.601
  200    HE1  TYR  24           1HE      TYR  24   3.561   9.560   7.475
  201    HE2  TYR  24           2HE      TYR  24   2.001  13.530   7.020
  202    HH   TYR  24           HH       TYR  24   2.358  12.553   8.994
  203    H    PHE  25           H        PHE  25   6.151  10.702   3.258
  204    HA   PHE  25           HA       PHE  25   7.238  12.234   5.386
  205   1HB   PHE  25          2HB       PHE  25   7.164   9.617   4.661
  206   2HB   PHE  25          1HB       PHE  25   8.749  10.012   4.022
  207    HD1  PHE  25           1HD      PHE  25   6.763  10.816   7.118
  208    HD2  PHE  25           2HD      PHE  25  10.492   9.599   5.362
  209    HE1  PHE  25           1HE      PHE  25   7.713  10.489   9.382
  210    HE2  PHE  25           2HE      PHE  25  11.446   9.253   7.629
  211    HZ   PHE  25           HZ       PHE  25  10.066   9.730   9.636
  212    H    GLY  26           H        GLY  26   7.466  12.975   2.157
  213   1HA   GLY  26          2HA       GLY  26  10.213  14.180   2.374
  214   2HA   GLY  26          1HA       GLY  26   9.563  13.555   0.892
  215    H    GLU  27           H        GLU  27   6.834  14.614   1.192
  216    HA   GLU  27           HA       GLU  27   7.297  17.523   1.295
  217   1HB   GLU  27          2HB       GLU  27   6.084  17.713  -0.874
  218   2HB   GLU  27          1HB       GLU  27   7.791  17.164  -0.884
  219   1HG   GLU  27          2HG       GLU  27   6.768  14.790  -0.969
  220   2HG   GLU  27          1HG       GLU  27   5.280  15.638  -1.503
  221    H    ARG  28           H        ARG  28   5.714  15.428   2.959
  222    HA   ARG  28           HA       ARG  28   3.699  14.947   3.769
  223   1HB   ARG  28          2HB       ARG  28   4.341  17.662   4.278
  224   2HB   ARG  28          1HB       ARG  28   2.584  17.411   4.268
  225   1HG   ARG  28          2HG       ARG  28   3.055  15.301   5.653
  226   2HG   ARG  28          1HG       ARG  28   4.691  15.994   5.899
  227   1HD   ARG  28          2HD       ARG  28   3.716  18.042   6.869
  228   2HD   ARG  28          1HD       ARG  28   2.081  17.497   6.491
  229    HE   ARG  28           HE       ARG  28   3.259  15.530   8.080
  230   1HH1  ARG  28          2HH2      ARG  28   2.348  18.902   8.415
  231   2HH1  ARG  28          1HH2      ARG  28   2.061  18.800  10.121
  232   1HH2  ARG  28          1HH1      ARG  28   2.870  15.429  10.355
  233   2HH2  ARG  28          2HH1      ARG  28   2.340  16.853  11.182
  234    H    ASN  29           H        ASN  29   3.664  14.973   0.887
  235    HA   ASN  29           HA       ASN  29   1.117  16.149   0.151
  236   1HB   ASN  29          2HB       ASN  29   3.351  16.210  -1.195
  237   2HB   ASN  29          1HB       ASN  29   2.955  14.566  -1.674
  238   1HD2  ASN  29          2HD2      ASN  29   2.773  15.306  -3.873
  239   2HD2  ASN  29          1HD2      ASN  29   1.348  16.200  -4.337
  240    H    VAL  30           H        VAL  30   0.240  14.651   1.842
  241    HA   VAL  30           HA       VAL  30  -0.054  11.873   1.590
  242    HB   VAL  30           HB       VAL  30  -1.937  13.926   2.768
  243   1HG1  VAL  30          1HG1      VAL  30  -2.823  12.027   4.036
  244   2HG1  VAL  30          2HG1      VAL  30  -3.071  11.792   2.289
  245   3HG1  VAL  30          3HG1      VAL  30  -1.769  10.917   3.129
  246   1HG2  VAL  30          1HG2      VAL  30  -0.931  13.212   4.890
  247   2HG2  VAL  30          2HG2      VAL  30   0.161  12.109   4.019
  248   3HG2  VAL  30          3HG2      VAL  30   0.319  13.868   3.808
  249    H    LYS  31           H        LYS  31  -2.052  14.541   0.204
  250    HA   LYS  31           HA       LYS  31  -3.895  13.081  -1.356
  251   1HB   LYS  31          2HB       LYS  31  -4.167  15.339  -0.882
  252   2HB   LYS  31          1HB       LYS  31  -2.540  15.750  -1.542
  253   1HG   LYS  31          2HG       LYS  31  -4.798  14.805  -3.312
  254   2HG   LYS  31          1HG       LYS  31  -4.589  16.503  -2.876
  255   1HD   LYS  31          2HD       LYS  31  -2.032  15.981  -3.693
  256   2HD   LYS  31          1HD       LYS  31  -2.847  14.786  -4.646
  257   1HE   LYS  31          2HE       LYS  31  -4.386  16.611  -5.439
  258   2HE   LYS  31          1HE       LYS  31  -3.250  17.745  -4.656
  259   1HZ   LYS  31          1HZ       LYS  31  -2.583  17.396  -6.876
  260   2HZ   LYS  31          2HZ       LYS  31  -1.494  16.615  -5.935
  261   3HZ   LYS  31          3HZ       LYS  31  -2.649  15.773  -6.724
  262    H    GLY  32           H        GLY  32  -0.426  13.898  -1.986
  263   1HA   GLY  32          2HA       GLY  32  -0.361  13.111  -4.757
  264   2HA   GLY  32          1HA       GLY  32   1.005  13.371  -3.685
  265    H    MET  33           H        MET  33   0.923  11.550  -1.751
  266    HA   MET  33           HA       MET  33   1.700   9.062  -2.840
  267   1HB   MET  33          2HB       MET  33   1.876   8.311  -0.761
  268   2HB   MET  33          1HB       MET  33   2.133  10.090  -0.604
  269   1HG   MET  33          2HG       MET  33   0.312  10.364   0.702
  270   2HG   MET  33          1HG       MET  33  -0.550   8.972   0.010
  271   1HE   MET  33          1HE       MET  33   0.294   8.571   3.950
  272   2HE   MET  33          2HE       MET  33   0.352  10.115   3.068
  273   3HE   MET  33          3HE       MET  33  -0.983   8.975   2.778
  274    H    PHE  34           H        PHE  34  -1.484  10.130  -1.802
  275    HA   PHE  34           HA       PHE  34  -2.910   7.744  -1.928
  276   1HB   PHE  34          2HB       PHE  34  -3.283  10.545  -1.510
  277   2HB   PHE  34          1HB       PHE  34  -4.448  10.066  -2.748
  278    HD1  PHE  34           1HD      PHE  34  -6.441   9.315  -2.089
  279    HD2  PHE  34           2HD      PHE  34  -3.088   8.690   0.526
  280    HE1  PHE  34           1HE      PHE  34  -7.939   8.274  -0.412
  281    HE2  PHE  34           2HE      PHE  34  -4.587   7.610   2.181
  282    HZ   PHE  34           HZ       PHE  34  -7.009   7.433   1.724
  283    H    GLU  35           H        GLU  35  -1.652   9.689  -4.583
  284    HA   GLU  35           HA       GLU  35  -3.442   8.606  -6.650
  285   1HB   GLU  35          2HB       GLU  35  -2.370  10.929  -6.598
  286   2HB   GLU  35          1HB       GLU  35  -0.871  10.124  -7.037
  287   1HG   GLU  35          2HG       GLU  35  -1.940   9.175  -9.054
  288   2HG   GLU  35          1HG       GLU  35  -3.479   9.904  -8.603
  289    H    VAL  36           H        VAL  36  -0.083   7.945  -5.465
  290    HA   VAL  36           HA       VAL  36   0.347   5.857  -7.522
  291    HB   VAL  36           HB       VAL  36   2.172   7.325  -7.103
  292   1HG1  VAL  36          1HG1      VAL  36   3.399   7.247  -5.047
  293   2HG1  VAL  36          2HG1      VAL  36   1.765   7.888  -4.756
  294   3HG1  VAL  36          3HG1      VAL  36   2.157   6.213  -4.301
  295   1HG2  VAL  36          1HG2      VAL  36   3.860   5.726  -6.847
  296   2HG2  VAL  36          2HG2      VAL  36   2.674   4.514  -6.308
  297   3HG2  VAL  36          3HG2      VAL  36   2.580   5.180  -7.955
  298    H    LEU  37           H        LEU  37  -0.817   6.140  -4.210
  299    HA   LEU  37           HA       LEU  37  -0.738   3.293  -3.678
  300   1HB   LEU  37          2HB       LEU  37  -1.093   5.756  -2.223
  301   2HB   LEU  37          1HB       LEU  37  -2.278   4.485  -1.756
  302    HG   LEU  37           HG       LEU  37   0.072   4.777  -0.560
  303   1HD1  LEU  37          1HD1      LEU  37  -0.095   2.355   0.032
  304   2HD1  LEU  37          2HD1      LEU  37  -1.703   3.115  -0.013
  305   3HD1  LEU  37          3HD1      LEU  37  -1.162   2.095  -1.369
  306   1HD2  LEU  37          1HD2      LEU  37   1.688   3.098  -1.297
  307   2HD2  LEU  37          2HD2      LEU  37   0.718   2.791  -2.757
  308   3HD2  LEU  37          3HD2      LEU  37   1.487   4.378  -2.517
  309    H    GLU  38           H        GLU  38  -3.113   5.609  -4.940
  310    HA   GLU  38           HA       GLU  38  -5.517   4.278  -4.791
  311   1HB   GLU  38          2HB       GLU  38  -4.396   6.379  -6.286
  312   2HB   GLU  38          1HB       GLU  38  -5.101   5.269  -7.452
  313   1HG   GLU  38          2HG       GLU  38  -6.916   5.461  -5.259
  314   2HG   GLU  38          1HG       GLU  38  -6.414   7.103  -5.716
  315    HA   PRO  39           HA       PRO  39  -4.437   1.103  -8.230
  316   1HB   PRO  39          2HB       PRO  39  -2.001   0.814  -9.245
  317   2HB   PRO  39          1HB       PRO  39  -3.143   1.983  -9.905
  318   1HG   PRO  39          2HG       PRO  39  -0.840   2.477  -7.959
  319   2HG   PRO  39          1HG       PRO  39  -1.269   3.404  -9.394
  320   1HD   PRO  39          1HD       PRO  39  -2.131   4.147  -6.841
  321   2HD   PRO  39          2HD       PRO  39  -3.148   4.458  -8.307
  322    H    LEU  40           H        LEU  40  -2.284   1.780  -5.479
  323    HA   LEU  40           HA       LEU  40  -1.309  -0.972  -5.124
  324   1HB   LEU  40          2HB       LEU  40  -1.213   1.567  -3.574
  325   2HB   LEU  40          1HB       LEU  40  -0.528  -0.019  -3.050
  326    HG   LEU  40           HG       LEU  40   0.722   2.058  -4.404
  327   1HD1  LEU  40          1HD1      LEU  40   2.617   0.454  -4.177
  328   2HD1  LEU  40          2HD1      LEU  40   1.601   0.553  -2.718
  329   3HD1  LEU  40          3HD1      LEU  40   1.440  -0.834  -3.822
  330   1HD2  LEU  40          1HD2      LEU  40   1.749   1.046  -6.362
  331   2HD2  LEU  40          2HD2      LEU  40   0.619  -0.326  -6.265
  332   3HD2  LEU  40          3HD2      LEU  40   0.007   1.308  -6.613
  333    H    HIS  41           H        HIS  41  -4.226   0.792  -4.311
  334    HA   HIS  41           HA       HIS  41  -5.133  -1.333  -2.479
  335   1HB   HIS  41          2HB       HIS  41  -5.703   0.741  -1.789
  336   2HB   HIS  41          1HB       HIS  41  -5.986   1.340  -3.460
  337    HD1  HIS  41           1HD      HIS  41  -8.353   1.736  -3.905
  338    HD2  HIS  41           2HD      HIS  41  -7.772  -1.248  -1.097
  339    HE1  HIS  41           1HE      HIS  41 -10.695   0.834  -3.344
  340    H    ALA  42           H        ALA  42  -5.528  -0.397  -5.882
  341    HA   ALA  42           HA       ALA  42  -7.845  -2.175  -6.361
  342   1HB   ALA  42          1HB       ALA  42  -7.699  -1.348  -8.608
  343   2HB   ALA  42          2HB       ALA  42  -7.776  -0.017  -7.428
  344   3HB   ALA  42          3HB       ALA  42  -6.227  -0.435  -8.200
  345    H    MET  43           H        MET  43  -4.332  -2.031  -7.148
  346    HA   MET  43           HA       MET  43  -4.049  -4.521  -8.510
  347   1HB   MET  43          2HB       MET  43  -2.150  -2.766  -6.901
  348   2HB   MET  43          1HB       MET  43  -1.647  -4.251  -7.663
  349   1HG   MET  43          2HG       MET  43  -1.849  -3.388  -9.804
  350   2HG   MET  43          1HG       MET  43  -3.086  -2.225  -9.354
  351   1HE   MET  43          1HE       MET  43   0.312  -0.394 -10.602
  352   2HE   MET  43          2HE       MET  43  -0.089  -2.090 -10.967
  353   3HE   MET  43          3HE       MET  43  -1.342  -0.832 -11.091
  354    H    MET  44           H        MET  44  -4.941  -3.980  -5.162
  355    HA   MET  44           HA       MET  44  -4.112  -6.807  -4.578
  356   1HB   MET  44          2HB       MET  44  -2.919  -4.931  -3.343
  357   2HB   MET  44          1HB       MET  44  -4.454  -4.569  -2.580
  358   1HG   MET  44          2HG       MET  44  -3.984  -7.411  -2.439
  359   2HG   MET  44          1HG       MET  44  -2.572  -6.528  -1.842
  360   1HE   MET  44          1HE       MET  44  -3.475  -5.503   1.544
  361   2HE   MET  44          2HE       MET  44  -2.486  -6.632   0.587
  362   3HE   MET  44          3HE       MET  44  -2.557  -4.911   0.138
  363    H    GLU  45           H        GLU  45  -6.732  -4.939  -5.452
  364    HA   GLU  45           HA       GLU  45  -8.710  -6.548  -3.868
  365   1HB   GLU  45          2HB       GLU  45  -8.619  -4.056  -3.519
  366   2HB   GLU  45          1HB       GLU  45  -9.152  -3.887  -5.189
  367   1HG   GLU  45          2HG       GLU  45 -11.206  -5.077  -4.745
  368   2HG   GLU  45          1HG       GLU  45 -10.640  -5.602  -3.161
  369    H    ARG  46           H        ARG  46  -7.883  -5.397  -7.207
  370    HA   ARG  46           HA       ARG  46  -9.881  -6.414  -8.772
  371   1HB   ARG  46          2HB       ARG  46  -7.352  -5.424  -9.124
  372   2HB   ARG  46          1HB       ARG  46  -7.169  -7.102  -9.666
  373   1HG   ARG  46          2HG       ARG  46  -8.406  -6.749 -11.510
  374   2HG   ARG  46          1HG       ARG  46  -9.671  -5.884 -10.593
  375   1HD   ARG  46          2HD       ARG  46  -7.397  -4.191 -10.565
  376   2HD   ARG  46          1HD       ARG  46  -7.524  -4.794 -12.234
  377    HE   ARG  46           HE       ARG  46 -10.102  -4.096 -11.403
  378   1HH1  ARG  46          2HH2      ARG  46  -7.092  -2.416 -12.033
  379   2HH1  ARG  46          1HH2      ARG  46  -7.861  -0.925 -12.478
  380   1HH2  ARG  46          1HH1      ARG  46 -11.091  -2.112 -12.012
  381   2HH2  ARG  46          2HH1      ARG  46 -10.093  -0.775 -12.467
  382    H    GLY  47           H        GLY  47  -7.545  -8.377  -6.944
  383   1HA   GLY  47          2HA       GLY  47  -8.377 -10.598  -6.307
  384   2HA   GLY  47          1HA       GLY  47  -8.868 -10.856  -7.969
  385    HA   PRO  48           HA       PRO  48  -4.258 -11.947  -7.266
  386   1HB   PRO  48          2HB       PRO  48  -4.320 -14.391  -6.234
  387   2HB   PRO  48          1HB       PRO  48  -4.191 -12.864  -5.241
  388   1HG   PRO  48          2HG       PRO  48  -6.659 -14.641  -5.740
  389   2HG   PRO  48          1HG       PRO  48  -6.163 -13.905  -4.216
  390   1HD   PRO  48          1HD       PRO  48  -8.024 -12.685  -5.951
  391   2HD   PRO  48          2HD       PRO  48  -6.905 -11.697  -4.906
  392    H    GLN  49           H        GLN  49  -3.317 -12.943  -8.950
  393    HA   GLN  49           HA       GLN  49  -4.977 -14.430 -10.857
  394   1HB   GLN  49          2HB       GLN  49  -3.678 -12.699 -11.739
  395   2HB   GLN  49          1HB       GLN  49  -2.191 -13.391 -11.077
  396   1HG   GLN  49          2HG       GLN  49  -2.090 -15.038 -12.737
  397   2HG   GLN  49          1HG       GLN  49  -3.809 -15.285 -12.762
  398   1HE2  GLN  49          2HE2      GLN  49  -1.143 -13.838 -14.304
  399   2HE2  GLN  49          1HE2      GLN  49  -2.114 -13.004 -15.492
  400    H    THR  50           H        THR  50  -1.626 -15.225 -10.417
  401    HA   THR  50           HA       THR  50  -1.895 -18.011 -10.595
  402    HB   THR  50           HB       THR  50   0.010 -17.341 -11.419
  403    HG1  THR  50           1HG      THR  50   1.680 -18.231 -10.063
  404   1HG2  THR  50          1HG2      THR  50   1.718 -15.920 -10.388
  405   2HG2  THR  50          2HG2      THR  50   0.176 -15.049 -10.556
  406   3HG2  THR  50          3HG2      THR  50   0.675 -15.675  -8.968
  407    H    LEU  51           H        LEU  51   0.020 -17.040  -7.967
  408    HA   LEU  51           HA       LEU  51  -1.559 -17.191  -5.602
  409   1HB   LEU  51          2HB       LEU  51  -1.229 -19.715  -6.887
  410   2HB   LEU  51          1HB       LEU  51  -0.209 -19.693  -5.437
  411    HG   LEU  51           HG       LEU  51  -3.034 -18.630  -5.280
  412   1HD1  LEU  51          1HD1      LEU  51  -3.821 -20.888  -4.713
  413   2HD1  LEU  51          2HD1      LEU  51  -3.225 -20.815  -6.389
  414   3HD1  LEU  51          3HD1      LEU  51  -2.220 -21.553  -5.119
  415   1HD2  LEU  51          1HD2      LEU  51  -2.809 -19.434  -2.960
  416   2HD2  LEU  51          2HD2      LEU  51  -1.194 -20.082  -3.333
  417   3HD2  LEU  51          3HD2      LEU  51  -1.480 -18.326  -3.376
  418    H    LYS  52           H        LYS  52   0.568 -15.631  -6.622
  419    HA   LYS  52           HA       LYS  52   2.877 -16.366  -4.851
  420   1HB   LYS  52          2HB       LYS  52   3.095 -15.220  -7.634
  421   2HB   LYS  52          1HB       LYS  52   4.410 -15.473  -6.508
  422   1HG   LYS  52          2HG       LYS  52   3.485 -17.930  -6.431
  423   2HG   LYS  52          1HG       LYS  52   2.774 -17.454  -8.006
  424   1HD   LYS  52          2HD       LYS  52   5.685 -17.016  -7.445
  425   2HD   LYS  52          1HD       LYS  52   5.074 -18.629  -7.938
  426   1HE   LYS  52          2HE       LYS  52   3.952 -16.984  -9.806
  427   2HE   LYS  52          1HE       LYS  52   5.539 -16.202  -9.508
  428   1HZ   LYS  52          1HZ       LYS  52   5.757 -17.931 -11.159
  429   2HZ   LYS  52          2HZ       LYS  52   6.536 -18.391  -9.802
  430   3HZ   LYS  52          3HZ       LYS  52   5.086 -19.032 -10.155
  431    H    GLU  53           H        GLU  53   1.291 -13.665  -6.628
  432    HA   GLU  53           HA       GLU  53   2.208 -11.604  -4.757
  433   1HB   GLU  53          2HB       GLU  53   1.138 -10.093  -6.313
  434   2HB   GLU  53          1HB       GLU  53   2.079 -11.223  -7.221
  435   1HG   GLU  53          2HG       GLU  53  -0.295 -12.530  -7.351
  436   2HG   GLU  53          1HG       GLU  53  -0.885 -10.918  -7.127
  437    H    THR  54           H        THR  54   1.129 -13.142  -3.010
  438    HA   THR  54           HA       THR  54  -1.342 -11.856  -2.054
  439    HB   THR  54           HB       THR  54  -1.439 -14.656  -3.035
  440    HG1  THR  54           1HG      THR  54  -2.186 -12.101  -3.888
  441   1HG2  THR  54          1HG2      THR  54  -3.762 -14.760  -2.328
  442   2HG2  THR  54          2HG2      THR  54  -2.669 -14.633  -0.930
  443   3HG2  THR  54          3HG2      THR  54  -3.587 -13.209  -1.472
  444    H    SER  55           H        SER  55   1.407 -11.964  -1.100
  445    HA   SER  55           HA       SER  55   1.143 -13.608   1.403
  446   1HB   SER  55          2HB       SER  55   3.571 -13.398   1.539
  447   2HB   SER  55          1HB       SER  55   3.069 -14.241   0.071
  448    HG   SER  55           HG       SER  55   4.739 -12.606  -0.181
  449    H    PHE  56           H        PHE  56   0.180 -10.834   0.474
  450    HA   PHE  56           HA       PHE  56   1.085  -9.172   2.785
  451   1HB   PHE  56          2HB       PHE  56   0.795  -7.211   1.168
  452   2HB   PHE  56          1HB       PHE  56   2.245  -8.150   1.028
  453    HD1  PHE  56           1HD      PHE  56  -0.658  -6.924  -0.658
  454    HD2  PHE  56           2HD      PHE  56   2.352  -9.997  -0.663
  455    HE1  PHE  56           1HE      PHE  56  -1.098  -7.363  -3.069
  456    HE2  PHE  56           2HE      PHE  56   1.895 -10.450  -3.043
  457    HZ   PHE  56           HZ       PHE  56   0.184  -9.104  -4.244
  458    H    ASN  57           H        ASN  57  -1.605  -9.578   0.279
  459    HA   ASN  57           HA       ASN  57  -3.554  -8.306   1.983
  460   1HB   ASN  57          2HB       ASN  57  -5.152  -9.082   0.438
  461   2HB   ASN  57          1HB       ASN  57  -3.755  -8.604  -0.493
  462   1HD2  ASN  57          2HD2      ASN  57  -5.635 -11.177   0.749
  463   2HD2  ASN  57          1HD2      ASN  57  -5.073 -12.412  -0.345
  464    H    GLN  58           H        GLN  58  -2.249 -11.592   1.903
  465    HA   GLN  58           HA       GLN  58  -4.331 -12.756   3.477
  466   1HB   GLN  58          2HB       GLN  58  -1.934 -13.663   2.080
  467   2HB   GLN  58          1HB       GLN  58  -2.267 -14.528   3.584
  468   1HG   GLN  58          2HG       GLN  58  -4.342 -14.102   1.349
  469   2HG   GLN  58          1HG       GLN  58  -3.477 -15.576   1.618
  470   1HE2  GLN  58          2HE2      GLN  58  -5.918 -16.094   1.586
  471   2HE2  GLN  58          1HE2      GLN  58  -6.620 -16.122   3.186
  472    H    ALA  59           H        ALA  59  -1.330 -11.155   4.282
  473    HA   ALA  59           HA       ALA  59  -1.570 -12.000   7.151
  474   1HB   ALA  59          1HB       ALA  59   0.834 -11.722   7.305
  475   2HB   ALA  59          2HB       ALA  59   0.395 -12.967   6.112
  476   3HB   ALA  59          3HB       ALA  59   0.918 -11.355   5.565
  477    H    TYR  60           H        TYR  60  -0.227  -9.509   5.049
  478    HA   TYR  60           HA       TYR  60  -0.549  -7.315   7.027
  479   1HB   TYR  60          2HB       TYR  60   0.334  -7.216   4.132
  480   2HB   TYR  60          1HB       TYR  60   0.782  -6.118   5.483
  481    HD1  TYR  60           1HD      TYR  60   2.327  -7.886   3.331
  482    HD2  TYR  60           2HD      TYR  60   1.645  -8.217   7.533
  483    HE1  TYR  60           1HE      TYR  60   4.484  -9.063   3.557
  484    HE2  TYR  60           2HE      TYR  60   3.754  -9.461   7.777
  485    HH   TYR  60           HH       TYR  60   5.452 -10.490   6.703
  486    H    GLY  61           H        GLY  61  -3.029  -8.544   6.356
  487   1HA   GLY  61          2HA       GLY  61  -4.544  -7.130   4.330
  488   2HA   GLY  61          1HA       GLY  61  -5.175  -8.110   5.637
  489    H    ARG  62           H        ARG  62  -3.541  -6.445   7.585
  490    HA   ARG  62           HA       ARG  62  -5.543  -4.553   8.334
  491   1HB   ARG  62          2HB       ARG  62  -2.869  -5.414   9.387
  492   2HB   ARG  62          1HB       ARG  62  -3.687  -3.987  10.055
  493   1HG   ARG  62          2HG       ARG  62  -5.490  -5.253  10.895
  494   2HG   ARG  62          1HG       ARG  62  -5.282  -6.539   9.714
  495   1HD   ARG  62          2HD       ARG  62  -4.136  -7.713  11.309
  496   2HD   ARG  62          1HD       ARG  62  -2.867  -6.527  11.253
  497    HE   ARG  62           HE       ARG  62  -4.769  -6.931  13.279
  498   1HH1  ARG  62          2HH2      ARG  62  -2.931  -4.304  11.841
  499   2HH1  ARG  62          1HH2      ARG  62  -2.892  -3.372  13.306
  500   1HH2  ARG  62          1HH1      ARG  62  -4.705  -5.669  15.166
  501   2HH2  ARG  62          2HH1      ARG  62  -3.899  -4.139  15.143
  502    H    ASP  63           H        ASP  63  -2.742  -4.268   6.269
  503    HA   ASP  63           HA       ASP  63  -2.776  -1.316   6.565
  504   1HB   ASP  63          2HB       ASP  63  -0.575  -1.198   5.862
  505   2HB   ASP  63          1HB       ASP  63  -0.606  -2.604   6.976
  506    H    LEU  64           H        LEU  64  -1.745  -0.769   3.925
  507    HA   LEU  64           HA       LEU  64  -2.579  -0.271   1.880
  508   1HB   LEU  64          2HB       LEU  64  -1.614  -2.997   1.984
  509   2HB   LEU  64          1HB       LEU  64  -2.515  -2.534   0.527
  510    HG   LEU  64           HG       LEU  64  -0.598  -0.502   1.554
  511   1HD1  LEU  64          1HD1      LEU  64   1.336  -1.666   0.544
  512   2HD1  LEU  64          2HD1      LEU  64   0.674  -2.600   1.907
  513   3HD1  LEU  64          3HD1      LEU  64   0.319  -3.092   0.233
  514   1HD2  LEU  64          1HD2      LEU  64  -0.156  -0.297  -0.872
  515   2HD2  LEU  64          2HD2      LEU  64  -1.176  -1.722  -1.180
  516   3HD2  LEU  64          3HD2      LEU  64  -1.902  -0.231  -0.533
  517    H    MET  65           H        MET  65  -4.156  -3.457   1.827
  518    HA   MET  65           HA       MET  65  -6.619  -2.854   0.676
  519   1HB   MET  65          2HB       MET  65  -5.432  -5.093   1.613
  520   2HB   MET  65          1HB       MET  65  -6.471  -4.754   3.006
  521   1HG   MET  65          2HG       MET  65  -8.220  -4.388   0.850
  522   2HG   MET  65          1HG       MET  65  -7.230  -5.717   0.302
  523   1HE   MET  65          1HE       MET  65 -10.561  -5.739   3.263
  524   2HE   MET  65          2HE       MET  65  -9.457  -4.347   3.159
  525   3HE   MET  65          3HE       MET  65 -10.340  -4.891   1.713
  526    H    GLU  66           H        GLU  66  -5.911  -2.972   4.229
  527    HA   GLU  66           HA       GLU  66  -8.401  -1.591   4.864
  528   1HB   GLU  66          2HB       GLU  66  -6.260  -2.892   6.533
  529   2HB   GLU  66          1HB       GLU  66  -7.464  -1.846   7.248
  530   1HG   GLU  66          2HG       GLU  66  -8.379  -4.117   5.444
  531   2HG   GLU  66          1HG       GLU  66  -7.950  -4.430   7.090
  532    H    ALA  67           H        ALA  67  -5.016  -0.647   4.366
  533    HA   ALA  67           HA       ALA  67  -5.117   1.824   6.016
  534   1HB   ALA  67          1HB       ALA  67  -3.037   2.341   5.093
  535   2HB   ALA  67          2HB       ALA  67  -3.052   0.725   5.839
  536   3HB   ALA  67          3HB       ALA  67  -3.092   0.889   4.067
  537    H    GLN  68           H        GLN  68  -6.134   0.831   2.828
  538    HA   GLN  68           HA       GLN  68  -6.805   3.642   2.052
  539   1HB   GLN  68          2HB       GLN  68  -5.383   2.493   0.506
  540   2HB   GLN  68          1HB       GLN  68  -6.529   1.138   0.420
  541   1HG   GLN  68          2HG       GLN  68  -7.903   2.247  -0.955
  542   2HG   GLN  68          1HG       GLN  68  -7.811   3.743   0.036
  543   1HE2  GLN  68          2HE2      GLN  68  -8.176   4.102  -2.477
  544   2HE2  GLN  68          1HE2      GLN  68  -6.694   4.627  -3.255
  545    H    GLU  69           H        GLU  69  -8.328   0.368   2.586
  546    HA   GLU  69           HA       GLU  69 -10.878   0.675   1.691
  547   1HB   GLU  69          2HB       GLU  69 -10.063  -1.279   2.848
  548   2HB   GLU  69          1HB       GLU  69 -10.031  -0.366   4.388
  549   1HG   GLU  69          2HG       GLU  69 -12.115  -1.002   4.764
  550   2HG   GLU  69          1HG       GLU  69 -12.629  -0.081   3.314
  551    H    TRP  70           H        TRP  70  -9.510   2.341   4.505
  552    HA   TRP  70           HA       TRP  70 -11.877   3.727   5.376
  553   1HB   TRP  70          2HB       TRP  70  -8.950   4.429   5.659
  554   2HB   TRP  70          1HB       TRP  70 -10.320   4.980   6.676
  555    HD1  TRP  70           HD       TRP  70  -7.526   2.919   7.020
  556    HE1  TRP  70           1HE      TRP  70  -7.836   0.894   8.505
  557    HE3  TRP  70           3HE      TRP  70 -12.555   2.950   7.251
  558    HZ2  TRP  70           2HZ      TRP  70  -9.994  -0.521   9.644
  559    HZ3  TRP  70           3HZ      TRP  70 -13.749   1.031   8.275
  560    HH2  TRP  70           HH       TRP  70 -12.463  -0.660   9.552
  561    H    CYS  71           H        CYS  71 -11.956   3.871   2.626
  562    HA   CYS  71           HA       CYS  71 -10.964   6.447   1.650
  563   1HB   CYS  71          2HB       CYS  71 -12.079   5.837  -0.402
  564   2HB   CYS  71          1HB       CYS  71 -10.961   4.563   0.178
  565    HG   CYS  71           HG       CYS  71 -13.087   3.601  -1.076
  566    H    ARG  72           H        ARG  72 -14.210   4.918   2.244
  567    HA   ARG  72           HA       ARG  72 -15.886   7.193   2.102
  568   1HB   ARG  72          2HB       ARG  72 -15.978   4.446   3.141
  569   2HB   ARG  72          1HB       ARG  72 -16.912   5.562   4.101
  570   1HG   ARG  72          2HG       ARG  72 -17.197   5.632   1.097
  571   2HG   ARG  72          1HG       ARG  72 -18.009   4.398   2.039
  572   1HD   ARG  72          2HD       ARG  72 -18.754   6.481   3.507
  573   2HD   ARG  72          1HD       ARG  72 -18.446   7.341   1.976
  574    HE   ARG  72           HE       ARG  72 -20.280   6.322   1.061
  575   1HH1  ARG  72          2HH2      ARG  72 -19.497   4.468   3.953
  576   2HH1  ARG  72          1HH2      ARG  72 -20.865   3.416   3.792
  577   1HH2  ARG  72          1HH1      ARG  72 -22.070   4.900   0.903
  578   2HH2  ARG  72          2HH1      ARG  72 -22.285   3.673   2.102
  579    H    LYS  73           H        LYS  73 -13.521   6.386   4.562
  580    HA   LYS  73           HA       LYS  73 -14.556   8.466   6.411
  581   1HB   LYS  73          2HB       LYS  73 -13.697   5.962   6.872
  582   2HB   LYS  73          1HB       LYS  73 -12.189   6.869   7.077
  583   1HG   LYS  73          2HG       LYS  73 -13.078   8.206   8.793
  584   2HG   LYS  73          1HG       LYS  73 -14.761   7.837   8.338
  585   1HD   LYS  73          2HD       LYS  73 -14.601   5.582   9.254
  586   2HD   LYS  73          1HD       LYS  73 -12.864   5.633   9.323
  587   1HE   LYS  73          2HE       LYS  73 -13.647   5.821  11.498
  588   2HE   LYS  73          1HE       LYS  73 -13.064   7.453  11.037
  589   1HZ   LYS  73          1HZ       LYS  73 -15.069   7.535  12.233
  590   2HZ   LYS  73          2HZ       LYS  73 -15.341   8.068  10.711
  591   3HZ   LYS  73          3HZ       LYS  73 -15.841   6.582  11.164
  592    H    TYR  74           H        TYR  74 -11.543   7.639   4.534
  593    HA   TYR  74           HA       TYR  74 -10.246  10.143   5.200
  594   1HB   TYR  74          2HB       TYR  74  -9.062   8.079   4.435
  595   2HB   TYR  74          1HB       TYR  74  -9.737   8.276   2.842
  596    HD1  TYR  74           1HD      TYR  74  -8.832   9.680   1.282
  597    HD2  TYR  74           2HD      TYR  74  -7.618   9.979   5.388
  598    HE1  TYR  74           1HE      TYR  74  -6.927  11.088   0.599
  599    HE2  TYR  74           2HE      TYR  74  -5.750  11.469   4.729
  600    HH   TYR  74           HH       TYR  74  -5.088  11.998   1.227
  601    H    MET  75           H        MET  75 -12.720   9.407   2.830
  602    HA   MET  75           HA       MET  75 -12.426  11.892   1.280
  603   1HB   MET  75          2HB       MET  75 -14.409   9.629   1.142
  604   2HB   MET  75          1HB       MET  75 -14.438  11.063   0.129
  605   1HG   MET  75          2HG       MET  75 -11.856  10.338  -0.287
  606   2HG   MET  75          1HG       MET  75 -12.518   8.766   0.093
  607   1HE   MET  75          1HE       MET  75 -12.366  10.587  -3.819
  608   2HE   MET  75          2HE       MET  75 -12.114  11.565  -2.353
  609   3HE   MET  75          3HE       MET  75 -11.196  10.058  -2.586
  610    H    LYS  76           H        LYS  76 -15.116  10.522   3.321
  611    HA   LYS  76           HA       LYS  76 -16.451  13.115   3.472
  612   1HB   LYS  76          2HB       LYS  76 -17.037  10.383   3.865
  613   2HB   LYS  76          1HB       LYS  76 -17.464  11.328   5.322
  614   1HG   LYS  76          2HG       LYS  76 -18.833  12.843   4.055
  615   2HG   LYS  76          1HG       LYS  76 -18.153  12.295   2.515
  616   1HD   LYS  76          2HD       LYS  76 -19.237  10.106   2.777
  617   2HD   LYS  76          1HD       LYS  76 -19.851  10.577   4.373
  618   1HE   LYS  76          2HE       LYS  76 -21.141  12.420   3.327
  619   2HE   LYS  76          1HE       LYS  76 -20.537  11.929   1.730
  620   1HZ   LYS  76          1HZ       LYS  76 -22.695  11.024   2.279
  621   2HZ   LYS  76          2HZ       LYS  76 -21.587   9.855   2.009
  622   3HZ   LYS  76          3HZ       LYS  76 -22.047  10.201   3.537
  623    H    SER  77           H        SER  77 -14.560  11.144   5.806
  624    HA   SER  77           HA       SER  77 -14.951  13.096   7.941
  625   1HB   SER  77          2HB       SER  77 -14.565  10.423   8.103
  626   2HB   SER  77          1HB       SER  77 -12.896  10.883   8.103
  627    HG   SER  77           HG       SER  77 -13.981  10.667  10.155
  628    H    GLY  78           H        GLY  78 -12.400  12.043   5.526
  629   1HA   GLY  78          2HA       GLY  78 -10.399  12.973   4.874
  630   2HA   GLY  78          1HA       GLY  78 -11.209  14.505   5.037
  631    H    ASN  79           H        ASN  79 -10.782  12.438   7.806
  632    HA   ASN  79           HA       ASN  79  -9.251  14.552   9.015
  633   1HB   ASN  79          2HB       ASN  79 -11.379  13.105   9.920
  634   2HB   ASN  79          1HB       ASN  79 -10.105  12.074  10.545
  635   1HD2  ASN  79          2HD2      ASN  79 -12.004  13.622  12.044
  636   2HD2  ASN  79          1HD2      ASN  79 -11.076  14.774  12.963
  637    H    VAL  80           H        VAL  80  -7.113  14.442   9.119
  638    HA   VAL  80           HA       VAL  80  -5.368  12.387   8.354
  639    HB   VAL  80           HB       VAL  80  -4.980  14.752  10.082
  640   1HG1  VAL  80          1HG1      VAL  80  -2.560  14.388   9.917
  641   2HG1  VAL  80          2HG1      VAL  80  -3.337  13.100  10.867
  642   3HG1  VAL  80          3HG1      VAL  80  -2.839  12.788   9.188
  643   1HG2  VAL  80          1HG2      VAL  80  -3.651  15.404   8.054
  644   2HG2  VAL  80          2HG2      VAL  80  -4.057  13.840   7.304
  645   3HG2  VAL  80          3HG2      VAL  80  -5.340  15.033   7.628
  646    H    LYS  81           H        LYS  81  -7.299  12.622  11.316
  647    HA   LYS  81           HA       LYS  81  -5.935  10.899  13.027
  648   1HB   LYS  81          2HB       LYS  81  -8.547  12.031  12.889
  649   2HB   LYS  81          1HB       LYS  81  -8.696  10.327  13.263
  650   1HG   LYS  81          2HG       LYS  81  -7.097  12.411  14.801
  651   2HG   LYS  81          1HG       LYS  81  -8.433  11.441  15.367
  652   1HD   LYS  81          2HD       LYS  81  -6.773   9.406  14.823
  653   2HD   LYS  81          1HD       LYS  81  -5.559  10.647  14.995
  654   1HE   LYS  81          2HE       LYS  81  -7.017  11.203  17.183
  655   2HE   LYS  81          1HE       LYS  81  -7.367   9.469  17.012
  656   1HZ   LYS  81          1HZ       LYS  81  -5.431   9.723  18.255
  657   2HZ   LYS  81          2HZ       LYS  81  -4.939   9.176  16.789
  658   3HZ   LYS  81          3HZ       LYS  81  -4.764  10.751  17.184
  659    H    ASP  82           H        ASP  82  -7.715  10.059  10.060
  660    HA   ASP  82           HA       ASP  82  -7.411   7.180  10.503
  661   1HB   ASP  82          2HB       ASP  82  -8.745   8.910   8.485
  662   2HB   ASP  82          1HB       ASP  82  -8.066   7.413   7.866
  663    H    LEU  83           H        LEU  83  -5.728   9.786   8.756
  664    HA   LEU  83           HA       LEU  83  -4.101   8.043   7.050
  665   1HB   LEU  83          2HB       LEU  83  -4.977  10.521   6.658
  666   2HB   LEU  83          1HB       LEU  83  -3.504  10.926   7.479
  667    HG   LEU  83           HG       LEU  83  -3.190  10.826   5.056
  668   1HD1  LEU  83          1HD1      LEU  83  -1.231   9.517   4.949
  669   2HD1  LEU  83          2HD1      LEU  83  -1.305  10.497   6.432
  670   3HD1  LEU  83          3HD1      LEU  83  -1.629   8.749   6.505
  671   1HD2  LEU  83          1HD2      LEU  83  -3.266   8.724   3.853
  672   2HD2  LEU  83          2HD2      LEU  83  -3.864   7.882   5.303
  673   3HD2  LEU  83          3HD2      LEU  83  -4.874   9.114   4.510
  674    H    THR  84           H        THR  84  -3.592   9.903  10.103
  675    HA   THR  84           HA       THR  84  -0.876   9.378  10.609
  676    HB   THR  84           HB       THR  84  -2.109  10.910  11.897
  677    HG1  THR  84           1HG      THR  84  -1.445  10.018  14.039
  678   1HG2  THR  84          1HG2      THR  84  -3.616  10.249  13.707
  679   2HG2  THR  84          2HG2      THR  84  -4.299   9.830  12.117
  680   3HG2  THR  84          3HG2      THR  84  -3.577   8.562  13.137
  681    H    GLN  85           H        GLN  85  -3.694   7.241  11.054
  682    HA   GLN  85           HA       GLN  85  -2.156   5.054  12.158
  683   1HB   GLN  85          2HB       GLN  85  -4.927   5.770  11.726
  684   2HB   GLN  85          1HB       GLN  85  -4.582   4.079  11.252
  685   1HG   GLN  85          2HG       GLN  85  -3.518   3.660  13.447
  686   2HG   GLN  85          1HG       GLN  85  -3.752   5.349  13.914
  687   1HE2  GLN  85          2HE2      GLN  85  -5.314   5.546  15.329
  688   2HE2  GLN  85          1HE2      GLN  85  -6.816   4.656  15.291
  689    H    ALA  86           H        ALA  86  -3.819   5.637   8.965
  690    HA   ALA  86           HA       ALA  86  -2.962   3.375   7.567
  691   1HB   ALA  86          1HB       ALA  86  -3.254   4.715   5.591
  692   2HB   ALA  86          2HB       ALA  86  -4.580   4.967   6.750
  693   3HB   ALA  86          3HB       ALA  86  -3.305   6.196   6.577
  694    H    TRP  87           H        TRP  87  -1.107   6.426   8.135
  695    HA   TRP  87           HA       TRP  87   1.274   5.807   6.746
  696   1HB   TRP  87          2HB       TRP  87   1.214   7.951   7.373
  697   2HB   TRP  87          1HB       TRP  87   0.459   7.595   8.960
  698    HD1  TRP  87           HD       TRP  87   1.960   7.762  10.956
  699    HE1  TRP  87           1HE      TRP  87   4.457   7.866  11.413
  700    HE3  TRP  87           3HE      TRP  87   3.593   7.135   6.235
  701    HZ2  TRP  87           2HZ      TRP  87   6.841   7.716   9.906
  702    HZ3  TRP  87           3HZ      TRP  87   6.020   6.786   5.802
  703    HH2  TRP  87           HH       TRP  87   7.645   7.186   7.629
  704    H    ASP  88           H        ASP  88   0.124   4.846  10.017
  705    HA   ASP  88           HA       ASP  88   2.631   3.707  10.886
  706   1HB   ASP  88          2HB       ASP  88   0.538   4.530  12.296
  707   2HB   ASP  88          1HB       ASP  88  -0.019   2.893  12.047
  708    H    LEU  89           H        LEU  89  -0.353   2.490   9.233
  709    HA   LEU  89           HA       LEU  89   0.383  -0.319   9.215
  710   1HB   LEU  89          2HB       LEU  89  -1.657   1.360   7.706
  711   2HB   LEU  89          1HB       LEU  89  -1.501  -0.364   7.530
  712    HG   LEU  89           HG       LEU  89  -1.949   0.923  10.236
  713   1HD1  LEU  89          1HD1      LEU  89  -4.311   0.441   9.873
  714   2HD1  LEU  89          2HD1      LEU  89  -3.710   1.624   8.688
  715   3HD1  LEU  89          3HD1      LEU  89  -3.965  -0.070   8.204
  716   1HD2  LEU  89          1HD2      LEU  89  -2.795  -1.293  10.799
  717   2HD2  LEU  89          2HD2      LEU  89  -2.429  -1.874   9.158
  718   3HD2  LEU  89          3HD2      LEU  89  -1.106  -1.395  10.247
  719    H    TYR  90           H        TYR  90   0.570   2.318   6.830
  720    HA   TYR  90           HA       TYR  90   1.935   0.930   4.675
  721   1HB   TYR  90          2HB       TYR  90   1.871   3.870   5.452
  722   2HB   TYR  90          1HB       TYR  90   2.574   3.251   3.985
  723    HD1  TYR  90           1HD      TYR  90   0.004   5.012   4.931
  724    HD2  TYR  90           2HD      TYR  90   0.675   1.202   3.065
  725    HE1  TYR  90           1HE      TYR  90  -2.245   5.107   3.904
  726    HE2  TYR  90           2HE      TYR  90  -1.515   1.351   1.958
  727    HH   TYR  90           HH       TYR  90  -3.274   2.663   1.478
  728    H    TYR  91           H        TYR  91   3.242   2.837   7.376
  729    HA   TYR  91           HA       TYR  91   6.024   2.421   6.644
  730   1HB   TYR  91          2HB       TYR  91   4.988   4.371   7.981
  731   2HB   TYR  91          1HB       TYR  91   4.895   3.288   9.350
  732    HD1  TYR  91           1HD      TYR  91   6.557   3.434  10.869
  733    HD2  TYR  91           2HD      TYR  91   7.399   4.262   6.738
  734    HE1  TYR  91           1HE      TYR  91   8.822   4.220  11.487
  735    HE2  TYR  91           2HE      TYR  91   9.649   5.057   7.342
  736    HH   TYR  91           HH       TYR  91  11.187   5.132   8.937
  737    H    HIS  92           H        HIS  92   3.939   0.948   9.227
  738    HA   HIS  92           HA       HIS  92   5.833  -0.864  10.291
  739   1HB   HIS  92          2HB       HIS  92   3.753  -0.284  11.355
  740   2HB   HIS  92          1HB       HIS  92   2.838  -1.063  10.017
  741    HD1  HIS  92           1HD      HIS  92   1.701  -2.845  11.397
  742    HD2  HIS  92           2HD      HIS  92   5.804  -2.711  11.926
  743    HE1  HIS  92           1HE      HIS  92   2.309  -4.943  12.736
  744    H    VAL  93           H        VAL  93   3.678  -1.104   7.413
  745    HA   VAL  93           HA       VAL  93   4.454  -3.878   6.827
  746    HB   VAL  93           HB       VAL  93   2.228  -2.766   6.376
  747   1HG1  VAL  93          1HG1      VAL  93   1.933  -2.073   4.045
  748   2HG1  VAL  93          2HG1      VAL  93   2.952  -0.915   4.933
  749   3HG1  VAL  93          3HG1      VAL  93   3.697  -2.076   3.809
  750   1HG2  VAL  93          1HG2      VAL  93   1.952  -4.467   4.635
  751   2HG2  VAL  93          2HG2      VAL  93   3.721  -4.643   4.553
  752   3HG2  VAL  93          3HG2      VAL  93   2.855  -5.049   6.054
  753    H    PHE  94           H        PHE  94   5.487  -0.589   5.905
  754    HA   PHE  94           HA       PHE  94   6.952  -0.944   3.610
  755   1HB   PHE  94          2HB       PHE  94   6.497   1.222   4.827
  756   2HB   PHE  94          1HB       PHE  94   7.666   0.783   6.031
  757    HD1  PHE  94           1HD      PHE  94   7.323   1.093   2.347
  758    HD2  PHE  94           2HD      PHE  94   9.846   1.421   5.813
  759    HE1  PHE  94           1HE      PHE  94   9.092   2.133   0.952
  760    HE2  PHE  94           2HE      PHE  94  11.613   2.478   4.420
  761    HZ   PHE  94           HZ       PHE  94  11.276   2.733   1.995
  762    H    ARG  95           H        ARG  95   7.859  -1.993   6.875
  763    HA   ARG  95           HA       ARG  95  10.389  -3.103   5.961
  764   1HB   ARG  95          2HB       ARG  95   9.261  -2.154   8.396
  765   2HB   ARG  95          1HB       ARG  95   9.484  -3.885   8.637
  766   1HG   ARG  95          2HG       ARG  95  11.638  -3.333   9.143
  767   2HG   ARG  95          1HG       ARG  95  11.876  -3.164   7.414
  768   1HD   ARG  95          2HD       ARG  95  11.975  -0.938   7.496
  769   2HD   ARG  95          1HD       ARG  95  10.698  -0.814   8.753
  770    HE   ARG  95           HE       ARG  95  12.329  -0.857  10.362
  771   1HH1  ARG  95          2HH2      ARG  95  13.850  -2.182   7.487
  772   2HH1  ARG  95          1HH2      ARG  95  15.395  -2.388   8.247
  773   1HH2  ARG  95          1HH1      ARG  95  14.363  -1.171  11.332
  774   2HH2  ARG  95          2HH1      ARG  95  15.662  -1.822  10.394
  775    H    ARG  96           H        ARG  96   7.129  -4.292   6.613
  776    HA   ARG  96           HA       ARG  96   7.678  -7.119   6.966
  777   1HB   ARG  96          2HB       ARG  96   5.175  -5.563   6.292
  778   2HB   ARG  96          1HB       ARG  96   5.258  -7.310   6.682
  779   1HG   ARG  96          2HG       ARG  96   6.393  -5.434   8.724
  780   2HG   ARG  96          1HG       ARG  96   4.652  -5.417   8.537
  781   1HD   ARG  96          2HD       ARG  96   4.445  -7.694   9.086
  782   2HD   ARG  96          1HD       ARG  96   6.188  -7.992   8.859
  783    HE   ARG  96           HE       ARG  96   4.879  -6.796  11.178
  784   1HH1  ARG  96          2HH2      ARG  96   7.945  -6.913   9.470
  785   2HH1  ARG  96          1HH2      ARG  96   8.881  -6.520  10.877
  786   1HH2  ARG  96          1HH1      ARG  96   6.129  -6.231  12.975
  787   2HH2  ARG  96          2HH1      ARG  96   7.853  -6.189  12.846
  788    H    ILE  97           H        ILE  97   5.847  -5.402   4.397
  789    HA   ILE  97           HA       ILE  97   6.104  -7.332   2.268
  790    HB   ILE  97           HB       ILE  97   5.420  -5.522   0.782
  791   1HG1  ILE  97          2HG1      ILE  97   4.305  -3.569   2.191
  792   2HG1  ILE  97          1HG1      ILE  97   5.838  -3.715   3.007
  793   1HG2  ILE  97          1HG2      ILE  97   3.150  -5.458   1.639
  794   2HG2  ILE  97          2HG2      ILE  97   3.837  -7.090   1.818
  795   3HG2  ILE  97          3HG2      ILE  97   3.713  -6.018   3.233
  796   1HD1  ILE  97          1HD1      ILE  97   5.970  -2.162   1.178
  797   2HD1  ILE  97          2HD1      ILE  97   7.016  -3.567   0.862
  798   3HD1  ILE  97          3HD1      ILE  97   5.450  -3.416   0.028
  799    H    SER  98           H        SER  98   8.374  -5.097   3.579
  800    HA   SER  98           HA       SER  98   9.971  -4.450   1.291
  801   1HB   SER  98          2HB       SER  98  10.186  -3.136   3.223
  802   2HB   SER  98          1HB       SER  98  10.412  -4.577   4.269
  803    HG   SER  98           HG       SER  98  12.375  -3.621   4.063
  804    H    LYS  99           H        LYS  99  10.715  -6.610   4.013
  805    HA   LYS  99           HA       LYS  99  11.520  -8.965   2.645
  806   1HB   LYS  99          2HB       LYS  99  13.977  -8.721   2.929
  807   2HB   LYS  99          1HB       LYS  99  13.209  -7.913   1.525
  808   1HG   LYS  99          2HG       LYS  99  14.087  -5.892   2.175
  809   2HG   LYS  99          1HG       LYS  99  13.435  -6.046   3.776
  810   1HD   LYS  99          2HD       LYS  99  15.417  -6.562   4.635
  811   2HD   LYS  99          1HD       LYS  99  15.745  -7.790   3.408
  812   1HE   LYS  99          2HE       LYS  99  15.869  -4.904   2.562
  813   2HE   LYS  99          1HE       LYS  99  17.187  -5.544   3.551
  814   1HZ   LYS  99          1HZ       LYS  99  17.562  -5.800   1.217
  815   2HZ   LYS  99          2HZ       LYS  99  17.494  -7.243   1.979
  816   3HZ   LYS  99          3HZ       LYS  99  16.236  -6.750   1.063
  817    H    GLN 100           H        GLN 100   9.998  -8.595   4.926
  818    HA   GLN 100           HA       GLN 100  11.119  -8.618   7.454
  819   1HB   GLN 100          2HB       GLN 100   8.772  -8.829   6.910
  820   2HB   GLN 100          1HB       GLN 100   9.064 -10.498   6.321
  821   1HG   GLN 100          2HG       GLN 100  10.013 -10.185   9.086
  822   2HG   GLN 100          1HG       GLN 100   8.337  -9.748   8.966
  823   1HE2  GLN 100          2HE2      GLN 100   9.265 -11.930  10.405
  824   2HE2  GLN 100          1HE2      GLN 100   8.603 -13.339   9.615
  Start of MODEL    8
    1   1H    GLU   1          1H        GLU   1   6.256  -6.814 -16.461
    2   2H    GLU   1          2H        GLU   1   7.350  -5.946 -15.525
    3    HA   GLU   1           HA       GLU   1   8.324  -6.727 -18.115
    4   1HB   GLU   1          2HB       GLU   1   9.432  -6.183 -15.440
    5   2HB   GLU   1          1HB       GLU   1  10.175  -7.552 -16.234
    6   1HG   GLU   1          2HG       GLU   1  11.387  -5.516 -16.845
    7   2HG   GLU   1          1HG       GLU   1  10.580  -6.094 -18.273
    8    H    LEU   2           H        LEU   2   7.262  -8.387 -15.151
    9    HA   LEU   2           HA       LEU   2   7.357 -10.603 -14.519
   10   1HB   LEU   2          2HB       LEU   2   5.632 -11.809 -15.764
   11   2HB   LEU   2          1HB       LEU   2   5.194 -10.189 -15.125
   12    HG   LEU   2           HG       LEU   2   6.054  -9.819 -17.803
   13   1HD1  LEU   2          1HD1      LEU   2   4.538 -11.248 -19.052
   14   2HD1  LEU   2          2HD1      LEU   2   5.785 -12.189 -18.198
   15   3HD1  LEU   2          3HD1      LEU   2   4.125 -12.125 -17.561
   16   1HD2  LEU   2          1HD2      LEU   2   3.711  -9.101 -18.091
   17   2HD2  LEU   2          2HD2      LEU   2   3.274  -9.890 -16.556
   18   3HD2  LEU   2          3HD2      LEU   2   4.376  -8.492 -16.557
   19    H    ILE   3           H        ILE   3   9.734 -10.814 -15.064
   20    HA   ILE   3           HA       ILE   3  10.299 -12.596 -17.351
   21    HB   ILE   3           HB       ILE   3  11.545 -10.594 -17.052
   22   1HG1  ILE   3          2HG1      ILE   3  12.273 -12.285 -18.395
   23   2HG1  ILE   3          1HG1      ILE   3  13.589 -11.330 -17.615
   24   1HG2  ILE   3          1HG2      ILE   3  13.316 -10.441 -15.353
   25   2HG2  ILE   3          2HG2      ILE   3  11.703 -10.412 -14.600
   26   3HG2  ILE   3          3HG2      ILE   3  12.683 -11.897 -14.549
   27   1HD1  ILE   3          1HD1      ILE   3  14.218 -13.656 -17.912
   28   2HD1  ILE   3          2HD1      ILE   3  14.108 -13.233 -16.187
   29   3HD1  ILE   3          3HD1      ILE   3  12.810 -14.177 -16.956
   30    H    ARG   4           H        ARG   4  10.219 -12.703 -13.822
   31    HA   ARG   4           HA       ARG   4  10.621 -15.637 -13.801
   32   1HB   ARG   4          2HB       ARG   4  12.253 -13.758 -12.104
   33   2HB   ARG   4          1HB       ARG   4  12.184 -15.544 -11.975
   34   1HG   ARG   4          2HG       ARG   4  12.880 -14.967 -14.664
   35   2HG   ARG   4          1HG       ARG   4  13.868 -13.901 -13.664
   36   1HD   ARG   4          2HD       ARG   4  15.213 -15.755 -13.557
   37   2HD   ARG   4          1HD       ARG   4  14.126 -16.210 -12.243
   38    HE   ARG   4           HE       ARG   4  13.159 -17.814 -13.583
   39   1HH1  ARG   4          2HH2      ARG   4  15.242 -15.841 -15.610
   40   2HH1  ARG   4          1HH2      ARG   4  15.255 -16.976 -16.919
   41   1HH2  ARG   4          2HH1      ARG   4  13.209 -19.289 -15.344
   42   2HH2  ARG   4          1HH1      ARG   4  14.117 -18.883 -16.758
   43    H    VAL   5           H        VAL   5  10.494 -12.917 -11.426
   44    HA   VAL   5           HA       VAL   5   8.678 -14.193  -9.602
   45    HB   VAL   5           HB       VAL   5  10.340 -12.567  -9.000
   46   1HG1  VAL   5          1HG1      VAL   5   9.818 -10.172  -9.129
   47   2HG1  VAL   5          2HG1      VAL   5  10.078 -10.859 -10.750
   48   3HG1  VAL   5          3HG1      VAL   5   8.425 -10.523 -10.181
   49   1HG2  VAL   5          1HG2      VAL   5   8.961 -11.559  -7.294
   50   2HG2  VAL   5          2HG2      VAL   5   7.508 -12.114  -8.159
   51   3HG2  VAL   5          3HG2      VAL   5   8.671 -13.300  -7.520
   52    H    ALA   6           H        ALA   6   8.149 -12.658 -12.615
   53    HA   ALA   6           HA       ALA   6   6.316 -12.109 -13.873
   54   1HB   ALA   6          1HB       ALA   6   4.164 -12.954 -13.362
   55   2HB   ALA   6          2HB       ALA   6   5.425 -14.208 -13.281
   56   3HB   ALA   6          3HB       ALA   6   4.743 -13.532 -11.781
   57    H    ILE   7           H        ILE   7   7.497 -10.302 -11.842
   58    HA   ILE   7           HA       ILE   7   7.082  -8.458 -10.520
   59    HB   ILE   7           HB       ILE   7   7.611  -7.630 -12.625
   60   1HG1  ILE   7          2HG1      ILE   7   7.298  -6.195 -10.817
   61   2HG1  ILE   7          1HG1      ILE   7   7.069  -5.484 -12.461
   62   1HG2  ILE   7          1HG2      ILE   7   5.935  -6.797 -14.217
   63   2HG2  ILE   7          2HG2      ILE   7   5.845  -8.567 -14.062
   64   3HG2  ILE   7          3HG2      ILE   7   4.636  -7.540 -13.253
   65   1HD1  ILE   7          1HD1      ILE   7   5.603  -4.456 -10.821
   66   2HD1  ILE   7          2HD1      ILE   7   4.672  -5.342 -12.053
   67   3HD1  ILE   7          3HD1      ILE   7   4.898  -6.043 -10.432
   68    H    LEU   8           H        LEU   8   5.641  -9.861  -9.079
   69    HA   LEU   8           HA       LEU   8   2.829  -9.852  -9.353
   70   1HB   LEU   8          2HB       LEU   8   4.491 -10.048  -6.846
   71   2HB   LEU   8          1HB       LEU   8   2.813 -10.629  -7.098
   72    HG   LEU   8           HG       LEU   8   5.292 -11.773  -8.500
   73   1HD1  LEU   8          1HD1      LEU   8   4.951 -13.638  -7.021
   74   2HD1  LEU   8          2HD1      LEU   8   5.290 -12.148  -6.106
   75   3HD1  LEU   8          3HD1      LEU   8   3.627 -12.776  -6.200
   76   1HD2  LEU   8          1HD2      LEU   8   3.848 -13.520  -9.257
   77   2HD2  LEU   8          2HD2      LEU   8   2.432 -12.727  -8.525
   78   3HD2  LEU   8          3HD2      LEU   8   3.280 -11.955  -9.887
   79    H    TRP   9           H        TRP   9   1.795  -8.882  -6.907
   80    HA   TRP   9           HA       TRP   9   1.967  -5.929  -7.206
   81   1HB   TRP   9          2HB       TRP   9   0.016  -7.555  -5.675
   82   2HB   TRP   9          1HB       TRP   9   0.057  -5.816  -5.818
   83    HD1  TRP   9           HD       TRP   9   0.920  -6.146  -9.147
   84    HE1  TRP   9           1HE      TRP   9  -1.144  -6.190 -10.615
   85    HE3  TRP   9           3HE      TRP   9  -2.381  -7.705  -5.707
   86    HZ2  TRP   9           2HZ      TRP   9  -3.852  -6.920 -10.334
   87    HZ3  TRP   9           3HZ      TRP   9  -4.687  -8.313  -6.376
   88    HH2  TRP   9           HH       TRP   9  -5.401  -7.990  -8.742
   89    H    HIS  10           H        HIS  10   3.112  -8.424  -4.998
   90    HA   HIS  10           HA       HIS  10   3.861  -6.844  -2.742
   91   1HB   HIS  10          2HB       HIS  10   3.903  -8.984  -2.258
   92   2HB   HIS  10          1HB       HIS  10   4.331  -9.477  -3.939
   93    HD1  HIS  10           1HD      HIS  10   5.833  -9.552  -0.605
   94    HD2  HIS  10           2HD      HIS  10   7.031  -9.005  -4.518
   95    HE1  HIS  10           1HE      HIS  10   8.354  -9.937  -0.632
   96    H    GLU  11           H        GLU  11   5.333  -7.287  -5.950
   97    HA   GLU  11           HA       GLU  11   7.995  -6.309  -5.257
   98   1HB   GLU  11          2HB       GLU  11   6.731  -6.867  -7.968
   99   2HB   GLU  11          1HB       GLU  11   8.414  -6.561  -7.660
  100   1HG   GLU  11          2HG       GLU  11   6.854  -8.846  -6.483
  101   2HG   GLU  11          1HG       GLU  11   7.881  -8.903  -7.957
  102    H    MET  12           H        MET  12   5.022  -5.021  -6.752
  103    HA   MET  12           HA       MET  12   6.177  -2.386  -7.339
  104   1HB   MET  12          2HB       MET  12   4.208  -1.942  -8.396
  105   2HB   MET  12          1HB       MET  12   4.503  -3.675  -8.740
  106   1HG   MET  12          2HG       MET  12   2.950  -4.185  -6.819
  107   2HG   MET  12          1HG       MET  12   2.511  -2.442  -6.844
  108   1HE   MET  12          1HE       MET  12   0.860  -2.238 -10.476
  109   2HE   MET  12          2HE       MET  12   1.358  -1.293  -9.052
  110   3HE   MET  12          3HE       MET  12   2.589  -2.020 -10.113
  111    H    TRP  13           H        TRP  13   5.218  -3.950  -4.484
  112    HA   TRP  13           HA       TRP  13   3.855  -1.699  -3.171
  113   1HB   TRP  13          2HB       TRP  13   4.354  -4.544  -2.557
  114   2HB   TRP  13          1HB       TRP  13   4.305  -3.441  -1.222
  115    HD1  TRP  13           HD       TRP  13   2.127  -5.681  -2.435
  116    HE1  TRP  13           1HE      TRP  13  -0.305  -4.944  -2.511
  117    HE3  TRP  13           3HE      TRP  13   2.838  -0.672  -2.274
  118    HZ2  TRP  13           2HZ      TRP  13  -1.720  -2.495  -2.549
  119    HZ3  TRP  13           3HZ      TRP  13   0.924   0.799  -1.848
  120    HH2  TRP  13           HH       TRP  13  -1.379  -0.108  -2.060
  121    H    HIS  14           H        HIS  14   7.144  -3.107  -3.249
  122    HA   HIS  14           HA       HIS  14   8.325  -1.746  -1.084
  123   1HB   HIS  14          2HB       HIS  14   9.162  -3.232  -3.464
  124   2HB   HIS  14          1HB       HIS  14  10.212  -1.865  -3.200
  125    HD1  HIS  14           1HD      HIS  14  10.233  -5.210  -2.395
  126    HD2  HIS  14           2HD      HIS  14  10.799  -1.700  -0.276
  127    HE1  HIS  14           1HE      HIS  14  11.861  -5.784  -0.510
  128    H    GLU  15           H        GLU  15   8.019  -0.706  -4.478
  129    HA   GLU  15           HA       GLU  15   8.908   2.062  -3.849
  130   1HB   GLU  15          2HB       GLU  15   9.157   2.419  -6.079
  131   2HB   GLU  15          1HB       GLU  15   9.902   0.828  -5.691
  132   1HG   GLU  15          2HG       GLU  15   8.854   0.351  -7.739
  133   2HG   GLU  15          1HG       GLU  15   7.581  -0.103  -6.644
  134    H    GLY  16           H        GLY  16   5.884   0.280  -5.044
  135   1HA   GLY  16          2HA       GLY  16   4.308   2.539  -5.517
  136   2HA   GLY  16          1HA       GLY  16   3.721   0.989  -5.003
  137    H    LEU  17           H        LEU  17   5.155   1.023  -2.384
  138    HA   LEU  17           HA       LEU  17   3.523   2.962  -0.872
  139   1HB   LEU  17          2HB       LEU  17   5.084   0.597  -0.130
  140   2HB   LEU  17          1HB       LEU  17   4.854   1.907   1.027
  141    HG   LEU  17           HG       LEU  17   2.589   0.576  -0.523
  142   1HD1  LEU  17          1HD1      LEU  17   2.064  -0.502   1.604
  143   2HD1  LEU  17          2HD1      LEU  17   3.678  -0.981   1.028
  144   3HD1  LEU  17          3HD1      LEU  17   3.519   0.210   2.339
  145   1HD2  LEU  17          1HD2      LEU  17   1.157   1.736   1.087
  146   2HD2  LEU  17          2HD2      LEU  17   2.580   2.507   1.824
  147   3HD2  LEU  17          3HD2      LEU  17   2.119   2.905   0.152
  148    H    GLU  18           H        GLU  18   6.888   2.738  -2.079
  149    HA   GLU  18           HA       GLU  18   7.947   4.722  -0.200
  150   1HB   GLU  18          2HB       GLU  18   9.279   2.875  -1.259
  151   2HB   GLU  18          1HB       GLU  18   9.206   3.809  -2.753
  152   1HG   GLU  18          2HG       GLU  18  10.315   5.692  -1.733
  153   2HG   GLU  18          1HG       GLU  18  10.154   4.994  -0.116
  154    H    GLU  19           H        GLU  19   6.776   4.753  -3.633
  155    HA   GLU  19           HA       GLU  19   7.272   7.562  -4.107
  156   1HB   GLU  19          2HB       GLU  19   7.165   5.874  -5.832
  157   2HB   GLU  19          1HB       GLU  19   5.418   5.665  -5.482
  158   1HG   GLU  19          2HG       GLU  19   5.883   7.174  -7.488
  159   2HG   GLU  19          1HG       GLU  19   4.959   7.966  -6.250
  160    H    ALA  20           H        ALA  20   4.719   5.812  -2.399
  161    HA   ALA  20           HA       ALA  20   2.913   8.153  -2.299
  162   1HB   ALA  20          1HB       ALA  20   1.532   6.641  -0.981
  163   2HB   ALA  20          2HB       ALA  20   2.021   5.855  -2.500
  164   3HB   ALA  20          3HB       ALA  20   2.829   5.423  -0.976
  165    H    SER  21           H        SER  21   4.515   6.028   0.072
  166    HA   SER  21           HA       SER  21   4.184   7.494   2.410
  167   1HB   SER  21          2HB       SER  21   5.860   6.174   3.396
  168   2HB   SER  21          1HB       SER  21   5.002   5.139   2.284
  169    HG   SER  21           HG       SER  21   6.911   6.062   0.792
  170    H    ARG  22           H        ARG  22   6.603   7.964  -0.221
  171    HA   ARG  22           HA       ARG  22   8.341   9.797   1.132
  172   1HB   ARG  22          2HB       ARG  22   8.965   8.610  -0.879
  173   2HB   ARG  22          1HB       ARG  22   7.760   9.537  -1.793
  174   1HG   ARG  22          2HG       ARG  22   8.911  11.608  -1.406
  175   2HG   ARG  22          1HG       ARG  22   9.885  10.928  -0.109
  176   1HD   ARG  22          2HD       ARG  22  10.984   9.467  -1.678
  177   2HD   ARG  22          1HD       ARG  22   9.994  10.205  -3.010
  178    HE   ARG  22           HE       ARG  22  10.940  12.413  -1.955
  179   1HH1  ARG  22          2HH2      ARG  22  12.877   9.504  -2.077
  180   2HH1  ARG  22          1HH2      ARG  22  14.383  10.348  -2.256
  181   1HH2  ARG  22          2HH1      ARG  22  12.916  13.508  -2.190
  182   2HH2  ARG  22          1HH1      ARG  22  14.389  12.608  -2.313
  183    H    LEU  23           H        LEU  23   5.305  10.304  -0.756
  184    HA   LEU  23           HA       LEU  23   5.366  13.137  -0.940
  185   1HB   LEU  23          2HB       LEU  23   3.310  11.051  -1.048
  186   2HB   LEU  23          1HB       LEU  23   2.790  12.719  -0.622
  187    HG   LEU  23           HG       LEU  23   2.495  12.597  -2.986
  188   1HD1  LEU  23          1HD1      LEU  23   4.023  14.068  -3.974
  189   2HD1  LEU  23          2HD1      LEU  23   3.503  14.623  -2.365
  190   3HD1  LEU  23          3HD1      LEU  23   5.121  13.914  -2.581
  191   1HD2  LEU  23          1HD2      LEU  23   4.120  11.744  -4.532
  192   2HD2  LEU  23          2HD2      LEU  23   5.220  11.321  -3.197
  193   3HD2  LEU  23          3HD2      LEU  23   3.661  10.478  -3.368
  194    H    TYR  24           H        TYR  24   4.100  11.025   1.704
  195    HA   TYR  24           HA       TYR  24   3.619  13.429   3.425
  196   1HB   TYR  24          2HB       TYR  24   2.791  12.152   5.023
  197   2HB   TYR  24          1HB       TYR  24   2.285  11.322   3.512
  198    HD1  TYR  24           1HD      TYR  24   2.949   8.989   3.118
  199    HD2  TYR  24           2HD      TYR  24   4.822  11.274   6.214
  200    HE1  TYR  24           1HE      TYR  24   3.689   6.914   4.215
  201    HE2  TYR  24           2HE      TYR  24   5.854   9.242   7.101
  202    HH   TYR  24           HH       TYR  24   6.231   7.068   6.720
  203    H    PHE  25           H        PHE  25   6.100  10.868   3.138
  204    HA   PHE  25           HA       PHE  25   7.526  10.900   5.427
  205   1HB   PHE  25          2HB       PHE  25   7.857   9.501   3.421
  206   2HB   PHE  25          1HB       PHE  25   8.615  10.907   2.599
  207    HD1  PHE  25           1HD      PHE  25  10.709  11.924   3.796
  208    HD2  PHE  25           2HD      PHE  25   9.214   7.934   4.373
  209    HE1  PHE  25           1HE      PHE  25  12.861  11.276   4.801
  210    HE2  PHE  25           2HE      PHE  25  11.404   7.265   5.334
  211    HZ   PHE  25           HZ       PHE  25  13.229   8.934   5.541
  212    H    GLY  26           H        GLY  26   7.859  13.267   2.762
  213   1HA   GLY  26          2HA       GLY  26   8.660  15.404   4.496
  214   2HA   GLY  26          1HA       GLY  26  10.059  14.761   3.630
  215    H    GLU  27           H        GLU  27   6.698  15.824   3.138
  216    HA   GLU  27           HA       GLU  27   7.369  17.679   0.978
  217   1HB   GLU  27          2HB       GLU  27   6.893  15.028   0.082
  218   2HB   GLU  27          1HB       GLU  27   5.436  15.930  -0.240
  219   1HG   GLU  27          2HG       GLU  27   6.407  16.947  -1.964
  220   2HG   GLU  27          1HG       GLU  27   7.708  17.564  -0.949
  221    H    ARG  28           H        ARG  28   4.750  15.784   2.549
  222    HA   ARG  28           HA       ARG  28   2.902  16.515   3.723
  223   1HB   ARG  28          2HB       ARG  28   4.456  18.777   3.943
  224   2HB   ARG  28          1HB       ARG  28   3.057  19.389   3.097
  225   1HG   ARG  28          2HG       ARG  28   1.693  18.073   4.870
  226   2HG   ARG  28          1HG       ARG  28   3.230  18.096   5.779
  227   1HD   ARG  28          2HD       ARG  28   2.492  20.737   4.552
  228   2HD   ARG  28          1HD       ARG  28   1.395  20.222   5.793
  229    HE   ARG  28           HE       ARG  28   4.225  20.120   6.455
  230   1HH1  ARG  28          2HH2      ARG  28   1.211  21.893   6.534
  231   2HH1  ARG  28          1HH2      ARG  28   1.656  22.892   7.880
  232   1HH2  ARG  28          2HH1      ARG  28   4.804  21.462   8.260
  233   2HH2  ARG  28          1HH1      ARG  28   3.669  22.639   8.828
  234    H    ASN  29           H        ASN  29   2.966  15.540   1.059
  235    HA   ASN  29           HA       ASN  29   0.608  16.920  -0.099
  236   1HB   ASN  29          2HB       ASN  29   2.805  17.401  -1.362
  237   2HB   ASN  29          1HB       ASN  29   2.825  15.725  -1.810
  238   1HD2  ASN  29          2HD2      ASN  29   2.813  17.550  -3.704
  239   2HD2  ASN  29          1HD2      ASN  29   1.251  17.654  -4.464
  240    H    VAL  30           H        VAL  30  -0.169  15.209   1.526
  241    HA   VAL  30           HA       VAL  30  -0.140  12.413   1.031
  242    HB   VAL  30           HB       VAL  30  -2.210  14.100   2.457
  243   1HG1  VAL  30          1HG1      VAL  30  -2.876  12.041   3.503
  244   2HG1  VAL  30          2HG1      VAL  30  -3.148  11.945   1.746
  245   3HG1  VAL  30          3HG1      VAL  30  -1.755  11.113   2.477
  246   1HG2  VAL  30          1HG2      VAL  30  -1.075  13.323   4.435
  247   2HG2  VAL  30          2HG2      VAL  30   0.146  12.487   3.445
  248   3HG2  VAL  30          3HG2      VAL  30   0.036  14.263   3.411
  249    H    LYS  31           H        LYS  31  -1.863  15.054  -0.590
  250    HA   LYS  31           HA       LYS  31  -3.845  13.589  -2.052
  251   1HB   LYS  31          2HB       LYS  31  -4.069  15.852  -1.758
  252   2HB   LYS  31          1HB       LYS  31  -2.384  16.180  -2.307
  253   1HG   LYS  31          2HG       LYS  31  -4.465  15.118  -4.191
  254   2HG   LYS  31          1HG       LYS  31  -4.347  16.858  -3.811
  255   1HD   LYS  31          2HD       LYS  31  -1.688  16.339  -4.324
  256   2HD   LYS  31          1HD       LYS  31  -2.375  15.119  -5.336
  257   1HE   LYS  31          2HE       LYS  31  -3.191  16.524  -6.780
  258   2HE   LYS  31          1HE       LYS  31  -3.562  17.781  -5.530
  259   1HZ   LYS  31          1HZ       LYS  31  -1.615  18.423  -6.825
  260   2HZ   LYS  31          2HZ       LYS  31  -1.196  18.071  -5.280
  261   3HZ   LYS  31          3HZ       LYS  31  -0.880  17.000  -6.478
  262    H    GLY  32           H        GLY  32  -0.295  14.125  -2.575
  263   1HA   GLY  32          2HA       GLY  32  -0.174  13.188  -5.292
  264   2HA   GLY  32          1HA       GLY  32   1.156  13.369  -4.171
  265    H    MET  33           H        MET  33   0.707  11.632  -2.152
  266    HA   MET  33           HA       MET  33   1.356   9.060  -3.057
  267   1HB   MET  33          2HB       MET  33   1.275   8.417  -0.925
  268   2HB   MET  33          1HB       MET  33   1.437  10.199  -0.730
  269   1HG   MET  33          2HG       MET  33  -0.794  10.394   0.098
  270   2HG   MET  33          1HG       MET  33  -1.281   8.851  -0.523
  271   1HE   MET  33          1HE       MET  33   1.009   9.820   3.231
  272   2HE   MET  33          2HE       MET  33   1.586  10.301   1.618
  273   3HE   MET  33          3HE       MET  33   0.016  10.891   2.213
  274    H    PHE  34           H        PHE  34  -1.790  10.538  -2.567
  275    HA   PHE  34           HA       PHE  34  -3.492   8.251  -2.592
  276   1HB   PHE  34          2HB       PHE  34  -3.622  11.059  -2.236
  277   2HB   PHE  34          1HB       PHE  34  -4.645  10.695  -3.625
  278    HD1  PHE  34           1HD      PHE  34  -6.815  10.356  -3.149
  279    HD2  PHE  34           2HD      PHE  34  -3.868   9.032  -0.316
  280    HE1  PHE  34           1HE      PHE  34  -8.618   9.591  -1.621
  281    HE2  PHE  34           2HE      PHE  34  -5.677   8.268   1.203
  282    HZ   PHE  34           HZ       PHE  34  -8.034   8.398   0.472
  283    H    GLU  35           H        GLU  35  -1.794   9.958  -5.180
  284    HA   GLU  35           HA       GLU  35  -3.434   8.833  -7.358
  285   1HB   GLU  35          2HB       GLU  35  -2.401  11.125  -7.384
  286   2HB   GLU  35          1HB       GLU  35  -0.832  10.362  -7.465
  287   1HG   GLU  35          2HG       GLU  35  -1.400   9.276  -9.573
  288   2HG   GLU  35          1HG       GLU  35  -3.062   9.843  -9.466
  289    H    VAL  36           H        VAL  36  -0.414   7.914  -5.621
  290    HA   VAL  36           HA       VAL  36   0.120   5.782  -7.638
  291    HB   VAL  36           HB       VAL  36   1.857   7.338  -6.872
  292   1HG1  VAL  36          1HG1      VAL  36   3.108   6.678  -4.877
  293   2HG1  VAL  36          2HG1      VAL  36   1.493   7.292  -4.450
  294   3HG1  VAL  36          3HG1      VAL  36   1.814   5.541  -4.430
  295   1HG2  VAL  36          1HG2      VAL  36   3.541   5.623  -6.984
  296   2HG2  VAL  36          2HG2      VAL  36   2.279   4.380  -6.803
  297   3HG2  VAL  36          3HG2      VAL  36   2.273   5.456  -8.222
  298    H    LEU  37           H        LEU  37  -1.159   6.262  -4.373
  299    HA   LEU  37           HA       LEU  37  -1.482   3.390  -3.769
  300   1HB   LEU  37          2HB       LEU  37  -1.293   5.808  -2.329
  301   2HB   LEU  37          1HB       LEU  37  -2.814   4.935  -1.947
  302    HG   LEU  37           HG       LEU  37  -0.874   4.303  -0.433
  303   1HD1  LEU  37          1HD1      LEU  37  -1.194   1.932  -0.542
  304   2HD1  LEU  37          2HD1      LEU  37  -2.740   2.794  -0.728
  305   3HD1  LEU  37          3HD1      LEU  37  -1.944   2.079  -2.150
  306   1HD2  LEU  37          1HD2      LEU  37   0.878   2.885  -1.297
  307   2HD2  LEU  37          2HD2      LEU  37   0.267   3.090  -2.956
  308   3HD2  LEU  37          3HD2      LEU  37   0.942   4.483  -2.078
  309    H    GLU  38           H        GLU  38  -3.409   5.928  -5.321
  310    HA   GLU  38           HA       GLU  38  -5.998   4.838  -5.052
  311   1HB   GLU  38          2HB       GLU  38  -6.116   6.818  -5.962
  312   2HB   GLU  38          1HB       GLU  38  -4.678   6.572  -7.013
  313   1HG   GLU  38          2HG       GLU  38  -6.017   5.140  -8.469
  314   2HG   GLU  38          1HG       GLU  38  -7.452   5.461  -7.437
  315    HA   PRO  39           HA       PRO  39  -5.326   1.991  -8.758
  316   1HB   PRO  39          2HB       PRO  39  -3.048   1.704 -10.127
  317   2HB   PRO  39          1HB       PRO  39  -4.155   3.034 -10.458
  318   1HG   PRO  39          2HG       PRO  39  -1.582   3.064  -8.831
  319   2HG   PRO  39          1HG       PRO  39  -2.171   4.271  -9.974
  320   1HD   PRO  39          1HD       PRO  39  -2.547   4.437  -7.175
  321   2HD   PRO  39          2HD       PRO  39  -3.619   5.257  -8.375
  322    H    LEU  40           H        LEU  40  -2.610   2.245  -6.388
  323    HA   LEU  40           HA       LEU  40  -2.013  -0.541  -6.364
  324   1HB   LEU  40          2HB       LEU  40  -1.253   1.840  -4.860
  325   2HB   LEU  40          1HB       LEU  40  -1.222   0.314  -3.953
  326    HG   LEU  40           HG       LEU  40   0.072   0.635  -6.714
  327   1HD1  LEU  40          1HD1      LEU  40   2.154   0.827  -5.435
  328   2HD1  LEU  40          2HD1      LEU  40   1.046   2.158  -5.025
  329   3HD1  LEU  40          3HD1      LEU  40   1.235   0.782  -3.912
  330   1HD2  LEU  40          1HD2      LEU  40   1.258  -1.386  -6.129
  331   2HD2  LEU  40          2HD2      LEU  40   0.401  -1.477  -4.572
  332   3HD2  LEU  40          3HD2      LEU  40  -0.498  -1.676  -6.095
  333    H    HIS  41           H        HIS  41  -4.492   1.381  -4.705
  334    HA   HIS  41           HA       HIS  41  -5.452  -0.704  -2.960
  335   1HB   HIS  41          2HB       HIS  41  -5.827   1.506  -2.402
  336   2HB   HIS  41          1HB       HIS  41  -6.441   1.906  -4.046
  337    HD1  HIS  41           1HD      HIS  41  -8.666   2.794  -3.323
  338    HD2  HIS  41           2HD      HIS  41  -7.887  -0.997  -1.880
  339    HE1  HIS  41           1HE      HIS  41 -10.937   1.829  -2.622
  340    H    ALA  42           H        ALA  42  -6.287   0.306  -6.327
  341    HA   ALA  42           HA       ALA  42  -8.501  -1.622  -6.582
  342   1HB   ALA  42          1HB       ALA  42  -8.614  -0.812  -8.825
  343   2HB   ALA  42          2HB       ALA  42  -8.595   0.528  -7.655
  344   3HB   ALA  42          3HB       ALA  42  -7.130   0.140  -8.586
  345    H    MET  43           H        MET  43  -5.154  -1.360  -7.847
  346    HA   MET  43           HA       MET  43  -4.995  -3.874  -9.205
  347   1HB   MET  43          2HB       MET  43  -2.938  -1.919  -8.067
  348   2HB   MET  43          1HB       MET  43  -2.477  -3.405  -8.831
  349   1HG   MET  43          2HG       MET  43  -3.218  -2.719 -10.931
  350   2HG   MET  43          1HG       MET  43  -4.291  -1.486 -10.271
  351   1HE   MET  43          1HE       MET  43  -0.563  -0.501 -12.151
  352   2HE   MET  43          2HE       MET  43  -1.032  -2.198 -11.896
  353   3HE   MET  43          3HE       MET  43  -2.183  -1.058 -12.632
  354    H    MET  44           H        MET  44  -5.324  -3.308  -5.782
  355    HA   MET  44           HA       MET  44  -3.975  -5.922  -5.227
  356   1HB   MET  44          2HB       MET  44  -3.699  -5.303  -3.093
  357   2HB   MET  44          1HB       MET  44  -3.313  -3.830  -4.047
  358   1HG   MET  44          2HG       MET  44  -4.597  -2.858  -2.349
  359   2HG   MET  44          1HG       MET  44  -5.893  -3.259  -3.428
  360   1HE   MET  44          1HE       MET  44  -4.720  -5.473   0.385
  361   2HE   MET  44          2HE       MET  44  -3.660  -5.408  -1.042
  362   3HE   MET  44          3HE       MET  44  -4.079  -3.911  -0.176
  363    H    GLU  45           H        GLU  45  -7.071  -4.430  -5.652
  364    HA   GLU  45           HA       GLU  45  -8.581  -6.477  -4.119
  365   1HB   GLU  45          2HB       GLU  45  -8.977  -3.927  -3.941
  366   2HB   GLU  45          1HB       GLU  45  -9.689  -4.047  -5.526
  367   1HG   GLU  45          2HG       GLU  45 -10.590  -6.057  -3.554
  368   2HG   GLU  45          1HG       GLU  45 -11.038  -4.344  -3.267
  369    H    ARG  46           H        ARG  46  -8.141  -5.310  -7.548
  370    HA   ARG  46           HA       ARG  46  -9.870  -6.773  -9.016
  371   1HB   ARG  46          2HB       ARG  46  -7.911  -5.356  -9.855
  372   2HB   ARG  46          1HB       ARG  46  -6.889  -6.752  -9.628
  373   1HG   ARG  46          2HG       ARG  46  -7.542  -6.854 -11.901
  374   2HG   ARG  46          1HG       ARG  46  -8.588  -8.030 -11.142
  375   1HD   ARG  46          2HD       ARG  46 -10.104  -6.916 -12.378
  376   2HD   ARG  46          1HD       ARG  46 -10.197  -5.935 -10.887
  377    HE   ARG  46           HE       ARG  46  -8.212  -5.151 -12.893
  378   1HH1  ARG  46          2HH2      ARG  46 -11.366  -4.397 -11.534
  379   2HH1  ARG  46          1HH2      ARG  46 -11.448  -2.836 -12.284
  380   1HH2  ARG  46          2HH1      ARG  46  -8.366  -3.108 -13.863
  381   2HH2  ARG  46          1HH1      ARG  46  -9.759  -2.124 -13.576
  382    H    GLY  47           H        GLY  47  -7.159  -8.208  -7.164
  383   1HA   GLY  47          2HA       GLY  47  -7.284 -10.406  -6.304
  384   2HA   GLY  47          1HA       GLY  47  -8.315 -10.894  -7.638
  385    HA   PRO  48           HA       PRO  48  -3.715 -11.756  -8.603
  386   1HB   PRO  48          2HB       PRO  48  -3.277 -14.168  -7.476
  387   2HB   PRO  48          1HB       PRO  48  -2.928 -12.658  -6.633
  388   1HG   PRO  48          2HG       PRO  48  -5.380 -14.454  -6.367
  389   2HG   PRO  48          1HG       PRO  48  -4.429 -13.708  -5.084
  390   1HD   PRO  48          1HD       PRO  48  -6.788 -12.531  -6.069
  391   2HD   PRO  48          2HD       PRO  48  -5.392 -11.503  -5.496
  392    H    GLN  49           H        GLN  49  -3.067 -14.082  -9.515
  393    HA   GLN  49           HA       GLN  49  -5.288 -15.203 -11.195
  394   1HB   GLN  49          2HB       GLN  49  -3.728 -15.084 -13.140
  395   2HB   GLN  49          1HB       GLN  49  -4.329 -13.547 -12.597
  396   1HG   GLN  49          2HG       GLN  49  -2.113 -13.556 -11.157
  397   2HG   GLN  49          1HG       GLN  49  -1.606 -14.684 -12.453
  398   1HE2  GLN  49          2HE2      GLN  49  -0.049 -13.232 -13.244
  399   2HE2  GLN  49          1HE2      GLN  49  -0.558 -11.782 -14.069
  400    H    THR  50           H        THR  50  -1.807 -15.616 -10.595
  401    HA   THR  50           HA       THR  50  -1.773 -18.475 -10.904
  402    HB   THR  50           HB       THR  50   0.067 -17.559 -11.691
  403    HG1  THR  50           1HG      THR  50   1.750 -18.398 -10.347
  404   1HG2  THR  50          1HG2      THR  50   1.606 -16.029 -10.552
  405   2HG2  THR  50          2HG2      THR  50  -0.004 -15.293 -10.747
  406   3HG2  THR  50          3HG2      THR  50   0.498 -15.930  -9.163
  407    H    LEU  51           H        LEU  51   0.047 -17.522  -8.267
  408    HA   LEU  51           HA       LEU  51  -1.664 -17.697  -5.954
  409   1HB   LEU  51          2HB       LEU  51  -1.288 -20.147  -7.238
  410   2HB   LEU  51          1HB       LEU  51   0.002 -20.142  -6.040
  411    HG   LEU  51           HG       LEU  51  -2.787 -19.338  -5.193
  412   1HD1  LEU  51          1HD1      LEU  51  -3.259 -21.699  -4.740
  413   2HD1  LEU  51          2HD1      LEU  51  -3.034 -21.423  -6.483
  414   3HD1  LEU  51          3HD1      LEU  51  -1.733 -22.168  -5.526
  415   1HD2  LEU  51          1HD2      LEU  51  -2.051 -20.315  -3.083
  416   2HD2  LEU  51          2HD2      LEU  51  -0.499 -20.784  -3.817
  417   3HD2  LEU  51          3HD2      LEU  51  -0.906 -19.063  -3.620
  418    H    LYS  52           H        LYS  52   0.392 -15.997  -6.943
  419    HA   LYS  52           HA       LYS  52   2.661 -16.480  -5.036
  420   1HB   LYS  52          2HB       LYS  52   2.975 -15.185  -7.761
  421   2HB   LYS  52          1HB       LYS  52   4.222 -15.575  -6.625
  422   1HG   LYS  52          2HG       LYS  52   3.245 -18.082  -6.964
  423   2HG   LYS  52          1HG       LYS  52   2.744 -17.404  -8.471
  424   1HD   LYS  52          2HD       LYS  52   4.823 -18.304  -8.876
  425   2HD   LYS  52          1HD       LYS  52   5.151 -16.571  -8.736
  426   1HE   LYS  52          2HE       LYS  52   6.105 -16.810  -6.565
  427   2HE   LYS  52          1HE       LYS  52   5.370 -18.393  -6.313
  428   1HZ   LYS  52          1HZ       LYS  52   7.648 -18.563  -6.819
  429   2HZ   LYS  52          2HZ       LYS  52   6.773 -19.244  -8.013
  430   3HZ   LYS  52          3HZ       LYS  52   7.469 -17.785  -8.246
  431    H    GLU  53           H        GLU  53   0.594 -14.071  -6.720
  432    HA   GLU  53           HA       GLU  53   1.462 -11.885  -5.004
  433   1HB   GLU  53          2HB       GLU  53   1.068 -11.484  -7.309
  434   2HB   GLU  53          1HB       GLU  53  -0.567 -12.214  -7.211
  435   1HG   GLU  53          2HG       GLU  53  -0.105  -9.906  -5.408
  436   2HG   GLU  53          1HG       GLU  53  -0.072  -9.531  -7.137
  437    H    THR  54           H        THR  54   0.820 -13.625  -3.200
  438    HA   THR  54           HA       THR  54  -1.639 -12.634  -1.924
  439    HB   THR  54           HB       THR  54  -1.510 -15.425  -2.875
  440    HG1  THR  54           1HG      THR  54  -2.684 -13.111  -3.657
  441   1HG2  THR  54          1HG2      THR  54  -3.579 -15.899  -1.691
  442   2HG2  THR  54          2HG2      THR  54  -2.237 -15.615  -0.557
  443   3HG2  THR  54          3HG2      THR  54  -3.456 -14.348  -0.827
  444    H    SER  55           H        SER  55   1.170 -12.286  -1.438
  445    HA   SER  55           HA       SER  55   1.570 -13.732   1.173
  446   1HB   SER  55          2HB       SER  55   3.304 -13.394  -1.083
  447   2HB   SER  55          1HB       SER  55   3.966 -12.645   0.403
  448    HG   SER  55           HG       SER  55   4.517 -14.894   0.419
  449    H    PHE  56           H        PHE  56   0.111 -11.150   0.353
  450    HA   PHE  56           HA       PHE  56   1.462  -9.256   2.247
  451   1HB   PHE  56          2HB       PHE  56   1.095  -7.463   0.805
  452   2HB   PHE  56          1HB       PHE  56   2.017  -8.728  -0.074
  453    HD1  PHE  56           1HD      PHE  56  -0.872  -6.583  -0.056
  454    HD2  PHE  56           2HD      PHE  56   0.695 -10.249  -1.659
  455    HE1  PHE  56           1HE      PHE  56  -2.563  -6.517  -1.878
  456    HE2  PHE  56           2HE      PHE  56  -1.093 -10.244  -3.376
  457    HZ   PHE  56           HZ       PHE  56  -2.676  -8.354  -3.524
  458    H    ASN  57           H        ASN  57  -1.539  -9.760   0.336
  459    HA   ASN  57           HA       ASN  57  -3.378  -8.608   2.224
  460   1HB   ASN  57          2HB       ASN  57  -5.010  -9.515   0.706
  461   2HB   ASN  57          1HB       ASN  57  -3.723  -8.625  -0.165
  462   1HD2  ASN  57          2HD2      ASN  57  -5.701 -11.114  -0.518
  463   2HD2  ASN  57          1HD2      ASN  57  -4.697 -12.200  -1.430
  464    H    GLN  58           H        GLN  58  -2.152 -11.929   1.657
  465    HA   GLN  58           HA       GLN  58  -3.986 -13.056   3.584
  466   1HB   GLN  58          2HB       GLN  58  -2.457 -14.020   1.422
  467   2HB   GLN  58          1HB       GLN  58  -1.850 -14.833   2.873
  468   1HG   GLN  58          2HG       GLN  58  -4.820 -14.668   2.098
  469   2HG   GLN  58          1HG       GLN  58  -3.810 -16.068   1.857
  470   1HE2  GLN  58          2HE2      GLN  58  -3.707 -17.554   3.436
  471   2HE2  GLN  58          1HE2      GLN  58  -4.246 -17.230   5.067
  472    H    ALA  59           H        ALA  59  -0.691 -11.807   3.664
  473    HA   ALA  59           HA       ALA  59  -0.016 -13.139   6.206
  474   1HB   ALA  59          1HB       ALA  59   2.088 -11.955   5.932
  475   2HB   ALA  59          2HB       ALA  59   1.683 -12.920   4.493
  476   3HB   ALA  59          3HB       ALA  59   1.459 -11.155   4.473
  477    H    TYR  60           H        TYR  60  -1.213 -10.105   4.897
  478    HA   TYR  60           HA       TYR  60  -1.713  -9.053   7.637
  479   1HB   TYR  60          2HB       TYR  60  -0.302  -7.264   5.675
  480   2HB   TYR  60          1HB       TYR  60  -0.420  -7.143   7.466
  481    HD1  TYR  60           1HD      TYR  60   1.479  -8.387   4.627
  482    HD2  TYR  60           2HD      TYR  60   0.960  -8.716   8.866
  483    HE1  TYR  60           1HE      TYR  60   3.751  -9.365   4.816
  484    HE2  TYR  60           2HE      TYR  60   3.221  -9.674   9.079
  485    HH   TYR  60           HH       TYR  60   4.954 -10.524   7.998
  486    H    GLY  61           H        GLY  61  -3.933  -9.646   6.691
  487   1HA   GLY  61          2HA       GLY  61  -5.150  -8.209   4.523
  488   2HA   GLY  61          1HA       GLY  61  -5.981  -8.970   5.841
  489    H    ARG  62           H        ARG  62  -4.329  -7.246   7.746
  490    HA   ARG  62           HA       ARG  62  -6.125  -4.941   7.753
  491   1HB   ARG  62          2HB       ARG  62  -5.485  -4.753  10.108
  492   2HB   ARG  62          1HB       ARG  62  -5.766  -6.436   9.805
  493   1HG   ARG  62          2HG       ARG  62  -3.320  -6.783   9.540
  494   2HG   ARG  62          1HG       ARG  62  -3.074  -5.079   9.948
  495   1HD   ARG  62          2HD       ARG  62  -3.194  -5.575  12.096
  496   2HD   ARG  62          1HD       ARG  62  -4.870  -6.173  11.862
  497    HE   ARG  62           HE       ARG  62  -4.081  -8.336  11.840
  498   1HH1  ARG  62          2HH2      ARG  62  -1.254  -6.261  11.464
  499   2HH1  ARG  62          1HH2      ARG  62  -0.130  -7.572  11.586
  500   1HH2  ARG  62          2HH1      ARG  62  -2.562 -10.020  11.997
  501   2HH2  ARG  62          1HH1      ARG  62  -0.874  -9.664  11.882
  502    H    ASP  63           H        ASP  63  -3.031  -5.534   6.522
  503    HA   ASP  63           HA       ASP  63  -1.437  -3.319   7.415
  504   1HB   ASP  63          2HB       ASP  63   0.039  -3.985   5.791
  505   2HB   ASP  63          1HB       ASP  63  -0.738  -5.484   6.427
  506    H    LEU  64           H        LEU  64  -0.639  -2.360   4.706
  507    HA   LEU  64           HA       LEU  64  -1.942  -0.197   3.973
  508   1HB   LEU  64          2HB       LEU  64  -1.173  -0.515   1.778
  509   2HB   LEU  64          1HB       LEU  64   0.004  -1.255   2.912
  510    HG   LEU  64           HG       LEU  64  -1.461  -3.454   2.283
  511   1HD1  LEU  64          1HD1      LEU  64  -2.038  -3.422  -0.057
  512   2HD1  LEU  64          2HD1      LEU  64  -3.000  -2.244   0.867
  513   3HD1  LEU  64          3HD1      LEU  64  -1.648  -1.689  -0.148
  514   1HD2  LEU  64          1HD2      LEU  64   0.255  -4.006   0.657
  515   2HD2  LEU  64          2HD2      LEU  64   0.761  -2.301   0.576
  516   3HD2  LEU  64          3HD2      LEU  64   0.980  -3.224   2.082
  517    H    MET  65           H        MET  65  -3.340  -3.468   3.358
  518    HA   MET  65           HA       MET  65  -5.482  -2.966   1.681
  519   1HB   MET  65          2HB       MET  65  -4.604  -5.173   2.681
  520   2HB   MET  65          1HB       MET  65  -5.508  -4.793   4.123
  521   1HG   MET  65          2HG       MET  65  -7.597  -4.929   2.985
  522   2HG   MET  65          1HG       MET  65  -6.842  -4.860   1.402
  523   1HE   MET  65          1HE       MET  65  -8.233  -8.445   1.391
  524   2HE   MET  65          2HE       MET  65  -8.965  -6.971   2.068
  525   3HE   MET  65          3HE       MET  65  -8.079  -6.896   0.527
  526    H    GLU  66           H        GLU  66  -5.477  -2.665   5.293
  527    HA   GLU  66           HA       GLU  66  -8.110  -1.287   5.303
  528   1HB   GLU  66          2HB       GLU  66  -6.345  -2.170   7.521
  529   2HB   GLU  66          1HB       GLU  66  -7.812  -1.196   7.689
  530   1HG   GLU  66          2HG       GLU  66  -9.008  -3.038   6.332
  531   2HG   GLU  66          1HG       GLU  66  -7.561  -4.023   6.605
  532    H    ALA  67           H        ALA  67  -4.634  -0.518   5.562
  533    HA   ALA  67           HA       ALA  67  -4.765   2.173   6.557
  534   1HB   ALA  67          1HB       ALA  67  -2.603   2.394   5.553
  535   2HB   ALA  67          2HB       ALA  67  -2.731   0.856   6.436
  536   3HB   ALA  67          3HB       ALA  67  -2.827   0.871   4.660
  537    H    GLN  68           H        GLN  68  -5.424   0.866   3.335
  538    HA   GLN  68           HA       GLN  68  -6.027   3.592   2.256
  539   1HB   GLN  68          2HB       GLN  68  -5.722   2.651   0.130
  540   2HB   GLN  68          1HB       GLN  68  -4.457   1.902   1.073
  541   1HG   GLN  68          2HG       GLN  68  -6.418   0.114   1.482
  542   2HG   GLN  68          1HG       GLN  68  -6.870   0.753  -0.136
  543   1HE2  GLN  68          2HE2      GLN  68  -6.539  -1.628  -0.409
  544   2HE2  GLN  68          1HE2      GLN  68  -4.939  -2.108  -0.909
  545    H    GLU  69           H        GLU  69  -7.623   0.521   3.209
  546    HA   GLU  69           HA       GLU  69 -10.061   0.705   1.815
  547   1HB   GLU  69          2HB       GLU  69  -9.156  -1.227   3.259
  548   2HB   GLU  69          1HB       GLU  69  -9.777  -0.339   4.641
  549   1HG   GLU  69          2HG       GLU  69 -11.811  -1.091   4.247
  550   2HG   GLU  69          1HG       GLU  69 -11.794  -0.372   2.606
  551    H    TRP  70           H        TRP  70  -8.810   2.657   4.396
  552    HA   TRP  70           HA       TRP  70 -11.357   3.751   5.288
  553   1HB   TRP  70          2HB       TRP  70  -8.502   4.651   5.709
  554   2HB   TRP  70          1HB       TRP  70  -9.958   5.124   6.654
  555    HD1  TRP  70           HD       TRP  70  -7.030   3.357   7.277
  556    HE1  TRP  70           1HE      TRP  70  -7.273   1.356   8.804
  557    HE3  TRP  70           3HE      TRP  70 -12.028   2.868   7.021
  558    HZ2  TRP  70           2HZ      TRP  70  -9.306  -0.552   9.354
  559    HZ3  TRP  70           3HZ      TRP  70 -13.109   0.830   7.929
  560    HH2  TRP  70           HH       TRP  70 -11.779  -0.732   9.328
  561    H    CYS  71           H        CYS  71 -11.205   3.823   2.502
  562    HA   CYS  71           HA       CYS  71 -10.247   6.407   1.514
  563   1HB   CYS  71          2HB       CYS  71 -10.141   4.568  -0.056
  564   2HB   CYS  71          1HB       CYS  71 -11.855   4.251   0.115
  565    HG   CYS  71           HG       CYS  71 -11.496   5.343  -2.163
  566    H    ARG  72           H        ARG  72 -13.530   4.815   1.661
  567    HA   ARG  72           HA       ARG  72 -15.213   7.016   1.430
  568   1HB   ARG  72          2HB       ARG  72 -16.850   5.734   2.454
  569   2HB   ARG  72          1HB       ARG  72 -15.822   4.650   1.459
  570   1HG   ARG  72          2HG       ARG  72 -16.038   3.321   3.359
  571   2HG   ARG  72          1HG       ARG  72 -14.639   4.244   3.859
  572   1HD   ARG  72          2HD       ARG  72 -15.899   4.556   5.699
  573   2HD   ARG  72          1HD       ARG  72 -16.561   5.908   4.748
  574    HE   ARG  72           HE       ARG  72 -17.860   3.350   4.311
  575   1HH1  ARG  72          2HH2      ARG  72 -18.092   6.371   6.126
  576   2HH1  ARG  72          1HH2      ARG  72 -19.714   6.047   6.646
  577   1HH2  ARG  72          2HH1      ARG  72 -19.965   2.998   5.016
  578   2HH2  ARG  72          1HH1      ARG  72 -20.754   4.174   6.008
  579    H    LYS  73           H        LYS  73 -13.096   6.293   4.097
  580    HA   LYS  73           HA       LYS  73 -14.491   8.063   6.011
  581   1HB   LYS  73          2HB       LYS  73 -13.241   5.699   6.385
  582   2HB   LYS  73          1HB       LYS  73 -11.927   6.849   6.743
  583   1HG   LYS  73          2HG       LYS  73 -12.898   7.180   8.788
  584   2HG   LYS  73          1HG       LYS  73 -14.240   7.967   7.951
  585   1HD   LYS  73          2HD       LYS  73 -15.150   5.524   7.600
  586   2HD   LYS  73          1HD       LYS  73 -14.031   5.093   8.891
  587   1HE   LYS  73          2HE       LYS  73 -15.502   7.471   9.700
  588   2HE   LYS  73          1HE       LYS  73 -16.634   6.254   9.171
  589   1HZ   LYS  73          1HZ       LYS  73 -16.187   6.024  11.396
  590   2HZ   LYS  73          2HZ       LYS  73 -15.546   4.726  10.642
  591   3HZ   LYS  73          3HZ       LYS  73 -14.573   5.923  11.181
  592    H    TYR  74           H        TYR  74 -11.262   7.680   4.409
  593    HA   TYR  74           HA       TYR  74 -10.195  10.306   5.129
  594   1HB   TYR  74          2HB       TYR  74  -8.824   8.469   4.451
  595   2HB   TYR  74          1HB       TYR  74  -9.642   8.405   2.859
  596    HD1  TYR  74           1HD      TYR  74  -9.403  10.255   1.283
  597    HD2  TYR  74           2HD      TYR  74  -7.001   9.986   4.826
  598    HE1  TYR  74           1HE      TYR  74  -7.850  11.907   0.326
  599    HE2  TYR  74           2HE      TYR  74  -5.433  11.650   3.885
  600    HH   TYR  74           HH       TYR  74  -4.800  12.712   2.044
  601    H    MET  75           H        MET  75 -12.505   9.343   2.640
  602    HA   MET  75           HA       MET  75 -12.284  11.752   1.092
  603   1HB   MET  75          2HB       MET  75 -13.801   9.179   1.022
  604   2HB   MET  75          1HB       MET  75 -14.597  10.544   0.265
  605   1HG   MET  75          2HG       MET  75 -11.694  10.007  -0.387
  606   2HG   MET  75          1HG       MET  75 -12.957   9.049  -1.139
  607   1HE   MET  75          1HE       MET  75 -11.498  13.014  -2.514
  608   2HE   MET  75          2HE       MET  75 -11.289  12.547  -0.810
  609   3HE   MET  75          3HE       MET  75 -10.680  11.489  -2.104
  610    H    LYS  76           H        LYS  76 -14.540  10.586   3.629
  611    HA   LYS  76           HA       LYS  76 -16.179  13.055   3.338
  612   1HB   LYS  76          2HB       LYS  76 -17.078  10.618   3.405
  613   2HB   LYS  76          1HB       LYS  76 -16.801  10.770   5.158
  614   1HG   LYS  76          2HG       LYS  76 -18.117  12.976   5.054
  615   2HG   LYS  76          1HG       LYS  76 -18.554  12.560   3.400
  616   1HD   LYS  76          2HD       LYS  76 -19.529  10.407   4.259
  617   2HD   LYS  76          1HD       LYS  76 -19.210  10.979   5.907
  618   1HE   LYS  76          2HE       LYS  76 -20.603  12.997   5.459
  619   2HE   LYS  76          1HE       LYS  76 -20.947  12.387   3.831
  620   1HZ   LYS  76          1HZ       LYS  76 -22.669  11.795   5.286
  621   2HZ   LYS  76          2HZ       LYS  76 -21.861  10.427   4.890
  622   3HZ   LYS  76          3HZ       LYS  76 -21.643  11.112   6.358
  623    H    SER  77           H        SER  77 -14.399  11.147   5.833
  624    HA   SER  77           HA       SER  77 -14.609  13.177   7.907
  625   1HB   SER  77          2HB       SER  77 -14.438  10.766   8.481
  626   2HB   SER  77          1HB       SER  77 -12.878  10.675   7.721
  627    HG   SER  77           HG       SER  77 -13.026  11.003  10.087
  628    H    GLY  78           H        GLY  78 -12.280  12.346   5.205
  629   1HA   GLY  78          2HA       GLY  78 -10.225  13.108   4.718
  630   2HA   GLY  78          1HA       GLY  78 -11.026  14.686   5.005
  631    H    ASN  79           H        ASN  79 -10.574  12.518   7.662
  632    HA   ASN  79           HA       ASN  79  -8.824  14.425   8.953
  633   1HB   ASN  79          2HB       ASN  79 -10.743  12.328   9.808
  634   2HB   ASN  79          1HB       ASN  79  -9.310  12.417  10.805
  635   1HD2  ASN  79          2HD2      ASN  79  -9.679  13.601  12.573
  636   2HD2  ASN  79          1HD2      ASN  79 -10.575  15.096  12.526
  637    H    VAL  80           H        VAL  80  -6.732  14.251   8.839
  638    HA   VAL  80           HA       VAL  80  -5.074  12.144   8.128
  639    HB   VAL  80           HB       VAL  80  -4.387  14.360  10.066
  640   1HG1  VAL  80          1HG1      VAL  80  -2.122  13.933   9.430
  641   2HG1  VAL  80          2HG1      VAL  80  -2.806  12.492  10.217
  642   3HG1  VAL  80          3HG1      VAL  80  -2.614  12.533   8.448
  643   1HG2  VAL  80          1HG2      VAL  80  -3.453  15.392   8.095
  644   2HG2  VAL  80          2HG2      VAL  80  -4.045  14.060   7.075
  645   3HG2  VAL  80          3HG2      VAL  80  -5.202  15.145   7.880
  646    H    LYS  81           H        LYS  81  -7.115  12.241  10.970
  647    HA   LYS  81           HA       LYS  81  -5.745  10.577  12.761
  648   1HB   LYS  81          2HB       LYS  81  -8.723  10.886  12.319
  649   2HB   LYS  81          1HB       LYS  81  -8.008  10.018  13.637
  650   1HG   LYS  81          2HG       LYS  81  -7.879  12.989  13.099
  651   2HG   LYS  81          1HG       LYS  81  -8.439  12.152  14.518
  652   1HD   LYS  81          2HD       LYS  81  -5.895  11.363  14.709
  653   2HD   LYS  81          1HD       LYS  81  -5.606  12.744  13.692
  654   1HE   LYS  81          2HE       LYS  81  -5.564  13.916  15.529
  655   2HE   LYS  81          1HE       LYS  81  -7.345  13.738  15.583
  656   1HZ   LYS  81          1HZ       LYS  81  -6.327  12.959  17.606
  657   2HZ   LYS  81          2HZ       LYS  81  -7.005  11.700  16.812
  658   3HZ   LYS  81          3HZ       LYS  81  -5.389  11.911  16.782
  659    H    ASP  82           H        ASP  82  -7.426   9.748   9.734
  660    HA   ASP  82           HA       ASP  82  -7.050   6.850   9.992
  661   1HB   ASP  82          2HB       ASP  82  -8.874   7.552   8.743
  662   2HB   ASP  82          1HB       ASP  82  -7.908   8.777   7.859
  663    H    LEU  83           H        LEU  83  -5.224   9.600   8.571
  664    HA   LEU  83           HA       LEU  83  -3.494   7.914   6.970
  665   1HB   LEU  83          2HB       LEU  83  -4.336  10.552   6.925
  666   2HB   LEU  83          1HB       LEU  83  -2.584  10.601   7.297
  667    HG   LEU  83           HG       LEU  83  -3.012  10.705   4.828
  668   1HD1  LEU  83          1HD1      LEU  83  -1.493   9.013   4.131
  669   2HD1  LEU  83          2HD1      LEU  83  -0.928   9.837   5.603
  670   3HD1  LEU  83          3HD1      LEU  83  -1.628   8.205   5.710
  671   1HD2  LEU  83          1HD2      LEU  83  -3.865   8.772   3.649
  672   2HD2  LEU  83          2HD2      LEU  83  -4.193   7.940   5.188
  673   3HD2  LEU  83          3HD2      LEU  83  -5.102   9.409   4.758
  674    H    THR  84           H        THR  84  -3.123   9.880   9.977
  675    HA   THR  84           HA       THR  84  -0.499   9.289  10.779
  676    HB   THR  84           HB       THR  84  -1.970  10.894  11.811
  677    HG1  THR  84           1HG      THR  84  -1.296  10.136  14.046
  678   1HG2  THR  84          1HG2      THR  84  -3.462  10.226  13.634
  679   2HG2  THR  84          2HG2      THR  84  -4.059   9.633  12.067
  680   3HG2  THR  84          3HG2      THR  84  -3.253   8.515  13.193
  681    H    GLN  85           H        GLN  85  -3.330   7.119  10.843
  682    HA   GLN  85           HA       GLN  85  -1.773   4.919  12.086
  683   1HB   GLN  85          2HB       GLN  85  -4.544   5.670  11.858
  684   2HB   GLN  85          1HB       GLN  85  -4.288   4.057  11.201
  685   1HG   GLN  85          2HG       GLN  85  -4.749   3.887  13.536
  686   2HG   GLN  85          1HG       GLN  85  -3.029   3.457  13.257
  687   1HE2  GLN  85          2HE2      GLN  85  -3.070   3.766  15.653
  688   2HE2  GLN  85          1HE2      GLN  85  -2.785   5.390  16.223
  689    H    ALA  86           H        ALA  86  -3.291   5.689   8.905
  690    HA   ALA  86           HA       ALA  86  -2.586   3.401   7.466
  691   1HB   ALA  86          1HB       ALA  86  -2.783   4.836   5.531
  692   2HB   ALA  86          2HB       ALA  86  -4.096   5.136   6.692
  693   3HB   ALA  86          3HB       ALA  86  -2.737   6.278   6.572
  694    H    TRP  87           H        TRP  87  -0.569   6.337   8.129
  695    HA   TRP  87           HA       TRP  87   1.729   5.606   6.659
  696   1HB   TRP  87          2HB       TRP  87   2.428   7.519   7.323
  697   2HB   TRP  87          1HB       TRP  87   0.912   7.691   8.277
  698    HD1  TRP  87           HD       TRP  87   1.286   8.211  10.753
  699    HE1  TRP  87           1HE      TRP  87   3.147   7.915  12.440
  700    HE3  TRP  87           3HE      TRP  87   4.590   5.983   7.726
  701    HZ2  TRP  87           2HZ      TRP  87   5.852   7.023  12.397
  702    HZ3  TRP  87           3HZ      TRP  87   6.864   5.435   8.554
  703    HH2  TRP  87           HH       TRP  87   7.441   5.802  10.928
  704    H    ASP  88           H        ASP  88   0.542   4.659   9.896
  705    HA   ASP  88           HA       ASP  88   2.991   3.421  10.795
  706   1HB   ASP  88          2HB       ASP  88   1.254   4.295  12.389
  707   2HB   ASP  88          1HB       ASP  88   0.216   2.978  11.921
  708    H    LEU  89           H        LEU  89  -0.112   2.291   9.215
  709    HA   LEU  89           HA       LEU  89   0.627  -0.529   9.190
  710   1HB   LEU  89          2HB       LEU  89  -1.515   0.951   7.639
  711   2HB   LEU  89          1HB       LEU  89  -1.322  -0.767   7.725
  712    HG   LEU  89           HG       LEU  89  -1.815   0.979  10.153
  713   1HD1  LEU  89          1HD1      LEU  89  -4.091   0.137   9.986
  714   2HD1  LEU  89          2HD1      LEU  89  -3.658   1.081   8.542
  715   3HD1  LEU  89          3HD1      LEU  89  -3.691  -0.696   8.466
  716   1HD2  LEU  89          1HD2      LEU  89  -2.385  -1.130  11.221
  717   2HD2  LEU  89          2HD2      LEU  89  -1.946  -2.024   9.746
  718   3HD2  LEU  89          3HD2      LEU  89  -0.694  -1.156  10.667
  719    H    TYR  90           H        TYR  90   0.725   2.096   6.779
  720    HA   TYR  90           HA       TYR  90   1.895   0.711   4.542
  721   1HB   TYR  90          2HB       TYR  90   2.175   3.623   5.397
  722   2HB   TYR  90          1HB       TYR  90   2.730   2.987   3.885
  723    HD1  TYR  90           1HD      TYR  90   0.571   5.088   4.778
  724    HD2  TYR  90           2HD      TYR  90   0.440   1.080   3.253
  725    HE1  TYR  90           1HE      TYR  90  -1.675   5.508   3.839
  726    HE2  TYR  90           2HE      TYR  90  -1.798   1.498   2.310
  727    HH   TYR  90           HH       TYR  90  -3.318   3.025   1.832
  728    H    TYR  91           H        TYR  91   3.525   2.423   7.220
  729    HA   TYR  91           HA       TYR  91   6.194   1.645   6.316
  730   1HB   TYR  91          2HB       TYR  91   5.543   3.744   7.657
  731   2HB   TYR  91          1HB       TYR  91   5.349   2.707   9.057
  732    HD1  TYR  91           1HD      TYR  91   7.782   3.589   6.385
  733    HD2  TYR  91           2HD      TYR  91   7.160   2.338  10.443
  734    HE1  TYR  91           1HE      TYR  91  10.147   4.077   6.894
  735    HE2  TYR  91           2HE      TYR  91   9.522   2.822  10.964
  736    HH   TYR  91           HH       TYR  91  11.636   3.124   9.966
  737    H    HIS  92           H        HIS  92   4.041   0.527   8.978
  738    HA   HIS  92           HA       HIS  92   5.736  -1.351  10.191
  739   1HB   HIS  92          2HB       HIS  92   3.561  -0.542  11.078
  740   2HB   HIS  92          1HB       HIS  92   2.733  -1.509   9.818
  741    HD1  HIS  92           1HD      HIS  92   5.502  -2.545  12.275
  742    HD2  HIS  92           2HD      HIS  92   1.711  -3.538  10.950
  743    HE1  HIS  92           1HE      HIS  92   4.932  -4.785  13.385
  744    H    VAL  93           H        VAL  93   3.615  -1.548   7.308
  745    HA   VAL  93           HA       VAL  93   4.315  -4.316   6.780
  746    HB   VAL  93           HB       VAL  93   2.068  -3.163   6.513
  747   1HG1  VAL  93          1HG1      VAL  93   1.470  -2.660   4.199
  748   2HG1  VAL  93          2HG1      VAL  93   2.613  -1.458   4.842
  749   3HG1  VAL  93          3HG1      VAL  93   3.186  -2.721   3.728
  750   1HG2  VAL  93          1HG2      VAL  93   1.534  -4.985   4.974
  751   2HG2  VAL  93          2HG2      VAL  93   3.275  -5.239   4.708
  752   3HG2  VAL  93          3HG2      VAL  93   2.580  -5.471   6.330
  753    H    PHE  94           H        PHE  94   5.278  -1.098   5.510
  754    HA   PHE  94           HA       PHE  94   6.676  -1.535   3.234
  755   1HB   PHE  94          2HB       PHE  94   6.429   0.577   4.462
  756   2HB   PHE  94          1HB       PHE  94   7.601  -0.019   5.685
  757    HD1  PHE  94           1HD      PHE  94   9.967  -0.507   4.945
  758    HD2  PHE  94           2HD      PHE  94   7.161   1.669   2.528
  759    HE1  PHE  94           1HE      PHE  94  11.816   0.244   3.500
  760    HE2  PHE  94           2HE      PHE  94   9.037   2.529   1.149
  761    HZ   PHE  94           HZ       PHE  94  11.360   1.781   1.604
  762    H    ARG  95           H        ARG  95   7.579  -2.811   6.387
  763    HA   ARG  95           HA       ARG  95  10.078  -4.054   5.287
  764   1HB   ARG  95          2HB       ARG  95  10.688  -4.314   7.604
  765   2HB   ARG  95          1HB       ARG  95  10.318  -2.629   7.268
  766   1HG   ARG  95          2HG       ARG  95   8.719  -2.607   8.810
  767   2HG   ARG  95          1HG       ARG  95   7.918  -4.027   8.091
  768   1HD   ARG  95          2HD       ARG  95   8.539  -5.003  10.078
  769   2HD   ARG  95          1HD       ARG  95  10.074  -5.237   9.210
  770    HE   ARG  95           HE       ARG  95  11.059  -3.636  10.517
  771   1HH1  ARG  95          2HH2      ARG  95   7.596  -3.407  11.002
  772   2HH1  ARG  95          1HH2      ARG  95   7.725  -2.295  12.341
  773   1HH2  ARG  95          2HH1      ARG  95  11.190  -2.179  12.264
  774   2HH2  ARG  95          1HH1      ARG  95   9.746  -1.616  13.035
  775    H    ARG  96           H        ARG  96   6.811  -4.834   6.222
  776    HA   ARG  96           HA       ARG  96   7.210  -7.617   6.987
  777   1HB   ARG  96          2HB       ARG  96   4.769  -5.939   6.377
  778   2HB   ARG  96          1HB       ARG  96   4.740  -7.662   6.875
  779   1HG   ARG  96          2HG       ARG  96   6.058  -5.604   8.673
  780   2HG   ARG  96          1HG       ARG  96   4.336  -5.788   8.703
  781   1HD   ARG  96          2HD       ARG  96   4.398  -7.777   9.677
  782   2HD   ARG  96          1HD       ARG  96   5.921  -8.267   8.863
  783    HE   ARG  96           HE       ARG  96   5.653  -6.511  11.244
  784   1HH1  ARG  96          2HH2      ARG  96   7.792  -7.920   8.853
  785   2HH1  ARG  96          1HH2      ARG  96   9.221  -7.755   9.818
  786   1HH2  ARG  96          2HH1      ARG  96   7.590  -6.275  12.507
  787   2HH2  ARG  96          1HH1      ARG  96   9.091  -6.819  11.846
  788    H    ILE  97           H        ILE  97   5.334  -5.995   4.344
  789    HA   ILE  97           HA       ILE  97   5.137  -8.320   2.623
  790    HB   ILE  97           HB       ILE  97   4.366  -6.760   0.959
  791   1HG1  ILE  97          2HG1      ILE  97   3.503  -4.494   2.041
  792   2HG1  ILE  97          1HG1      ILE  97   4.979  -4.610   2.935
  793   1HG2  ILE  97          1HG2      ILE  97   2.228  -6.410   2.177
  794   2HG2  ILE  97          2HG2      ILE  97   2.903  -8.023   2.508
  795   3HG2  ILE  97          3HG2      ILE  97   3.061  -6.727   3.718
  796   1HD1  ILE  97          1HD1      ILE  97   5.266  -3.326   0.954
  797   2HD1  ILE  97          2HD1      ILE  97   6.251  -4.805   0.859
  798   3HD1  ILE  97          3HD1      ILE  97   4.731  -4.687  -0.061
  799    H    SER  98           H        SER  98   7.563  -5.842   3.116
  800    HA   SER  98           HA       SER  98   9.003  -6.277   0.690
  801   1HB   SER  98          2HB       SER  98   9.585  -5.034   3.349
  802   2HB   SER  98          1HB       SER  98  10.774  -5.093   1.978
  803    HG   SER  98           HG       SER  98   9.451  -3.123   1.911
  804    H    LYS  99           H        LYS  99   9.565  -7.352   4.109
  805    HA   LYS  99           HA       LYS  99  10.873  -8.976   5.028
  806   1HB   LYS  99          2HB       LYS  99  10.695 -10.334   2.353
  807   2HB   LYS  99          1HB       LYS  99  11.199 -11.045   3.886
  808   1HG   LYS  99          2HG       LYS  99   8.946 -10.281   4.809
  809   2HG   LYS  99          1HG       LYS  99   8.489  -9.999   3.100
  810   1HD   LYS  99          2HD       LYS  99   8.593 -12.273   2.577
  811   2HD   LYS  99          1HD       LYS  99   9.558 -12.660   4.027
  812   1HE   LYS  99          2HE       LYS  99   6.648 -11.681   4.061
  813   2HE   LYS  99          1HE       LYS  99   7.149 -13.352   4.312
  814   1HZ   LYS  99          1HZ       LYS  99   6.800 -12.215   6.343
  815   2HZ   LYS  99          2HZ       LYS  99   8.386 -12.618   6.209
  816   3HZ   LYS  99          3HZ       LYS  99   7.903 -11.077   5.967
  817    H    GLN 100           H        GLN 100  12.191  -6.604   4.058
  818    HA   GLN 100           HA       GLN 100  14.574  -6.839   2.662
  819   1HB   GLN 100          2HB       GLN 100  13.625  -4.754   3.616
  820   2HB   GLN 100          1HB       GLN 100  14.122  -5.262   5.209
  821   1HG   GLN 100          2HG       GLN 100  16.490  -5.534   3.748
  822   2HG   GLN 100          1HG       GLN 100  15.750  -4.126   3.037
  823   1HE2  GLN 100          2HE2      GLN 100  17.251  -2.748   3.845
  824   2HE2  GLN 100          1HE2      GLN 100  17.314  -2.371   5.551
  Start of MODEL    9
    1   1H    GLU   1          1H        GLU   1  11.531  -8.628 -17.495
    2   2H    GLU   1          2H        GLU   1  10.513  -9.864 -18.010
    3    HA   GLU   1           HA       GLU   1   9.636  -7.746 -16.568
    4   1HB   GLU   1          2HB       GLU   1   9.405  -7.026 -19.503
    5   2HB   GLU   1          1HB       GLU   1   8.372  -6.358 -18.256
    6   1HG   GLU   1          2HG       GLU   1   9.993  -4.940 -17.536
    7   2HG   GLU   1          1HG       GLU   1  11.233  -6.180 -17.551
    8    H    LEU   2           H        LEU   2   8.178  -8.934 -15.608
    9    HA   LEU   2           HA       LEU   2   6.427 -10.451 -15.242
   10   1HB   LEU   2          2HB       LEU   2   4.419  -9.809 -15.918
   11   2HB   LEU   2          1HB       LEU   2   5.411  -8.320 -15.694
   12    HG   LEU   2           HG       LEU   2   5.485  -8.896 -18.456
   13   1HD1  LEU   2          1HD1      LEU   2   3.119  -9.006 -19.036
   14   2HD1  LEU   2          2HD1      LEU   2   3.624 -10.454 -18.134
   15   3HD1  LEU   2          3HD1      LEU   2   2.691  -9.177 -17.317
   16   1HD2  LEU   2          1HD2      LEU   2   4.210  -6.826 -18.623
   17   2HD2  LEU   2          2HD2      LEU   2   3.796  -6.916 -16.894
   18   3HD2  LEU   2          3HD2      LEU   2   5.487  -6.673 -17.392
   19    H    ILE   3           H        ILE   3   8.236 -11.895 -16.425
   20    HA   ILE   3           HA       ILE   3   6.963 -13.292 -18.730
   21    HB   ILE   3           HB       ILE   3   9.189 -14.320 -18.991
   22   1HG1  ILE   3          2HG1      ILE   3  10.142 -14.021 -16.928
   23   2HG1  ILE   3          1HG1      ILE   3  11.109 -13.449 -18.340
   24   1HG2  ILE   3          1HG2      ILE   3   9.945 -12.333 -20.252
   25   2HG2  ILE   3          2HG2      ILE   3   8.195 -12.582 -20.455
   26   3HG2  ILE   3          3HG2      ILE   3   8.793 -11.317 -19.355
   27   1HD1  ILE   3          1HD1      ILE   3  11.476 -12.066 -16.375
   28   2HD1  ILE   3          2HD1      ILE   3  10.690 -11.142 -17.676
   29   3HD1  ILE   3          3HD1      ILE   3   9.735 -11.705 -16.283
   30    H    ARG   4           H        ARG   4   8.456 -13.991 -15.588
   31    HA   ARG   4           HA       ARG   4   6.904 -16.552 -15.363
   32   1HB   ARG   4          2HB       ARG   4   9.677 -15.814 -14.513
   33   2HB   ARG   4          1HB       ARG   4   8.770 -17.239 -13.915
   34   1HG   ARG   4          2HG       ARG   4   8.382 -17.353 -16.685
   35   2HG   ARG   4          1HG       ARG   4  10.059 -16.804 -16.554
   36   1HD   ARG   4          2HD       ARG   4   9.157 -19.117 -14.828
   37   2HD   ARG   4          1HD       ARG   4   9.494 -19.401 -16.533
   38    HE   ARG   4           HE       ARG   4  11.366 -18.962 -14.451
   39   1HH1  ARG   4          2HH2      ARG   4  10.930 -18.364 -17.887
   40   2HH1  ARG   4          1HH2      ARG   4  12.627 -18.383 -18.240
   41   1HH2  ARG   4          1HH1      ARG   4  13.599 -18.994 -14.959
   42   2HH2  ARG   4          2HH1      ARG   4  14.103 -18.727 -16.593
   43    H    VAL   5           H        VAL   5   8.533 -14.082 -13.298
   44    HA   VAL   5           HA       VAL   5   6.997 -14.440 -10.976
   45    HB   VAL   5           HB       VAL   5   9.089 -13.322 -11.025
   46   1HG1  VAL   5          1HG1      VAL   5   9.270 -10.951 -11.643
   47   2HG1  VAL   5          2HG1      VAL   5   8.916 -11.958 -13.067
   48   3HG1  VAL   5          3HG1      VAL   5   7.623 -10.992 -12.318
   49   1HG2  VAL   5          1HG2      VAL   5   8.569 -11.593  -9.432
   50   2HG2  VAL   5          2HG2      VAL   5   6.844 -11.740  -9.844
   51   3HG2  VAL   5          3HG2      VAL   5   7.708 -13.121  -9.129
   52    H    ALA   6           H        ALA   6   6.141 -12.773 -13.983
   53    HA   ALA   6           HA       ALA   6   4.277 -11.675 -14.740
   54   1HB   ALA   6          1HB       ALA   6   2.143 -12.253 -13.861
   55   2HB   ALA   6          2HB       ALA   6   3.154 -13.686 -14.168
   56   3HB   ALA   6          3HB       ALA   6   2.911 -13.109 -12.502
   57    H    ILE   7           H        ILE   7   6.113 -10.331 -12.970
   58    HA   ILE   7           HA       ILE   7   6.398  -8.584 -11.475
   59    HB   ILE   7           HB       ILE   7   6.304  -7.662 -13.643
   60   1HG1  ILE   7          2HG1      ILE   7   7.001  -6.483 -11.731
   61   2HG1  ILE   7          1HG1      ILE   7   6.359  -5.494 -13.095
   62   1HG2  ILE   7          1HG2      ILE   7   4.394  -6.304 -14.377
   63   2HG2  ILE   7          2HG2      ILE   7   3.966  -8.031 -14.316
   64   3HG2  ILE   7          3HG2      ILE   7   3.418  -6.933 -13.027
   65   1HD1  ILE   7          1HD1      ILE   7   5.816  -4.514 -10.939
   66   2HD1  ILE   7          2HD1      ILE   7   4.347  -5.033 -11.798
   67   3HD1  ILE   7          3HD1      ILE   7   4.980  -6.007 -10.452
   68    H    LEU   8           H        LEU   8   5.537  -9.575  -9.526
   69    HA   LEU   8           HA       LEU   8   2.732  -9.508  -8.904
   70   1HB   LEU   8          2HB       LEU   8   5.097  -9.791  -7.110
   71   2HB   LEU   8          1HB       LEU   8   3.376 -10.124  -6.724
   72    HG   LEU   8           HG       LEU   8   5.212 -11.617  -8.598
   73   1HD1  LEU   8          1HD1      LEU   8   4.642 -13.483  -7.082
   74   2HD1  LEU   8          2HD1      LEU   8   5.411 -12.120  -6.234
   75   3HD1  LEU   8          3HD1      LEU   8   3.653 -12.369  -6.108
   76   1HD2  LEU   8          1HD2      LEU   8   3.349 -13.116  -9.148
   77   2HD2  LEU   8          2HD2      LEU   8   2.223 -12.056  -8.268
   78   3HD2  LEU   8          3HD2      LEU   8   3.037 -11.466  -9.737
   79    H    TRP   9           H        TRP   9   2.337  -8.472  -6.524
   80    HA   TRP   9           HA       TRP   9   2.499  -5.527  -6.955
   81   1HB   TRP   9          2HB       TRP   9   0.733  -7.070  -5.103
   82   2HB   TRP   9          1HB       TRP   9   0.882  -5.324  -5.160
   83    HD1  TRP   9           HD       TRP   9   1.037  -5.237  -8.505
   84    HE1  TRP   9           1HE      TRP   9  -1.115  -5.673  -9.778
   85    HE3  TRP   9           3HE      TRP   9  -1.411  -7.640  -4.854
   86    HZ2  TRP   9           2HZ      TRP   9  -3.496  -7.083  -9.298
   87    HZ3  TRP   9           3HZ      TRP   9  -3.679  -8.535  -5.249
   88    HH2  TRP   9           HH       TRP   9  -4.732  -8.210  -7.458
   89    H    HIS  10           H        HIS  10   3.521  -8.087  -4.654
   90    HA   HIS  10           HA       HIS  10   4.584  -6.578  -2.545
   91   1HB   HIS  10          2HB       HIS  10   4.718  -8.654  -2.000
   92   2HB   HIS  10          1HB       HIS  10   4.774  -9.205  -3.716
   93    HD1  HIS  10           1HD      HIS  10   6.802  -9.545  -0.785
   94    HD2  HIS  10           2HD      HIS  10   7.374  -8.879  -4.811
   95    HE1  HIS  10           1HE      HIS  10   9.283  -9.974  -1.219
   96    H    GLU  11           H        GLU  11   5.843  -7.034  -5.829
   97    HA   GLU  11           HA       GLU  11   8.508  -6.013  -5.464
   98   1HB   GLU  11          2HB       GLU  11   6.799  -6.179  -7.951
   99   2HB   GLU  11          1HB       GLU  11   8.585  -6.075  -7.843
  100   1HG   GLU  11          2HG       GLU  11   6.925  -8.380  -6.801
  101   2HG   GLU  11          1HG       GLU  11   7.722  -8.332  -8.413
  102    H    MET  12           H        MET  12   5.442  -4.581  -6.736
  103    HA   MET  12           HA       MET  12   6.622  -1.931  -7.145
  104   1HB   MET  12          2HB       MET  12   4.598  -1.180  -7.852
  105   2HB   MET  12          1HB       MET  12   4.882  -2.783  -8.610
  106   1HG   MET  12          2HG       MET  12   3.313  -3.804  -7.071
  107   2HG   MET  12          1HG       MET  12   3.052  -2.221  -6.268
  108   1HE   MET  12          1HE       MET  12   1.726  -3.222 -10.575
  109   2HE   MET  12          2HE       MET  12   3.421  -2.966 -10.099
  110   3HE   MET  12          3HE       MET  12   2.525  -4.372  -9.477
  111    H    TRP  13           H        TRP  13   4.443  -3.549  -4.771
  112    HA   TRP  13           HA       TRP  13   3.512  -1.440  -3.246
  113   1HB   TRP  13          2HB       TRP  13   3.626  -4.263  -3.073
  114   2HB   TRP  13          1HB       TRP  13   4.067  -3.541  -1.496
  115    HD1  TRP  13           HD       TRP  13   1.245  -5.060  -2.515
  116    HE1  TRP  13           1HE      TRP  13  -0.959  -3.918  -1.965
  117    HE3  TRP  13           3HE      TRP  13   2.941  -0.335  -1.862
  118    HZ2  TRP  13           2HZ      TRP  13  -1.839  -1.307  -1.365
  119    HZ3  TRP  13           3HZ      TRP  13   1.485   1.353  -0.913
  120    HH2  TRP  13           HH       TRP  13  -0.948   0.908  -0.692
  121    H    HIS  14           H        HIS  14   6.660  -3.195  -2.818
  122    HA   HIS  14           HA       HIS  14   7.802  -1.835  -0.692
  123   1HB   HIS  14          2HB       HIS  14   9.030  -2.583  -3.328
  124   2HB   HIS  14          1HB       HIS  14   9.920  -2.089  -1.849
  125    HD1  HIS  14           1HD      HIS  14  10.501  -4.811  -3.083
  126    HD2  HIS  14           2HD      HIS  14   7.593  -4.097  -0.179
  127    HE1  HIS  14           1HE      HIS  14  10.014  -7.075  -1.948
  128    H    GLU  15           H        GLU  15   8.545  -0.740  -4.024
  129    HA   GLU  15           HA       GLU  15   9.230   1.897  -3.220
  130   1HB   GLU  15          2HB       GLU  15   8.684   0.757  -5.963
  131   2HB   GLU  15          1HB       GLU  15   9.267   2.392  -5.659
  132   1HG   GLU  15          2HG       GLU  15  11.168   1.331  -4.324
  133   2HG   GLU  15          1HG       GLU  15  10.638  -0.224  -5.003
  134    H    GLY  16           H        GLY  16   6.144   0.629  -4.716
  135   1HA   GLY  16          2HA       GLY  16   4.723   3.035  -5.086
  136   2HA   GLY  16          1HA       GLY  16   4.021   1.484  -4.702
  137    H    LEU  17           H        LEU  17   5.300   1.170  -2.057
  138    HA   LEU  17           HA       LEU  17   3.785   2.943  -0.341
  139   1HB   LEU  17          2HB       LEU  17   5.542   0.651   0.084
  140   2HB   LEU  17          1HB       LEU  17   5.497   1.887   1.339
  141    HG   LEU  17           HG       LEU  17   3.078   0.461   0.145
  142   1HD1  LEU  17          1HD1      LEU  17   2.881  -0.478   2.377
  143   2HD1  LEU  17          2HD1      LEU  17   4.437  -0.916   1.631
  144   3HD1  LEU  17          3HD1      LEU  17   4.373   0.355   2.876
  145   1HD2  LEU  17          1HD2      LEU  17   1.781   1.662   1.823
  146   2HD2  LEU  17          2HD2      LEU  17   3.229   2.567   2.325
  147   3HD2  LEU  17          3HD2      LEU  17   2.552   2.805   0.697
  148    H    GLU  18           H        GLU  18   7.187   2.967  -1.534
  149    HA   GLU  18           HA       GLU  18   7.962   5.090   0.360
  150   1HB   GLU  18          2HB       GLU  18   9.455   3.276  -0.569
  151   2HB   GLU  18          1HB       GLU  18   9.477   4.253  -2.054
  152   1HG   GLU  18          2HG       GLU  18  10.519   6.101  -0.962
  153   2HG   GLU  18          1HG       GLU  18   9.990   5.594   0.630
  154    H    GLU  19           H        GLU  19   7.154   4.868  -3.167
  155    HA   GLU  19           HA       GLU  19   7.286   7.694  -3.766
  156   1HB   GLU  19          2HB       GLU  19   7.463   5.777  -5.396
  157   2HB   GLU  19          1HB       GLU  19   5.744   5.586  -5.255
  158   1HG   GLU  19          2HG       GLU  19   6.397   7.003  -7.170
  159   2HG   GLU  19          1HG       GLU  19   5.374   7.881  -6.056
  160    H    ALA  20           H        ALA  20   5.119   6.132  -1.679
  161    HA   ALA  20           HA       ALA  20   3.063   8.283  -2.062
  162   1HB   ALA  20          1HB       ALA  20   1.484   6.755  -1.050
  163   2HB   ALA  20          2HB       ALA  20   2.170   6.070  -2.542
  164   3HB   ALA  20          3HB       ALA  20   2.734   5.493  -0.956
  165    H    SER  21           H        SER  21   4.422   6.068   0.447
  166    HA   SER  21           HA       SER  21   3.724   7.564   2.736
  167   1HB   SER  21          2HB       SER  21   6.035   5.649   2.390
  168   2HB   SER  21          1HB       SER  21   5.357   6.238   3.914
  169    HG   SER  21           HG       SER  21   4.597   4.087   3.067
  170    H    ARG  22           H        ARG  22   6.582   7.866   0.485
  171    HA   ARG  22           HA       ARG  22   8.038   9.819   2.069
  172   1HB   ARG  22          2HB       ARG  22   9.111   8.477   0.273
  173   2HB   ARG  22          1HB       ARG  22   8.176   9.340  -0.909
  174   1HG   ARG  22          2HG       ARG  22   9.135  11.479   0.030
  175   2HG   ARG  22          1HG       ARG  22  10.237  10.451   0.973
  176   1HD   ARG  22          2HD       ARG  22  10.319   9.333  -1.551
  177   2HD   ARG  22          1HD       ARG  22  10.229  11.105  -1.869
  178    HE   ARG  22           HE       ARG  22  12.281  11.396  -0.819
  179   1HH1  ARG  22          2HH2      ARG  22  11.251   8.097  -0.163
  180   2HH1  ARG  22          1HH2      ARG  22  12.768   7.630   0.542
  181   1HH2  ARG  22          1HH1      ARG  22  14.242  10.745   0.125
  182   2HH2  ARG  22          2HH1      ARG  22  14.431   9.121   0.694
  183    H    LEU  23           H        LEU  23   5.817  10.266  -0.796
  184    HA   LEU  23           HA       LEU  23   5.758  13.005  -0.838
  185   1HB   LEU  23          2HB       LEU  23   3.927  10.906  -1.705
  186   2HB   LEU  23          1HB       LEU  23   3.198  12.504  -1.437
  187    HG   LEU  23           HG       LEU  23   5.567  13.167  -2.731
  188   1HD1  LEU  23          1HD1      LEU  23   5.814  11.738  -4.636
  189   2HD1  LEU  23          2HD1      LEU  23   6.177  10.882  -3.118
  190   3HD1  LEU  23          3HD1      LEU  23   4.635  10.593  -3.956
  191   1HD2  LEU  23          1HD2      LEU  23   4.178  13.541  -4.698
  192   2HD2  LEU  23          2HD2      LEU  23   2.896  12.514  -4.010
  193   3HD2  LEU  23          3HD2      LEU  23   3.324  14.051  -3.222
  194    H    TYR  24           H        TYR  24   4.469  10.963   1.601
  195    HA   TYR  24           HA       TYR  24   3.156  13.278   2.981
  196   1HB   TYR  24          2HB       TYR  24   1.702  11.344   2.771
  197   2HB   TYR  24          1HB       TYR  24   2.952  10.238   3.260
  198    HD1  TYR  24           1HD      TYR  24   3.202   9.581   5.402
  199    HD2  TYR  24           2HD      TYR  24   1.066  13.202   4.558
  200    HE1  TYR  24           1HE      TYR  24   2.630   9.809   7.796
  201    HE2  TYR  24           2HE      TYR  24   0.399  13.387   6.920
  202    HH   TYR  24           HH       TYR  24   0.328  12.333   8.893
  203    H    PHE  25           H        PHE  25   5.837  10.964   3.314
  204    HA   PHE  25           HA       PHE  25   6.537  11.069   5.980
  205   1HB   PHE  25          2HB       PHE  25   7.443   9.560   4.281
  206   2HB   PHE  25          1HB       PHE  25   8.241  10.945   3.469
  207    HD1  PHE  25           1HD      PHE  25   8.112   9.041   6.658
  208    HD2  PHE  25           2HD      PHE  25  10.421  11.564   4.055
  209    HE1  PHE  25           1HE      PHE  25  10.086   8.752   8.133
  210    HE2  PHE  25           2HE      PHE  25  12.396  11.280   5.529
  211    HZ   PHE  25           HZ       PHE  25  12.231   9.864   7.558
  212    H    GLY  26           H        GLY  26   7.707  13.198   3.322
  213   1HA   GLY  26          2HA       GLY  26   7.840  15.541   5.115
  214   2HA   GLY  26          1HA       GLY  26   9.382  14.972   4.542
  215    H    GLU  27           H        GLU  27   6.380  14.741   2.601
  216    HA   GLU  27           HA       GLU  27   7.417  16.972   0.847
  217   1HB   GLU  27          2HB       GLU  27   6.715  14.282   0.134
  218   2HB   GLU  27          1HB       GLU  27   5.644  15.423  -0.633
  219   1HG   GLU  27          2HG       GLU  27   7.265  15.685  -2.140
  220   2HG   GLU  27          1HG       GLU  27   8.122  16.641  -0.931
  221    H    ARG  28           H        ARG  28   5.052  16.398   3.181
  222    HA   ARG  28           HA       ARG  28   2.783  16.966   3.473
  223   1HB   ARG  28          2HB       ARG  28   4.188  19.432   2.476
  224   2HB   ARG  28          1HB       ARG  28   2.601  19.410   3.250
  225   1HG   ARG  28          2HG       ARG  28   3.474  19.022   5.317
  226   2HG   ARG  28          1HG       ARG  28   4.716  17.915   4.705
  227   1HD   ARG  28          2HD       ARG  28   6.146  19.718   4.051
  228   2HD   ARG  28          1HD       ARG  28   4.845  20.913   4.219
  229    HE   ARG  28           HE       ARG  28   6.546  19.879   6.283
  230   1HH1  ARG  28          2HH2      ARG  28   3.332  21.186   5.761
  231   2HH1  ARG  28          1HH2      ARG  28   3.137  21.727   7.397
  232   1HH2  ARG  28          1HH1      ARG  28   6.256  20.599   8.440
  233   2HH2  ARG  28          2HH1      ARG  28   4.779  21.388   8.881
  234    H    ASN  29           H        ASN  29   3.230  15.653   0.863
  235    HA   ASN  29           HA       ASN  29   1.052  16.934  -0.695
  236   1HB   ASN  29          2HB       ASN  29   3.443  17.121  -1.609
  237   2HB   ASN  29          1HB       ASN  29   3.359  15.379  -1.877
  238   1HD2  ASN  29          2HD2      ASN  29   3.712  17.020  -3.972
  239   2HD2  ASN  29          1HD2      ASN  29   2.255  17.128  -4.927
  240    H    VAL  30           H        VAL  30  -0.347  15.705   0.514
  241    HA   VAL  30           HA       VAL  30  -0.349  12.804   0.522
  242    HB   VAL  30           HB       VAL  30  -2.364  14.875   1.412
  243   1HG1  VAL  30          1HG1      VAL  30  -3.417  13.024   2.586
  244   2HG1  VAL  30          2HG1      VAL  30  -3.455  12.752   0.828
  245   3HG1  VAL  30          3HG1      VAL  30  -2.280  11.878   1.839
  246   1HG2  VAL  30          1HG2      VAL  30  -1.616  14.191   3.642
  247   2HG2  VAL  30          2HG2      VAL  30  -0.434  13.072   2.924
  248   3HG2  VAL  30          3HG2      VAL  30  -0.245  14.827   2.703
  249    H    LYS  31           H        LYS  31  -1.898  15.425  -1.387
  250    HA   LYS  31           HA       LYS  31  -3.703  13.913  -2.989
  251   1HB   LYS  31          2HB       LYS  31  -3.990  16.168  -2.906
  252   2HB   LYS  31          1HB       LYS  31  -2.256  16.504  -3.253
  253   1HG   LYS  31          2HG       LYS  31  -3.864  17.059  -5.171
  254   2HG   LYS  31          1HG       LYS  31  -2.585  15.974  -5.616
  255   1HD   LYS  31          2HD       LYS  31  -4.142  14.544  -6.380
  256   2HD   LYS  31          1HD       LYS  31  -4.741  14.304  -4.766
  257   1HE   LYS  31          2HE       LYS  31  -5.880  16.682  -5.352
  258   2HE   LYS  31          1HE       LYS  31  -5.794  15.896  -6.960
  259   1HZ   LYS  31          1HZ       LYS  31  -7.763  15.210  -5.822
  260   2HZ   LYS  31          2HZ       LYS  31  -6.748  13.926  -5.897
  261   3HZ   LYS  31          3HZ       LYS  31  -6.910  14.760  -4.505
  262    H    GLY  32           H        GLY  32  -0.135  14.438  -3.199
  263   1HA   GLY  32          2HA       GLY  32   0.188  13.208  -5.812
  264   2HA   GLY  32          1HA       GLY  32   1.443  13.592  -4.665
  265    H    MET  33           H        MET  33   1.083  12.057  -2.463
  266    HA   MET  33           HA       MET  33   1.760   9.423  -3.061
  267   1HB   MET  33          2HB       MET  33   1.593   8.968  -0.888
  268   2HB   MET  33          1HB       MET  33   1.779  10.760  -0.869
  269   1HG   MET  33          2HG       MET  33  -0.497  11.052  -0.304
  270   2HG   MET  33          1HG       MET  33  -0.832   9.304  -0.528
  271   1HE   MET  33          1HE       MET  33   0.724   7.685   2.633
  272   2HE   MET  33          2HE       MET  33  -0.383   7.478   1.255
  273   3HE   MET  33          3HE       MET  33   1.354   7.739   0.970
  274    H    PHE  34           H        PHE  34  -1.425  10.877  -2.871
  275    HA   PHE  34           HA       PHE  34  -3.015   8.511  -2.733
  276   1HB   PHE  34          2HB       PHE  34  -3.499  11.090  -2.241
  277   2HB   PHE  34          1HB       PHE  34  -4.062  11.029  -3.912
  278    HD1  PHE  34           1HD      PHE  34  -4.190   8.649  -0.984
  279    HD2  PHE  34           2HD      PHE  34  -6.346  10.773  -4.031
  280    HE1  PHE  34           1HE      PHE  34  -6.280   7.588  -0.240
  281    HE2  PHE  34           2HE      PHE  34  -8.474   9.815  -3.177
  282    HZ   PHE  34           HZ       PHE  34  -8.435   8.222  -1.287
  283    H    GLU  35           H        GLU  35  -1.219  10.023  -5.370
  284    HA   GLU  35           HA       GLU  35  -2.928   9.062  -7.546
  285   1HB   GLU  35          2HB       GLU  35  -1.494  11.122  -7.633
  286   2HB   GLU  35          1HB       GLU  35  -0.068  10.037  -7.597
  287   1HG   GLU  35          2HG       GLU  35  -0.393  10.518  -9.910
  288   2HG   GLU  35          1HG       GLU  35  -1.117   8.930  -9.709
  289    H    VAL  36           H        VAL  36   0.347   8.162  -6.176
  290    HA   VAL  36           HA       VAL  36   0.545   5.747  -7.769
  291    HB   VAL  36           HB       VAL  36   2.520   7.010  -7.086
  292   1HG1  VAL  36          1HG1      VAL  36   3.430   6.703  -4.907
  293   2HG1  VAL  36          2HG1      VAL  36   1.897   7.600  -4.797
  294   3HG1  VAL  36          3HG1      VAL  36   1.955   5.876  -4.357
  295   1HG2  VAL  36          1HG2      VAL  36   3.852   5.131  -6.691
  296   2HG2  VAL  36          2HG2      VAL  36   2.411   4.140  -6.356
  297   3HG2  VAL  36          3HG2      VAL  36   2.652   4.841  -7.974
  298    H    LEU  37           H        LEU  37  -0.667   6.493  -4.455
  299    HA   LEU  37           HA       LEU  37  -1.321   3.678  -3.896
  300   1HB   LEU  37          2HB       LEU  37  -0.605   5.910  -2.341
  301   2HB   LEU  37          1HB       LEU  37  -2.322   5.837  -2.119
  302    HG   LEU  37           HG       LEU  37  -1.929   3.308  -1.672
  303   1HD1  LEU  37          1HD1      LEU  37   0.264   2.870  -0.659
  304   2HD1  LEU  37          2HD1      LEU  37   0.413   3.257  -2.389
  305   3HD1  LEU  37          3HD1      LEU  37   0.823   4.481  -1.166
  306   1HD2  LEU  37          1HD2      LEU  37  -1.534   3.906   0.701
  307   2HD2  LEU  37          2HD2      LEU  37  -1.021   5.536   0.204
  308   3HD2  LEU  37          3HD2      LEU  37  -2.703   5.015  -0.054
  309    H    GLU  38           H        GLU  38  -2.803   5.807  -5.983
  310    HA   GLU  38           HA       GLU  38  -5.554   5.305  -5.186
  311   1HB   GLU  38          2HB       GLU  38  -4.250   7.037  -7.043
  312   2HB   GLU  38          1HB       GLU  38  -5.580   6.120  -7.825
  313   1HG   GLU  38          2HG       GLU  38  -6.361   7.233  -5.217
  314   2HG   GLU  38          1HG       GLU  38  -5.857   8.478  -6.351
  315    HA   PRO  39           HA       PRO  39  -5.556   2.287  -8.841
  316   1HB   PRO  39          2HB       PRO  39  -3.504   1.879 -10.527
  317   2HB   PRO  39          1HB       PRO  39  -4.566   3.274 -10.716
  318   1HG   PRO  39          2HG       PRO  39  -1.784   3.155  -9.502
  319   2HG   PRO  39          1HG       PRO  39  -2.485   4.408 -10.523
  320   1HD   PRO  39          1HD       PRO  39  -2.402   4.509  -7.700
  321   2HD   PRO  39          2HD       PRO  39  -3.541   5.460  -8.713
  322    H    LEU  40           H        LEU  40  -2.204   2.354  -7.352
  323    HA   LEU  40           HA       LEU  40  -1.794  -0.446  -7.156
  324   1HB   LEU  40          2HB       LEU  40   0.089   0.376  -6.738
  325   2HB   LEU  40          1HB       LEU  40  -0.618   2.027  -6.577
  326    HG   LEU  40           HG       LEU  40  -0.986   1.462  -4.121
  327   1HD1  LEU  40          1HD1      LEU  40   0.435  -0.406  -3.316
  328   2HD1  LEU  40          2HD1      LEU  40  -0.766  -1.011  -4.481
  329   3HD1  LEU  40          3HD1      LEU  40   0.921  -0.765  -4.989
  330   1HD2  LEU  40          1HD2      LEU  40   1.323   1.897  -3.514
  331   2HD2  LEU  40          2HD2      LEU  40   1.863   1.472  -5.155
  332   3HD2  LEU  40          3HD2      LEU  40   0.847   2.911  -4.896
  333    H    HIS  41           H        HIS  41  -3.814   1.748  -5.191
  334    HA   HIS  41           HA       HIS  41  -4.336  -0.054  -2.984
  335   1HB   HIS  41          2HB       HIS  41  -4.698   2.014  -2.403
  336   2HB   HIS  41          1HB       HIS  41  -5.289   2.506  -4.033
  337    HD1  HIS  41           1HD      HIS  41  -7.763   2.887  -4.160
  338    HD2  HIS  41           2HD      HIS  41  -6.621   0.545  -0.946
  339    HE1  HIS  41           1HE      HIS  41  -9.930   2.023  -3.114
  340    H    ALA  42           H        ALA  42  -6.201   0.730  -6.002
  341    HA   ALA  42           HA       ALA  42  -8.285  -1.257  -5.458
  342   1HB   ALA  42          1HB       ALA  42  -9.102  -0.618  -7.621
  343   2HB   ALA  42          2HB       ALA  42  -8.790   0.808  -6.602
  344   3HB   ALA  42          3HB       ALA  42  -7.653   0.379  -7.900
  345    H    MET  43           H        MET  43  -5.364  -1.073  -7.552
  346    HA   MET  43           HA       MET  43  -5.415  -3.515  -8.897
  347   1HB   MET  43          2HB       MET  43  -3.231  -1.770  -7.878
  348   2HB   MET  43          1HB       MET  43  -2.840  -3.406  -8.367
  349   1HG   MET  43          2HG       MET  43  -4.530  -2.473 -10.406
  350   2HG   MET  43          1HG       MET  43  -3.491  -1.102 -10.002
  351   1HE   MET  43          1HE       MET  43  -1.253  -2.163 -12.854
  352   2HE   MET  43          2HE       MET  43  -2.994  -1.806 -12.757
  353   3HE   MET  43          3HE       MET  43  -1.832  -0.834 -11.820
  354    H    MET  44           H        MET  44  -4.742  -2.979  -5.417
  355    HA   MET  44           HA       MET  44  -3.869  -5.650  -4.897
  356   1HB   MET  44          2HB       MET  44  -3.143  -3.839  -3.470
  357   2HB   MET  44          1HB       MET  44  -4.771  -3.345  -3.126
  358   1HG   MET  44          2HG       MET  44  -3.656  -4.669  -1.298
  359   2HG   MET  44          1HG       MET  44  -5.178  -5.337  -1.794
  360   1HE   MET  44          1HE       MET  44  -4.118  -8.661  -1.273
  361   2HE   MET  44          2HE       MET  44  -4.301  -7.187  -0.293
  362   3HE   MET  44          3HE       MET  44  -5.450  -7.531  -1.608
  363    H    GLU  45           H        GLU  45  -7.045  -4.274  -5.428
  364    HA   GLU  45           HA       GLU  45  -8.437  -6.413  -3.866
  365   1HB   GLU  45          2HB       GLU  45  -8.893  -3.917  -3.478
  366   2HB   GLU  45          1HB       GLU  45  -9.674  -3.953  -5.064
  367   1HG   GLU  45          2HG       GLU  45 -11.212  -5.759  -4.288
  368   2HG   GLU  45          1HG       GLU  45 -10.400  -5.831  -2.745
  369    H    ARG  46           H        ARG  46  -8.071  -4.972  -7.154
  370    HA   ARG  46           HA       ARG  46  -9.998  -6.343  -8.618
  371   1HB   ARG  46          2HB       ARG  46  -7.307  -5.234  -9.108
  372   2HB   ARG  46          1HB       ARG  46  -7.931  -6.416 -10.290
  373   1HG   ARG  46          2HG       ARG  46  -9.657  -5.015 -10.967
  374   2HG   ARG  46          1HG       ARG  46  -9.866  -4.318  -9.359
  375   1HD   ARG  46          2HD       ARG  46  -7.777  -3.040  -9.659
  376   2HD   ARG  46          1HD       ARG  46  -7.649  -3.703 -11.319
  377    HE   ARG  46           HE       ARG  46 -10.245  -2.614 -10.891
  378   1HH1  ARG  46          2HH2      ARG  46  -6.975  -1.506 -11.467
  379   2HH1  ARG  46          1HH2      ARG  46  -7.465  -0.002 -12.182
  380   1HH2  ARG  46          1HH1      ARG  46 -10.867  -0.634 -11.862
  381   2HH2  ARG  46          2HH1      ARG  46  -9.650   0.469 -12.401
  382    H    GLY  47           H        GLY  47  -6.931  -7.642  -7.274
  383   1HA   GLY  47          2HA       GLY  47  -6.026  -9.742  -7.256
  384   2HA   GLY  47          1HA       GLY  47  -7.673 -10.317  -7.069
  385    HA   PRO  48           HA       PRO  48  -7.490 -10.537 -11.753
  386   1HB   PRO  48          2HB       PRO  48  -5.794  -9.304 -13.280
  387   2HB   PRO  48          1HB       PRO  48  -7.242  -8.476 -12.532
  388   1HG   PRO  48          2HG       PRO  48  -4.277  -8.287 -11.723
  389   2HG   PRO  48          1HG       PRO  48  -5.457  -6.978 -11.775
  390   1HD   PRO  48          1HD       PRO  48  -4.863  -8.472  -9.453
  391   2HD   PRO  48          2HD       PRO  48  -6.421  -7.599  -9.707
  392    H    GLN  49           H        GLN  49  -4.022 -10.220 -10.787
  393    HA   GLN  49           HA       GLN  49  -2.982 -12.396 -12.269
  394   1HB   GLN  49          2HB       GLN  49  -2.175 -10.441 -10.244
  395   2HB   GLN  49          1HB       GLN  49  -1.630 -11.998  -9.724
  396   1HG   GLN  49          2HG       GLN  49  -0.023 -12.042 -11.195
  397   2HG   GLN  49          1HG       GLN  49  -1.106 -11.599 -12.544
  398   1HE2  GLN  49          2HE2      GLN  49  -1.216  -9.507 -13.210
  399   2HE2  GLN  49          1HE2      GLN  49  -0.316  -8.207 -12.473
  400    H    THR  50           H        THR  50  -1.824 -14.164 -10.678
  401    HA   THR  50           HA       THR  50  -3.767 -16.169 -10.064
  402    HB   THR  50           HB       THR  50  -1.902 -16.984 -10.843
  403    HG1  THR  50           1HG      THR  50  -1.061 -18.270  -9.087
  404   1HG2  THR  50          1HG2      THR  50   0.366 -16.650  -9.968
  405   2HG2  THR  50          2HG2      THR  50  -0.329 -15.118 -10.547
  406   3HG2  THR  50          3HG2      THR  50  -0.250 -15.454  -8.802
  407    H    LEU  51           H        LEU  51  -1.588 -16.006  -7.551
  408    HA   LEU  51           HA       LEU  51  -3.154 -14.607  -5.502
  409   1HB   LEU  51          2HB       LEU  51  -3.582 -17.397  -6.124
  410   2HB   LEU  51          1HB       LEU  51  -2.816 -17.268  -4.534
  411    HG   LEU  51           HG       LEU  51  -4.800 -15.205  -4.712
  412   1HD1  LEU  51          1HD1      LEU  51  -6.824 -16.515  -5.065
  413   2HD1  LEU  51          2HD1      LEU  51  -5.817 -16.447  -6.530
  414   3HD1  LEU  51          3HD1      LEU  51  -5.839 -17.922  -5.535
  415   1HD2  LEU  51          1HD2      LEU  51  -5.756 -16.453  -2.807
  416   2HD2  LEU  51          2HD2      LEU  51  -4.727 -17.851  -3.199
  417   3HD2  LEU  51          3HD2      LEU  51  -3.987 -16.326  -2.658
  418    H    LYS  52           H        LYS  52  -0.539 -14.317  -6.648
  419    HA   LYS  52           HA       LYS  52   1.281 -15.122  -4.418
  420   1HB   LYS  52          2HB       LYS  52   1.904 -14.232  -7.259
  421   2HB   LYS  52          1HB       LYS  52   3.063 -14.733  -6.062
  422   1HG   LYS  52          2HG       LYS  52   1.964 -16.985  -5.987
  423   2HG   LYS  52          1HG       LYS  52   0.897 -16.460  -7.286
  424   1HD   LYS  52          2HD       LYS  52   2.932 -15.933  -8.665
  425   2HD   LYS  52          1HD       LYS  52   3.922 -16.656  -7.378
  426   1HE   LYS  52          2HE       LYS  52   2.482 -18.763  -7.613
  427   2HE   LYS  52          1HE       LYS  52   1.781 -18.033  -9.062
  428   1HZ   LYS  52          1HZ       LYS  52   3.586 -19.421  -9.601
  429   2HZ   LYS  52          2HZ       LYS  52   4.005 -17.878  -9.942
  430   3HZ   LYS  52          3HZ       LYS  52   4.596 -18.614  -8.609
  431    H    GLU  53           H        GLU  53  -0.588 -12.474  -5.460
  432    HA   GLU  53           HA       GLU  53   1.299 -10.524  -4.242
  433   1HB   GLU  53          2HB       GLU  53  -1.029  -9.686  -5.866
  434   2HB   GLU  53          1HB       GLU  53   0.599  -8.932  -5.641
  435   1HG   GLU  53          2HG       GLU  53   0.388  -9.491  -7.964
  436   2HG   GLU  53          1HG       GLU  53   1.470 -10.672  -7.287
  437    H    THR  54           H        THR  54   0.261 -11.826  -2.331
  438    HA   THR  54           HA       THR  54  -1.512 -10.080  -0.833
  439    HB   THR  54           HB       THR  54  -2.647 -12.466  -2.054
  440    HG1  THR  54           1HG      THR  54  -4.318 -10.938  -2.294
  441   1HG2  THR  54          1HG2      THR  54  -4.489 -12.600  -0.487
  442   2HG2  THR  54          2HG2      THR  54  -2.961 -13.119   0.265
  443   3HG2  THR  54          3HG2      THR  54  -3.636 -11.514   0.636
  444    H    SER  55           H        SER  55   1.103 -10.526  -0.280
  445    HA   SER  55           HA       SER  55   1.398 -12.720   1.639
  446   1HB   SER  55          2HB       SER  55   3.112 -11.416   0.063
  447   2HB   SER  55          1HB       SER  55   3.349 -10.550   1.617
  448    HG   SER  55           HG       SER  55   4.673 -12.590   1.386
  449    H    PHE  56           H        PHE  56   1.108  -9.166   1.779
  450    HA   PHE  56           HA       PHE  56   0.976  -8.945   4.672
  451   1HB   PHE  56          2HB       PHE  56   0.553  -6.622   4.272
  452   2HB   PHE  56          1HB       PHE  56   1.850  -7.116   3.227
  453    HD1  PHE  56           1HD      PHE  56   1.511  -7.389   0.803
  454    HD2  PHE  56           2HD      PHE  56  -1.609  -6.080   3.461
  455    HE1  PHE  56           1HE      PHE  56   0.157  -6.628  -1.141
  456    HE2  PHE  56           2HE      PHE  56  -2.901  -5.203   1.520
  457    HZ   PHE  56           HZ       PHE  56  -1.929  -5.376  -0.737
  458    H    ASN  57           H        ASN  57  -1.566  -8.882   2.016
  459    HA   ASN  57           HA       ASN  57  -3.770  -8.403   3.780
  460   1HB   ASN  57          2HB       ASN  57  -3.921  -7.992   1.474
  461   2HB   ASN  57          1HB       ASN  57  -3.473  -9.682   1.083
  462   1HD2  ASN  57          2HD2      ASN  57  -5.256 -10.230  -0.048
  463   2HD2  ASN  57          1HD2      ASN  57  -6.828 -10.353   0.721
  464    H    GLN  58           H        GLN  58  -1.782 -11.203   3.417
  465    HA   GLN  58           HA       GLN  58  -3.806 -13.201   4.148
  466   1HB   GLN  58          2HB       GLN  58  -1.962 -13.746   2.556
  467   2HB   GLN  58          1HB       GLN  58  -0.801 -13.477   3.829
  468   1HG   GLN  58          2HG       GLN  58  -1.349 -15.867   3.580
  469   2HG   GLN  58          1HG       GLN  58  -1.815 -15.300   5.171
  470   1HE2  GLN  58          2HE2      GLN  58  -4.048 -15.138   5.726
  471   2HE2  GLN  58          1HE2      GLN  58  -5.207 -15.949   4.712
  472    H    ALA  59           H        ALA  59  -0.677 -12.130   5.601
  473    HA   ALA  59           HA       ALA  59  -1.615 -12.859   8.327
  474   1HB   ALA  59          1HB       ALA  59   0.697 -12.596   8.908
  475   2HB   ALA  59          2HB       ALA  59   0.498 -13.700   7.525
  476   3HB   ALA  59          3HB       ALA  59   1.073 -12.036   7.260
  477    H    TYR  60           H        TYR  60   0.033 -10.086   6.866
  478    HA   TYR  60           HA       TYR  60  -0.679  -8.076   8.908
  479   1HB   TYR  60          2HB       TYR  60   0.245  -7.750   6.063
  480   2HB   TYR  60          1HB       TYR  60   0.368  -6.580   7.422
  481    HD1  TYR  60           1HD      TYR  60   1.361  -8.633   9.501
  482    HD2  TYR  60           2HD      TYR  60   2.547  -7.767   5.460
  483    HE1  TYR  60           1HE      TYR  60   3.571  -9.615   9.933
  484    HE2  TYR  60           2HE      TYR  60   4.734  -8.795   5.868
  485    HH   TYR  60           HH       TYR  60   6.187  -9.439   7.498
  486    H    GLY  61           H        GLY  61  -3.103  -9.470   8.075
  487   1HA   GLY  61          2HA       GLY  61  -4.821  -8.001   6.394
  488   2HA   GLY  61          1HA       GLY  61  -5.311  -8.885   7.816
  489    H    ARG  62           H        ARG  62  -3.599  -7.228   9.595
  490    HA   ARG  62           HA       ARG  62  -5.432  -4.973   9.968
  491   1HB   ARG  62          2HB       ARG  62  -3.364  -6.351  11.660
  492   2HB   ARG  62          1HB       ARG  62  -3.868  -4.704  12.054
  493   1HG   ARG  62          2HG       ARG  62  -5.789  -5.466  12.953
  494   2HG   ARG  62          1HG       ARG  62  -6.207  -6.318  11.463
  495   1HD   ARG  62          2HD       ARG  62  -4.063  -7.714  12.876
  496   2HD   ARG  62          1HD       ARG  62  -5.464  -7.481  13.923
  497    HE   ARG  62           HE       ARG  62  -5.243  -9.239  11.704
  498   1HH1  ARG  62          2HH2      ARG  62  -7.652  -7.263  13.335
  499   2HH1  ARG  62          1HH2      ARG  62  -8.982  -8.252  12.824
  500   1HH2  ARG  62          1HH1      ARG  62  -7.031 -10.486  11.024
  501   2HH2  ARG  62          2HH1      ARG  62  -8.620 -10.030  11.532
  502    H    ASP  63           H        ASP  63  -2.584  -5.453   8.217
  503    HA   ASP  63           HA       ASP  63  -1.406  -2.836   8.880
  504   1HB   ASP  63          2HB       ASP  63  -0.031  -5.036   8.812
  505   2HB   ASP  63          1HB       ASP  63  -0.159  -4.939   7.086
  506    H    LEU  64           H        LEU  64  -0.367  -2.809   5.953
  507    HA   LEU  64           HA       LEU  64  -1.684  -1.194   4.547
  508   1HB   LEU  64          2HB       LEU  64   0.275  -2.963   3.947
  509   2HB   LEU  64          1HB       LEU  64  -0.980  -3.709   3.013
  510    HG   LEU  64           HG       LEU  64  -0.064  -0.830   2.714
  511   1HD1  LEU  64          1HD1      LEU  64   0.888  -1.750   0.675
  512   2HD1  LEU  64          2HD1      LEU  64   1.551  -2.558   2.115
  513   3HD1  LEU  64          3HD1      LEU  64   0.320  -3.376   1.125
  514   1HD2  LEU  64          1HD2      LEU  64  -1.451  -0.773   0.755
  515   2HD2  LEU  64          2HD2      LEU  64  -2.085  -2.397   1.110
  516   3HD2  LEU  64          3HD2      LEU  64  -2.455  -1.041   2.201
  517    H    MET  65           H        MET  65  -2.824  -4.653   4.287
  518    HA   MET  65           HA       MET  65  -5.132  -4.530   2.889
  519   1HB   MET  65          2HB       MET  65  -4.250  -6.494   4.055
  520   2HB   MET  65          1HB       MET  65  -4.836  -5.844   5.583
  521   1HG   MET  65          2HG       MET  65  -6.420  -7.478   4.514
  522   2HG   MET  65          1HG       MET  65  -7.150  -5.900   4.782
  523   1HE   MET  65          1HE       MET  65  -8.974  -6.593   1.540
  524   2HE   MET  65          2HE       MET  65  -8.725  -7.601   2.986
  525   3HE   MET  65          3HE       MET  65  -9.015  -5.853   3.157
  526    H    GLU  66           H        GLU  66  -5.030  -3.451   6.322
  527    HA   GLU  66           HA       GLU  66  -7.697  -2.267   6.129
  528   1HB   GLU  66          2HB       GLU  66  -5.963  -3.095   8.295
  529   2HB   GLU  66          1HB       GLU  66  -6.669  -1.491   8.544
  530   1HG   GLU  66          2HG       GLU  66  -8.435  -2.856   9.349
  531   2HG   GLU  66          1HG       GLU  66  -8.922  -2.732   7.687
  532    H    ALA  67           H        ALA  67  -4.283  -1.208   6.169
  533    HA   ALA  67           HA       ALA  67  -4.579   1.624   6.569
  534   1HB   ALA  67          1HB       ALA  67  -2.427   1.750   5.509
  535   2HB   ALA  67          2HB       ALA  67  -2.461   0.433   6.705
  536   3HB   ALA  67          3HB       ALA  67  -2.561   0.060   4.969
  537    H    GLN  68           H        GLN  68  -5.159  -0.410   3.761
  538    HA   GLN  68           HA       GLN  68  -5.832   1.913   2.019
  539   1HB   GLN  68          2HB       GLN  68  -5.425   0.577   0.262
  540   2HB   GLN  68          1HB       GLN  68  -4.241  -0.050   1.455
  541   1HG   GLN  68          2HG       GLN  68  -5.939  -1.836   2.007
  542   2HG   GLN  68          1HG       GLN  68  -6.851  -1.287   0.564
  543   1HE2  GLN  68          2HE2      GLN  68  -5.177  -1.022  -1.417
  544   2HE2  GLN  68          1HE2      GLN  68  -4.223  -2.455  -1.653
  545    H    GLU  69           H        GLU  69  -7.341  -1.106   3.419
  546    HA   GLU  69           HA       GLU  69  -9.844  -1.049   2.248
  547   1HB   GLU  69          2HB       GLU  69  -8.951  -2.808   3.777
  548   2HB   GLU  69          1HB       GLU  69  -9.309  -1.765   5.130
  549   1HG   GLU  69          2HG       GLU  69 -11.599  -2.020   4.902
  550   2HG   GLU  69          1HG       GLU  69 -11.527  -2.267   3.166
  551    H    TRP  70           H        TRP  70  -8.544   1.325   4.419
  552    HA   TRP  70           HA       TRP  70 -11.125   2.499   5.130
  553   1HB   TRP  70          2HB       TRP  70  -8.307   3.530   5.506
  554   2HB   TRP  70          1HB       TRP  70  -9.801   4.073   6.338
  555    HD1  TRP  70           HD       TRP  70 -10.490   0.678   6.727
  556    HE1  TRP  70           1HE      TRP  70  -9.226  -0.530   8.545
  557    HE3  TRP  70           3HE      TRP  70  -6.723   3.955   7.289
  558    HZ2  TRP  70           2HZ      TRP  70  -6.884  -0.101  10.077
  559    HZ3  TRP  70           3HZ      TRP  70  -5.183   3.745   9.220
  560    HH2  TRP  70           HH       TRP  70  -5.208   1.658  10.566
  561    H    CYS  71           H        CYS  71 -10.493   2.118   2.242
  562    HA   CYS  71           HA       CYS  71  -9.820   4.626   1.026
  563   1HB   CYS  71          2HB       CYS  71 -10.586   3.664  -0.983
  564   2HB   CYS  71          1HB       CYS  71  -9.602   2.467  -0.071
  565    HG   CYS  71           HG       CYS  71 -11.461   1.333  -1.509
  566    H    ARG  72           H        ARG  72 -12.992   2.955   1.561
  567    HA   ARG  72           HA       ARG  72 -14.714   5.035   0.692
  568   1HB   ARG  72          2HB       ARG  72 -14.942   2.490   1.680
  569   2HB   ARG  72          1HB       ARG  72 -15.628   3.494   2.981
  570   1HG   ARG  72          2HG       ARG  72 -17.039   4.687   1.215
  571   2HG   ARG  72          1HG       ARG  72 -16.447   3.545   0.021
  572   1HD   ARG  72          2HD       ARG  72 -18.052   2.842   2.508
  573   2HD   ARG  72          1HD       ARG  72 -18.630   2.844   0.847
  574    HE   ARG  72           HE       ARG  72 -16.358   1.179   1.033
  575   1HH1  ARG  72          2HH2      ARG  72 -19.716   1.226   2.023
  576   2HH1  ARG  72          1HH2      ARG  72 -19.864  -0.502   2.075
  577   1HH2  ARG  72          1HH1      ARG  72 -16.571  -1.097   1.119
  578   2HH2  ARG  72          2HH1      ARG  72 -18.093  -1.788   1.564
  579    H    LYS  73           H        LYS  73 -12.718   4.907   3.491
  580    HA   LYS  73           HA       LYS  73 -14.194   7.025   4.961
  581   1HB   LYS  73          2HB       LYS  73 -12.418   4.803   5.728
  582   2HB   LYS  73          1HB       LYS  73 -12.021   6.332   6.480
  583   1HG   LYS  73          2HG       LYS  73 -14.906   5.566   6.414
  584   2HG   LYS  73          1HG       LYS  73 -13.818   4.676   7.500
  585   1HD   LYS  73          2HD       LYS  73 -13.041   7.317   7.951
  586   2HD   LYS  73          1HD       LYS  73 -14.764   7.496   7.688
  587   1HE   LYS  73          2HE       LYS  73 -13.791   5.342   9.600
  588   2HE   LYS  73          1HE       LYS  73 -13.884   6.992  10.127
  589   1HZ   LYS  73          1HZ       LYS  73 -15.783   5.722  10.575
  590   2HZ   LYS  73          2HZ       LYS  73 -16.132   7.020   9.657
  591   3HZ   LYS  73          3HZ       LYS  73 -16.112   5.531   8.985
  592    H    TYR  74           H        TYR  74 -10.983   6.256   3.484
  593    HA   TYR  74           HA       TYR  74  -9.872   8.971   3.837
  594   1HB   TYR  74          2HB       TYR  74  -8.736   6.654   3.449
  595   2HB   TYR  74          1HB       TYR  74  -9.061   6.963   1.745
  596    HD1  TYR  74           1HD      TYR  74  -6.929   7.713   4.560
  597    HD2  TYR  74           2HD      TYR  74  -8.263   9.084   0.723
  598    HE1  TYR  74           1HE      TYR  74  -4.885   9.025   4.292
  599    HE2  TYR  74           2HE      TYR  74  -6.225  10.436   0.461
  600    HH   TYR  74           HH       TYR  74  -3.732  10.434   3.005
  601    H    MET  75           H        MET  75 -12.032   7.584   1.420
  602    HA   MET  75           HA       MET  75 -11.695   9.748  -0.532
  603   1HB   MET  75          2HB       MET  75 -13.486   7.310  -0.347
  604   2HB   MET  75          1HB       MET  75 -13.589   8.488  -1.637
  605   1HG   MET  75          2HG       MET  75 -11.522   7.874  -2.545
  606   2HG   MET  75          1HG       MET  75 -10.889   7.287  -1.021
  607   1HE   MET  75          1HE       MET  75 -12.218   4.729  -4.277
  608   2HE   MET  75          2HE       MET  75 -12.611   6.464  -4.292
  609   3HE   MET  75          3HE       MET  75 -10.932   5.934  -4.036
  610    H    LYS  76           H        LYS  76 -14.430   8.681   1.632
  611    HA   LYS  76           HA       LYS  76 -15.874  11.191   1.089
  612   1HB   LYS  76          2HB       LYS  76 -16.517   8.557   1.736
  613   2HB   LYS  76          1HB       LYS  76 -17.004   9.584   3.114
  614   1HG   LYS  76          2HG       LYS  76 -18.108  11.165   1.468
  615   2HG   LYS  76          1HG       LYS  76 -17.717  10.042   0.165
  616   1HD   LYS  76          2HD       LYS  76 -19.092   8.301   1.199
  617   2HD   LYS  76          1HD       LYS  76 -19.415   9.348   2.592
  618   1HE   LYS  76          2HE       LYS  76 -21.163  10.268   1.473
  619   2HE   LYS  76          1HE       LYS  76 -20.064  10.845   0.220
  620   1HZ   LYS  76          1HZ       LYS  76 -21.739   9.443  -0.640
  621   2HZ   LYS  76          2HZ       LYS  76 -20.277   8.745  -0.847
  622   3HZ   LYS  76          3HZ       LYS  76 -21.283   8.202   0.321
  623    H    SER  77           H        SER  77 -14.280   9.675   3.937
  624    HA   SER  77           HA       SER  77 -14.945  11.946   5.672
  625   1HB   SER  77          2HB       SER  77 -14.872   9.473   6.448
  626   2HB   SER  77          1HB       SER  77 -13.148   9.570   6.320
  627    HG   SER  77           HG       SER  77 -14.099   9.991   8.404
  628    H    GLY  78           H        GLY  78 -12.134  10.567   3.779
  629   1HA   GLY  78          2HA       GLY  78 -10.064  11.430   3.257
  630   2HA   GLY  78          1HA       GLY  78 -10.847  12.984   3.203
  631    H    ASN  79           H        ASN  79 -10.623  10.994   6.115
  632    HA   ASN  79           HA       ASN  79  -9.503  13.310   7.461
  633   1HB   ASN  79          2HB       ASN  79 -11.159  11.000   8.264
  634   2HB   ASN  79          1HB       ASN  79  -9.888  11.341   9.409
  635   1HD2  ASN  79          2HD2      ASN  79 -11.198  12.137  11.032
  636   2HD2  ASN  79          1HD2      ASN  79 -12.044  13.646  10.804
  637    H    VAL  80           H        VAL  80  -7.397  13.507   7.714
  638    HA   VAL  80           HA       VAL  80  -5.332  11.714   7.297
  639    HB   VAL  80           HB       VAL  80  -5.256  13.985   9.275
  640   1HG1  VAL  80          1HG1      VAL  80  -2.883  13.912   8.903
  641   2HG1  VAL  80          2HG1      VAL  80  -3.430  12.375   9.612
  642   3HG1  VAL  80          3HG1      VAL  80  -3.048  12.468   7.876
  643   1HG2  VAL  80          1HG2      VAL  80  -4.269  15.179   7.416
  644   2HG2  VAL  80          2HG2      VAL  80  -4.524  13.782   6.343
  645   3HG2  VAL  80          3HG2      VAL  80  -5.921  14.664   7.002
  646    H    LYS  81           H        LYS  81  -7.721  11.502   9.861
  647    HA   LYS  81           HA       LYS  81  -6.328  10.018  11.811
  648   1HB   LYS  81          2HB       LYS  81  -9.101  10.599  11.171
  649   2HB   LYS  81          1HB       LYS  81  -8.847   9.011  11.896
  650   1HG   LYS  81          2HG       LYS  81  -7.810  11.652  13.007
  651   2HG   LYS  81          1HG       LYS  81  -9.182  10.720  13.629
  652   1HD   LYS  81          2HD       LYS  81  -7.322   8.748  13.780
  653   2HD   LYS  81          1HD       LYS  81  -6.216  10.085  13.842
  654   1HE   LYS  81          2HE       LYS  81  -8.505  10.387  15.702
  655   2HE   LYS  81          1HE       LYS  81  -7.487   9.013  16.013
  656   1HZ   LYS  81          1HZ       LYS  81  -6.750  10.836  17.129
  657   2HZ   LYS  81          2HZ       LYS  81  -5.626  10.487  15.999
  658   3HZ   LYS  81          3HZ       LYS  81  -6.625  11.767  15.795
  659    H    ASP  82           H        ASP  82  -7.304   9.130   8.583
  660    HA   ASP  82           HA       ASP  82  -6.935   6.226   9.009
  661   1HB   ASP  82          2HB       ASP  82  -7.472   7.739   6.466
  662   2HB   ASP  82          1HB       ASP  82  -7.601   5.975   6.769
  663    H    LEU  83           H        LEU  83  -5.130   9.084   7.967
  664    HA   LEU  83           HA       LEU  83  -3.054   7.571   6.460
  665   1HB   LEU  83          2HB       LEU  83  -4.212   9.793   5.783
  666   2HB   LEU  83          1HB       LEU  83  -2.962  10.467   6.884
  667    HG   LEU  83           HG       LEU  83  -2.287  10.374   4.389
  668   1HD1  LEU  83          1HD1      LEU  83  -0.075   9.617   4.817
  669   2HD1  LEU  83          2HD1      LEU  83  -0.662  10.618   6.165
  670   3HD1  LEU  83          3HD1      LEU  83  -0.591   8.848   6.336
  671   1HD2  LEU  83          1HD2      LEU  83  -1.530   8.300   3.491
  672   2HD2  LEU  83          2HD2      LEU  83  -2.126   7.413   4.913
  673   3HD2  LEU  83          3HD2      LEU  83  -3.277   8.210   3.814
  674    H    THR  84           H        THR  84  -3.327   9.737   9.378
  675    HA   THR  84           HA       THR  84  -0.766   9.498  10.492
  676    HB   THR  84           HB       THR  84  -2.500  10.962  11.280
  677    HG1  THR  84           1HG      THR  84  -2.047  10.352  13.623
  678   1HG2  THR  84          1HG2      THR  84  -4.142  10.201  12.932
  679   2HG2  THR  84          2HG2      THR  84  -4.467   9.494  11.332
  680   3HG2  THR  84          3HG2      THR  84  -3.705   8.508  12.602
  681    H    GLN  85           H        GLN  85  -3.207   7.016  10.195
  682    HA   GLN  85           HA       GLN  85  -1.705   5.085  11.925
  683   1HB   GLN  85          2HB       GLN  85  -4.489   5.624  11.477
  684   2HB   GLN  85          1HB       GLN  85  -4.088   3.978  10.971
  685   1HG   GLN  85          2HG       GLN  85  -4.585   3.856  13.367
  686   2HG   GLN  85          1HG       GLN  85  -2.865   3.721  13.259
  687   1HE2  GLN  85          2HE2      GLN  85  -4.883   4.698  15.238
  688   2HE2  GLN  85          1HE2      GLN  85  -4.184   6.216  15.752
  689    H    ALA  86           H        ALA  86  -3.084   5.452   8.581
  690    HA   ALA  86           HA       ALA  86  -2.115   3.023   7.531
  691   1HB   ALA  86          1HB       ALA  86  -2.348   4.066   5.379
  692   2HB   ALA  86          2HB       ALA  86  -3.770   4.360   6.408
  693   3HB   ALA  86          3HB       ALA  86  -2.574   5.653   6.151
  694    H    TRP  87           H        TRP  87  -0.480   6.209   8.021
  695    HA   TRP  87           HA       TRP  87   1.967   5.726   6.714
  696   1HB   TRP  87          2HB       TRP  87   1.894   7.842   7.343
  697   2HB   TRP  87          1HB       TRP  87   0.818   7.499   8.740
  698    HD1  TRP  87           HD       TRP  87   1.827   7.964  10.975
  699    HE1  TRP  87           1HE      TRP  87   4.148   8.060  11.992
  700    HE3  TRP  87           3HE      TRP  87   4.476   6.882   6.826
  701    HZ2  TRP  87           2HZ      TRP  87   6.811   7.725  11.109
  702    HZ3  TRP  87           3HZ      TRP  87   6.917   6.501   7.000
  703    HH2  TRP  87           HH       TRP  87   8.093   6.937   9.140
  704    H    ASP  88           H        ASP  88   0.779   4.771   9.972
  705    HA   ASP  88           HA       ASP  88   3.306   3.749  10.917
  706   1HB   ASP  88          2HB       ASP  88   0.907   4.433  12.124
  707   2HB   ASP  88          1HB       ASP  88   0.889   2.682  12.185
  708    H    LEU  89           H        LEU  89   0.326   2.349   9.349
  709    HA   LEU  89           HA       LEU  89   1.248  -0.413   9.417
  710   1HB   LEU  89          2HB       LEU  89  -0.932   0.910   7.829
  711   2HB   LEU  89          1HB       LEU  89  -0.586  -0.799   7.859
  712    HG   LEU  89           HG       LEU  89  -1.344   0.859  10.306
  713   1HD1  LEU  89          1HD1      LEU  89  -3.426  -0.330  10.163
  714   2HD1  LEU  89          2HD1      LEU  89  -3.141   0.651   8.704
  715   3HD1  LEU  89          3HD1      LEU  89  -2.903  -1.112   8.651
  716   1HD2  LEU  89          1HD2      LEU  89  -1.539  -1.258  11.447
  717   2HD2  LEU  89          2HD2      LEU  89  -0.933  -2.124  10.014
  718   3HD2  LEU  89          3HD2      LEU  89   0.136  -1.012  10.901
  719    H    TYR  90           H        TYR  90   1.380   2.187   7.029
  720    HA   TYR  90           HA       TYR  90   2.648   0.759   4.839
  721   1HB   TYR  90          2HB       TYR  90   2.563   3.728   5.557
  722   2HB   TYR  90          1HB       TYR  90   3.170   3.102   4.063
  723    HD1  TYR  90           1HD      TYR  90   0.934   0.806   3.870
  724    HD2  TYR  90           2HD      TYR  90   0.955   5.050   4.574
  725    HE1  TYR  90           1HE      TYR  90  -1.262   1.001   2.791
  726    HE2  TYR  90           2HE      TYR  90  -1.245   5.241   3.474
  727    HH   TYR  90           HH       TYR  90  -3.087   4.039   2.780
  728    H    TYR  91           H        TYR  91   4.000   2.807   7.400
  729    HA   TYR  91           HA       TYR  91   6.846   2.361   6.729
  730   1HB   TYR  91          2HB       TYR  91   5.685   4.342   7.950
  731   2HB   TYR  91          1HB       TYR  91   5.683   3.296   9.360
  732    HD1  TYR  91           1HD      TYR  91   7.466   3.359  10.771
  733    HD2  TYR  91           2HD      TYR  91   7.992   4.454   6.652
  734    HE1  TYR  91           1HE      TYR  91   9.816   3.989  11.237
  735    HE2  TYR  91           2HE      TYR  91  10.323   5.114   7.106
  736    HH   TYR  91           HH       TYR  91  11.837   5.494   8.671
  737    H    HIS  92           H        HIS  92   4.630   0.890   9.165
  738    HA   HIS  92           HA       HIS  92   6.598  -0.733  10.429
  739   1HB   HIS  92          2HB       HIS  92   4.351  -0.124  11.322
  740   2HB   HIS  92          1HB       HIS  92   3.623  -1.219  10.106
  741    HD1  HIS  92           1HD      HIS  92   5.416  -1.294  13.404
  742    HD2  HIS  92           2HD      HIS  92   3.877  -3.835  10.520
  743    HE1  HIS  92           1HE      HIS  92   5.451  -3.643  14.436
  744    H    VAL  93           H        VAL  93   4.335  -1.251   7.684
  745    HA   VAL  93           HA       VAL  93   5.175  -3.990   7.144
  746    HB   VAL  93           HB       VAL  93   2.910  -2.944   6.815
  747   1HG1  VAL  93          1HG1      VAL  93   2.388  -2.381   4.501
  748   2HG1  VAL  93          2HG1      VAL  93   3.438  -1.150   5.240
  749   3HG1  VAL  93          3HG1      VAL  93   4.122  -2.339   4.105
  750   1HG2  VAL  93          1HG2      VAL  93   2.429  -4.670   5.219
  751   2HG2  VAL  93          2HG2      VAL  93   4.176  -4.940   5.009
  752   3HG2  VAL  93          3HG2      VAL  93   3.420  -5.198   6.600
  753    H    PHE  94           H        PHE  94   6.221  -0.734   6.135
  754    HA   PHE  94           HA       PHE  94   7.543  -1.140   3.752
  755   1HB   PHE  94          2HB       PHE  94   7.188   0.952   5.085
  756   2HB   PHE  94          1HB       PHE  94   8.521   0.417   6.156
  757    HD1  PHE  94           1HD      PHE  94  10.818   0.418   5.391
  758    HD2  PHE  94           2HD      PHE  94   7.600   1.675   2.839
  759    HE1  PHE  94           1HE      PHE  94  12.459   1.448   3.837
  760    HE2  PHE  94           2HE      PHE  94   9.231   2.686   1.279
  761    HZ   PHE  94           HZ       PHE  94  11.672   2.511   1.752
  762    H    ARG  95           H        ARG  95   8.573  -2.187   6.985
  763    HA   ARG  95           HA       ARG  95  10.998  -3.419   5.905
  764   1HB   ARG  95          2HB       ARG  95  10.185  -2.189   8.292
  765   2HB   ARG  95          1HB       ARG  95  10.430  -3.917   8.686
  766   1HG   ARG  95          2HG       ARG  95  12.678  -3.876   7.752
  767   2HG   ARG  95          1HG       ARG  95  12.435  -2.248   7.097
  768   1HD   ARG  95          2HD       ARG  95  12.350  -1.291   9.313
  769   2HD   ARG  95          1HD       ARG  95  12.327  -2.903  10.065
  770    HE   ARG  95           HE       ARG  95  14.571  -3.035   9.816
  771   1HH1  ARG  95          2HH2      ARG  95  13.590  -0.480   7.590
  772   2HH1  ARG  95          1HH2      ARG  95  15.222  -0.070   7.175
  773   1HH2  ARG  95          1HH1      ARG  95  16.665  -2.454   9.242
  774   2HH2  ARG  95          2HH1      ARG  95  16.931  -1.177   8.104
  775    H    ARG  96           H        ARG  96   7.775  -4.378   6.877
  776    HA   ARG  96           HA       ARG  96   8.244  -7.207   7.402
  777   1HB   ARG  96          2HB       ARG  96   5.757  -5.585   6.820
  778   2HB   ARG  96          1HB       ARG  96   5.812  -7.295   7.366
  779   1HG   ARG  96          2HG       ARG  96   6.821  -4.943   9.008
  780   2HG   ARG  96          1HG       ARG  96   5.227  -5.664   9.182
  781   1HD   ARG  96          2HD       ARG  96   6.875  -7.845   9.236
  782   2HD   ARG  96          1HD       ARG  96   7.816  -6.565  10.097
  783    HE   ARG  96           HE       ARG  96   5.045  -6.528  10.846
  784   1HH1  ARG  96          2HH2      ARG  96   8.025  -8.171  11.619
  785   2HH1  ARG  96          1HH2      ARG  96   7.494  -8.683  13.195
  786   1HH2  ARG  96          1HH1      ARG  96   4.371  -7.165  12.889
  787   2HH2  ARG  96          2HH1      ARG  96   5.396  -8.142  13.886
  788    H    ILE  97           H        ILE  97   6.417  -5.444   4.830
  789    HA   ILE  97           HA       ILE  97   6.208  -7.710   3.002
  790    HB   ILE  97           HB       ILE  97   5.709  -5.980   1.304
  791   1HG1  ILE  97          2HG1      ILE  97   5.079  -4.106   3.462
  792   2HG1  ILE  97          1HG1      ILE  97   6.693  -4.132   2.684
  793   1HG2  ILE  97          1HG2      ILE  97   3.377  -5.902   2.164
  794   2HG2  ILE  97          2HG2      ILE  97   4.096  -7.512   2.404
  795   3HG2  ILE  97          3HG2      ILE  97   3.959  -6.387   3.775
  796   1HD1  ILE  97          1HD1      ILE  97   5.214  -2.489   1.626
  797   2HD1  ILE  97          2HD1      ILE  97   5.635  -3.797   0.494
  798   3HD1  ILE  97          3HD1      ILE  97   4.033  -3.770   1.268
  799    H    SER  98           H        SER  98   8.706  -5.368   3.737
  800    HA   SER  98           HA       SER  98  10.078  -4.937   1.376
  801   1HB   SER  98          2HB       SER  98  10.459  -4.413   4.090
  802   2HB   SER  98          1HB       SER  98  11.773  -5.527   3.740
  803    HG   SER  98           HG       SER  98  12.044  -3.132   3.402
  804    H    LYS  99           H        LYS  99  11.119  -7.406   3.808
  805    HA   LYS  99           HA       LYS  99  11.169  -9.620   1.879
  806   1HB   LYS  99          2HB       LYS  99  13.637  -9.929   1.984
  807   2HB   LYS  99          1HB       LYS  99  13.150  -8.569   1.030
  808   1HG   LYS  99          2HG       LYS  99  13.984  -7.036   2.501
  809   2HG   LYS  99          1HG       LYS  99  13.814  -8.109   3.907
  810   1HD   LYS  99          2HD       LYS  99  15.539  -9.359   1.953
  811   2HD   LYS  99          1HD       LYS  99  16.119  -7.710   2.289
  812   1HE   LYS  99          2HE       LYS  99  16.676  -8.218   4.463
  813   2HE   LYS  99          1HE       LYS  99  15.257  -9.254   4.689
  814   1HZ   LYS  99          1HZ       LYS  99  17.314 -10.456   4.699
  815   2HZ   LYS  99          2HZ       LYS  99  16.331 -10.939   3.491
  816   3HZ   LYS  99          3HZ       LYS  99  17.628 -10.000   3.155
  817    H    GLN 100           H        GLN 100   9.707  -9.467   4.236
  818    HA   GLN 100           HA       GLN 100  10.808 -10.293   6.648
  819   1HB   GLN 100          2HB       GLN 100   8.457  -9.766   6.211
  820   2HB   GLN 100          1HB       GLN 100   8.295 -11.328   5.350
  821   1HG   GLN 100          2HG       GLN 100   7.428 -11.679   7.505
  822   2HG   GLN 100          1HG       GLN 100   9.058 -12.429   7.498
  823   1HE2  GLN 100          2HE2      GLN 100   8.050 -12.149   9.872
  824   2HE2  GLN 100          1HE2      GLN 100   8.700 -10.759  10.698
  Start of MODEL   10
    1   1H    GLU   1          1H        GLU   1   8.380 -11.524  -7.884
    2   2H    GLU   1          2H        GLU   1   8.390 -11.624  -6.205
    3    HA   GLU   1           HA       GLU   1  10.376 -13.105  -6.425
    4   1HB   GLU   1          2HB       GLU   1   7.527 -13.631  -6.595
    5   2HB   GLU   1          1HB       GLU   1   8.435 -14.904  -7.396
    6   1HG   GLU   1          2HG       GLU   1   9.291 -15.683  -5.427
    7   2HG   GLU   1          1HG       GLU   1   9.617 -14.073  -4.805
    8    H    LEU   2           H        LEU   2   9.465 -11.766  -9.354
    9    HA   LEU   2           HA       LEU   2   9.675 -12.334 -11.656
   10   1HB   LEU   2          2HB       LEU   2  11.912 -12.271 -12.231
   11   2HB   LEU   2          1HB       LEU   2  11.528 -11.081 -10.948
   12    HG   LEU   2           HG       LEU   2  12.529 -13.611  -9.839
   13   1HD1  LEU   2          1HD1      LEU   2  14.809 -13.410 -10.622
   14   2HD1  LEU   2          2HD1      LEU   2  13.690 -13.786 -11.954
   15   3HD1  LEU   2          3HD1      LEU   2  14.321 -12.134 -11.761
   16   1HD2  LEU   2          1HD2      LEU   2  14.032 -12.090  -8.662
   17   2HD2  LEU   2          2HD2      LEU   2  13.528 -10.747  -9.714
   18   3HD2  LEU   2          3HD2      LEU   2  12.359 -11.487  -8.594
   19    H    ILE   3           H        ILE   3   8.336 -14.151 -11.767
   20    HA   ILE   3           HA       ILE   3   9.727 -16.820 -11.897
   21    HB   ILE   3           HB       ILE   3   7.433 -17.712 -11.815
   22   1HG1  ILE   3          2HG1      ILE   3   6.448 -15.378 -10.315
   23   2HG1  ILE   3          1HG1      ILE   3   6.445 -15.242 -12.064
   24   1HG2  ILE   3          1HG2      ILE   3   7.534 -17.619  -9.324
   25   2HG2  ILE   3          2HG2      ILE   3   9.153 -17.858 -10.026
   26   3HG2  ILE   3          3HG2      ILE   3   8.670 -16.253  -9.428
   27   1HD1  ILE   3          1HD1      ILE   3   4.354 -16.174 -11.252
   28   2HD1  ILE   3          2HD1      ILE   3   5.223 -17.373 -12.240
   29   3HD1  ILE   3          3HD1      ILE   3   5.226 -17.511 -10.465
   30    H    ARG   4           H        ARG   4   7.802 -14.540 -13.704
   31    HA   ARG   4           HA       ARG   4   8.391 -15.663 -16.303
   32   1HB   ARG   4          2HB       ARG   4   6.059 -16.295 -16.901
   33   2HB   ARG   4          1HB       ARG   4   6.710 -17.346 -15.683
   34   1HG   ARG   4          2HG       ARG   4   5.493 -15.960 -13.938
   35   2HG   ARG   4          1HG       ARG   4   4.725 -15.100 -15.260
   36   1HD   ARG   4          2HD       ARG   4   4.041 -17.366 -16.160
   37   2HD   ARG   4          1HD       ARG   4   4.552 -18.011 -14.567
   38    HE   ARG   4           HE       ARG   4   3.017 -16.000 -13.761
   39   1HH1  ARG   4          2HH2      ARG   4   2.340 -18.197 -16.391
   40   2HH1  ARG   4          1HH2      ARG   4   0.619 -18.084 -16.243
   41   1HH2  ARG   4          1HH1      ARG   4   0.713 -15.826 -13.592
   42   2HH2  ARG   4          2HH1      ARG   4  -0.264 -16.786 -14.651
   43    H    VAL   5           H        VAL   5   6.006 -13.682 -14.460
   44    HA   VAL   5           HA       VAL   5   5.634 -11.693 -16.481
   45    HB   VAL   5           HB       VAL   5   4.590 -10.382 -14.683
   46   1HG1  VAL   5          1HG1      VAL   5   2.648 -11.897 -14.591
   47   2HG1  VAL   5          2HG1      VAL   5   3.359 -11.881 -16.223
   48   3HG1  VAL   5          3HG1      VAL   5   3.667 -13.252 -15.129
   49   1HG2  VAL   5          1HG2      VAL   5   3.967 -11.438 -12.628
   50   2HG2  VAL   5          2HG2      VAL   5   5.060 -12.799 -12.971
   51   3HG2  VAL   5          3HG2      VAL   5   5.722 -11.166 -12.726
   52    H    ALA   6           H        ALA   6   7.759 -11.913 -13.632
   53    HA   ALA   6           HA       ALA   6   9.569 -10.727 -12.860
   54   1HB   ALA   6          1HB       ALA   6  11.039  -9.663 -14.394
   55   2HB   ALA   6          2HB       ALA   6  10.583 -11.297 -14.932
   56   3HB   ALA   6          3HB       ALA   6   9.855  -9.869 -15.707
   57    H    ILE   7           H        ILE   7   6.708  -9.444 -13.553
   58    HA   ILE   7           HA       ILE   7   7.357  -6.689 -12.834
   59    HB   ILE   7           HB       ILE   7   5.876  -7.336 -14.712
   60   1HG1  ILE   7          2HG1      ILE   7   6.284  -5.188 -14.148
   61   2HG1  ILE   7          1HG1      ILE   7   4.527  -5.411 -14.478
   62   1HG2  ILE   7          1HG2      ILE   7   3.475  -7.491 -14.291
   63   2HG2  ILE   7          2HG2      ILE   7   4.327  -8.933 -13.687
   64   3HG2  ILE   7          3HG2      ILE   7   3.779  -7.681 -12.548
   65   1HD1  ILE   7          1HD1      ILE   7   4.909  -3.784 -12.708
   66   2HD1  ILE   7          2HD1      ILE   7   4.066  -5.223 -12.087
   67   3HD1  ILE   7          3HD1      ILE   7   5.801  -5.000 -11.761
   68    H    LEU   8           H        LEU   8   5.098  -9.281 -11.644
   69    HA   LEU   8           HA       LEU   8   4.243  -9.781  -9.564
   70   1HB   LEU   8          2HB       LEU   8   7.021  -9.184  -9.135
   71   2HB   LEU   8          1HB       LEU   8   5.987  -8.800  -7.717
   72    HG   LEU   8           HG       LEU   8   6.879 -11.116  -7.531
   73   1HD1  LEU   8          1HD1      LEU   8   4.833 -12.216  -7.123
   74   2HD1  LEU   8          2HD1      LEU   8   4.818 -10.542  -6.519
   75   3HD1  LEU   8          3HD1      LEU   8   3.944 -10.957  -8.013
   76   1HD2  LEU   8          1HD2      LEU   8   6.256 -12.847  -9.052
   77   2HD2  LEU   8          2HD2      LEU   8   5.444 -11.679 -10.121
   78   3HD2  LEU   8          3HD2      LEU   8   7.208 -11.612  -9.908
   79    H    TRP   9           H        TRP   9   3.689  -8.675  -7.327
   80    HA   TRP   9           HA       TRP   9   2.746  -5.931  -7.969
   81   1HB   TRP   9          2HB       TRP   9   1.415  -7.981  -6.234
   82   2HB   TRP   9          1HB       TRP   9   1.075  -6.291  -6.070
   83    HD1  TRP   9           HD       TRP   9   1.464  -6.111  -9.551
   84    HE1  TRP   9           1HE      TRP   9  -0.820  -6.251 -10.632
   85    HE3  TRP   9           3HE      TRP   9  -0.925  -8.528  -5.838
   86    HZ2  TRP   9           2HZ      TRP   9  -3.375  -7.226  -9.932
   87    HZ3  TRP   9           3HZ      TRP   9  -3.349  -8.986  -6.032
   88    HH2  TRP   9           HH       TRP   9  -4.548  -8.401  -8.118
   89    H    HIS  10           H        HIS  10   4.115  -7.891  -5.286
   90    HA   HIS  10           HA       HIS  10   4.731  -6.011  -3.347
   91   1HB   HIS  10          2HB       HIS  10   5.259  -8.016  -2.660
   92   2HB   HIS  10          1HB       HIS  10   5.609  -8.607  -4.326
   93    HD1  HIS  10           1HD      HIS  10   7.401  -7.873  -1.165
   94    HD2  HIS  10           2HD      HIS  10   8.099  -8.119  -5.231
   95    HE1  HIS  10           1HE      HIS  10   9.935  -7.769  -1.449
   96    H    GLU  11           H        GLU  11   6.214  -6.369  -6.522
   97    HA   GLU  11           HA       GLU  11   8.664  -4.918  -6.069
   98   1HB   GLU  11          2HB       GLU  11   7.144  -5.574  -8.645
   99   2HB   GLU  11          1HB       GLU  11   8.770  -4.961  -8.565
  100   1HG   GLU  11          2HG       GLU  11   7.979  -7.610  -7.271
  101   2HG   GLU  11          1HG       GLU  11   8.582  -7.475  -8.886
  102    H    MET  12           H        MET  12   5.470  -4.091  -7.556
  103    HA   MET  12           HA       MET  12   6.069  -1.288  -7.939
  104   1HB   MET  12          2HB       MET  12   4.073  -1.121  -8.858
  105   2HB   MET  12          1HB       MET  12   4.367  -2.879  -9.092
  106   1HG   MET  12          2HG       MET  12   3.052  -2.842  -6.713
  107   2HG   MET  12          1HG       MET  12   2.291  -1.467  -7.583
  108   1HE   MET  12          1HE       MET  12   1.241  -3.611 -10.904
  109   2HE   MET  12          2HE       MET  12   1.503  -1.954 -10.308
  110   3HE   MET  12          3HE       MET  12   2.893  -3.023 -10.600
  111    H    TRP  13           H        TRP  13   5.051  -3.292  -5.192
  112    HA   TRP  13           HA       TRP  13   3.792  -1.210  -3.612
  113   1HB   TRP  13          2HB       TRP  13   4.668  -3.994  -3.174
  114   2HB   TRP  13          1HB       TRP  13   4.327  -2.896  -1.798
  115    HD1  TRP  13           HD       TRP  13   2.079  -2.594  -4.901
  116    HE1  TRP  13           1HE      TRP  13  -0.274  -3.204  -4.184
  117    HE3  TRP  13           3HE      TRP  13   3.130  -4.172  -0.277
  118    HZ2  TRP  13           2HZ      TRP  13  -1.509  -4.289  -1.896
  119    HZ3  TRP  13           3HZ      TRP  13   1.382  -5.198   1.136
  120    HH2  TRP  13           HH       TRP  13  -0.940  -5.265   0.327
  121    H    HIS  14           H        HIS  14   7.154  -2.521  -3.930
  122    HA   HIS  14           HA       HIS  14   8.409  -1.196  -1.785
  123   1HB   HIS  14          2HB       HIS  14   9.239  -2.414  -4.347
  124   2HB   HIS  14          1HB       HIS  14  10.265  -1.110  -3.832
  125    HD1  HIS  14           1HD      HIS  14  10.862  -4.251  -3.822
  126    HD2  HIS  14           2HD      HIS  14  10.053  -1.707  -0.618
  127    HE1  HIS  14           1HE      HIS  14  12.182  -5.156  -1.801
  128    H    GLU  15           H        GLU  15   8.335  -0.013  -5.157
  129    HA   GLU  15           HA       GLU  15   8.978   2.689  -4.409
  130   1HB   GLU  15          2HB       GLU  15   8.313   1.331  -7.037
  131   2HB   GLU  15          1HB       GLU  15   8.532   3.057  -6.935
  132   1HG   GLU  15          2HG       GLU  15  10.678   1.418  -5.665
  133   2HG   GLU  15          1HG       GLU  15  10.545   1.344  -7.417
  134    H    GLY  16           H        GLY  16   5.823   1.124  -5.555
  135   1HA   GLY  16          2HA       GLY  16   4.217   3.444  -5.665
  136   2HA   GLY  16          1HA       GLY  16   3.664   1.842  -5.325
  137    H    LEU  17           H        LEU  17   5.447   1.722  -2.830
  138    HA   LEU  17           HA       LEU  17   3.841   3.436  -1.026
  139   1HB   LEU  17          2HB       LEU  17   5.570   1.055  -0.634
  140   2HB   LEU  17          1HB       LEU  17   5.056   2.139   0.697
  141    HG   LEU  17           HG       LEU  17   2.918   1.338  -1.223
  142   1HD1  LEU  17          1HD1      LEU  17   2.593  -0.859  -0.135
  143   2HD1  LEU  17          2HD1      LEU  17   4.167  -0.792  -0.964
  144   3HD1  LEU  17          3HD1      LEU  17   4.084  -0.616   0.805
  145   1HD2  LEU  17          1HD2      LEU  17   1.637   1.164   0.885
  146   2HD2  LEU  17          2HD2      LEU  17   3.137   1.397   1.816
  147   3HD2  LEU  17          3HD2      LEU  17   2.509   2.712   0.793
  148    H    GLU  18           H        GLU  18   7.124   3.269  -2.450
  149    HA   GLU  18           HA       GLU  18   8.318   5.033  -0.427
  150   1HB   GLU  18          2HB       GLU  18   9.588   3.331  -1.715
  151   2HB   GLU  18          1HB       GLU  18   9.363   4.342  -3.149
  152   1HG   GLU  18          2HG       GLU  18  10.464   6.235  -2.025
  153   2HG   GLU  18          1HG       GLU  18  10.618   5.293  -0.537
  154    H    GLU  19           H        GLU  19   7.136   5.421  -3.841
  155    HA   GLU  19           HA       GLU  19   7.424   8.282  -4.029
  156   1HB   GLU  19          2HB       GLU  19   7.334   6.773  -5.901
  157   2HB   GLU  19          1HB       GLU  19   5.633   6.380  -5.487
  158   1HG   GLU  19          2HG       GLU  19   5.912   8.107  -7.377
  159   2HG   GLU  19          1HG       GLU  19   4.920   8.654  -6.063
  160    H    ALA  20           H        ALA  20   5.186   6.331  -2.252
  161    HA   ALA  20           HA       ALA  20   3.111   8.458  -2.082
  162   1HB   ALA  20          1HB       ALA  20   1.848   6.640  -1.014
  163   2HB   ALA  20          2HB       ALA  20   2.463   6.116  -2.600
  164   3HB   ALA  20          3HB       ALA  20   3.273   5.577  -1.109
  165    H    SER  21           H        SER  21   4.902   6.226   0.113
  166    HA   SER  21           HA       SER  21   4.336   7.531   2.538
  167   1HB   SER  21          2HB       SER  21   6.686   5.791   1.825
  168   2HB   SER  21          1HB       SER  21   6.224   6.318   3.454
  169    HG   SER  21           HG       SER  21   5.413   4.146   2.620
  170    H    ARG  22           H        ARG  22   6.765   8.296  -0.043
  171    HA   ARG  22           HA       ARG  22   8.273  10.263   1.463
  172   1HB   ARG  22          2HB       ARG  22   8.934   9.087  -0.677
  173   2HB   ARG  22          1HB       ARG  22   7.882  10.253  -1.493
  174   1HG   ARG  22          2HG       ARG  22   9.162  12.136  -0.587
  175   2HG   ARG  22          1HG       ARG  22  10.090  11.078   0.460
  176   1HD   ARG  22          2HD       ARG  22  11.586  11.343  -1.296
  177   2HD   ARG  22          1HD       ARG  22  10.760   9.911  -1.861
  178    HE   ARG  22           HE       ARG  22   9.553  12.382  -2.739
  179   1HH1  ARG  22          2HH2      ARG  22  11.937   9.912  -3.441
  180   2HH1  ARG  22          1HH2      ARG  22  12.106  10.348  -5.111
  181   1HH2  ARG  22          1HH1      ARG  22   9.806  12.948  -4.967
  182   2HH2  ARG  22          2HH1      ARG  22  10.905  12.041  -5.947
  183    H    LEU  23           H        LEU  23   5.218  10.465  -0.409
  184    HA   LEU  23           HA       LEU  23   5.006  13.392  -0.459
  185   1HB   LEU  23          2HB       LEU  23   3.434  11.078  -1.391
  186   2HB   LEU  23          1HB       LEU  23   2.559  12.531  -0.944
  187    HG   LEU  23           HG       LEU  23   5.007  12.890  -2.615
  188   1HD1  LEU  23          1HD1      LEU  23   3.730  12.397  -4.661
  189   2HD1  LEU  23          2HD1      LEU  23   3.913  10.940  -3.655
  190   3HD1  LEU  23          3HD1      LEU  23   2.365  11.818  -3.676
  191   1HD2  LEU  23          1HD2      LEU  23   3.553  14.624  -3.618
  192   2HD2  LEU  23          2HD2      LEU  23   2.195  14.073  -2.607
  193   3HD2  LEU  23          3HD2      LEU  23   3.629  14.803  -1.849
  194    H    TYR  24           H        TYR  24   4.692  11.025   1.913
  195    HA   TYR  24           HA       TYR  24   3.094  12.843   3.749
  196   1HB   TYR  24          2HB       TYR  24   2.039  10.750   3.469
  197   2HB   TYR  24          1HB       TYR  24   3.600   9.871   3.548
  198    HD1  TYR  24           1HD      TYR  24   4.781   9.625   5.654
  199    HD2  TYR  24           2HD      TYR  24   0.860  11.351   5.500
  200    HE1  TYR  24           1HE      TYR  24   4.617   9.455   8.104
  201    HE2  TYR  24           2HE      TYR  24   0.638  11.109   7.938
  202    HH   TYR  24           HH       TYR  24   1.521  10.165   9.774
  203    H    PHE  25           H        PHE  25   6.028  10.735   3.597
  204    HA   PHE  25           HA       PHE  25   7.041  10.897   6.136
  205   1HB   PHE  25          2HB       PHE  25   7.854   9.440   4.413
  206   2HB   PHE  25          1HB       PHE  25   8.410  10.843   3.443
  207    HD1  PHE  25           1HD      PHE  25   8.872   9.318   6.840
  208    HD2  PHE  25           2HD      PHE  25  10.601  11.518   3.579
  209    HE1  PHE  25           1HE      PHE  25  11.075   9.266   7.977
  210    HE2  PHE  25           2HE      PHE  25  12.810  11.457   4.707
  211    HZ   PHE  25           HZ       PHE  25  13.039  10.353   6.917
  212    H    GLY  26           H        GLY  26   7.655  13.195   3.464
  213   1HA   GLY  26          2HA       GLY  26   8.288  15.359   5.369
  214   2HA   GLY  26          1HA       GLY  26   9.582  14.865   4.288
  215    H    GLU  27           H        GLU  27   6.050  15.087   3.760
  216    HA   GLU  27           HA       GLU  27   6.524  17.238   1.797
  217   1HB   GLU  27          2HB       GLU  27   5.729  14.587   1.023
  218   2HB   GLU  27          1HB       GLU  27   4.521  15.833   0.567
  219   1HG   GLU  27          2HG       GLU  27   5.891  15.919  -1.332
  220   2HG   GLU  27          1HG       GLU  27   6.756  17.065  -0.361
  221    H    ARG  28           H        ARG  28   4.126  15.372   3.754
  222    HA   ARG  28           HA       ARG  28   2.085  15.967   4.690
  223   1HB   ARG  28          2HB       ARG  28   3.480  18.547   4.575
  224   2HB   ARG  28          1HB       ARG  28   1.721  18.598   4.680
  225   1HG   ARG  28          2HG       ARG  28   1.665  17.578   6.731
  226   2HG   ARG  28          1HG       ARG  28   3.176  16.674   6.448
  227   1HD   ARG  28          2HD       ARG  28   4.219  18.325   7.714
  228   2HD   ARG  28          1HD       ARG  28   3.990  19.386   6.354
  229    HE   ARG  28           HE       ARG  28   1.645  19.656   7.600
  230   1HH1  ARG  28          2HH2      ARG  28   4.956  19.743   8.739
  231   2HH1  ARG  28          1HH2      ARG  28   4.638  20.844  10.039
  232   1HH2  ARG  28          1HH1      ARG  28   1.239  21.118   9.352
  233   2HH2  ARG  28          2HH1      ARG  28   2.555  21.599  10.367
  234    H    ASN  29           H        ASN  29   2.438  15.449   1.749
  235    HA   ASN  29           HA       ASN  29  -0.118  16.681   0.901
  236   1HB   ASN  29          2HB       ASN  29   1.991  17.543  -0.212
  237   2HB   ASN  29          1HB       ASN  29   2.118  15.929  -0.962
  238   1HD2  ASN  29          2HD2      ASN  29  -0.009  18.723  -0.509
  239   2HD2  ASN  29          1HD2      ASN  29  -0.924  18.491  -1.978
  240    H    VAL  30           H        VAL  30  -0.627  14.678   2.277
  241    HA   VAL  30           HA       VAL  30  -0.424  12.019   1.377
  242    HB   VAL  30           HB       VAL  30  -2.254  11.497   2.691
  243   1HG1  VAL  30          1HG1      VAL  30  -1.331  12.401   4.824
  244   2HG1  VAL  30          2HG1      VAL  30  -0.030  11.918   3.711
  245   3HG1  VAL  30          3HG1      VAL  30  -0.442  13.639   3.906
  246   1HG2  VAL  30          1HG2      VAL  30  -3.515  13.103   3.989
  247   2HG2  VAL  30          2HG2      VAL  30  -2.766  14.438   3.083
  248   3HG2  VAL  30          3HG2      VAL  30  -3.817  13.272   2.243
  249    H    LYS  31           H        LYS  31  -2.284  14.658   0.066
  250    HA   LYS  31           HA       LYS  31  -4.253  13.299  -1.486
  251   1HB   LYS  31          2HB       LYS  31  -4.854  15.322  -1.769
  252   2HB   LYS  31          1HB       LYS  31  -3.436  15.830  -0.769
  253   1HG   LYS  31          2HG       LYS  31  -3.521  17.252  -2.662
  254   2HG   LYS  31          1HG       LYS  31  -2.184  16.130  -2.934
  255   1HD   LYS  31          2HD       LYS  31  -3.382  14.917  -4.590
  256   2HD   LYS  31          1HD       LYS  31  -4.944  15.482  -4.026
  257   1HE   LYS  31          2HE       LYS  31  -3.459  17.770  -4.697
  258   2HE   LYS  31          1HE       LYS  31  -3.235  16.550  -6.010
  259   1HZ   LYS  31          1HZ       LYS  31  -5.289  17.877  -6.264
  260   2HZ   LYS  31          2HZ       LYS  31  -5.585  16.281  -6.083
  261   3HZ   LYS  31          3HZ       LYS  31  -5.823  17.295  -4.828
  262    H    GLY  32           H        GLY  32  -0.746  14.072  -2.060
  263   1HA   GLY  32          2HA       GLY  32  -0.679  13.177  -4.806
  264   2HA   GLY  32          1HA       GLY  32   0.680  13.530  -3.753
  265    H    MET  33           H        MET  33   0.661  11.792  -1.733
  266    HA   MET  33           HA       MET  33   1.410   9.246  -2.623
  267   1HB   MET  33          2HB       MET  33   1.515   8.599  -0.507
  268   2HB   MET  33          1HB       MET  33   1.714  10.389  -0.394
  269   1HG   MET  33          2HG       MET  33  -0.478  10.620   0.491
  270   2HG   MET  33          1HG       MET  33  -0.804   8.872   0.253
  271   1HE   MET  33          1HE       MET  33   1.242   7.151   2.999
  272   2HE   MET  33          2HE       MET  33  -0.083   7.021   1.818
  273   3HE   MET  33          3HE       MET  33   1.580   7.317   1.259
  274    H    PHE  34           H        PHE  34  -1.827  10.394  -1.874
  275    HA   PHE  34           HA       PHE  34  -3.194   7.877  -1.793
  276   1HB   PHE  34          2HB       PHE  34  -3.879  10.150  -0.782
  277   2HB   PHE  34          1HB       PHE  34  -4.296  10.659  -2.404
  278    HD1  PHE  34           1HD      PHE  34  -6.097   9.612  -3.640
  279    HD2  PHE  34           2HD      PHE  34  -5.185   8.504   0.408
  280    HE1  PHE  34           1HE      PHE  34  -8.334   8.570  -3.431
  281    HE2  PHE  34           2HE      PHE  34  -7.450   7.497   0.634
  282    HZ   PHE  34           HZ       PHE  34  -8.990   7.469  -1.301
  283    H    GLU  35           H        GLU  35  -2.055   9.955  -4.429
  284    HA   GLU  35           HA       GLU  35  -3.819   8.782  -6.471
  285   1HB   GLU  35          2HB       GLU  35  -2.930  11.193  -6.388
  286   2HB   GLU  35          1HB       GLU  35  -1.387  10.503  -6.903
  287   1HG   GLU  35          2HG       GLU  35  -2.723   9.356  -8.816
  288   2HG   GLU  35          1HG       GLU  35  -4.046  10.427  -8.387
  289    H    VAL  36           H        VAL  36  -0.392   8.375  -5.331
  290    HA   VAL  36           HA       VAL  36   0.223   6.460  -7.497
  291    HB   VAL  36           HB       VAL  36   1.861   8.167  -6.699
  292   1HG1  VAL  36          1HG1      VAL  36   3.208   7.602  -4.830
  293   2HG1  VAL  36          2HG1      VAL  36   1.547   7.945  -4.291
  294   3HG1  VAL  36          3HG1      VAL  36   2.121   6.263  -4.391
  295   1HG2  VAL  36          1HG2      VAL  36   3.668   6.736  -7.031
  296   2HG2  VAL  36          2HG2      VAL  36   2.617   5.310  -6.861
  297   3HG2  VAL  36          3HG2      VAL  36   2.364   6.448  -8.206
  298    H    LEU  37           H        LEU  37  -0.926   6.373  -4.154
  299    HA   LEU  37           HA       LEU  37  -0.693   3.479  -3.957
  300   1HB   LEU  37          2HB       LEU  37  -1.607   5.632  -2.065
  301   2HB   LEU  37          1HB       LEU  37  -2.022   3.957  -1.772
  302    HG   LEU  37           HG       LEU  37   0.836   4.907  -2.227
  303   1HD1  LEU  37          1HD1      LEU  37   0.992   4.679   0.212
  304   2HD1  LEU  37          2HD1      LEU  37  -0.232   5.898  -0.213
  305   3HD1  LEU  37          3HD1      LEU  37  -0.738   4.270   0.299
  306   1HD2  LEU  37          1HD2      LEU  37   1.431   2.777  -1.259
  307   2HD2  LEU  37          2HD2      LEU  37  -0.285   2.323  -1.131
  308   3HD2  LEU  37          3HD2      LEU  37   0.461   2.534  -2.732
  309    H    GLU  38           H        GLU  38  -3.170   5.835  -4.906
  310    HA   GLU  38           HA       GLU  38  -5.543   4.435  -4.806
  311   1HB   GLU  38          2HB       GLU  38  -4.538   6.644  -6.282
  312   2HB   GLU  38          1HB       GLU  38  -5.365   5.573  -7.391
  313   1HG   GLU  38          2HG       GLU  38  -7.233   5.496  -5.563
  314   2HG   GLU  38          1HG       GLU  38  -6.444   6.955  -4.952
  315    HA   PRO  39           HA       PRO  39  -4.511   1.638  -8.556
  316   1HB   PRO  39          2HB       PRO  39  -2.082   1.469  -9.626
  317   2HB   PRO  39          1HB       PRO  39  -3.230   2.702 -10.145
  318   1HG   PRO  39          2HG       PRO  39  -0.913   2.983  -8.171
  319   2HG   PRO  39          1HG       PRO  39  -1.346   4.057  -9.498
  320   1HD   PRO  39          1HD       PRO  39  -2.201   4.533  -6.884
  321   2HD   PRO  39          2HD       PRO  39  -3.230   4.980  -8.306
  322    H    LEU  40           H        LEU  40  -2.265   2.028  -5.791
  323    HA   LEU  40           HA       LEU  40  -1.188  -0.686  -5.830
  324   1HB   LEU  40          2HB       LEU  40  -1.209   1.561  -3.918
  325   2HB   LEU  40          1HB       LEU  40  -0.600  -0.097  -3.545
  326    HG   LEU  40           HG       LEU  40   0.779   2.103  -4.598
  327   1HD1  LEU  40          1HD1      LEU  40   2.663   0.508  -4.379
  328   2HD1  LEU  40          2HD1      LEU  40   1.565   0.479  -2.979
  329   3HD1  LEU  40          3HD1      LEU  40   1.490  -0.819  -4.196
  330   1HD2  LEU  40          1HD2      LEU  40   1.914   1.205  -6.560
  331   2HD2  LEU  40          2HD2      LEU  40   0.768  -0.155  -6.618
  332   3HD2  LEU  40          3HD2      LEU  40   0.192   1.506  -6.896
  333    H    HIS  41           H        HIS  41  -4.157   0.871  -4.550
  334    HA   HIS  41           HA       HIS  41  -5.028  -1.553  -3.137
  335   1HB   HIS  41          2HB       HIS  41  -5.597   0.613  -2.334
  336   2HB   HIS  41          1HB       HIS  41  -6.344   1.033  -3.911
  337    HD1  HIS  41           1HD      HIS  41  -8.727   0.019  -4.341
  338    HD2  HIS  41           2HD      HIS  41  -7.027  -0.902  -0.684
  339    HE1  HIS  41           1HE      HIS  41 -10.646  -0.821  -2.864
  340    H    ALA  42           H        ALA  42  -5.731  -0.021  -6.336
  341    HA   ALA  42           HA       ALA  42  -7.858  -1.857  -7.071
  342   1HB   ALA  42          1HB       ALA  42  -7.569  -0.920  -9.268
  343   2HB   ALA  42          2HB       ALA  42  -7.678   0.351  -8.027
  344   3HB   ALA  42          3HB       ALA  42  -6.100  -0.069  -8.735
  345    H    MET  43           H        MET  43  -4.332  -1.705  -7.684
  346    HA   MET  43           HA       MET  43  -3.971  -4.173  -9.116
  347   1HB   MET  43          2HB       MET  43  -2.119  -2.397  -7.446
  348   2HB   MET  43          1HB       MET  43  -1.579  -3.790  -8.322
  349   1HG   MET  43          2HG       MET  43  -1.905  -2.795 -10.392
  350   2HG   MET  43          1HG       MET  43  -3.094  -1.648  -9.787
  351   1HE   MET  43          1HE       MET  43   0.114   0.391 -10.993
  352   2HE   MET  43          2HE       MET  43  -0.373  -1.211 -11.597
  353   3HE   MET  43          3HE       MET  43  -1.602   0.045 -11.313
  354    H    MET  44           H        MET  44  -4.850  -3.685  -5.761
  355    HA   MET  44           HA       MET  44  -3.993  -6.493  -5.176
  356   1HB   MET  44          2HB       MET  44  -3.116  -4.452  -3.849
  357   2HB   MET  44          1HB       MET  44  -4.723  -4.353  -3.180
  358   1HG   MET  44          2HG       MET  44  -3.753  -7.103  -3.082
  359   2HG   MET  44          1HG       MET  44  -2.645  -5.990  -2.297
  360   1HE   MET  44          1HE       MET  44  -4.040  -5.985   1.062
  361   2HE   MET  44          2HE       MET  44  -2.941  -6.932   0.030
  362   3HE   MET  44          3HE       MET  44  -2.902  -5.153  -0.024
  363    H    GLU  45           H        GLU  45  -6.751  -4.622  -5.997
  364    HA   GLU  45           HA       GLU  45  -8.672  -6.458  -4.653
  365   1HB   GLU  45          2HB       GLU  45  -8.779  -3.853  -4.622
  366   2HB   GLU  45          1HB       GLU  45  -9.368  -4.032  -6.281
  367   1HG   GLU  45          2HG       GLU  45 -11.420  -4.369  -5.354
  368   2HG   GLU  45          1HG       GLU  45 -10.834  -5.962  -4.875
  369    H    ARG  46           H        ARG  46  -7.714  -5.339  -7.976
  370    HA   ARG  46           HA       ARG  46  -9.512  -6.491  -9.648
  371   1HB   ARG  46          2HB       ARG  46  -7.315  -5.253 -10.194
  372   2HB   ARG  46          1HB       ARG  46  -6.539  -6.807 -10.125
  373   1HG   ARG  46          2HG       ARG  46  -9.003  -6.584 -11.851
  374   2HG   ARG  46          1HG       ARG  46  -7.524  -5.866 -12.407
  375   1HD   ARG  46          2HD       ARG  46  -6.548  -7.845 -12.815
  376   2HD   ARG  46          1HD       ARG  46  -7.241  -8.624 -11.380
  377    HE   ARG  46           HE       ARG  46  -9.406  -8.158 -12.985
  378   1HH1  ARG  46          2HH2      ARG  46  -6.432  -9.970 -13.394
  379   2HH1  ARG  46          1HH2      ARG  46  -7.138 -11.140 -14.461
  380   1HH2  ARG  46          1HH1      ARG  46 -10.304  -9.720 -14.404
  381   2HH2  ARG  46          2HH1      ARG  46  -9.295 -10.983 -15.021
  382    H    GLY  47           H        GLY  47  -7.023  -8.345  -7.810
  383   1HA   GLY  47          2HA       GLY  47  -7.994 -10.508  -6.949
  384   2HA   GLY  47          1HA       GLY  47  -8.384 -10.879  -8.617
  385    HA   PRO  48           HA       PRO  48  -3.845 -11.927  -7.531
  386   1HB   PRO  48          2HB       PRO  48  -4.009 -14.422  -6.668
  387   2HB   PRO  48          1HB       PRO  48  -4.027 -12.956  -5.575
  388   1HG   PRO  48          2HG       PRO  48  -6.273 -14.716  -6.550
  389   2HG   PRO  48          1HG       PRO  48  -5.973 -14.057  -4.869
  390   1HD   PRO  48          1HD       PRO  48  -7.741 -12.749  -6.751
  391   2HD   PRO  48          2HD       PRO  48  -6.775 -11.827  -5.507
  392    H    GLN  49           H        GLN  49  -2.664 -12.913  -9.060
  393    HA   GLN  49           HA       GLN  49  -4.071 -14.314 -11.248
  394   1HB   GLN  49          2HB       GLN  49  -2.781 -12.413 -11.941
  395   2HB   GLN  49          1HB       GLN  49  -1.367 -12.954 -11.106
  396   1HG   GLN  49          2HG       GLN  49  -0.708 -14.004 -12.875
  397   2HG   GLN  49          1HG       GLN  49  -2.160 -15.056 -12.829
  398   1HE2  GLN  49          2HE2      GLN  49  -2.365 -15.228 -15.051
  399   2HE2  GLN  49          1HE2      GLN  49  -2.757 -13.840 -16.024
  400    H    THR  50           H        THR  50  -0.713 -14.889 -10.636
  401    HA   THR  50           HA       THR  50  -0.842 -17.717 -10.827
  402    HB   THR  50           HB       THR  50   0.973 -16.973 -11.780
  403    HG1  THR  50           1HG      THR  50   2.752 -17.769 -10.533
  404   1HG2  THR  50          1HG2      THR  50   2.642 -15.413 -10.896
  405   2HG2  THR  50          2HG2      THR  50   1.040 -14.645 -11.001
  406   3HG2  THR  50          3HG2      THR  50   1.665 -15.186  -9.425
  407    H    LEU  51           H        LEU  51   1.218 -16.665  -8.341
  408    HA   LEU  51           HA       LEU  51  -0.380 -16.899  -5.929
  409   1HB   LEU  51          2HB       LEU  51   0.073 -19.335  -7.146
  410   2HB   LEU  51          1HB       LEU  51   1.516 -19.202  -6.173
  411    HG   LEU  51           HG       LEU  51   0.030 -18.681  -4.200
  412   1HD1  LEU  51          1HD1      LEU  51  -2.311 -19.363  -4.333
  413   2HD1  LEU  51          2HD1      LEU  51  -1.971 -17.962  -5.376
  414   3HD1  LEU  51          3HD1      LEU  51  -2.153 -19.580  -6.092
  415   1HD2  LEU  51          1HD2      LEU  51  -0.566 -21.080  -3.934
  416   2HD2  LEU  51          2HD2      LEU  51  -0.316 -21.332  -5.677
  417   3HD2  LEU  51          3HD2      LEU  51   1.060 -20.896  -4.634
  418    H    LYS  52           H        LYS  52   1.405 -14.995  -6.972
  419    HA   LYS  52           HA       LYS  52   3.830 -15.244  -5.252
  420   1HB   LYS  52          2HB       LYS  52   3.503 -13.995  -8.006
  421   2HB   LYS  52          1HB       LYS  52   4.992 -13.960  -7.011
  422   1HG   LYS  52          2HG       LYS  52   3.765 -16.602  -7.736
  423   2HG   LYS  52          1HG       LYS  52   4.717 -15.713  -8.951
  424   1HD   LYS  52          2HD       LYS  52   6.720 -16.050  -7.783
  425   2HD   LYS  52          1HD       LYS  52   5.967 -15.886  -6.223
  426   1HE   LYS  52          2HE       LYS  52   4.875 -18.148  -6.781
  427   2HE   LYS  52          1HE       LYS  52   6.234 -18.243  -7.972
  428   1HZ   LYS  52          1HZ       LYS  52   6.822 -19.046  -5.689
  429   2HZ   LYS  52          2HZ       LYS  52   7.754 -17.807  -6.199
  430   3HZ   LYS  52          3HZ       LYS  52   6.546 -17.539  -5.133
  431    H    GLU  53           H        GLU  53   1.901 -12.873  -7.118
  432    HA   GLU  53           HA       GLU  53   2.202 -10.718  -5.296
  433   1HB   GLU  53          2HB       GLU  53   0.611  -9.603  -6.772
  434   2HB   GLU  53          1HB       GLU  53   2.084 -10.283  -7.554
  435   1HG   GLU  53          2HG       GLU  53  -0.349 -11.988  -7.731
  436   2HG   GLU  53          1HG       GLU  53  -0.435 -10.473  -8.605
  437    H    THR  54           H        THR  54   1.393 -12.451  -3.552
  438    HA   THR  54           HA       THR  54  -1.148 -11.624  -2.422
  439    HB   THR  54           HB       THR  54  -1.065 -14.203  -3.876
  440    HG1  THR  54           1HG      THR  54  -3.199 -13.213  -4.521
  441   1HG2  THR  54          1HG2      THR  54  -3.243 -14.774  -2.980
  442   2HG2  THR  54          2HG2      THR  54  -1.997 -14.786  -1.709
  443   3HG2  THR  54          3HG2      THR  54  -3.138 -13.426  -1.824
  444    H    SER  55           H        SER  55   1.514 -11.493  -1.512
  445    HA   SER  55           HA       SER  55   1.630 -13.545   0.701
  446   1HB   SER  55          2HB       SER  55   3.773 -11.838  -0.457
  447   2HB   SER  55          1HB       SER  55   3.893 -12.855   1.010
  448    HG   SER  55           HG       SER  55   4.587 -14.164  -0.725
  449    H    PHE  56           H        PHE  56   0.915 -10.319  -0.018
  450    HA   PHE  56           HA       PHE  56   0.937  -9.367   2.800
  451   1HB   PHE  56          2HB       PHE  56   0.620  -7.210   1.314
  452   2HB   PHE  56          1HB       PHE  56   2.223  -7.885   1.746
  453    HD1  PHE  56           1HD      PHE  56  -0.185  -7.299  -1.011
  454    HD2  PHE  56           2HD      PHE  56   3.518  -9.143   0.134
  455    HE1  PHE  56           1HE      PHE  56   0.474  -7.446  -3.391
  456    HE2  PHE  56           2HE      PHE  56   4.058  -9.531  -2.244
  457    HZ   PHE  56           HZ       PHE  56   2.577  -8.589  -4.017
  458    H    ASN  57           H        ASN  57  -1.243 -10.199   0.127
  459    HA   ASN  57           HA       ASN  57  -3.492  -8.803   1.400
  460   1HB   ASN  57          2HB       ASN  57  -3.264  -8.877  -1.022
  461   2HB   ASN  57          1HB       ASN  57  -3.295 -10.642  -0.989
  462   1HD2  ASN  57          2HD2      ASN  57  -5.224 -11.735  -0.655
  463   2HD2  ASN  57          1HD2      ASN  57  -6.729 -10.878  -0.629
  464    H    GLN  58           H        GLN  58  -1.982 -11.989   1.504
  465    HA   GLN  58           HA       GLN  58  -4.368 -13.253   2.631
  466   1HB   GLN  58          2HB       GLN  58  -2.269 -14.112   0.996
  467   2HB   GLN  58          1HB       GLN  58  -2.033 -14.925   2.556
  468   1HG   GLN  58          2HG       GLN  58  -3.581 -16.331   1.255
  469   2HG   GLN  58          1HG       GLN  58  -4.551 -15.551   2.472
  470   1HE2  GLN  58          2HE2      GLN  58  -4.011 -16.030  -0.843
  471   2HE2  GLN  58          1HE2      GLN  58  -5.328 -15.019  -1.382
  472    H    ALA  59           H        ALA  59  -1.475 -11.731   3.687
  473    HA   ALA  59           HA       ALA  59  -1.721 -12.764   6.487
  474   1HB   ALA  59          1HB       ALA  59   0.646 -12.271   6.701
  475   2HB   ALA  59          2HB       ALA  59   0.355 -13.462   5.411
  476   3HB   ALA  59          3HB       ALA  59   0.714 -11.769   4.996
  477    H    TYR  60           H        TYR  60  -1.161  -9.970   4.377
  478    HA   TYR  60           HA       TYR  60  -1.718  -8.078   6.689
  479   1HB   TYR  60          2HB       TYR  60   0.267  -8.014   4.437
  480   2HB   TYR  60          1HB       TYR  60  -0.456  -6.507   4.888
  481    HD1  TYR  60           1HD      TYR  60   0.723  -5.259   6.257
  482    HD2  TYR  60           2HD      TYR  60   1.034  -9.510   6.641
  483    HE1  TYR  60           1HE      TYR  60   2.446  -4.948   7.965
  484    HE2  TYR  60           2HE      TYR  60   2.572  -9.209   8.523
  485    HH   TYR  60           HH       TYR  60   3.680  -6.066   9.704
  486    H    GLY  61           H        GLY  61  -3.997  -9.182   5.732
  487   1HA   GLY  61          2HA       GLY  61  -5.212  -7.921   3.456
  488   2HA   GLY  61          1HA       GLY  61  -6.034  -8.719   4.783
  489    H    ARG  62           H        ARG  62  -4.776  -6.968   6.836
  490    HA   ARG  62           HA       ARG  62  -6.630  -4.730   6.669
  491   1HB   ARG  62          2HB       ARG  62  -5.233  -6.232   8.702
  492   2HB   ARG  62          1HB       ARG  62  -5.010  -4.477   8.930
  493   1HG   ARG  62          2HG       ARG  62  -7.396  -4.101   8.855
  494   2HG   ARG  62          1HG       ARG  62  -7.693  -5.809   8.411
  495   1HD   ARG  62          2HD       ARG  62  -6.779  -6.553  10.577
  496   2HD   ARG  62          1HD       ARG  62  -6.391  -4.876  11.015
  497    HE   ARG  62           HE       ARG  62  -9.118  -4.987  10.368
  498   1HH1  ARG  62          2HH2      ARG  62  -7.011  -6.315  12.840
  499   2HH1  ARG  62          1HH2      ARG  62  -8.238  -6.330  14.067
  500   1HH2  ARG  62          1HH1      ARG  62 -10.715  -5.020  12.015
  501   2HH2  ARG  62          2HH1      ARG  62 -10.303  -5.606  13.589
  502    H    ASP  63           H        ASP  63  -3.660  -5.170   5.294
  503    HA   ASP  63           HA       ASP  63  -2.431  -2.639   6.126
  504   1HB   ASP  63          2HB       ASP  63  -1.241  -4.819   5.921
  505   2HB   ASP  63          1HB       ASP  63  -1.505  -4.704   4.151
  506    H    LEU  64           H        LEU  64  -1.388  -2.511   3.120
  507    HA   LEU  64           HA       LEU  64  -2.465  -0.671   1.843
  508   1HB   LEU  64          2HB       LEU  64  -1.098  -2.897   1.191
  509   2HB   LEU  64          1HB       LEU  64  -2.482  -2.891   0.038
  510    HG   LEU  64           HG       LEU  64  -1.367  -0.213   0.554
  511   1HD1  LEU  64          1HD1      LEU  64   0.690  -0.500  -0.764
  512   2HD1  LEU  64          2HD1      LEU  64   0.735  -1.448   0.741
  513   3HD1  LEU  64          3HD1      LEU  64   0.413  -2.258  -0.810
  514   1HD2  LEU  64          1HD2      LEU  64  -1.492  -0.122  -1.926
  515   2HD2  LEU  64          2HD2      LEU  64  -1.805  -1.874  -1.968
  516   3HD2  LEU  64          3HD2      LEU  64  -2.993  -0.776  -1.226
  517    H    MET  65           H        MET  65  -4.327  -3.763   1.472
  518    HA   MET  65           HA       MET  65  -6.643  -2.956   0.291
  519   1HB   MET  65          2HB       MET  65  -5.758  -5.169   1.711
  520   2HB   MET  65          1HB       MET  65  -6.992  -4.570   2.777
  521   1HG   MET  65          2HG       MET  65  -8.462  -4.447   0.622
  522   2HG   MET  65          1HG       MET  65  -7.250  -5.560  -0.025
  523   1HE   MET  65          1HE       MET  65  -9.289  -8.555   0.815
  524   2HE   MET  65          2HE       MET  65  -9.463  -7.160  -0.277
  525   3HE   MET  65          3HE       MET  65  -7.870  -7.918  -0.050
  526    H    GLU  66           H        GLU  66  -6.215  -2.674   3.911
  527    HA   GLU  66           HA       GLU  66  -8.544  -0.942   4.152
  528   1HB   GLU  66          2HB       GLU  66  -7.189  -2.610   5.929
  529   2HB   GLU  66          1HB       GLU  66  -6.863  -0.970   6.491
  530   1HG   GLU  66          2HG       GLU  66  -8.936  -1.414   7.533
  531   2HG   GLU  66          1HG       GLU  66  -9.489  -0.628   6.078
  532    H    ALA  67           H        ALA  67  -5.073  -0.543   3.718
  533    HA   ALA  67           HA       ALA  67  -4.535   2.050   4.696
  534   1HB   ALA  67          1HB       ALA  67  -2.827   2.142   2.952
  535   2HB   ALA  67          2HB       ALA  67  -2.832   0.524   3.694
  536   3HB   ALA  67          3HB       ALA  67  -3.584   0.775   2.101
  537    H    GLN  68           H        GLN  68  -5.968   1.027   1.590
  538    HA   GLN  68           HA       GLN  68  -6.808   3.849   1.012
  539   1HB   GLN  68          2HB       GLN  68  -5.538   2.837  -0.699
  540   2HB   GLN  68          1HB       GLN  68  -6.614   1.430  -0.728
  541   1HG   GLN  68          2HG       GLN  68  -8.439   2.687  -1.518
  542   2HG   GLN  68          1HG       GLN  68  -7.655   4.244  -1.086
  543   1HE2  GLN  68          2HE2      GLN  68  -8.887   3.643  -3.527
  544   2HE2  GLN  68          1HE2      GLN  68  -7.619   3.742  -4.733
  545    H    GLU  69           H        GLU  69  -8.192   0.659   1.920
  546    HA   GLU  69           HA       GLU  69 -10.888   1.170   1.204
  547   1HB   GLU  69          2HB       GLU  69  -9.710  -0.962   2.105
  548   2HB   GLU  69          1HB       GLU  69 -10.189  -0.314   3.686
  549   1HG   GLU  69          2HG       GLU  69 -12.463   0.020   2.002
  550   2HG   GLU  69          1HG       GLU  69 -11.854  -1.595   1.659
  551    H    TRP  70           H        TRP  70  -8.898   2.707   3.619
  552    HA   TRP  70           HA       TRP  70 -10.855   3.870   5.332
  553   1HB   TRP  70          2HB       TRP  70  -9.154   5.234   6.000
  554   2HB   TRP  70          1HB       TRP  70  -8.406   3.640   5.626
  555    HD1  TRP  70           HD       TRP  70  -8.541   5.015   2.341
  556    HE1  TRP  70           1HE      TRP  70  -6.395   6.188   1.716
  557    HE3  TRP  70           3HE      TRP  70  -6.960   5.974   6.993
  558    HZ2  TRP  70           2HZ      TRP  70  -4.363   7.577   3.063
  559    HZ3  TRP  70           3HZ      TRP  70  -4.677   6.930   7.263
  560    HH2  TRP  70           HH       TRP  70  -3.447   7.737   5.342
  561    H    CYS  71           H        CYS  71 -12.203   3.926   2.954
  562    HA   CYS  71           HA       CYS  71 -11.977   6.613   1.746
  563   1HB   CYS  71          2HB       CYS  71 -13.715   5.796   0.247
  564   2HB   CYS  71          1HB       CYS  71 -12.215   4.818   0.244
  565    HG   CYS  71           HG       CYS  71 -14.336   3.344  -0.154
  566    H    ARG  72           H        ARG  72 -14.556   4.600   3.329
  567    HA   ARG  72           HA       ARG  72 -16.343   6.680   3.908
  568   1HB   ARG  72          2HB       ARG  72 -15.929   3.913   4.786
  569   2HB   ARG  72          1HB       ARG  72 -16.942   4.976   5.819
  570   1HG   ARG  72          2HG       ARG  72 -18.655   4.975   4.227
  571   2HG   ARG  72          1HG       ARG  72 -17.540   5.387   2.949
  572   1HD   ARG  72          2HD       ARG  72 -18.295   3.328   2.225
  573   2HD   ARG  72          1HD       ARG  72 -16.873   2.811   3.108
  574    HE   ARG  72           HE       ARG  72 -19.070   2.876   4.872
  575   1HH1  ARG  72          2HH2      ARG  72 -17.838   1.042   2.149
  576   2HH1  ARG  72          1HH2      ARG  72 -18.693  -0.409   2.565
  577   1HH2  ARG  72          1HH1      ARG  72 -20.203   0.929   5.388
  578   2HH2  ARG  72          2HH1      ARG  72 -19.999  -0.455   4.373
  579    H    LYS  73           H        LYS  73 -13.305   6.341   5.173
  580    HA   LYS  73           HA       LYS  73 -13.853   7.759   7.744
  581   1HB   LYS  73          2HB       LYS  73 -11.383   6.857   8.168
  582   2HB   LYS  73          1HB       LYS  73 -12.845   6.112   8.749
  583   1HG   LYS  73          2HG       LYS  73 -12.887   4.707   6.702
  584   2HG   LYS  73          1HG       LYS  73 -11.280   5.394   6.293
  585   1HD   LYS  73          2HD       LYS  73 -10.229   4.101   7.716
  586   2HD   LYS  73          1HD       LYS  73 -11.496   4.309   8.987
  587   1HE   LYS  73          2HE       LYS  73 -12.682   2.394   8.244
  588   2HE   LYS  73          1HE       LYS  73 -12.398   2.767   6.564
  589   1HZ   LYS  73          1HZ       LYS  73 -11.414   0.773   7.405
  590   2HZ   LYS  73          2HZ       LYS  73 -10.369   1.765   6.649
  591   3HZ   LYS  73          3HZ       LYS  73 -10.347   1.659   8.282
  592    H    TYR  74           H        TYR  74 -11.430   7.490   5.013
  593    HA   TYR  74           HA       TYR  74 -10.296  10.095   5.596
  594   1HB   TYR  74          2HB       TYR  74  -9.180   8.329   4.358
  595   2HB   TYR  74          1HB       TYR  74 -10.354   8.543   3.015
  596    HD1  TYR  74           1HD      TYR  74  -9.359   9.373   1.198
  597    HD2  TYR  74           2HD      TYR  74  -8.303  10.900   5.070
  598    HE1  TYR  74           1HE      TYR  74  -7.917  11.075   0.121
  599    HE2  TYR  74           2HE      TYR  74  -6.919  12.646   4.015
  600    HH   TYR  74           HH       TYR  74  -5.993  13.331   2.155
  601    H    MET  75           H        MET  75 -13.241   9.210   3.862
  602    HA   MET  75           HA       MET  75 -13.664  11.827   2.599
  603   1HB   MET  75          2HB       MET  75 -15.357   9.353   2.850
  604   2HB   MET  75          1HB       MET  75 -15.858  10.842   2.052
  605   1HG   MET  75          2HG       MET  75 -13.246  10.166   1.033
  606   2HG   MET  75          1HG       MET  75 -14.230   8.721   0.977
  607   1HE   MET  75          1HE       MET  75 -14.064  10.578  -2.570
  608   2HE   MET  75          2HE       MET  75 -12.906  10.849  -1.246
  609   3HE   MET  75          3HE       MET  75 -13.452   9.198  -1.627
  610    H    LYS  76           H        LYS  76 -15.285  10.052   5.325
  611    HA   LYS  76           HA       LYS  76 -16.897  12.427   6.022
  612   1HB   LYS  76          2HB       LYS  76 -16.972   9.612   6.498
  613   2HB   LYS  76          1HB       LYS  76 -17.225  10.612   7.970
  614   1HG   LYS  76          2HG       LYS  76 -18.956  11.892   6.903
  615   2HG   LYS  76          1HG       LYS  76 -18.564  11.192   5.298
  616   1HD   LYS  76          2HD       LYS  76 -20.545  10.155   5.859
  617   2HD   LYS  76          1HD       LYS  76 -19.306   8.960   6.362
  618   1HE   LYS  76          2HE       LYS  76 -19.780   9.191   8.564
  619   2HE   LYS  76          1HE       LYS  76 -20.261  10.908   8.397
  620   1HZ   LYS  76          1HZ       LYS  76 -22.168   9.474   8.767
  621   2HZ   LYS  76          2HZ       LYS  76 -22.231  10.176   7.296
  622   3HZ   LYS  76          3HZ       LYS  76 -21.813   8.605   7.426
  623    H    SER  77           H        SER  77 -14.173  10.597   7.450
  624    HA   SER  77           HA       SER  77 -14.026  12.328   9.794
  625   1HB   SER  77          2HB       SER  77 -13.435   9.756   9.654
  626   2HB   SER  77          1HB       SER  77 -11.927  10.292   8.975
  627    HG   SER  77           HG       SER  77 -12.027   9.970  11.290
  628    H    GLY  78           H        GLY  78 -12.433  11.892   6.529
  629   1HA   GLY  78          2HA       GLY  78 -10.605  12.886   5.615
  630   2HA   GLY  78          1HA       GLY  78 -11.692  14.286   5.888
  631    H    ASN  79           H        ASN  79  -9.760  12.398   8.197
  632    HA   ASN  79           HA       ASN  79  -8.363  14.883   9.014
  633   1HB   ASN  79          2HB       ASN  79 -10.301  13.263  10.502
  634   2HB   ASN  79          1HB       ASN  79  -8.755  13.288  11.327
  635   1HD2  ASN  79          2HD2      ASN  79  -8.185  15.127  12.507
  636   2HD2  ASN  79          1HD2      ASN  79  -9.101  16.596  12.340
  637    H    VAL  80           H        VAL  80  -6.291  14.670   9.558
  638    HA   VAL  80           HA       VAL  80  -4.595  12.559   8.843
  639    HB   VAL  80           HB       VAL  80  -4.022  14.652  10.939
  640   1HG1  VAL  80          1HG1      VAL  80  -1.729  14.264  10.333
  641   2HG1  VAL  80          2HG1      VAL  80  -2.447  12.769  10.978
  642   3HG1  VAL  80          3HG1      VAL  80  -2.202  12.955   9.224
  643   1HG2  VAL  80          1HG2      VAL  80  -3.017  15.855   9.105
  644   2HG2  VAL  80          2HG2      VAL  80  -3.579  14.626   7.947
  645   3HG2  VAL  80          3HG2      VAL  80  -4.760  15.637   8.814
  646    H    LYS  81           H        LYS  81  -6.737  12.703  11.619
  647    HA   LYS  81           HA       LYS  81  -5.669  10.912  13.412
  648   1HB   LYS  81          2HB       LYS  81  -8.611  11.173  12.662
  649   2HB   LYS  81          1HB       LYS  81  -7.970  10.593  14.169
  650   1HG   LYS  81          2HG       LYS  81  -7.822  13.414  13.085
  651   2HG   LYS  81          1HG       LYS  81  -8.642  12.833  14.530
  652   1HD   LYS  81          2HD       LYS  81  -6.423  12.333  15.594
  653   2HD   LYS  81          1HD       LYS  81  -5.594  12.840  14.162
  654   1HE   LYS  81          2HE       LYS  81  -6.187  15.014  14.400
  655   2HE   LYS  81          1HE       LYS  81  -7.469  14.606  15.622
  656   1HZ   LYS  81          1HZ       LYS  81  -5.463  15.240  16.810
  657   2HZ   LYS  81          2HZ       LYS  81  -5.670  13.623  16.932
  658   3HZ   LYS  81          3HZ       LYS  81  -4.548  14.223  15.914
  659    H    ASP  82           H        ASP  82  -6.816  10.247  10.198
  660    HA   ASP  82           HA       ASP  82  -6.754   7.319  10.592
  661   1HB   ASP  82          2HB       ASP  82  -7.181   8.921   8.053
  662   2HB   ASP  82          1HB       ASP  82  -7.570   7.196   8.349
  663    H    LEU  83           H        LEU  83  -5.031   9.991   8.848
  664    HA   LEU  83           HA       LEU  83  -3.174   8.476   7.387
  665   1HB   LEU  83          2HB       LEU  83  -3.709  11.235   8.034
  666   2HB   LEU  83          1HB       LEU  83  -1.946  10.882   8.029
  667    HG   LEU  83           HG       LEU  83  -2.499  11.640   5.809
  668   1HD1  LEU  83          1HD1      LEU  83  -1.877   9.860   4.433
  669   2HD1  LEU  83          2HD1      LEU  83  -0.874  10.005   5.894
  670   3HD1  LEU  83          3HD1      LEU  83  -2.097   8.718   5.780
  671   1HD2  LEU  83          1HD2      LEU  83  -4.250  10.664   4.453
  672   2HD2  LEU  83          2HD2      LEU  83  -4.744   9.608   5.796
  673   3HD2  LEU  83          3HD2      LEU  83  -4.942  11.371   5.931
  674    H    THR  84           H        THR  84  -2.896   9.928  10.652
  675    HA   THR  84           HA       THR  84  -0.323   9.153  11.496
  676    HB   THR  84           HB       THR  84  -1.695  10.626  12.717
  677    HG1  THR  84           1HG      THR  84  -1.369   9.442  14.828
  678   1HG2  THR  84          1HG2      THR  84  -3.458   9.839  14.222
  679   2HG2  THR  84          2HG2      THR  84  -3.920   9.611  12.519
  680   3HG2  THR  84          3HG2      THR  84  -3.376   8.220  13.487
  681    H    GLN  85           H        GLN  85  -3.103   7.071  10.885
  682    HA   GLN  85           HA       GLN  85  -1.813   4.675  12.120
  683   1HB   GLN  85          2HB       GLN  85  -4.599   5.424  11.500
  684   2HB   GLN  85          1HB       GLN  85  -4.127   3.798  11.029
  685   1HG   GLN  85          2HG       GLN  85  -4.742   3.404  13.239
  686   2HG   GLN  85          1HG       GLN  85  -3.057   3.777  13.508
  687   1HE2  GLN  85          2HE2      GLN  85  -2.898   4.888  15.332
  688   2HE2  GLN  85          1HE2      GLN  85  -3.999   6.170  15.775
  689    H    ALA  86           H        ALA  86  -2.926   5.986   8.909
  690    HA   ALA  86           HA       ALA  86  -2.232   3.671   7.406
  691   1HB   ALA  86          1HB       ALA  86  -1.992   5.070   5.510
  692   2HB   ALA  86          2HB       ALA  86  -3.465   5.486   6.418
  693   3HB   ALA  86          3HB       ALA  86  -2.025   6.525   6.534
  694    H    TRP  87           H        TRP  87  -0.187   6.458   8.479
  695    HA   TRP  87           HA       TRP  87   2.252   5.659   7.289
  696   1HB   TRP  87          2HB       TRP  87   2.244   7.729   8.207
  697   2HB   TRP  87          1HB       TRP  87   1.367   7.200   9.678
  698    HD1  TRP  87           HD       TRP  87   2.711   7.145  11.713
  699    HE1  TRP  87           1HE      TRP  87   5.146   6.842  12.369
  700    HE3  TRP  87           3HE      TRP  87   4.662   6.619   7.086
  701    HZ2  TRP  87           2HZ      TRP  87   7.603   6.417  11.053
  702    HZ3  TRP  87           3HZ      TRP  87   7.029   5.893   6.835
  703    HH2  TRP  87           HH       TRP  87   8.519   5.884   8.817
  704    H    ASP  88           H        ASP  88   0.493   4.327  10.104
  705    HA   ASP  88           HA       ASP  88   2.680   2.750  11.153
  706   1HB   ASP  88          2HB       ASP  88   0.269   3.544  12.186
  707   2HB   ASP  88          1HB       ASP  88  -0.121   1.921  11.706
  708    H    LEU  89           H        LEU  89  -0.291   1.936   9.138
  709    HA   LEU  89           HA       LEU  89   0.511  -0.831   8.651
  710   1HB   LEU  89          2HB       LEU  89  -1.364  -0.737   7.051
  711   2HB   LEU  89          1HB       LEU  89  -1.751  -0.469   8.730
  712    HG   LEU  89           HG       LEU  89  -1.342   2.126   7.868
  713   1HD1  LEU  89          1HD1      LEU  89  -2.370   2.380   5.754
  714   2HD1  LEU  89          2HD1      LEU  89  -0.842   1.476   5.660
  715   3HD1  LEU  89          3HD1      LEU  89  -2.394   0.615   5.530
  716   1HD2  LEU  89          1HD2      LEU  89  -3.749   2.302   7.824
  717   2HD2  LEU  89          2HD2      LEU  89  -3.909   0.530   7.747
  718   3HD2  LEU  89          3HD2      LEU  89  -3.232   1.300   9.202
  719    H    TYR  90           H        TYR  90   0.927   2.219   6.911
  720    HA   TYR  90           HA       TYR  90   2.146   1.196   4.483
  721   1HB   TYR  90          2HB       TYR  90   2.300   3.927   5.788
  722   2HB   TYR  90          1HB       TYR  90   3.112   3.532   4.305
  723    HD1  TYR  90           1HD      TYR  90   0.986   1.682   3.100
  724    HD2  TYR  90           2HD      TYR  90   0.745   5.467   5.100
  725    HE1  TYR  90           1HE      TYR  90  -0.859   2.350   1.619
  726    HE2  TYR  90           2HE      TYR  90  -1.223   6.058   3.736
  727    HH   TYR  90           HH       TYR  90  -2.762   5.316   2.274
  728    H    TYR  91           H        TYR  91   3.622   2.512   7.468
  729    HA   TYR  91           HA       TYR  91   6.340   1.876   6.672
  730   1HB   TYR  91          2HB       TYR  91   5.588   3.714   8.328
  731   2HB   TYR  91          1HB       TYR  91   5.234   2.478   9.484
  732    HD1  TYR  91           1HD      TYR  91   8.078   3.144   7.142
  733    HD2  TYR  91           2HD      TYR  91   6.678   2.442  11.142
  734    HE1  TYR  91           1HE      TYR  91  10.378   3.445   7.990
  735    HE2  TYR  91           2HE      TYR  91   8.971   2.743  12.005
  736    HH   TYR  91           HH       TYR  91  11.115   2.874  11.461
  737    H    HIS  92           H        HIS  92   4.063   0.306   8.992
  738    HA   HIS  92           HA       HIS  92   5.691  -1.785   9.923
  739   1HB   HIS  92          2HB       HIS  92   3.560  -1.116  10.889
  740   2HB   HIS  92          1HB       HIS  92   2.710  -1.695   9.412
  741    HD1  HIS  92           1HD      HIS  92   1.326  -3.274  11.087
  742    HD2  HIS  92           2HD      HIS  92   5.391  -3.999  10.802
  743    HE1  HIS  92           1HE      HIS  92   1.680  -5.643  11.984
  744    H    VAL  93           H        VAL  93   3.595  -1.528   6.975
  745    HA   VAL  93           HA       VAL  93   4.247  -4.228   6.094
  746    HB   VAL  93           HB       VAL  93   2.138  -2.970   5.623
  747   1HG1  VAL  93          1HG1      VAL  93   1.992  -2.022   3.375
  748   2HG1  VAL  93          2HG1      VAL  93   2.988  -1.001   4.438
  749   3HG1  VAL  93          3HG1      VAL  93   3.765  -2.054   3.233
  750   1HG2  VAL  93          1HG2      VAL  93   1.888  -4.464   3.717
  751   2HG2  VAL  93          2HG2      VAL  93   3.645  -4.748   3.740
  752   3HG2  VAL  93          3HG2      VAL  93   2.648  -5.216   5.139
  753    H    PHE  94           H        PHE  94   5.199  -0.853   5.044
  754    HA   PHE  94           HA       PHE  94   6.978  -1.141   3.090
  755   1HB   PHE  94          2HB       PHE  94   6.513   0.948   4.062
  756   2HB   PHE  94          1HB       PHE  94   7.242   0.452   5.625
  757    HD1  PHE  94           1HD      PHE  94   9.621   0.236   5.880
  758    HD2  PHE  94           2HD      PHE  94   7.910   1.608   2.188
  759    HE1  PHE  94           1HE      PHE  94  11.844   1.062   5.172
  760    HE2  PHE  94           2HE      PHE  94  10.129   2.492   1.493
  761    HZ   PHE  94           HZ       PHE  94  12.095   2.198   2.978
  762    H    ARG  95           H        ARG  95   7.730  -2.073   6.465
  763    HA   ARG  95           HA       ARG  95  10.335  -3.104   5.807
  764   1HB   ARG  95          2HB       ARG  95   8.589  -3.007   8.253
  765   2HB   ARG  95          1HB       ARG  95  10.129  -3.889   8.231
  766   1HG   ARG  95          2HG       ARG  95   9.843  -0.974   7.389
  767   2HG   ARG  95          1HG       ARG  95  10.310  -1.490   9.023
  768   1HD   ARG  95          2HD       ARG  95  11.989  -2.962   7.249
  769   2HD   ARG  95          1HD       ARG  95  11.966  -1.314   6.619
  770    HE   ARG  95           HE       ARG  95  13.340  -0.782   8.290
  771   1HH1  ARG  95          2HH2      ARG  95  11.377  -3.394   9.605
  772   2HH1  ARG  95          1HH2      ARG  95  12.160  -3.372  11.150
  773   1HH2  ARG  95          1HH1      ARG  95  14.311  -0.768  10.337
  774   2HH2  ARG  95          2HH1      ARG  95  13.785  -1.891  11.548
  775    H    ARG  96           H        ARG  96   7.166  -4.661   6.436
  776    HA   ARG  96           HA       ARG  96   8.042  -7.431   6.377
  777   1HB   ARG  96          2HB       ARG  96   6.110  -7.042   7.529
  778   2HB   ARG  96          1HB       ARG  96   5.462  -5.927   6.286
  779   1HG   ARG  96          2HG       ARG  96   4.327  -7.656   5.336
  780   2HG   ARG  96          1HG       ARG  96   5.816  -8.541   5.089
  781   1HD   ARG  96          2HD       ARG  96   4.735  -8.517   7.838
  782   2HD   ARG  96          1HD       ARG  96   3.823  -9.412   6.577
  783    HE   ARG  96           HE       ARG  96   6.163 -10.207   7.924
  784   1HH1  ARG  96          2HH2      ARG  96   4.547 -10.498   4.815
  785   2HH1  ARG  96          1HH2      ARG  96   5.261 -12.034   4.442
  786   1HH2  ARG  96          1HH1      ARG  96   7.065 -12.212   7.415
  787   2HH2  ARG  96          2HH1      ARG  96   6.692 -12.986   5.911
  788    H    ILE  97           H        ILE  97   6.242  -5.408   3.994
  789    HA   ILE  97           HA       ILE  97   6.469  -7.338   1.794
  790    HB   ILE  97           HB       ILE  97   5.683  -5.462   0.410
  791   1HG1  ILE  97          2HG1      ILE  97   4.563  -4.007   2.626
  792   2HG1  ILE  97          1HG1      ILE  97   6.347  -3.888   2.524
  793   1HG2  ILE  97          1HG2      ILE  97   3.373  -5.750   1.256
  794   2HG2  ILE  97          2HG2      ILE  97   4.261  -7.291   1.278
  795   3HG2  ILE  97          3HG2      ILE  97   4.014  -6.384   2.789
  796   1HD1  ILE  97          1HD1      ILE  97   5.258  -2.078   1.306
  797   2HD1  ILE  97          2HD1      ILE  97   6.160  -3.146   0.205
  798   3HD1  ILE  97          3HD1      ILE  97   4.387  -3.264   0.307
  799    H    SER  98           H        SER  98   8.564  -4.919   3.196
  800    HA   SER  98           HA       SER  98  10.148  -4.219   0.937
  801   1HB   SER  98          2HB       SER  98  10.352  -3.889   3.670
  802   2HB   SER  98          1HB       SER  98  11.819  -4.815   3.105
  803    HG   SER  98           HG       SER  98  10.685  -2.406   1.925
  804    H    LYS  99           H        LYS  99  10.450  -7.004   3.254
  805    HA   LYS  99           HA       LYS  99  11.440  -9.062   2.990
  806   1HB   LYS  99          2HB       LYS  99  10.562  -8.354   0.344
  807   2HB   LYS  99          1HB       LYS  99  12.089  -9.290   0.298
  808   1HG   LYS  99          2HG       LYS  99  10.074 -10.433   2.141
  809   2HG   LYS  99          1HG       LYS  99   9.539 -10.397   0.477
  810   1HD   LYS  99          2HD       LYS  99  10.603 -12.450   0.792
  811   2HD   LYS  99          1HD       LYS  99  11.750 -11.450  -0.154
  812   1HE   LYS  99          2HE       LYS  99  12.319 -11.140   2.672
  813   2HE   LYS  99          1HE       LYS  99  12.262 -12.851   2.286
  814   1HZ   LYS  99          1HZ       LYS  99  14.391 -11.946   1.960
  815   2HZ   LYS  99          2HZ       LYS  99  13.793 -12.435   0.522
  816   3HZ   LYS  99          3HZ       LYS  99  13.853 -10.844   0.893
  817    H    GLN 100           H        GLN 100  12.974  -6.666   3.629
  818    HA   GLN 100           HA       GLN 100  15.364  -6.283   2.459
  819   1HB   GLN 100          2HB       GLN 100  14.539  -5.051   4.322
  820   2HB   GLN 100          1HB       GLN 100  14.802  -6.456   5.404
  821   1HG   GLN 100          2HG       GLN 100  16.633  -4.680   5.572
  822   2HG   GLN 100          1HG       GLN 100  17.249  -6.243   5.132
  823   1HE2  GLN 100          2HE2      GLN 100  19.019  -5.737   3.994
  824   2HE2  GLN 100          1HE2      GLN 100  18.945  -4.746   2.558
  Start of MODEL   11
    1   1H    GLU   1          1H        GLU   1  13.325  -9.516 -16.309
    2   2H    GLU   1          2H        GLU   1  12.345  -8.989 -17.570
    3    HA   GLU   1           HA       GLU   1  11.762 -11.187 -16.359
    4   1HB   GLU   1          2HB       GLU   1  10.564  -9.204 -14.470
    5   2HB   GLU   1          1HB       GLU   1  10.426 -10.998 -14.458
    6   1HG   GLU   1          2HG       GLU   1  12.091 -11.039 -13.027
    7   2HG   GLU   1          1HG       GLU   1  13.162 -10.437 -14.329
    8    H    LEU   2           H        LEU   2   8.883  -9.843 -15.425
    9    HA   LEU   2           HA       LEU   2   6.820  -9.568 -16.365
   10   1HB   LEU   2          2HB       LEU   2   8.509  -8.092 -18.262
   11   2HB   LEU   2          1HB       LEU   2   7.109  -8.810 -19.030
   12    HG   LEU   2           HG       LEU   2   6.125  -7.764 -16.631
   13   1HD1  LEU   2          1HD1      LEU   2   6.869  -5.438 -16.661
   14   2HD1  LEU   2          2HD1      LEU   2   8.193  -6.560 -16.266
   15   3HD1  LEU   2          3HD1      LEU   2   8.089  -5.844 -17.892
   16   1HD2  LEU   2          1HD2      LEU   2   5.014  -6.183 -18.196
   17   2HD2  LEU   2          2HD2      LEU   2   6.175  -6.632 -19.468
   18   3HD2  LEU   2          3HD2      LEU   2   5.021  -7.837 -18.852
   19    H    ILE   3           H        ILE   3   5.442 -10.419 -18.359
   20    HA   ILE   3           HA       ILE   3   4.571 -12.321 -19.213
   21    HB   ILE   3           HB       ILE   3   5.707 -13.197 -21.135
   22   1HG1  ILE   3          2HG1      ILE   3   7.915 -13.325 -20.241
   23   2HG1  ILE   3          1HG1      ILE   3   7.588 -12.930 -21.976
   24   1HG2  ILE   3          1HG2      ILE   3   5.781 -11.046 -22.332
   25   2HG2  ILE   3          2HG2      ILE   3   4.393 -11.097 -21.220
   26   3HG2  ILE   3          3HG2      ILE   3   5.850 -10.172 -20.783
   27   1HD1  ILE   3          1HD1      ILE   3   9.574 -11.816 -21.153
   28   2HD1  ILE   3          2HD1      ILE   3   8.303 -10.643 -21.575
   29   3HD1  ILE   3          3HD1      ILE   3   8.625 -11.032 -19.867
   30    H    ARG   4           H        ARG   4   6.229 -12.759 -16.721
   31    HA   ARG   4           HA       ARG   4   6.190 -15.705 -16.500
   32   1HB   ARG   4          2HB       ARG   4   8.427 -15.934 -15.914
   33   2HB   ARG   4          1HB       ARG   4   8.405 -15.023 -17.461
   34   1HG   ARG   4          2HG       ARG   4   8.794 -12.944 -16.200
   35   2HG   ARG   4          1HG       ARG   4   8.915 -13.913 -14.693
   36   1HD   ARG   4          2HD       ARG   4  11.094 -13.412 -15.316
   37   2HD   ARG   4          1HD       ARG   4  10.821 -15.119 -15.802
   38    HE   ARG   4           HE       ARG   4  10.103 -13.313 -17.912
   39   1HH1  ARG   4          2HH2      ARG   4  12.906 -14.799 -16.435
   40   2HH1  ARG   4          1HH2      ARG   4  13.893 -14.686 -17.855
   41   1HH2  ARG   4          2HH1      ARG   4  11.396 -13.190 -19.781
   42   2HH2  ARG   4          1HH1      ARG   4  13.021 -13.783 -19.743
   43    H    VAL   5           H        VAL   5   7.329 -12.727 -14.843
   44    HA   VAL   5           HA       VAL   5   6.502 -13.603 -12.231
   45    HB   VAL   5           HB       VAL   5   8.573 -12.404 -12.800
   46   1HG1  VAL   5          1HG1      VAL   5   8.583  -9.958 -12.869
   47   2HG1  VAL   5          2HG1      VAL   5   7.769 -10.636 -14.298
   48   3HG1  VAL   5          3HG1      VAL   5   6.807  -9.943 -12.971
   49   1HG2  VAL   5          1HG2      VAL   5   8.639 -11.096 -10.788
   50   2HG2  VAL   5          2HG2      VAL   5   6.877 -11.285 -10.620
   51   3HG2  VAL   5          3HG2      VAL   5   7.933 -12.716 -10.574
   52    H    ALA   6           H        ALA   6   5.347 -11.281 -14.638
   53    HA   ALA   6           HA       ALA   6   3.363 -10.255 -15.067
   54   1HB   ALA   6          1HB       ALA   6   1.316 -10.963 -14.048
   55   2HB   ALA   6          2HB       ALA   6   2.262 -12.322 -14.698
   56   3HB   ALA   6          3HB       ALA   6   2.221 -12.027 -12.944
   57    H    ILE   7           H        ILE   7   5.291  -8.920 -13.693
   58    HA   ILE   7           HA       ILE   7   5.922  -7.524 -11.937
   59    HB   ILE   7           HB       ILE   7   5.219  -6.261 -13.802
   60   1HG1  ILE   7          2HG1      ILE   7   6.423  -5.271 -12.245
   61   2HG1  ILE   7          1HG1      ILE   7   5.121  -4.168 -12.833
   62   1HG2  ILE   7          1HG2      ILE   7   3.130  -4.977 -13.779
   63   2HG2  ILE   7          2HG2      ILE   7   2.808  -6.720 -13.938
   64   3HG2  ILE   7          3HG2      ILE   7   2.561  -5.908 -12.374
   65   1HD1  ILE   7          1HD1      ILE   7   5.628  -3.797 -10.491
   66   2HD1  ILE   7          2HD1      ILE   7   3.971  -4.409 -10.702
   67   3HD1  ILE   7          3HD1      ILE   7   5.255  -5.496 -10.122
   68    H    LEU   8           H        LEU   8   5.687  -8.836 -10.048
   69    HA   LEU   8           HA       LEU   8   3.296  -9.394  -8.645
   70   1HB   LEU   8          2HB       LEU   8   6.163  -9.435  -8.209
   71   2HB   LEU   8          1HB       LEU   8   5.188  -9.093  -6.736
   72    HG   LEU   8           HG       LEU   8   5.666 -11.422  -6.846
   73   1HD1  LEU   8          1HD1      LEU   8   3.369 -12.296  -6.824
   74   2HD1  LEU   8          2HD1      LEU   8   3.505 -10.732  -5.989
   75   3HD1  LEU   8          3HD1      LEU   8   2.806 -10.809  -7.622
   76   1HD2  LEU   8          1HD2      LEU   8   4.858 -12.892  -8.626
   77   2HD2  LEU   8          2HD2      LEU   8   4.326 -11.478  -9.565
   78   3HD2  LEU   8          3HD2      LEU   8   6.057 -11.732  -9.245
   79    H    TRP   9           H        TRP   9   2.707  -8.579  -6.491
   80    HA   TRP   9           HA       TRP   9   2.277  -5.617  -6.667
   81   1HB   TRP   9          2HB       TRP   9   0.728  -7.790  -5.374
   82   2HB   TRP   9          1HB       TRP   9   0.588  -6.114  -4.878
   83    HD1  TRP   9           HD       TRP   9   0.988  -5.046  -8.096
   84    HE1  TRP   9           1HE      TRP   9  -1.155  -5.087  -9.436
   85    HE3  TRP   9           3HE      TRP   9  -1.678  -8.123  -5.157
   86    HZ2  TRP   9           2HZ      TRP   9  -3.677  -6.376  -9.261
   87    HZ3  TRP   9           3HZ      TRP   9  -3.807  -9.086  -5.968
   88    HH2  TRP   9           HH       TRP   9  -4.849  -8.096  -7.992
   89    H    HIS  10           H        HIS  10   3.248  -8.071  -4.245
   90    HA   HIS  10           HA       HIS  10   4.136  -6.426  -2.161
   91   1HB   HIS  10          2HB       HIS  10   4.125  -8.508  -1.500
   92   2HB   HIS  10          1HB       HIS  10   4.404  -9.145  -3.164
   93    HD1  HIS  10           1HD      HIS  10   6.127  -9.011   0.097
   94    HD2  HIS  10           2HD      HIS  10   7.032  -9.168  -3.939
   95    HE1  HIS  10           1HE      HIS  10   8.632  -9.457  -0.053
   96    H    GLU  11           H        GLU  11   5.684  -7.155  -5.262
   97    HA   GLU  11           HA       GLU  11   8.379  -6.324  -4.618
   98   1HB   GLU  11          2HB       GLU  11   6.941  -6.603  -7.253
   99   2HB   GLU  11          1HB       GLU  11   8.693  -6.309  -7.025
  100   1HG   GLU  11          2HG       GLU  11   7.127  -8.741  -6.162
  101   2HG   GLU  11          1HG       GLU  11   8.286  -8.621  -7.536
  102    H    MET  12           H        MET  12   5.445  -4.773  -5.905
  103    HA   MET  12           HA       MET  12   6.772  -2.209  -6.414
  104   1HB   MET  12          2HB       MET  12   5.244  -1.823  -7.794
  105   2HB   MET  12          1HB       MET  12   4.637  -3.494  -7.527
  106   1HG   MET  12          2HG       MET  12   2.901  -2.693  -6.043
  107   2HG   MET  12          1HG       MET  12   3.611  -1.115  -5.914
  108   1HE   MET  12          1HE       MET  12   2.736   0.642  -9.171
  109   2HE   MET  12          2HE       MET  12   3.259   0.805  -7.479
  110   3HE   MET  12          3HE       MET  12   4.289  -0.053  -8.649
  111    H    TRP  13           H        TRP  13   4.438  -3.707  -4.023
  112    HA   TRP  13           HA       TRP  13   3.577  -1.612  -2.499
  113   1HB   TRP  13          2HB       TRP  13   4.025  -4.414  -2.116
  114   2HB   TRP  13          1HB       TRP  13   4.216  -3.444  -0.618
  115    HD1  TRP  13           HD       TRP  13   1.600  -2.039  -2.974
  116    HE1  TRP  13           1HE      TRP  13  -0.686  -2.436  -1.965
  117    HE3  TRP  13           3HE      TRP  13   2.978  -4.922   0.868
  118    HZ2  TRP  13           2HZ      TRP  13  -1.756  -3.777   0.242
  119    HZ3  TRP  13           3HZ      TRP  13   1.226  -5.999   2.304
  120    HH2  TRP  13           HH       TRP  13  -1.115  -5.360   2.047
  121    H    HIS  14           H        HIS  14   6.835  -3.068  -2.172
  122    HA   HIS  14           HA       HIS  14   8.071  -1.420  -0.260
  123   1HB   HIS  14          2HB       HIS  14   8.811  -2.997  -2.602
  124   2HB   HIS  14          1HB       HIS  14   9.939  -1.678  -2.151
  125    HD1  HIS  14           1HD      HIS  14  11.502  -3.855  -1.645
  126    HD2  HIS  14           2HD      HIS  14   8.363  -3.099   0.947
  127    HE1  HIS  14           1HE      HIS  14  12.116  -4.992   0.556
  128    H    GLU  15           H        GLU  15   8.312  -0.646  -3.778
  129    HA   GLU  15           HA       GLU  15   9.027   2.096  -3.280
  130   1HB   GLU  15          2HB       GLU  15   9.012   2.440  -5.591
  131   2HB   GLU  15          1HB       GLU  15   9.779   0.857  -5.249
  132   1HG   GLU  15          2HG       GLU  15   7.721  -0.311  -6.033
  133   2HG   GLU  15          1HG       GLU  15   6.908   1.201  -6.282
  134    H    GLY  16           H        GLY  16   5.899   0.496  -4.309
  135   1HA   GLY  16          2HA       GLY  16   4.366   2.751  -4.895
  136   2HA   GLY  16          1HA       GLY  16   3.763   1.219  -4.261
  137    H    LEU  17           H        LEU  17   5.174   1.288  -1.687
  138    HA   LEU  17           HA       LEU  17   3.728   3.308  -0.157
  139   1HB   LEU  17          2HB       LEU  17   5.587   1.060   0.586
  140   2HB   LEU  17          1HB       LEU  17   5.010   2.224   1.725
  141    HG   LEU  17           HG       LEU  17   3.289   0.341   0.089
  142   1HD1  LEU  17          1HD1      LEU  17   2.885  -0.562   2.324
  143   2HD1  LEU  17          2HD1      LEU  17   4.622  -0.601   1.939
  144   3HD1  LEU  17          3HD1      LEU  17   3.980   0.651   3.030
  145   1HD2  LEU  17          1HD2      LEU  17   1.417   1.190   1.336
  146   2HD2  LEU  17          2HD2      LEU  17   2.440   2.434   2.094
  147   3HD2  LEU  17          3HD2      LEU  17   2.125   2.487   0.343
  148    H    GLU  18           H        GLU  18   7.082   2.945  -1.355
  149    HA   GLU  18           HA       GLU  18   8.201   5.073   0.309
  150   1HB   GLU  18          2HB       GLU  18   9.551   3.229  -0.431
  151   2HB   GLU  18          1HB       GLU  18   9.344   3.755  -2.112
  152   1HG   GLU  18          2HG       GLU  18  10.821   5.516  -1.850
  153   2HG   GLU  18          1HG       GLU  18  10.188   5.945  -0.273
  154    H    GLU  19           H        GLU  19   7.581   4.875  -3.248
  155    HA   GLU  19           HA       GLU  19   7.855   7.649  -3.903
  156   1HB   GLU  19          2HB       GLU  19   8.043   5.756  -5.432
  157   2HB   GLU  19          1HB       GLU  19   6.285   5.461  -5.233
  158   1HG   GLU  19          2HG       GLU  19   6.838   6.730  -7.342
  159   2HG   GLU  19          1HG       GLU  19   5.783   7.635  -6.278
  160    H    ALA  20           H        ALA  20   5.326   5.945  -2.178
  161    HA   ALA  20           HA       ALA  20   3.260   7.992  -2.721
  162   1HB   ALA  20          1HB       ALA  20   1.842   6.736  -1.253
  163   2HB   ALA  20          2HB       ALA  20   2.467   5.728  -2.578
  164   3HB   ALA  20          3HB       ALA  20   3.154   5.575  -0.943
  165    H    SER  21           H        SER  21   4.849   6.527   0.196
  166    HA   SER  21           HA       SER  21   4.076   8.517   2.048
  167   1HB   SER  21          2HB       SER  21   5.592   7.603   3.589
  168   2HB   SER  21          1HB       SER  21   5.110   6.236   2.645
  169    HG   SER  21           HG       SER  21   7.276   7.317   1.442
  170    H    ARG  22           H        ARG  22   6.726   8.520  -0.386
  171    HA   ARG  22           HA       ARG  22   8.337  10.639   0.684
  172   1HB   ARG  22          2HB       ARG  22   8.819   8.920  -1.170
  173   2HB   ARG  22          1HB       ARG  22   7.948  10.028  -2.225
  174   1HG   ARG  22          2HG       ARG  22   9.492  11.862  -1.621
  175   2HG   ARG  22          1HG       ARG  22  10.327  10.816  -0.481
  176   1HD   ARG  22          2HD       ARG  22  11.602  10.891  -2.543
  177   2HD   ARG  22          1HD       ARG  22  10.908   9.279  -2.403
  178    HE   ARG  22           HE       ARG  22   9.585   9.677  -4.211
  179   1HH1  ARG  22          2HH2      ARG  22  10.784  12.833  -3.210
  180   2HH1  ARG  22          1HH2      ARG  22  10.271  13.605  -4.673
  181   1HH2  ARG  22          2HH1      ARG  22   8.890  10.753  -6.055
  182   2HH2  ARG  22          1HH1      ARG  22   9.235  12.437  -6.268
  183    H    LEU  23           H        LEU  23   5.172  10.669  -0.888
  184    HA   LEU  23           HA       LEU  23   5.206  13.537  -1.610
  185   1HB   LEU  23          2HB       LEU  23   3.474  11.220  -1.986
  186   2HB   LEU  23          1HB       LEU  23   2.731  12.850  -1.836
  187    HG   LEU  23           HG       LEU  23   3.099  12.280  -4.235
  188   1HD1  LEU  23          1HD1      LEU  23   4.226  14.225  -4.911
  189   2HD1  LEU  23          2HD1      LEU  23   3.082  14.547  -3.587
  190   3HD1  LEU  23          3HD1      LEU  23   4.830  14.489  -3.259
  191   1HD2  LEU  23          1HD2      LEU  23   5.284  12.038  -5.162
  192   2HD2  LEU  23          2HD2      LEU  23   6.025  12.098  -3.544
  193   3HD2  LEU  23          3HD2      LEU  23   4.978  10.731  -3.994
  194    H    TYR  24           H        TYR  24   4.745  11.657   1.206
  195    HA   TYR  24           HA       TYR  24   3.331  13.989   2.486
  196   1HB   TYR  24          2HB       TYR  24   2.031  11.843   2.362
  197   2HB   TYR  24          1HB       TYR  24   3.244  11.096   3.400
  198    HD1  TYR  24           1HD      TYR  24   2.120  10.703   5.361
  199    HD2  TYR  24           2HD      TYR  24   1.778  14.575   3.539
  200    HE1  TYR  24           1HE      TYR  24   0.908  11.533   7.345
  201    HE2  TYR  24           2HE      TYR  24   0.537  15.403   5.487
  202    HH   TYR  24           HH       TYR  24  -0.479  14.853   7.372
  203    H    PHE  25           H        PHE  25   5.916  11.599   2.862
  204    HA   PHE  25           HA       PHE  25   6.945  11.971   5.376
  205   1HB   PHE  25          2HB       PHE  25   7.625  10.228   3.865
  206   2HB   PHE  25          1HB       PHE  25   8.185  11.426   2.654
  207    HD1  PHE  25           1HD      PHE  25  10.295  12.632   2.967
  208    HD2  PHE  25           2HD      PHE  25   8.973   9.647   5.763
  209    HE1  PHE  25           1HE      PHE  25  12.506  12.689   4.057
  210    HE2  PHE  25           2HE      PHE  25  11.219   9.658   6.819
  211    HZ   PHE  25           HZ       PHE  25  12.982  11.187   5.975
  212    H    GLY  26           H        GLY  26   8.112  13.608   2.353
  213   1HA   GLY  26          2HA       GLY  26   8.738  16.092   3.895
  214   2HA   GLY  26          1HA       GLY  26   9.977  15.334   2.934
  215    H    GLU  27           H        GLU  27   6.541  15.371   1.971
  216    HA   GLU  27           HA       GLU  27   7.215  17.423  -0.141
  217   1HB   GLU  27          2HB       GLU  27   6.363  14.745  -0.494
  218   2HB   GLU  27          1HB       GLU  27   5.129  15.913  -1.068
  219   1HG   GLU  27          2HG       GLU  27   6.366  15.929  -2.990
  220   2HG   GLU  27          1HG       GLU  27   7.461  16.977  -2.111
  221    H    ARG  28           H        ARG  28   5.430  16.975   2.691
  222    HA   ARG  28           HA       ARG  28   3.349  17.498   3.441
  223   1HB   ARG  28          2HB       ARG  28   4.658  19.904   2.281
  224   2HB   ARG  28          1HB       ARG  28   2.997  20.069   2.835
  225   1HG   ARG  28          2HG       ARG  28   3.622  19.150   5.028
  226   2HG   ARG  28          1HG       ARG  28   5.303  18.971   4.467
  227   1HD   ARG  28          2HD       ARG  28   5.518  21.378   4.150
  228   2HD   ARG  28          1HD       ARG  28   3.791  21.624   4.462
  229    HE   ARG  28           HE       ARG  28   5.900  21.242   6.387
  230   1HH1  ARG  28          2HH2      ARG  28   2.413  20.984   5.974
  231   2HH1  ARG  28          1HH2      ARG  28   2.086  21.067   7.674
  232   1HH2  ARG  28          2HH1      ARG  28   5.418  21.349   8.605
  233   2HH2  ARG  28          1HH1      ARG  28   3.771  21.273   9.131
  234    H    ASN  29           H        ASN  29   3.189  16.231   0.744
  235    HA   ASN  29           HA       ASN  29   0.569  17.284  -0.083
  236   1HB   ASN  29          2HB       ASN  29   2.758  17.735  -1.495
  237   2HB   ASN  29          1HB       ASN  29   2.593  16.027  -1.958
  238   1HD2  ASN  29          2HD2      ASN  29   1.079  19.185  -1.978
  239   2HD2  ASN  29          1HD2      ASN  29  -0.066  18.849  -3.252
  240    H    VAL  30           H        VAL  30   0.303  15.503   1.771
  241    HA   VAL  30           HA       VAL  30   0.363  12.772   1.377
  242    HB   VAL  30           HB       VAL  30  -0.471  14.111   3.315
  243   1HG1  VAL  30          1HG1      VAL  30  -2.892  14.128   3.648
  244   2HG1  VAL  30          2HG1      VAL  30  -2.416  15.238   2.341
  245   3HG1  VAL  30          3HG1      VAL  30  -3.142  13.661   1.950
  246   1HG2  VAL  30          1HG2      VAL  30  -1.634  12.166   4.156
  247   2HG2  VAL  30          2HG2      VAL  30  -1.655  11.484   2.511
  248   3HG2  VAL  30          3HG2      VAL  30  -0.103  11.788   3.329
  249    H    LYS  31           H        LYS  31  -1.491  15.098  -0.460
  250    HA   LYS  31           HA       LYS  31  -3.498  13.446  -1.680
  251   1HB   LYS  31          2HB       LYS  31  -3.815  15.717  -1.544
  252   2HB   LYS  31          1HB       LYS  31  -2.168  16.074  -2.189
  253   1HG   LYS  31          2HG       LYS  31  -4.326  14.853  -3.900
  254   2HG   LYS  31          1HG       LYS  31  -4.179  16.605  -3.668
  255   1HD   LYS  31          2HD       LYS  31  -1.650  16.180  -4.245
  256   2HD   LYS  31          1HD       LYS  31  -2.291  14.681  -4.993
  257   1HE   LYS  31          2HE       LYS  31  -3.823  16.105  -6.336
  258   2HE   LYS  31          1HE       LYS  31  -2.961  17.538  -5.691
  259   1HZ   LYS  31          1HZ       LYS  31  -1.937  16.905  -7.708
  260   2HZ   LYS  31          2HZ       LYS  31  -0.912  16.441  -6.512
  261   3HZ   LYS  31          3HZ       LYS  31  -1.848  15.338  -7.264
  262    H    GLY  32           H        GLY  32  -0.017  14.185  -2.427
  263   1HA   GLY  32          2HA       GLY  32   0.036  13.007  -5.049
  264   2HA   GLY  32          1HA       GLY  32   1.404  13.387  -4.028
  265    H    MET  33           H        MET  33   1.056  11.743  -1.787
  266    HA   MET  33           HA       MET  33   1.803   9.188  -2.447
  267   1HB   MET  33          2HB       MET  33   1.783   8.759  -0.335
  268   2HB   MET  33          1HB       MET  33   1.487  10.536  -0.198
  269   1HG   MET  33          2HG       MET  33  -0.899  10.071   0.281
  270   2HG   MET  33          1HG       MET  33  -0.625   8.364   0.135
  271   1HE   MET  33          1HE       MET  33   1.375   7.426   3.254
  272   2HE   MET  33          2HE       MET  33   0.360   6.856   1.908
  273   3HE   MET  33          3HE       MET  33   1.940   7.607   1.576
  274    H    PHE  34           H        PHE  34  -1.476  10.495  -2.243
  275    HA   PHE  34           HA       PHE  34  -3.010   8.080  -2.561
  276   1HB   PHE  34          2HB       PHE  34  -3.777  10.953  -3.142
  277   2HB   PHE  34          1HB       PHE  34  -4.838   9.614  -2.859
  278    HD1  PHE  34           1HD      PHE  34  -2.961   8.470  -0.481
  279    HD2  PHE  34           2HD      PHE  34  -4.806  12.221  -1.473
  280    HE1  PHE  34           1HE      PHE  34  -2.985   9.079   1.886
  281    HE2  PHE  34           2HE      PHE  34  -4.920  12.788   0.926
  282    HZ   PHE  34           HZ       PHE  34  -4.031  11.217   2.618
  283    H    GLU  35           H        GLU  35  -1.134   9.892  -4.921
  284    HA   GLU  35           HA       GLU  35  -2.688   9.030  -7.237
  285   1HB   GLU  35          2HB       GLU  35  -1.230  11.159  -7.049
  286   2HB   GLU  35          1HB       GLU  35   0.153  10.110  -7.200
  287   1HG   GLU  35          2HG       GLU  35  -0.292  10.832  -9.377
  288   2HG   GLU  35          1HG       GLU  35  -0.967   9.204  -9.345
  289    H    VAL  36           H        VAL  36   0.653   8.210  -6.044
  290    HA   VAL  36           HA       VAL  36   0.913   5.797  -7.660
  291    HB   VAL  36           HB       VAL  36   2.808   7.111  -7.287
  292   1HG1  VAL  36          1HG1      VAL  36   3.836   7.306  -5.113
  293   2HG1  VAL  36          2HG1      VAL  36   2.243   8.099  -5.112
  294   3HG1  VAL  36          3HG1      VAL  36   2.444   6.505  -4.348
  295   1HG2  VAL  36          1HG2      VAL  36   4.341   5.483  -6.592
  296   2HG2  VAL  36          2HG2      VAL  36   3.020   4.457  -5.984
  297   3HG2  VAL  36          3HG2      VAL  36   3.128   4.833  -7.720
  298    H    LEU  37           H        LEU  37  -0.284   6.405  -4.338
  299    HA   LEU  37           HA       LEU  37  -0.620   3.579  -3.716
  300   1HB   LEU  37          2HB       LEU  37  -0.174   5.593  -2.183
  301   2HB   LEU  37          1HB       LEU  37  -1.939   5.894  -2.368
  302    HG   LEU  37           HG       LEU  37  -2.066   3.362  -1.602
  303   1HD1  LEU  37          1HD1      LEU  37  -0.378   2.874   0.109
  304   2HD1  LEU  37          2HD1      LEU  37   0.364   3.019  -1.502
  305   3HD1  LEU  37          3HD1      LEU  37   0.508   4.353  -0.333
  306   1HD2  LEU  37          1HD2      LEU  37  -2.346   4.219   0.706
  307   2HD2  LEU  37          2HD2      LEU  37  -1.509   5.721   0.250
  308   3HD2  LEU  37          3HD2      LEU  37  -3.083   5.324  -0.480
  309    H    GLU  38           H        GLU  38  -2.624   6.064  -5.384
  310    HA   GLU  38           HA       GLU  38  -5.201   5.049  -5.152
  311   1HB   GLU  38          2HB       GLU  38  -3.858   6.786  -6.982
  312   2HB   GLU  38          1HB       GLU  38  -4.868   5.663  -7.868
  313   1HG   GLU  38          2HG       GLU  38  -6.343   6.506  -5.562
  314   2HG   GLU  38          1HG       GLU  38  -5.656   7.935  -6.350
  315    HA   PRO  39           HA       PRO  39  -4.423   1.543  -8.343
  316   1HB   PRO  39          2HB       PRO  39  -2.000   0.872  -9.194
  317   2HB   PRO  39          1HB       PRO  39  -2.945   2.124  -9.996
  318   1HG   PRO  39          2HG       PRO  39  -0.697   2.465  -7.955
  319   2HG   PRO  39          1HG       PRO  39  -0.932   3.332  -9.470
  320   1HD   PRO  39          1HD       PRO  39  -1.812   4.363  -7.028
  321   2HD   PRO  39          2HD       PRO  39  -2.712   4.686  -8.566
  322    H    LEU  40           H        LEU  40  -2.367   2.119  -5.490
  323    HA   LEU  40           HA       LEU  40  -1.771  -0.715  -4.937
  324   1HB   LEU  40          2HB       LEU  40  -1.593   1.632  -3.138
  325   2HB   LEU  40          1HB       LEU  40  -0.922  -0.026  -2.940
  326    HG   LEU  40           HG       LEU  40  -0.029   2.151  -4.819
  327   1HD1  LEU  40          1HD1      LEU  40   2.093   1.770  -3.516
  328   2HD1  LEU  40          2HD1      LEU  40   0.739   2.196  -2.441
  329   3HD1  LEU  40          3HD1      LEU  40   1.266   0.501  -2.582
  330   1HD2  LEU  40          1HD2      LEU  40   1.725   0.653  -5.618
  331   2HD2  LEU  40          2HD2      LEU  40   1.002  -0.696  -4.708
  332   3HD2  LEU  40          3HD2      LEU  40   0.110   0.046  -6.058
  333    H    HIS  41           H        HIS  41  -4.479   1.450  -4.465
  334    HA   HIS  41           HA       HIS  41  -5.837  -0.188  -2.480
  335   1HB   HIS  41          2HB       HIS  41  -6.196   2.205  -2.622
  336   2HB   HIS  41          1HB       HIS  41  -6.668   2.058  -4.344
  337    HD1  HIS  41           1HD      HIS  41  -8.073   0.212  -1.226
  338    HD2  HIS  41           2HD      HIS  41  -9.116   2.412  -4.579
  339    HE1  HIS  41           1HE      HIS  41 -10.599  -0.052  -1.486
  340    H    ALA  42           H        ALA  42  -6.032   0.322  -6.033
  341    HA   ALA  42           HA       ALA  42  -8.310  -1.472  -6.419
  342   1HB   ALA  42          1HB       ALA  42  -8.020  -0.939  -8.736
  343   2HB   ALA  42          2HB       ALA  42  -8.079   0.529  -7.734
  344   3HB   ALA  42          3HB       ALA  42  -6.522  -0.052  -8.369
  345    H    MET  43           H        MET  43  -4.752  -1.596  -7.184
  346    HA   MET  43           HA       MET  43  -4.725  -4.250  -8.242
  347   1HB   MET  43          2HB       MET  43  -2.468  -4.101  -8.167
  348   2HB   MET  43          1HB       MET  43  -2.983  -2.395  -8.355
  349   1HG   MET  43          2HG       MET  43  -2.506  -1.963  -5.975
  350   2HG   MET  43          1HG       MET  43  -2.160  -3.645  -5.683
  351   1HE   MET  43          1HE       MET  43   1.385  -3.218  -5.397
  352   2HE   MET  43          2HE       MET  43  -0.078  -2.759  -4.493
  353   3HE   MET  43          3HE       MET  43   0.009  -4.343  -5.301
  354    H    MET  44           H        MET  44  -5.204  -3.103  -4.951
  355    HA   MET  44           HA       MET  44  -4.385  -5.737  -3.825
  356   1HB   MET  44          2HB       MET  44  -3.414  -3.643  -2.999
  357   2HB   MET  44          1HB       MET  44  -5.049  -3.196  -2.413
  358   1HG   MET  44          2HG       MET  44  -3.783  -5.815  -1.537
  359   2HG   MET  44          1HG       MET  44  -3.367  -4.330  -0.727
  360   1HE   MET  44          1HE       MET  44  -6.557  -7.003   0.409
  361   2HE   MET  44          2HE       MET  44  -5.793  -7.148  -1.192
  362   3HE   MET  44          3HE       MET  44  -4.784  -7.087   0.273
  363    H    GLU  45           H        GLU  45  -7.179  -3.974  -4.928
  364    HA   GLU  45           HA       GLU  45  -9.063  -5.522  -3.188
  365   1HB   GLU  45          2HB       GLU  45  -9.121  -2.952  -3.264
  366   2HB   GLU  45          1HB       GLU  45  -9.719  -3.110  -4.883
  367   1HG   GLU  45          2HG       GLU  45 -10.987  -4.552  -2.580
  368   2HG   GLU  45          1HG       GLU  45 -11.384  -2.869  -3.053
  369    H    ARG  46           H        ARG  46  -8.293  -4.814  -6.658
  370    HA   ARG  46           HA       ARG  46 -10.276  -6.173  -8.002
  371   1HB   ARG  46          2HB       ARG  46  -7.951  -4.860  -8.595
  372   2HB   ARG  46          1HB       ARG  46  -7.465  -6.519  -8.928
  373   1HG   ARG  46          2HG       ARG  46  -9.253  -6.812 -10.524
  374   2HG   ARG  46          1HG       ARG  46 -10.018  -5.298 -10.043
  375   1HD   ARG  46          2HD       ARG  46  -8.298  -3.986 -11.009
  376   2HD   ARG  46          1HD       ARG  46  -7.192  -5.375 -11.132
  377    HE   ARG  46           HE       ARG  46  -9.307  -4.636 -12.958
  378   1HH1  ARG  46          2HH2      ARG  46  -7.528  -7.425 -11.783
  379   2HH1  ARG  46          1HH2      ARG  46  -7.799  -8.370 -13.209
  380   1HH2  ARG  46          2HH1      ARG  46  -9.678  -5.933 -14.824
  381   2HH2  ARG  46          1HH1      ARG  46  -9.010  -7.529 -14.883
  382    H    GLY  47           H        GLY  47  -7.494  -7.603  -6.225
  383   1HA   GLY  47          2HA       GLY  47  -7.815  -9.689  -5.113
  384   2HA   GLY  47          1HA       GLY  47  -8.860 -10.235  -6.423
  385    HA   PRO  48           HA       PRO  48  -4.251 -11.306  -7.219
  386   1HB   PRO  48          2HB       PRO  48  -4.034 -13.717  -6.207
  387   2HB   PRO  48          1HB       PRO  48  -3.658 -12.186  -5.273
  388   1HG   PRO  48          2HG       PRO  48  -6.185 -13.961  -5.132
  389   2HG   PRO  48          1HG       PRO  48  -5.289 -13.289  -3.769
  390   1HD   PRO  48          1HD       PRO  48  -7.517 -11.971  -4.895
  391   2HD   PRO  48          2HD       PRO  48  -6.116 -11.026  -4.198
  392    H    GLN  49           H        GLN  49  -3.611 -12.733  -8.815
  393    HA   GLN  49           HA       GLN  49  -5.816 -14.133 -10.241
  394   1HB   GLN  49          2HB       GLN  49  -4.918 -12.332 -11.569
  395   2HB   GLN  49          1HB       GLN  49  -3.277 -12.831 -11.283
  396   1HG   GLN  49          2HG       GLN  49  -3.408 -14.056 -13.187
  397   2HG   GLN  49          1HG       GLN  49  -4.540 -15.121 -12.423
  398   1HE2  GLN  49          2HE2      GLN  49  -6.169 -15.513 -13.704
  399   2HE2  GLN  49          1HE2      GLN  49  -6.890 -14.305 -14.733
  400    H    THR  50           H        THR  50  -2.338 -14.535 -10.632
  401    HA   THR  50           HA       THR  50  -2.203 -17.275 -10.967
  402    HB   THR  50           HB       THR  50  -0.493 -16.311 -11.855
  403    HG1  THR  50           1HG      THR  50   1.397 -17.030 -10.675
  404   1HG2  THR  50          1HG2      THR  50   1.093 -14.739 -10.850
  405   2HG2  THR  50          2HG2      THR  50  -0.560 -14.081 -10.833
  406   3HG2  THR  50          3HG2      THR  50   0.151 -14.736  -9.340
  407    H    LEU  51           H        LEU  51  -0.324 -16.163  -8.339
  408    HA   LEU  51           HA       LEU  51  -1.548 -16.821  -5.905
  409   1HB   LEU  51          2HB       LEU  51  -0.916 -19.208  -7.424
  410   2HB   LEU  51          1HB       LEU  51  -0.077 -19.132  -5.863
  411    HG   LEU  51           HG       LEU  51  -2.918 -18.263  -5.811
  412   1HD1  LEU  51          1HD1      LEU  51  -3.787 -20.565  -5.833
  413   2HD1  LEU  51          2HD1      LEU  51  -3.078 -20.125  -7.405
  414   3HD1  LEU  51          3HD1      LEU  51  -2.177 -21.173  -6.285
  415   1HD2  LEU  51          1HD2      LEU  51  -2.855 -19.611  -3.730
  416   2HD2  LEU  51          2HD2      LEU  51  -1.226 -20.189  -4.154
  417   3HD2  LEU  51          3HD2      LEU  51  -1.494 -18.467  -3.792
  418    H    LYS  52           H        LYS  52   0.285 -14.911  -6.891
  419    HA   LYS  52           HA       LYS  52   2.788 -15.630  -5.411
  420   1HB   LYS  52          2HB       LYS  52   2.713 -13.909  -7.843
  421   2HB   LYS  52          1HB       LYS  52   4.126 -14.422  -6.864
  422   1HG   LYS  52          2HG       LYS  52   3.153 -16.869  -7.609
  423   2HG   LYS  52          1HG       LYS  52   2.633 -15.929  -8.984
  424   1HD   LYS  52          2HD       LYS  52   4.685 -16.398  -9.751
  425   2HD   LYS  52          1HD       LYS  52   5.191 -15.030  -8.743
  426   1HE   LYS  52          2HE       LYS  52   5.616 -16.665  -6.838
  427   2HE   LYS  52          1HE       LYS  52   5.235 -17.986  -7.922
  428   1HZ   LYS  52          1HZ       LYS  52   7.492 -17.687  -7.841
  429   2HZ   LYS  52          2HZ       LYS  52   7.028 -17.189  -9.326
  430   3HZ   LYS  52          3HZ       LYS  52   7.411 -16.094  -8.172
  431    H    GLU  53           H        GLU  53   0.879 -12.819  -6.673
  432    HA   GLU  53           HA       GLU  53   1.623 -11.064  -4.584
  433   1HB   GLU  53          2HB       GLU  53  -0.011  -9.566  -5.508
  434   2HB   GLU  53          1HB       GLU  53   1.133 -10.251  -6.707
  435   1HG   GLU  53          2HG       GLU  53  -1.243 -11.884  -6.685
  436   2HG   GLU  53          1HG       GLU  53  -1.737 -10.208  -6.826
  437    H    THR  54           H        THR  54   0.984 -13.004  -2.989
  438    HA   THR  54           HA       THR  54  -1.348 -12.183  -1.407
  439    HB   THR  54           HB       THR  54  -1.456 -14.767  -2.881
  440    HG1  THR  54           1HG      THR  54  -2.374 -12.194  -3.279
  441   1HG2  THR  54          1HG2      THR  54  -3.621 -15.161  -1.834
  442   2HG2  THR  54          2HG2      THR  54  -2.313 -15.167  -0.627
  443   3HG2  THR  54          3HG2      THR  54  -3.381 -13.752  -0.774
  444    H    SER  55           H        SER  55   1.401 -12.116  -0.873
  445    HA   SER  55           HA       SER  55   1.731 -14.237   1.261
  446   1HB   SER  55          2HB       SER  55   3.781 -12.680  -0.235
  447   2HB   SER  55          1HB       SER  55   4.070 -13.609   1.263
  448    HG   SER  55           HG       SER  55   4.462 -15.064  -0.402
  449    H    PHE  56           H        PHE  56   0.796 -11.112   0.778
  450    HA   PHE  56           HA       PHE  56   1.589 -10.104   3.462
  451   1HB   PHE  56          2HB       PHE  56   1.121  -7.912   2.293
  452   2HB   PHE  56          1HB       PHE  56   2.628  -8.796   1.894
  453    HD1  PHE  56           1HD      PHE  56  -0.492  -7.407   0.569
  454    HD2  PHE  56           2HD      PHE  56   2.739 -10.126  -0.195
  455    HE1  PHE  56           1HE      PHE  56  -0.954  -7.281  -1.859
  456    HE2  PHE  56           2HE      PHE  56   2.109 -10.208  -2.589
  457    HZ   PHE  56           HZ       PHE  56   0.272  -8.744  -3.431
  458    H    ASN  57           H        ASN  57  -1.214 -10.339   1.116
  459    HA   ASN  57           HA       ASN  57  -3.149  -9.339   3.009
  460   1HB   ASN  57          2HB       ASN  57  -3.467  -9.285   0.567
  461   2HB   ASN  57          1HB       ASN  57  -3.506 -11.025   0.521
  462   1HD2  ASN  57          2HD2      ASN  57  -5.569 -11.057  -0.304
  463   2HD2  ASN  57          1HD2      ASN  57  -6.917 -10.705   0.742
  464    H    GLN  58           H        GLN  58  -1.581 -12.500   2.652
  465    HA   GLN  58           HA       GLN  58  -3.665 -14.021   4.056
  466   1HB   GLN  58          2HB       GLN  58  -2.004 -14.792   2.185
  467   2HB   GLN  58          1HB       GLN  58  -0.897 -15.000   3.527
  468   1HG   GLN  58          2HG       GLN  58  -2.132 -17.085   3.117
  469   2HG   GLN  58          1HG       GLN  58  -2.595 -16.454   4.681
  470   1HE2  GLN  58          2HE2      GLN  58  -4.699 -16.548   5.095
  471   2HE2  GLN  58          1HE2      GLN  58  -5.934 -16.501   3.863
  472    H    ALA  59           H        ALA  59  -0.905 -12.094   4.956
  473    HA   ALA  59           HA       ALA  59  -0.919 -13.168   7.750
  474   1HB   ALA  59          1HB       ALA  59   1.410 -12.508   7.868
  475   2HB   ALA  59          2HB       ALA  59   1.133 -13.723   6.596
  476   3HB   ALA  59          3HB       ALA  59   1.369 -12.015   6.158
  477    H    TYR  60           H        TYR  60   0.132 -10.306   5.938
  478    HA   TYR  60           HA       TYR  60  -0.763  -8.366   8.033
  479   1HB   TYR  60          2HB       TYR  60   0.729  -8.056   5.374
  480   2HB   TYR  60          1HB       TYR  60   0.369  -6.744   6.446
  481    HD1  TYR  60           1HD      TYR  60   2.709  -9.182   5.548
  482    HD2  TYR  60           2HD      TYR  60   1.185  -7.007   8.932
  483    HE1  TYR  60           1HE      TYR  60   4.880  -9.441   6.699
  484    HE2  TYR  60           2HE      TYR  60   3.341  -7.257  10.077
  485    HH   TYR  60           HH       TYR  60   5.304  -8.292  10.076
  486    H    GLY  61           H        GLY  61  -2.975  -9.840   6.994
  487   1HA   GLY  61          2HA       GLY  61  -4.440  -8.485   4.920
  488   2HA   GLY  61          1HA       GLY  61  -5.091  -9.540   6.153
  489    H    ARG  62           H        ARG  62  -3.882  -7.812   8.315
  490    HA   ARG  62           HA       ARG  62  -5.979  -5.746   8.377
  491   1HB   ARG  62          2HB       ARG  62  -4.436  -7.293  10.375
  492   2HB   ARG  62          1HB       ARG  62  -4.888  -5.627  10.809
  493   1HG   ARG  62          2HG       ARG  62  -7.238  -6.085  10.385
  494   2HG   ARG  62          1HG       ARG  62  -6.860  -7.669   9.688
  495   1HD   ARG  62          2HD       ARG  62  -6.149  -8.532  11.821
  496   2HD   ARG  62          1HD       ARG  62  -6.191  -6.916  12.557
  497    HE   ARG  62           HE       ARG  62  -8.433  -8.680  12.008
  498   1HH1  ARG  62          2HH2      ARG  62  -7.561  -5.344  12.687
  499   2HH1  ARG  62          1HH2      ARG  62  -9.141  -4.917  13.263
  500   1HH2  ARG  62          2HH1      ARG  62 -10.496  -8.075  12.776
  501   2HH2  ARG  62          1HH1      ARG  62 -10.766  -6.451  13.307
  502    H    ASP  63           H        ASP  63  -2.822  -5.888   7.317
  503    HA   ASP  63           HA       ASP  63  -1.902  -3.347   8.485
  504   1HB   ASP  63          2HB       ASP  63  -0.560  -5.552   8.146
  505   2HB   ASP  63          1HB       ASP  63  -0.413  -4.995   6.474
  506    H    LEU  64           H        LEU  64  -0.501  -2.715   5.784
  507    HA   LEU  64           HA       LEU  64  -1.768  -0.906   4.541
  508   1HB   LEU  64          2HB       LEU  64   0.326  -2.284   3.819
  509   2HB   LEU  64          1HB       LEU  64  -0.828  -2.955   2.617
  510    HG   LEU  64           HG       LEU  64  -0.024  -0.068   2.984
  511   1HD1  LEU  64          1HD1      LEU  64   0.898  -0.472   0.666
  512   2HD1  LEU  64          2HD1      LEU  64   1.610  -1.590   1.853
  513   3HD1  LEU  64          3HD1      LEU  64   0.325  -2.154   0.758
  514   1HD2  LEU  64          1HD2      LEU  64  -1.242   0.478   0.950
  515   2HD2  LEU  64          2HD2      LEU  64  -1.912  -1.170   0.892
  516   3HD2  LEU  64          3HD2      LEU  64  -2.344  -0.080   2.231
  517    H    MET  65           H        MET  65  -2.674  -4.313   3.613
  518    HA   MET  65           HA       MET  65  -4.773  -4.094   1.909
  519   1HB   MET  65          2HB       MET  65  -3.974  -6.124   2.928
  520   2HB   MET  65          1HB       MET  65  -4.631  -5.604   4.519
  521   1HG   MET  65          2HG       MET  65  -6.280  -6.205   2.068
  522   2HG   MET  65          1HG       MET  65  -5.946  -7.357   3.411
  523   1HE   MET  65          1HE       MET  65  -9.602  -6.953   4.271
  524   2HE   MET  65          2HE       MET  65  -8.791  -7.327   2.731
  525   3HE   MET  65          3HE       MET  65  -8.174  -8.017   4.251
  526    H    GLU  66           H        GLU  66  -5.182  -3.634   5.446
  527    HA   GLU  66           HA       GLU  66  -7.883  -2.485   5.188
  528   1HB   GLU  66          2HB       GLU  66  -7.231  -4.222   6.905
  529   2HB   GLU  66          1HB       GLU  66  -6.284  -2.979   7.691
  530   1HG   GLU  66          2HG       GLU  66  -8.083  -2.283   8.707
  531   2HG   GLU  66          1HG       GLU  66  -8.788  -1.818   7.120
  532    H    ALA  67           H        ALA  67  -4.542  -1.428   5.986
  533    HA   ALA  67           HA       ALA  67  -5.029   1.197   6.839
  534   1HB   ALA  67          1HB       ALA  67  -2.700   1.614   6.113
  535   2HB   ALA  67          2HB       ALA  67  -2.850   0.082   7.006
  536   3HB   ALA  67          3HB       ALA  67  -2.706   0.068   5.231
  537    H    GLN  68           H        GLN  68  -5.158  -0.129   3.618
  538    HA   GLN  68           HA       GLN  68  -5.569   2.531   2.323
  539   1HB   GLN  68          2HB       GLN  68  -3.785   1.099   1.376
  540   2HB   GLN  68          1HB       GLN  68  -4.878  -0.253   1.259
  541   1HG   GLN  68          2HG       GLN  68  -5.514   0.463  -0.798
  542   2HG   GLN  68          1HG       GLN  68  -6.106   1.951  -0.150
  543   1HE2  GLN  68          2HE2      GLN  68  -5.436   3.550  -1.305
  544   2HE2  GLN  68          1HE2      GLN  68  -3.832   3.624  -1.991
  545    H    GLU  69           H        GLU  69  -7.195  -0.690   2.816
  546    HA   GLU  69           HA       GLU  69  -9.340  -0.475   1.076
  547   1HB   GLU  69          2HB       GLU  69 -10.468  -2.060   2.355
  548   2HB   GLU  69          1HB       GLU  69  -8.818  -2.393   2.745
  549   1HG   GLU  69          2HG       GLU  69  -9.040  -1.204   4.899
  550   2HG   GLU  69          1HG       GLU  69 -10.655  -0.719   4.504
  551    H    TRP  70           H        TRP  70  -8.840   1.360   4.045
  552    HA   TRP  70           HA       TRP  70 -11.355   2.653   4.325
  553   1HB   TRP  70          2HB       TRP  70  -8.531   3.507   5.005
  554   2HB   TRP  70          1HB       TRP  70 -10.053   4.180   5.678
  555    HD1  TRP  70           HD       TRP  70  -7.415   2.411   6.949
  556    HE1  TRP  70           1HE      TRP  70  -7.985   0.583   8.605
  557    HE3  TRP  70           3HE      TRP  70 -12.356   2.041   5.997
  558    HZ2  TRP  70           2HZ      TRP  70 -10.225  -0.997   9.251
  559    HZ3  TRP  70           3HZ      TRP  70 -13.654   0.159   6.957
  560    HH2  TRP  70           HH       TRP  70 -12.616  -1.266   8.706
  561    H    CYS  71           H        CYS  71 -10.916   2.550   1.580
  562    HA   CYS  71           HA       CYS  71  -9.998   5.091   0.518
  563   1HB   CYS  71          2HB       CYS  71  -9.947   2.999  -0.843
  564   2HB   CYS  71          1HB       CYS  71 -11.695   2.971  -0.841
  565    HG   CYS  71           HG       CYS  71 -10.909   3.776  -3.117
  566    H    ARG  72           H        ARG  72 -13.302   3.559   0.975
  567    HA   ARG  72           HA       ARG  72 -14.840   5.868   0.317
  568   1HB   ARG  72          2HB       ARG  72 -15.604   3.462   0.501
  569   2HB   ARG  72          1HB       ARG  72 -15.686   3.719   2.234
  570   1HG   ARG  72          2HG       ARG  72 -17.006   5.866   0.632
  571   2HG   ARG  72          1HG       ARG  72 -17.744   4.294   0.501
  572   1HD   ARG  72          2HD       ARG  72 -17.028   5.209   3.238
  573   2HD   ARG  72          1HD       ARG  72 -18.369   6.021   2.391
  574    HE   ARG  72           HE       ARG  72 -18.740   3.301   1.988
  575   1HH1  ARG  72          2HH2      ARG  72 -18.685   5.371   4.830
  576   2HH1  ARG  72          1HH2      ARG  72 -19.830   4.404   5.702
  577   1HH2  ARG  72          2HH1      ARG  72 -20.252   2.072   3.167
  578   2HH2  ARG  72          1HH1      ARG  72 -20.693   2.566   4.764
  579    H    LYS  73           H        LYS  73 -12.835   5.235   3.049
  580    HA   LYS  73           HA       LYS  73 -14.163   7.159   4.859
  581   1HB   LYS  73          2HB       LYS  73 -12.794   4.739   5.271
  582   2HB   LYS  73          1HB       LYS  73 -11.697   5.984   5.825
  583   1HG   LYS  73          2HG       LYS  73 -14.564   6.262   6.656
  584   2HG   LYS  73          1HG       LYS  73 -13.615   4.976   7.391
  585   1HD   LYS  73          2HD       LYS  73 -11.865   6.729   8.038
  586   2HD   LYS  73          1HD       LYS  73 -12.913   7.962   7.427
  587   1HE   LYS  73          2HE       LYS  73 -13.839   6.051   9.599
  588   2HE   LYS  73          1HE       LYS  73 -13.008   7.537   9.930
  589   1HZ   LYS  73          1HZ       LYS  73 -15.327   7.679  10.025
  590   2HZ   LYS  73          2HZ       LYS  73 -14.745   8.718   8.926
  591   3HZ   LYS  73          3HZ       LYS  73 -15.482   7.353   8.435
  592    H    TYR  74           H        TYR  74 -10.893   6.576   3.356
  593    HA   TYR  74           HA       TYR  74  -9.890   9.220   3.769
  594   1HB   TYR  74          2HB       TYR  74  -8.304   7.745   3.312
  595   2HB   TYR  74          1HB       TYR  74  -9.295   6.873   2.093
  596    HD1  TYR  74           1HD      TYR  74  -7.889  10.370   2.390
  597    HD2  TYR  74           2HD      TYR  74  -8.602   6.890  -0.005
  598    HE1  TYR  74           1HE      TYR  74  -6.911  11.509   0.452
  599    HE2  TYR  74           2HE      TYR  74  -7.390   7.934  -1.895
  600    HH   TYR  74           HH       TYR  74  -6.563   9.881  -2.691
  601    H    MET  75           H        MET  75 -12.136   8.082   1.269
  602    HA   MET  75           HA       MET  75 -12.009  10.440  -0.452
  603   1HB   MET  75          2HB       MET  75 -13.468   7.837  -0.334
  604   2HB   MET  75          1HB       MET  75 -14.154   9.161  -1.271
  605   1HG   MET  75          2HG       MET  75 -11.230   8.472  -1.612
  606   2HG   MET  75          1HG       MET  75 -12.466   7.504  -2.411
  607   1HE   MET  75          1HE       MET  75 -10.583  10.736  -4.465
  608   2HE   MET  75          2HE       MET  75 -10.151  10.346  -2.784
  609   3HE   MET  75          3HE       MET  75 -10.229   9.053  -4.005
  610    H    LYS  76           H        LYS  76 -14.515   9.182   1.842
  611    HA   LYS  76           HA       LYS  76 -16.061  11.672   1.474
  612   1HB   LYS  76          2HB       LYS  76 -16.777   9.083   1.691
  613   2HB   LYS  76          1HB       LYS  76 -16.918   9.604   3.383
  614   1HG   LYS  76          2HG       LYS  76 -18.343  11.507   2.693
  615   2HG   LYS  76          1HG       LYS  76 -18.170  11.041   0.995
  616   1HD   LYS  76          2HD       LYS  76 -19.187   8.793   1.602
  617   2HD   LYS  76          1HD       LYS  76 -19.535   9.461   3.205
  618   1HE   LYS  76          2HE       LYS  76 -20.881  11.264   2.177
  619   2HE   LYS  76          1HE       LYS  76 -20.507  10.637   0.564
  620   1HZ   LYS  76          1HZ       LYS  76 -22.584   9.850   1.293
  621   2HZ   LYS  76          2HZ       LYS  76 -21.550   8.583   1.232
  622   3HZ   LYS  76          3HZ       LYS  76 -21.957   9.239   2.672
  623    H    SER  77           H        SER  77 -14.292   9.950   4.088
  624    HA   SER  77           HA       SER  77 -14.927  11.983   6.094
  625   1HB   SER  77          2HB       SER  77 -14.626   9.486   6.503
  626   2HB   SER  77          1HB       SER  77 -12.874   9.794   6.287
  627    HG   SER  77           HG       SER  77 -13.527   9.808   8.494
  628    H    GLY  78           H        GLY  78 -12.169  10.974   3.880
  629   1HA   GLY  78          2HA       GLY  78 -10.204  12.038   3.312
  630   2HA   GLY  78          1HA       GLY  78 -11.138  13.502   3.377
  631    H    ASN  79           H        ASN  79 -10.493  11.423   6.153
  632    HA   ASN  79           HA       ASN  79  -9.285  13.774   7.425
  633   1HB   ASN  79          2HB       ASN  79 -11.381  11.929   8.180
  634   2HB   ASN  79          1HB       ASN  79 -10.058  11.722   9.320
  635   1HD2  ASN  79          2HD2      ASN  79 -12.840  13.104   9.283
  636   2HD2  ASN  79          1HD2      ASN  79 -12.475  14.610  10.077
  637    H    VAL  80           H        VAL  80  -7.273  13.662   8.123
  638    HA   VAL  80           HA       VAL  80  -5.383  11.684   7.614
  639    HB   VAL  80           HB       VAL  80  -5.224  13.744   9.820
  640   1HG1  VAL  80          1HG1      VAL  80  -2.851  13.459   9.606
  641   2HG1  VAL  80          2HG1      VAL  80  -3.600  11.926  10.114
  642   3HG1  VAL  80          3HG1      VAL  80  -3.074  12.144   8.427
  643   1HG2  VAL  80          1HG2      VAL  80  -3.980  14.998   8.169
  644   2HG2  VAL  80          2HG2      VAL  80  -4.287  13.748   6.940
  645   3HG2  VAL  80          3HG2      VAL  80  -5.637  14.708   7.590
  646    H    LYS  81           H        LYS  81  -7.919  11.609  10.108
  647    HA   LYS  81           HA       LYS  81  -7.006   9.796  11.930
  648   1HB   LYS  81          2HB       LYS  81  -9.807   9.855  10.776
  649   2HB   LYS  81          1HB       LYS  81  -9.332   9.217  12.312
  650   1HG   LYS  81          2HG       LYS  81  -9.340  12.065  11.404
  651   2HG   LYS  81          1HG       LYS  81 -10.221  11.279  12.751
  652   1HD   LYS  81          2HD       LYS  81  -8.001  11.006  13.948
  653   2HD   LYS  81          1HD       LYS  81  -7.224  11.908  12.667
  654   1HE   LYS  81          2HE       LYS  81  -9.506  13.444  13.629
  655   2HE   LYS  81          1HE       LYS  81  -8.514  12.968  14.972
  656   1HZ   LYS  81          1HZ       LYS  81  -7.783  14.921  14.180
  657   2HZ   LYS  81          2HZ       LYS  81  -6.635  13.852  13.730
  658   3HZ   LYS  81          3HZ       LYS  81  -7.697  14.444  12.630
  659    H    ASP  82           H        ASP  82  -7.682   9.119   8.532
  660    HA   ASP  82           HA       ASP  82  -7.365   6.176   8.771
  661   1HB   ASP  82          2HB       ASP  82  -7.673   7.995   6.364
  662   2HB   ASP  82          1HB       ASP  82  -7.558   6.244   6.319
  663    H    LEU  83           H        LEU  83  -5.445   9.040   7.879
  664    HA   LEU  83           HA       LEU  83  -3.238   7.568   6.726
  665   1HB   LEU  83          2HB       LEU  83  -4.067  10.347   6.969
  666   2HB   LEU  83          1HB       LEU  83  -2.306  10.062   7.144
  667    HG   LEU  83           HG       LEU  83  -2.865  10.528   4.772
  668   1HD1  LEU  83          1HD1      LEU  83  -1.833   8.635   3.757
  669   2HD1  LEU  83          2HD1      LEU  83  -0.997   9.125   5.250
  670   3HD1  LEU  83          3HD1      LEU  83  -2.049   7.689   5.249
  671   1HD2  LEU  83          1HD2      LEU  83  -4.252   9.026   3.480
  672   2HD2  LEU  83          2HD2      LEU  83  -4.653   8.092   4.940
  673   3HD2  LEU  83          3HD2      LEU  83  -5.207   9.776   4.782
  674    H    THR  84           H        THR  84  -3.711   9.496   9.754
  675    HA   THR  84           HA       THR  84  -1.326   9.062  11.133
  676    HB   THR  84           HB       THR  84  -3.059  10.532  11.870
  677    HG1  THR  84           1HG      THR  84  -2.917   9.773  14.164
  678   1HG2  THR  84          1HG2      THR  84  -4.929   9.761  13.241
  679   2HG2  THR  84          2HG2      THR  84  -5.102   9.218  11.555
  680   3HG2  THR  84          3HG2      THR  84  -4.566   8.073  12.807
  681    H    GLN  85           H        GLN  85  -4.157   6.817  10.981
  682    HA   GLN  85           HA       GLN  85  -2.871   4.659  12.449
  683   1HB   GLN  85          2HB       GLN  85  -5.385   5.363  11.395
  684   2HB   GLN  85          1HB       GLN  85  -4.886   3.724  10.821
  685   1HG   GLN  85          2HG       GLN  85  -4.703   2.880  13.064
  686   2HG   GLN  85          1HG       GLN  85  -4.354   4.453  13.734
  687   1HE2  GLN  85          2HE2      GLN  85  -6.119   2.576  14.800
  688   2HE2  GLN  85          1HE2      GLN  85  -7.693   3.336  14.756
  689    H    ALA  86           H        ALA  86  -3.334   5.385   8.973
  690    HA   ALA  86           HA       ALA  86  -2.158   3.011   7.942
  691   1HB   ALA  86          1HB       ALA  86  -1.915   4.263   5.890
  692   2HB   ALA  86          2HB       ALA  86  -3.546   4.441   6.581
  693   3HB   ALA  86          3HB       ALA  86  -2.364   5.763   6.736
  694    H    TRP  87           H        TRP  87  -0.736   5.984   9.385
  695    HA   TRP  87           HA       TRP  87   1.897   5.705   8.420
  696   1HB   TRP  87          2HB       TRP  87   0.692   7.648   9.703
  697   2HB   TRP  87          1HB       TRP  87   1.256   6.807  11.144
  698    HD1  TRP  87           HD       TRP  87   3.597   7.579  11.900
  699    HE1  TRP  87           1HE      TRP  87   5.525   8.819  10.811
  700    HE3  TRP  87           3HE      TRP  87   1.767   7.808   7.221
  701    HZ2  TRP  87           2HZ      TRP  87   6.179   9.773   8.216
  702    HZ3  TRP  87           3HZ      TRP  87   3.226   8.545   5.352
  703    HH2  TRP  87           HH       TRP  87   5.403   9.627   5.869
  704    H    ASP  88           H        ASP  88   0.282   4.354  11.361
  705    HA   ASP  88           HA       ASP  88   2.653   2.991  12.333
  706   1HB   ASP  88          2HB       ASP  88   0.501   3.673  13.703
  707   2HB   ASP  88          1HB       ASP  88  -0.147   2.178  13.116
  708    H    LEU  89           H        LEU  89  -0.251   2.043  10.333
  709    HA   LEU  89           HA       LEU  89   0.464  -0.759  10.084
  710   1HB   LEU  89          2HB       LEU  89  -1.445   0.913   8.480
  711   2HB   LEU  89          1HB       LEU  89  -1.216  -0.795   8.318
  712    HG   LEU  89           HG       LEU  89  -2.141   0.602  10.854
  713   1HD1  LEU  89          1HD1      LEU  89  -4.247  -0.471  10.347
  714   2HD1  LEU  89          2HD1      LEU  89  -3.772   0.635   9.036
  715   3HD1  LEU  89          3HD1      LEU  89  -3.579  -1.121   8.831
  716   1HD2  LEU  89          1HD2      LEU  89  -2.584  -1.625  11.688
  717   2HD2  LEU  89          2HD2      LEU  89  -1.853  -2.348  10.235
  718   3HD2  LEU  89          3HD2      LEU  89  -0.844  -1.424  11.373
  719    H    TYR  90           H        TYR  90   1.038   2.079   8.050
  720    HA   TYR  90           HA       TYR  90   2.503   0.799   5.921
  721   1HB   TYR  90          2HB       TYR  90   1.584   3.028   5.715
  722   2HB   TYR  90          1HB       TYR  90   2.567   3.595   7.113
  723    HD1  TYR  90           1HD      TYR  90   5.128   3.576   6.808
  724    HD2  TYR  90           2HD      TYR  90   2.275   3.476   3.605
  725    HE1  TYR  90           1HE      TYR  90   6.885   4.279   5.251
  726    HE2  TYR  90           2HE      TYR  90   4.020   4.302   2.070
  727    HH   TYR  90           HH       TYR  90   7.372   4.662   3.057
  728    H    TYR  91           H        TYR  91   3.507   2.269   9.018
  729    HA   TYR  91           HA       TYR  91   6.404   1.993   8.554
  730   1HB   TYR  91          2HB       TYR  91   5.203   3.716  10.069
  731   2HB   TYR  91          1HB       TYR  91   4.924   2.421  11.197
  732    HD1  TYR  91           1HD      TYR  91   6.932   1.121  12.091
  733    HD2  TYR  91           2HD      TYR  91   7.202   4.866  10.006
  734    HE1  TYR  91           1HE      TYR  91   9.077   1.579  13.214
  735    HE2  TYR  91           2HE      TYR  91   9.333   5.352  11.148
  736    HH   TYR  91           HH       TYR  91  10.993   4.497  12.365
  737    H    HIS  92           H        HIS  92   4.002   0.230  10.577
  738    HA   HIS  92           HA       HIS  92   5.666  -1.750  11.659
  739   1HB   HIS  92          2HB       HIS  92   3.271  -1.265  12.341
  740   2HB   HIS  92          1HB       HIS  92   2.717  -1.958  10.831
  741    HD1  HIS  92           1HD      HIS  92   4.917  -3.143  13.720
  742    HD2  HIS  92           2HD      HIS  92   2.118  -4.442  10.961
  743    HE1  HIS  92           1HE      HIS  92   4.525  -5.628  14.227
  744    H    VAL  93           H        VAL  93   3.843  -1.612   8.554
  745    HA   VAL  93           HA       VAL  93   4.782  -4.247   7.669
  746    HB   VAL  93           HB       VAL  93   2.555  -3.087   7.283
  747   1HG1  VAL  93          1HG1      VAL  93   2.255  -2.474   4.947
  748   2HG1  VAL  93          2HG1      VAL  93   3.237  -1.265   5.808
  749   3HG1  VAL  93          3HG1      VAL  93   4.018  -2.432   4.714
  750   1HG2  VAL  93          1HG2      VAL  93   2.285  -4.826   5.624
  751   2HG2  VAL  93          2HG2      VAL  93   4.048  -5.067   5.634
  752   3HG2  VAL  93          3HG2      VAL  93   3.104  -5.335   7.119
  753    H    PHE  94           H        PHE  94   5.456  -0.822   6.637
  754    HA   PHE  94           HA       PHE  94   6.858  -0.142   4.989
  755   1HB   PHE  94          2HB       PHE  94   7.574   0.743   6.947
  756   2HB   PHE  94          1HB       PHE  94   8.220  -0.817   7.549
  757    HD1  PHE  94           1HD      PHE  94  10.479  -0.906   7.753
  758    HD2  PHE  94           2HD      PHE  94   8.765   1.189   4.422
  759    HE1  PHE  94           1HE      PHE  94  12.751  -0.455   6.870
  760    HE2  PHE  94           2HE      PHE  94  11.032   1.681   3.557
  761    HZ   PHE  94           HZ       PHE  94  13.028   0.852   4.778
  762    H    ARG  95           H        ARG  95   9.360  -2.164   6.224
  763    HA   ARG  95           HA       ARG  95   9.806  -3.677   3.715
  764   1HB   ARG  95          2HB       ARG  95  11.363  -2.572   5.864
  765   2HB   ARG  95          1HB       ARG  95  11.647  -4.318   5.714
  766   1HG   ARG  95          2HG       ARG  95  11.476  -3.203   3.080
  767   2HG   ARG  95          1HG       ARG  95  12.608  -2.218   4.047
  768   1HD   ARG  95          2HD       ARG  95  13.201  -4.836   4.794
  769   2HD   ARG  95          1HD       ARG  95  12.891  -4.958   3.034
  770    HE   ARG  95           HE       ARG  95  15.071  -3.574   4.374
  771   1HH1  ARG  95          2HH2      ARG  95  13.258  -3.625   1.371
  772   2HH1  ARG  95          1HH2      ARG  95  14.528  -2.875   0.449
  773   1HH2  ARG  95          2HH1      ARG  95  16.671  -2.537   3.157
  774   2HH2  ARG  95          1HH1      ARG  95  16.419  -2.245   1.471
  775    H    ARG  96           H        ARG  96   8.578  -4.350   7.013
  776    HA   ARG  96           HA       ARG  96   8.910  -7.061   7.305
  777   1HB   ARG  96          2HB       ARG  96   6.918  -5.005   8.109
  778   2HB   ARG  96          1HB       ARG  96   6.224  -6.614   7.984
  779   1HG   ARG  96          2HG       ARG  96   7.065  -6.191  10.246
  780   2HG   ARG  96          1HG       ARG  96   7.982  -7.493   9.495
  781   1HD   ARG  96          2HD       ARG  96   9.784  -5.983   8.949
  782   2HD   ARG  96          1HD       ARG  96   8.839  -4.597   9.589
  783    HE   ARG  96           HE       ARG  96  10.224  -6.667  11.103
  784   1HH1  ARG  96          2HH2      ARG  96   7.555  -4.375  11.282
  785   2HH1  ARG  96          1HH2      ARG  96   7.601  -4.269  13.013
  786   1HH2  ARG  96          2HH1      ARG  96  10.225  -6.534  13.357
  787   2HH2  ARG  96          1HH1      ARG  96   9.094  -5.508  14.175
  788    H    ILE  97           H        ILE  97   6.393  -5.482   5.268
  789    HA   ILE  97           HA       ILE  97   5.038  -7.674   4.305
  790    HB   ILE  97           HB       ILE  97   5.481  -6.211   2.043
  791   1HG1  ILE  97          2HG1      ILE  97   5.108  -4.226   4.238
  792   2HG1  ILE  97          1HG1      ILE  97   6.619  -4.497   3.309
  793   1HG2  ILE  97          1HG2      ILE  97   3.055  -5.608   2.650
  794   2HG2  ILE  97          2HG2      ILE  97   3.429  -7.324   2.933
  795   3HG2  ILE  97          3HG2      ILE  97   3.385  -6.186   4.300
  796   1HD1  ILE  97          1HD1      ILE  97   5.391  -2.553   2.477
  797   2HD1  ILE  97          2HD1      ILE  97   5.463  -3.840   1.251
  798   3HD1  ILE  97          3HD1      ILE  97   3.963  -3.570   2.172
  799    H    SER  98           H        SER  98   8.304  -6.672   3.405
  800    HA   SER  98           HA       SER  98   8.742  -8.605   1.262
  801   1HB   SER  98          2HB       SER  98  10.816  -7.914   1.067
  802   2HB   SER  98          1HB       SER  98  10.005  -6.423   1.662
  803    HG   SER  98           HG       SER  98  11.741  -6.414   2.894
  804    H    LYS  99           H        LYS  99   9.879  -8.295   4.665
  805    HA   LYS  99           HA       LYS  99  10.448  -9.814   6.280
  806   1HB   LYS  99          2HB       LYS  99   8.427 -11.133   4.797
  807   2HB   LYS  99          1HB       LYS  99   9.709 -12.307   5.231
  808   1HG   LYS  99          2HG       LYS  99   8.670 -10.447   7.337
  809   2HG   LYS  99          1HG       LYS  99   7.679 -11.844   6.847
  810   1HD   LYS  99          2HD       LYS  99  10.110 -13.055   7.079
  811   2HD   LYS  99          1HD       LYS  99  10.299 -11.773   8.289
  812   1HE   LYS  99          2HE       LYS  99   8.464 -12.533   9.562
  813   2HE   LYS  99          1HE       LYS  99   7.803 -13.483   8.211
  814   1HZ   LYS  99          1HZ       LYS  99   8.891 -14.882   9.772
  815   2HZ   LYS  99          2HZ       LYS  99   9.731 -14.880   8.369
  816   3HZ   LYS  99          3HZ       LYS  99  10.288 -14.034   9.650
  817    H    GLN 100           H        GLN 100  12.281  -8.910   4.334
  818    HA   GLN 100           HA       GLN 100  13.896 -10.753   2.973
  819   1HB   GLN 100          2HB       GLN 100  14.102  -8.331   2.850
  820   2HB   GLN 100          1HB       GLN 100  14.726  -8.303   4.530
  821   1HG   GLN 100          2HG       GLN 100  16.744  -8.364   3.575
  822   2HG   GLN 100          1HG       GLN 100  16.400 -10.102   3.309
  823   1HE2  GLN 100          2HE2      GLN 100  15.631 -10.766   1.144
  824   2HE2  GLN 100          1HE2      GLN 100  16.069  -9.735  -0.194
  Start of MODEL   12
    1   1H    GLU   1          1H        GLU   1   2.021 -16.621 -12.380
    2   2H    GLU   1          2H        GLU   1   2.681 -15.813 -11.062
    3    HA   GLU   1           HA       GLU   1   4.658 -16.674 -11.517
    4   1HB   GLU   1          2HB       GLU   1   3.204 -17.721 -14.036
    5   2HB   GLU   1          1HB       GLU   1   4.837 -18.152 -13.669
    6   1HG   GLU   1          2HG       GLU   1   3.057 -18.624 -11.394
    7   2HG   GLU   1          1HG       GLU   1   2.593 -19.483 -12.861
    8    H    LEU   2           H        LEU   2   6.589 -15.879 -12.300
    9    HA   LEU   2           HA       LEU   2   7.245 -13.553 -13.441
   10   1HB   LEU   2          2HB       LEU   2   9.215 -14.390 -14.116
   11   2HB   LEU   2          1HB       LEU   2   8.704 -15.277 -12.619
   12    HG   LEU   2           HG       LEU   2   9.767 -16.966 -13.750
   13   1HD1  LEU   2          1HD1      LEU   2   8.386 -18.507 -14.720
   14   2HD1  LEU   2          2HD1      LEU   2   7.764 -17.838 -13.193
   15   3HD1  LEU   2          3HD1      LEU   2   7.051 -17.331 -14.742
   16   1HD2  LEU   2          1HD2      LEU   2   9.843 -17.239 -16.154
   17   2HD2  LEU   2          2HD2      LEU   2   8.779 -15.830 -16.378
   18   3HD2  LEU   2          3HD2      LEU   2  10.411 -15.614 -15.703
   19    H    ILE   3           H        ILE   3   5.446 -12.874 -14.761
   20    HA   ILE   3           HA       ILE   3   4.937 -13.886 -17.286
   21    HB   ILE   3           HB       ILE   3   3.286 -12.554 -16.416
   22   1HG1  ILE   3          2HG1      ILE   3   2.787 -11.033 -18.067
   23   2HG1  ILE   3          1HG1      ILE   3   4.464 -11.095 -18.698
   24   1HG2  ILE   3          1HG2      ILE   3   3.480 -10.223 -15.946
   25   2HG2  ILE   3          2HG2      ILE   3   4.600 -11.137 -14.910
   26   3HG2  ILE   3          3HG2      ILE   3   5.220 -10.246 -16.319
   27   1HD1  ILE   3          1HD1      ILE   3   2.939 -12.440 -20.072
   28   2HD1  ILE   3          2HD1      ILE   3   4.154 -13.466 -19.272
   29   3HD1  ILE   3          3HD1      ILE   3   2.490 -13.405 -18.645
   30    H    ARG   4           H        ARG   4   7.127 -11.257 -16.410
   31    HA   ARG   4           HA       ARG   4   8.767 -11.698 -18.868
   32   1HB   ARG   4          2HB       ARG   4   7.924  -9.001 -17.688
   33   2HB   ARG   4          1HB       ARG   4   8.933  -9.240 -19.092
   34   1HG   ARG   4          2HG       ARG   4   6.386 -10.670 -19.378
   35   2HG   ARG   4          1HG       ARG   4   6.160  -8.960 -19.087
   36   1HD   ARG   4          2HD       ARG   4   8.245  -9.014 -20.889
   37   2HD   ARG   4          1HD       ARG   4   7.158 -10.347 -21.409
   38    HE   ARG   4           HE       ARG   4   5.612  -8.770 -22.031
   39   1HH1  ARG   4          2HH2      ARG   4   7.690  -7.184 -19.678
   40   2HH1  ARG   4          1HH2      ARG   4   6.870  -5.659 -19.785
   41   1HH2  ARG   4          2HH1      ARG   4   4.571  -6.737 -22.154
   42   2HH2  ARG   4          1HH1      ARG   4   5.136  -5.427 -21.175
   43    H    VAL   5           H        VAL   5   8.760  -9.790 -15.805
   44    HA   VAL   5           HA       VAL   5  11.412 -10.951 -15.014
   45    HB   VAL   5           HB       VAL   5  11.555  -8.796 -16.192
   46   1HG1  VAL   5          1HG1      VAL   5  10.918  -6.734 -15.012
   47   2HG1  VAL   5          2HG1      VAL   5   9.483  -7.694 -15.442
   48   3HG1  VAL   5          3HG1      VAL   5  10.083  -7.695 -13.768
   49   1HG2  VAL   5          1HG2      VAL   5  13.081  -7.781 -14.671
   50   2HG2  VAL   5          2HG2      VAL   5  12.541  -8.900 -13.396
   51   3HG2  VAL   5          3HG2      VAL   5  13.305  -9.535 -14.872
   52    H    ALA   6           H        ALA   6   8.489 -11.469 -14.182
   53    HA   ALA   6           HA       ALA   6   7.263 -11.898 -12.316
   54   1HB   ALA   6          1HB       ALA   6   8.327 -12.264 -10.188
   55   2HB   ALA   6          2HB       ALA   6   9.134 -13.128 -11.519
   56   3HB   ALA   6          3HB       ALA   6   9.863 -11.651 -10.843
   57    H    ILE   7           H        ILE   7   6.565  -9.637 -13.229
   58    HA   ILE   7           HA       ILE   7   7.047  -7.322 -11.563
   59    HB   ILE   7           HB       ILE   7   6.773  -7.211 -13.969
   60   1HG1  ILE   7          2HG1      ILE   7   7.055  -5.345 -12.977
   61   2HG1  ILE   7          1HG1      ILE   7   5.517  -5.134 -13.899
   62   1HG2  ILE   7          1HG2      ILE   7   4.538  -6.920 -14.917
   63   2HG2  ILE   7          2HG2      ILE   7   4.797  -8.600 -14.391
   64   3HG2  ILE   7          3HG2      ILE   7   3.806  -7.501 -13.404
   65   1HD1  ILE   7          1HD1      ILE   7   5.476  -3.931 -11.791
   66   2HD1  ILE   7          2HD1      ILE   7   4.266  -5.235 -11.812
   67   3HD1  ILE   7          3HD1      ILE   7   5.782  -5.442 -10.903
   68    H    LEU   8           H        LEU   8   6.490  -8.974  -9.732
   69    HA   LEU   8           HA       LEU   8   3.759  -9.615  -9.180
   70   1HB   LEU   8          2HB       LEU   8   6.005  -9.321  -7.212
   71   2HB   LEU   8          1HB       LEU   8   4.505 -10.301  -7.071
   72    HG   LEU   8           HG       LEU   8   6.919 -10.802  -8.812
   73   1HD1  LEU   8          1HD1      LEU   8   7.030 -12.879  -7.500
   74   2HD1  LEU   8          2HD1      LEU   8   7.164 -11.417  -6.493
   75   3HD1  LEU   8          3HD1      LEU   8   5.636 -12.330  -6.539
   76   1HD2  LEU   8          1HD2      LEU   8   5.829 -12.842  -9.632
   77   2HD2  LEU   8          2HD2      LEU   8   4.318 -12.374  -8.815
   78   3HD2  LEU   8          3HD2      LEU   8   4.946 -11.388 -10.156
   79    H    TRP   9           H        TRP   9   3.042  -8.704  -6.753
   80    HA   TRP   9           HA       TRP   9   2.663  -5.765  -7.086
   81   1HB   TRP   9          2HB       TRP   9   1.094  -7.743  -5.495
   82   2HB   TRP   9          1HB       TRP   9   0.867  -6.012  -5.474
   83    HD1  TRP   9           HD       TRP   9   1.503  -5.958  -8.859
   84    HE1  TRP   9           1HE      TRP   9  -0.684  -6.047 -10.138
   85    HE3  TRP   9           3HE      TRP   9  -1.363  -7.955  -5.271
   86    HZ2  TRP   9           2HZ      TRP   9  -3.303  -6.920  -9.650
   87    HZ3  TRP   9           3HZ      TRP   9  -3.647  -8.749  -5.789
   88    HH2  TRP   9           HH       TRP   9  -4.620  -8.163  -7.981
   89    H    HIS  10           H        HIS  10   3.761  -8.100  -4.564
   90    HA   HIS  10           HA       HIS  10   4.612  -6.379  -2.548
   91   1HB   HIS  10          2HB       HIS  10   4.837  -8.464  -1.943
   92   2HB   HIS  10          1HB       HIS  10   5.191  -9.030  -3.616
   93    HD1  HIS  10           1HD      HIS  10   6.864  -8.863  -0.400
   94    HD2  HIS  10           2HD      HIS  10   7.827  -8.516  -4.397
   95    HE1  HIS  10           1HE      HIS  10   9.411  -8.988  -0.520
   96    H    GLU  11           H        GLU  11   6.008  -6.761  -5.763
   97    HA   GLU  11           HA       GLU  11   8.632  -5.642  -5.210
   98   1HB   GLU  11          2HB       GLU  11   7.146  -6.134  -7.803
   99   2HB   GLU  11          1HB       GLU  11   8.891  -5.770  -7.611
  100   1HG   GLU  11          2HG       GLU  11   7.549  -8.215  -6.451
  101   2HG   GLU  11          1HG       GLU  11   8.318  -8.168  -8.071
  102    H    MET  12           H        MET  12   5.627  -4.573  -6.911
  103    HA   MET  12           HA       MET  12   6.504  -1.856  -7.389
  104   1HB   MET  12          2HB       MET  12   4.375  -1.391  -8.126
  105   2HB   MET  12          1HB       MET  12   4.842  -2.996  -8.775
  106   1HG   MET  12          2HG       MET  12   3.361  -4.120  -7.349
  107   2HG   MET  12          1HG       MET  12   3.119  -2.665  -6.325
  108   1HE   MET  12          1HE       MET  12   1.285  -3.248 -10.533
  109   2HE   MET  12          2HE       MET  12   3.026  -2.996 -10.266
  110   3HE   MET  12          3HE       MET  12   2.243  -4.483  -9.681
  111    H    TRP  13           H        TRP  13   5.074  -3.613  -4.647
  112    HA   TRP  13           HA       TRP  13   3.981  -1.469  -3.243
  113   1HB   TRP  13          2HB       TRP  13   4.568  -4.267  -2.713
  114   2HB   TRP  13          1HB       TRP  13   4.822  -3.264  -1.304
  115    HD1  TRP  13           HD       TRP  13   2.402  -5.345  -1.995
  116    HE1  TRP  13           1HE      TRP  13   0.007  -4.542  -1.682
  117    HE3  TRP  13           3HE      TRP  13   3.216  -0.329  -2.247
  118    HZ2  TRP  13           2HZ      TRP  13  -1.341  -2.091  -1.675
  119    HZ3  TRP  13           3HZ      TRP  13   1.396   1.206  -1.651
  120    HH2  TRP  13           HH       TRP  13  -0.903   0.282  -1.324
  121    H    HIS  14           H        HIS  14   7.329  -2.850  -3.013
  122    HA   HIS  14           HA       HIS  14   8.416  -1.285  -0.996
  123   1HB   HIS  14          2HB       HIS  14   9.380  -2.882  -3.231
  124   2HB   HIS  14          1HB       HIS  14  10.351  -1.448  -3.080
  125    HD1  HIS  14           1HD      HIS  14  11.145  -4.441  -2.276
  126    HD2  HIS  14           2HD      HIS  14  10.161  -1.283   0.207
  127    HE1  HIS  14           1HE      HIS  14  12.730  -4.600  -0.272
  128    H    GLU  15           H        GLU  15   8.412  -0.394  -4.458
  129    HA   GLU  15           HA       GLU  15   9.246   2.381  -3.952
  130   1HB   GLU  15          2HB       GLU  15   9.199   2.708  -6.236
  131   2HB   GLU  15          1HB       GLU  15   9.990   1.133  -5.915
  132   1HG   GLU  15          2HG       GLU  15   7.883  -0.038  -6.614
  133   2HG   GLU  15          1HG       GLU  15   7.121   1.496  -6.936
  134    H    GLY  16           H        GLY  16   6.101   0.720  -4.980
  135   1HA   GLY  16          2HA       GLY  16   4.578   3.017  -5.350
  136   2HA   GLY  16          1HA       GLY  16   3.973   1.465  -4.840
  137    H    LEU  17           H        LEU  17   5.487   1.412  -2.283
  138    HA   LEU  17           HA       LEU  17   3.921   3.298  -0.646
  139   1HB   LEU  17          2HB       LEU  17   5.502   0.907  -0.111
  140   2HB   LEU  17          1HB       LEU  17   5.323   2.142   1.135
  141    HG   LEU  17           HG       LEU  17   2.993   0.849  -0.385
  142   1HD1  LEU  17          1HD1      LEU  17   2.498  -0.225   1.708
  143   2HD1  LEU  17          2HD1      LEU  17   4.105  -0.706   1.111
  144   3HD1  LEU  17          3HD1      LEU  17   3.964   0.469   2.440
  145   1HD2  LEU  17          1HD2      LEU  17   1.570   1.965   1.214
  146   2HD2  LEU  17          2HD2      LEU  17   2.973   2.778   1.946
  147   3HD2  LEU  17          3HD2      LEU  17   2.491   3.165   0.277
  148    H    GLU  18           H        GLU  18   7.182   3.206  -2.031
  149    HA   GLU  18           HA       GLU  18   8.270   5.222  -0.166
  150   1HB   GLU  18          2HB       GLU  18   9.605   3.317  -0.993
  151   2HB   GLU  18          1HB       GLU  18   9.543   4.035  -2.596
  152   1HG   GLU  18          2HG       GLU  18  10.849   5.857  -1.985
  153   2HG   GLU  18          1HG       GLU  18  10.383   5.767  -0.282
  154    H    GLU  19           H        GLU  19   7.400   5.088  -3.680
  155    HA   GLU  19           HA       GLU  19   7.834   7.856  -4.289
  156   1HB   GLU  19          2HB       GLU  19   7.765   6.027  -5.919
  157   2HB   GLU  19          1HB       GLU  19   6.022   5.806  -5.565
  158   1HG   GLU  19          2HG       GLU  19   6.398   7.168  -7.676
  159   2HG   GLU  19          1HG       GLU  19   5.551   8.089  -6.483
  160    H    ALA  20           H        ALA  20   5.120   6.032  -2.864
  161    HA   ALA  20           HA       ALA  20   3.200   8.233  -2.848
  162   1HB   ALA  20          1HB       ALA  20   1.965   6.771  -1.398
  163   2HB   ALA  20          2HB       ALA  20   2.531   5.882  -2.832
  164   3HB   ALA  20          3HB       ALA  20   3.358   5.670  -1.270
  165    H    SER  21           H        SER  21   4.776   6.526  -0.078
  166    HA   SER  21           HA       SER  21   4.256   8.402   1.901
  167   1HB   SER  21          2HB       SER  21   6.132   7.501   3.113
  168   2HB   SER  21          1HB       SER  21   5.416   6.164   2.240
  169    HG   SER  21           HG       SER  21   7.104   6.778   0.514
  170    H    ARG  22           H        ARG  22   6.733   8.627  -0.670
  171    HA   ARG  22           HA       ARG  22   8.061  10.955   0.444
  172   1HB   ARG  22          2HB       ARG  22   9.079   9.245  -1.056
  173   2HB   ARG  22          1HB       ARG  22   8.094   9.932  -2.376
  174   1HG   ARG  22          2HG       ARG  22   9.184  12.197  -1.155
  175   2HG   ARG  22          1HG       ARG  22  10.512  11.030  -1.072
  176   1HD   ARG  22          2HD       ARG  22   8.975  11.361  -3.645
  177   2HD   ARG  22          1HD       ARG  22  10.236  12.531  -3.201
  178    HE   ARG  22           HE       ARG  22  11.470  10.164  -2.788
  179   1HH1  ARG  22          2HH2      ARG  22   9.720  11.380  -5.574
  180   2HH1  ARG  22          1HH2      ARG  22  10.728  10.570  -6.728
  181   1HH2  ARG  22          2HH1      ARG  22  12.794   9.123  -4.334
  182   2HH2  ARG  22          1HH1      ARG  22  12.437   9.299  -6.017
  183    H    LEU  23           H        LEU  23   5.297  10.431  -1.851
  184    HA   LEU  23           HA       LEU  23   5.205  13.175  -2.739
  185   1HB   LEU  23          2HB       LEU  23   3.832  10.740  -3.303
  186   2HB   LEU  23          1HB       LEU  23   2.726  12.141  -3.124
  187    HG   LEU  23           HG       LEU  23   3.442  11.884  -5.499
  188   1HD1  LEU  23          1HD1      LEU  23   4.198  14.093  -5.929
  189   2HD1  LEU  23          2HD1      LEU  23   2.891  14.069  -4.719
  190   3HD1  LEU  23          3HD1      LEU  23   4.575  14.329  -4.206
  191   1HD2  LEU  23          1HD2      LEU  23   5.734  12.232  -6.162
  192   2HD2  LEU  23          2HD2      LEU  23   6.249  12.315  -4.461
  193   3HD2  LEU  23          3HD2      LEU  23   5.610  10.792  -5.124
  194    H    TYR  24           H        TYR  24   4.366  11.529   0.105
  195    HA   TYR  24           HA       TYR  24   2.625  13.770   1.160
  196   1HB   TYR  24          2HB       TYR  24   1.507  11.799   1.436
  197   2HB   TYR  24          1HB       TYR  24   3.007  10.875   1.784
  198    HD1  TYR  24           1HD      TYR  24   2.432   9.822   3.737
  199    HD2  TYR  24           2HD      TYR  24   1.993  14.091   3.462
  200    HE1  TYR  24           1HE      TYR  24   1.889   9.959   6.161
  201    HE2  TYR  24           2HE      TYR  24   1.605  14.224   5.874
  202    HH   TYR  24           HH       TYR  24   1.627  13.117   7.801
  203    H    PHE  25           H        PHE  25   5.039  11.553   2.726
  204    HA   PHE  25           HA       PHE  25   5.727  13.482   4.684
  205   1HB   PHE  25          2HB       PHE  25   5.620  10.963   4.897
  206   2HB   PHE  25          1HB       PHE  25   7.065  10.850   3.909
  207    HD1  PHE  25           1HD      PHE  25   5.723  12.421   6.994
  208    HD2  PHE  25           2HD      PHE  25   9.191  11.125   4.820
  209    HE1  PHE  25           1HE      PHE  25   7.104  12.704   9.039
  210    HE2  PHE  25           2HE      PHE  25  10.578  11.395   6.861
  211    HZ   PHE  25           HZ       PHE  25   9.534  12.198   8.964
  212    H    GLY  26           H        GLY  26   6.694  13.413   1.420
  213   1HA   GLY  26          2HA       GLY  26   9.248  14.872   1.996
  214   2HA   GLY  26          1HA       GLY  26   8.936  13.948   0.554
  215    H    GLU  27           H        GLU  27   5.974  15.193   0.793
  216    HA   GLU  27           HA       GLU  27   6.667  17.845  -0.450
  217   1HB   GLU  27          2HB       GLU  27   4.471  16.364  -1.659
  218   2HB   GLU  27          1HB       GLU  27   5.700  17.484  -2.357
  219   1HG   GLU  27          2HG       GLU  27   5.952  14.530  -1.856
  220   2HG   GLU  27          1HG       GLU  27   5.858  15.390  -3.432
  221    H    ARG  28           H        ARG  28   5.270  16.626   2.163
  222    HA   ARG  28           HA       ARG  28   3.348  16.594   3.298
  223   1HB   ARG  28          2HB       ARG  28   4.610  18.959   3.307
  224   2HB   ARG  28          1HB       ARG  28   2.932  19.438   2.969
  225   1HG   ARG  28          2HG       ARG  28   2.139  18.577   4.985
  226   2HG   ARG  28          1HG       ARG  28   3.397  17.335   5.075
  227   1HD   ARG  28          2HD       ARG  28   4.411  18.744   6.619
  228   2HD   ARG  28          1HD       ARG  28   4.883  19.719   5.262
  229    HE   ARG  28           HE       ARG  28   3.076  20.353   7.277
  230   1HH1  ARG  28          2HH2      ARG  28   3.472  20.987   3.832
  231   2HH1  ARG  28          1HH2      ARG  28   2.607  22.485   3.898
  232   1HH2  ARG  28          2HH1      ARG  28   1.938  22.300   7.297
  233   2HH2  ARG  28          1HH1      ARG  28   1.746  23.195   5.827
  234    H    ASN  29           H        ASN  29   2.868  16.003   0.452
  235    HA   ASN  29           HA       ASN  29   0.123  17.034   0.144
  236   1HB   ASN  29          2HB       ASN  29   2.111  17.556  -1.537
  237   2HB   ASN  29          1HB       ASN  29   1.796  15.938  -2.131
  238   1HD2  ASN  29          2HD2      ASN  29   0.948  16.519  -4.117
  239   2HD2  ASN  29          1HD2      ASN  29  -0.548  17.415  -4.229
  240    H    VAL  30           H        VAL  30  -0.576  15.373   1.607
  241    HA   VAL  30           HA       VAL  30  -0.417  12.565   1.265
  242    HB   VAL  30           HB       VAL  30  -1.830  14.433   2.838
  243   1HG1  VAL  30          1HG1      VAL  30  -3.702  13.025   3.502
  244   2HG1  VAL  30          2HG1      VAL  30  -3.896  13.609   1.832
  245   3HG1  VAL  30          3HG1      VAL  30  -3.383  11.932   2.134
  246   1HG2  VAL  30          1HG2      VAL  30  -1.620  12.491   4.405
  247   2HG2  VAL  30          2HG2      VAL  30  -1.112  11.467   3.041
  248   3HG2  VAL  30          3HG2      VAL  30  -0.088  12.826   3.563
  249    H    LYS  31           H        LYS  31  -2.237  15.022  -0.528
  250    HA   LYS  31           HA       LYS  31  -4.055  13.371  -2.012
  251   1HB   LYS  31          2HB       LYS  31  -4.376  15.673  -1.698
  252   2HB   LYS  31          1HB       LYS  31  -2.736  16.052  -2.347
  253   1HG   LYS  31          2HG       LYS  31  -4.944  14.923  -4.080
  254   2HG   LYS  31          1HG       LYS  31  -4.739  16.652  -3.813
  255   1HD   LYS  31          2HD       LYS  31  -2.154  15.973  -4.495
  256   2HD   LYS  31          1HD       LYS  31  -3.028  14.782  -5.410
  257   1HE   LYS  31          2HE       LYS  31  -4.481  16.740  -6.212
  258   2HE   LYS  31          1HE       LYS  31  -3.144  17.750  -5.588
  259   1HZ   LYS  31          1HZ       LYS  31  -2.745  17.147  -7.841
  260   2HZ   LYS  31          2HZ       LYS  31  -1.650  16.352  -6.916
  261   3HZ   LYS  31          3HZ       LYS  31  -2.947  15.563  -7.516
  262    H    GLY  32           H        GLY  32  -0.584  14.322  -2.532
  263   1HA   GLY  32          2HA       GLY  32  -0.306  13.380  -5.225
  264   2HA   GLY  32          1HA       GLY  32   0.976  13.690  -4.077
  265    H    MET  33           H        MET  33   0.701  11.906  -2.073
  266    HA   MET  33           HA       MET  33   1.555   9.381  -2.988
  267   1HB   MET  33          2HB       MET  33   1.431   8.631  -0.884
  268   2HB   MET  33          1HB       MET  33   1.733  10.398  -0.709
  269   1HG   MET  33          2HG       MET  33  -0.498  10.761   0.001
  270   2HG   MET  33          1HG       MET  33  -0.932   9.052  -0.334
  271   1HE   MET  33          1HE       MET  33   0.882   7.143   2.542
  272   2HE   MET  33          2HE       MET  33  -0.269   7.034   1.189
  273   3HE   MET  33          3HE       MET  33   1.444   7.404   0.874
  274    H    PHE  34           H        PHE  34  -1.711  10.593  -2.571
  275    HA   PHE  34           HA       PHE  34  -3.122   8.124  -2.618
  276   1HB   PHE  34          2HB       PHE  34  -3.820  11.018  -2.819
  277   2HB   PHE  34          1HB       PHE  34  -4.993   9.839  -3.394
  278    HD1  PHE  34           1HD      PHE  34  -4.509  11.766  -0.732
  279    HD2  PHE  34           2HD      PHE  34  -4.830   7.592  -1.665
  280    HE1  PHE  34           1HE      PHE  34  -5.325  11.307   1.543
  281    HE2  PHE  34           2HE      PHE  34  -5.737   7.161   0.600
  282    HZ   PHE  34           HZ       PHE  34  -5.921   9.020   2.221
  283    H    GLU  35           H        GLU  35  -1.603  10.004  -5.147
  284    HA   GLU  35           HA       GLU  35  -3.196   8.987  -7.378
  285   1HB   GLU  35          2HB       GLU  35  -1.899  11.225  -7.244
  286   2HB   GLU  35          1HB       GLU  35  -0.454  10.261  -7.509
  287   1HG   GLU  35          2HG       GLU  35  -1.099  10.898  -9.674
  288   2HG   GLU  35          1HG       GLU  35  -1.745   9.261  -9.549
  289    H    VAL  36           H        VAL  36   0.053   8.232  -5.938
  290    HA   VAL  36           HA       VAL  36   0.575   6.101  -7.897
  291    HB   VAL  36           HB       VAL  36   2.424   7.419  -7.340
  292   1HG1  VAL  36          1HG1      VAL  36   3.372   7.470  -5.126
  293   2HG1  VAL  36          2HG1      VAL  36   1.750   8.203  -5.118
  294   3HG1  VAL  36          3HG1      VAL  36   1.988   6.559  -4.479
  295   1HG2  VAL  36          1HG2      VAL  36   3.990   5.782  -6.720
  296   2HG2  VAL  36          2HG2      VAL  36   2.683   4.674  -6.238
  297   3HG2  VAL  36          3HG2      VAL  36   2.836   5.183  -7.936
  298    H    LEU  37           H        LEU  37  -0.812   6.465  -4.651
  299    HA   LEU  37           HA       LEU  37  -0.923   3.605  -4.016
  300   1HB   LEU  37          2HB       LEU  37  -1.193   6.053  -2.652
  301   2HB   LEU  37          1HB       LEU  37  -2.682   5.070  -2.466
  302    HG   LEU  37           HG       LEU  37  -1.021   4.595  -0.629
  303   1HD1  LEU  37          1HD1      LEU  37  -0.968   2.205  -0.827
  304   2HD1  LEU  37          2HD1      LEU  37  -2.550   2.823  -1.359
  305   3HD1  LEU  37          3HD1      LEU  37  -1.347   2.304  -2.563
  306   1HD2  LEU  37          1HD2      LEU  37   1.006   3.434  -1.076
  307   2HD2  LEU  37          2HD2      LEU  37   0.752   3.580  -2.832
  308   3HD2  LEU  37          3HD2      LEU  37   1.040   5.036  -1.852
  309    H    GLU  38           H        GLU  38  -3.057   5.976  -5.662
  310    HA   GLU  38           HA       GLU  38  -5.509   4.723  -5.704
  311   1HB   GLU  38          2HB       GLU  38  -4.130   6.736  -7.217
  312   2HB   GLU  38          1HB       GLU  38  -4.942   5.684  -8.328
  313   1HG   GLU  38          2HG       GLU  38  -6.532   6.497  -5.959
  314   2HG   GLU  38          1HG       GLU  38  -6.111   7.749  -7.130
  315    HA   PRO  39           HA       PRO  39  -4.269   1.475  -8.999
  316   1HB   PRO  39          2HB       PRO  39  -1.769   1.096  -9.838
  317   2HB   PRO  39          1HB       PRO  39  -2.839   2.268 -10.603
  318   1HG   PRO  39          2HG       PRO  39  -0.659   2.769  -8.526
  319   2HG   PRO  39          1HG       PRO  39  -0.991   3.678  -9.997
  320   1HD   PRO  39          1HD       PRO  39  -1.979   4.478  -7.512
  321   2HD   PRO  39          2HD       PRO  39  -2.906   4.779  -9.038
  322    H    LEU  40           H        LEU  40  -1.623   1.984  -6.495
  323    HA   LEU  40           HA       LEU  40  -1.260  -0.753  -5.986
  324   1HB   LEU  40          2HB       LEU  40  -0.870   1.646  -4.143
  325   2HB   LEU  40          1HB       LEU  40  -0.140   0.070  -3.938
  326    HG   LEU  40           HG       LEU  40   0.315   1.668  -6.485
  327   1HD1  LEU  40          1HD1      LEU  40   2.294   2.503  -5.295
  328   2HD1  LEU  40          2HD1      LEU  40   0.810   3.007  -4.450
  329   3HD1  LEU  40          3HD1      LEU  40   1.779   1.654  -3.818
  330   1HD2  LEU  40          1HD2      LEU  40   2.335   0.394  -6.599
  331   2HD2  LEU  40          2HD2      LEU  40   1.931  -0.460  -5.092
  332   3HD2  LEU  40          3HD2      LEU  40   0.933  -0.699  -6.545
  333    H    HIS  41           H        HIS  41  -3.832   1.357  -4.916
  334    HA   HIS  41           HA       HIS  41  -4.993  -0.306  -2.867
  335   1HB   HIS  41          2HB       HIS  41  -5.401   1.986  -2.824
  336   2HB   HIS  41          1HB       HIS  41  -5.820   2.032  -4.567
  337    HD1  HIS  41           1HD      HIS  41  -7.354   0.891  -1.249
  338    HD2  HIS  41           2HD      HIS  41  -8.287   1.607  -5.220
  339    HE1  HIS  41           1HE      HIS  41  -9.884   0.563  -1.451
  340    H    ALA  42           H        ALA  42  -5.489   0.014  -6.409
  341    HA   ALA  42           HA       ALA  42  -7.707  -1.949  -6.443
  342   1HB   ALA  42          1HB       ALA  42  -7.797  -1.412  -8.787
  343   2HB   ALA  42          2HB       ALA  42  -7.863   0.056  -7.782
  344   3HB   ALA  42          3HB       ALA  42  -6.358  -0.377  -8.626
  345    H    MET  43           H        MET  43  -4.314  -1.677  -7.528
  346    HA   MET  43           HA       MET  43  -3.861  -4.286  -8.573
  347   1HB   MET  43          2HB       MET  43  -2.148  -2.179  -7.262
  348   2HB   MET  43          1HB       MET  43  -1.509  -3.758  -7.817
  349   1HG   MET  43          2HG       MET  43  -2.967  -1.882  -9.736
  350   2HG   MET  43          1HG       MET  43  -1.262  -1.734  -9.459
  351   1HE   MET  43          1HE       MET  43  -1.524  -3.298 -12.966
  352   2HE   MET  43          2HE       MET  43  -2.660  -2.159 -12.207
  353   3HE   MET  43          3HE       MET  43  -0.907  -1.954 -11.977
  354    H    MET  44           H        MET  44  -4.598  -3.381  -5.238
  355    HA   MET  44           HA       MET  44  -3.361  -5.951  -4.300
  356   1HB   MET  44          2HB       MET  44  -3.550  -5.227  -2.156
  357   2HB   MET  44          1HB       MET  44  -2.741  -3.956  -3.130
  358   1HG   MET  44          2HG       MET  44  -4.193  -2.481  -2.134
  359   2HG   MET  44          1HG       MET  44  -5.456  -3.176  -3.092
  360   1HE   MET  44          1HE       MET  44  -6.454  -2.438   0.698
  361   2HE   MET  44          2HE       MET  44  -4.995  -1.784  -0.083
  362   3HE   MET  44          3HE       MET  44  -6.539  -1.817  -0.967
  363    H    GLU  45           H        GLU  45  -6.363  -4.633  -5.354
  364    HA   GLU  45           HA       GLU  45  -8.018  -6.604  -3.845
  365   1HB   GLU  45          2HB       GLU  45  -8.526  -4.108  -3.917
  366   2HB   GLU  45          1HB       GLU  45  -8.959  -4.379  -5.621
  367   1HG   GLU  45          2HG       GLU  45 -10.452  -6.352  -4.707
  368   2HG   GLU  45          1HG       GLU  45 -10.258  -5.609  -3.138
  369    H    ARG  46           H        ARG  46  -7.169  -5.628  -7.241
  370    HA   ARG  46           HA       ARG  46  -8.647  -7.167  -8.877
  371   1HB   ARG  46          2HB       ARG  46  -6.097  -5.991  -8.878
  372   2HB   ARG  46          1HB       ARG  46  -5.852  -7.693  -9.382
  373   1HG   ARG  46          2HG       ARG  46  -6.381  -7.014 -11.442
  374   2HG   ARG  46          1HG       ARG  46  -8.056  -6.862 -10.859
  375   1HD   ARG  46          2HD       ARG  46  -7.738  -4.516 -10.329
  376   2HD   ARG  46          1HD       ARG  46  -5.989  -4.630 -10.593
  377    HE   ARG  46           HE       ARG  46  -6.323  -4.414 -12.823
  378   1HH1  ARG  46          2HH2      ARG  46  -9.461  -5.303 -11.505
  379   2HH1  ARG  46          1HH2      ARG  46 -10.287  -5.076 -13.011
  380   1HH2  ARG  46          2HH1      ARG  46  -7.444  -4.151 -14.778
  381   2HH2  ARG  46          1HH1      ARG  46  -9.149  -4.440 -14.827
  382    H    GLY  47           H        GLY  47  -6.225  -8.519  -6.606
  383   1HA   GLY  47          2HA       GLY  47  -6.631 -10.694  -5.644
  384   2HA   GLY  47          1HA       GLY  47  -7.287 -11.253  -7.163
  385    HA   PRO  48           HA       PRO  48  -2.645 -12.147  -6.801
  386   1HB   PRO  48          2HB       PRO  48  -2.651 -14.755  -6.085
  387   2HB   PRO  48          1HB       PRO  48  -2.693 -13.469  -4.880
  388   1HG   PRO  48          2HG       PRO  48  -5.025 -15.106  -5.984
  389   2HG   PRO  48          1HG       PRO  48  -4.670 -14.712  -4.302
  390   1HD   PRO  48          1HD       PRO  48  -6.454 -13.181  -5.868
  391   2HD   PRO  48          2HD       PRO  48  -5.438 -12.410  -4.561
  392    H    GLN  49           H        GLN  49  -1.668 -14.238  -7.965
  393    HA   GLN  49           HA       GLN  49  -3.234 -14.882 -10.465
  394   1HB   GLN  49          2HB       GLN  49  -1.259 -14.498 -11.810
  395   2HB   GLN  49          1HB       GLN  49  -1.729 -13.032 -11.006
  396   1HG   GLN  49          2HG       GLN  49  -0.025 -13.486  -9.262
  397   2HG   GLN  49          1HG       GLN  49   0.509 -14.884 -10.252
  398   1HE2  GLN  49          2HE2      GLN  49   2.517 -14.261 -10.899
  399   2HE2  GLN  49          1HE2      GLN  49   2.800 -12.715 -11.663
  400    H    THR  50           H        THR  50  -0.379 -15.723  -8.533
  401    HA   THR  50           HA       THR  50  -0.644 -18.596  -9.306
  402    HB   THR  50           HB       THR  50   1.136 -17.900 -10.490
  403    HG1  THR  50           1HG      THR  50   2.759 -19.271  -9.464
  404   1HG2  THR  50          1HG2      THR  50   3.174 -16.917  -9.553
  405   2HG2  THR  50          2HG2      THR  50   1.791 -15.813  -9.378
  406   3HG2  THR  50          3HG2      THR  50   2.375 -16.738  -7.974
  407    H    LEU  51           H        LEU  51   1.012 -16.580  -6.876
  408    HA   LEU  51           HA       LEU  51  -0.124 -17.107  -4.420
  409   1HB   LEU  51          2HB       LEU  51   1.226 -19.547  -5.347
  410   2HB   LEU  51          1HB       LEU  51   1.635 -18.990  -3.730
  411    HG   LEU  51           HG       LEU  51  -1.257 -18.893  -4.403
  412   1HD1  LEU  51          1HD1      LEU  51  -1.543 -21.309  -4.064
  413   2HD1  LEU  51          2HD1      LEU  51  -0.601 -20.972  -5.535
  414   3HD1  LEU  51          3HD1      LEU  51   0.223 -21.524  -4.057
  415   1HD2  LEU  51          1HD2      LEU  51  -1.392 -19.792  -2.106
  416   2HD2  LEU  51          2HD2      LEU  51   0.378 -19.970  -2.067
  417   3HD2  LEU  51          3HD2      LEU  51  -0.351 -18.349  -2.164
  418    H    LYS  52           H        LYS  52   1.326 -15.017  -5.613
  419    HA   LYS  52           HA       LYS  52   3.869 -14.919  -4.035
  420   1HB   LYS  52          2HB       LYS  52   3.467 -13.825  -6.860
  421   2HB   LYS  52          1HB       LYS  52   4.924 -13.733  -5.910
  422   1HG   LYS  52          2HG       LYS  52   3.884 -16.453  -6.212
  423   2HG   LYS  52          1HG       LYS  52   4.352 -15.622  -7.733
  424   1HD   LYS  52          2HD       LYS  52   6.560 -15.524  -7.154
  425   2HD   LYS  52          1HD       LYS  52   6.218 -15.655  -5.399
  426   1HE   LYS  52          2HE       LYS  52   5.645 -18.030  -5.622
  427   2HE   LYS  52          1HE       LYS  52   5.627 -17.934  -7.373
  428   1HZ   LYS  52          1HZ       LYS  52   7.578 -18.924  -6.355
  429   2HZ   LYS  52          2HZ       LYS  52   7.891 -17.732  -7.415
  430   3HZ   LYS  52          3HZ       LYS  52   8.029 -17.451  -5.810
  431    H    GLU  53           H        GLU  53   1.423 -12.954  -5.812
  432    HA   GLU  53           HA       GLU  53   1.842 -10.575  -4.174
  433   1HB   GLU  53          2HB       GLU  53  -0.215 -11.230  -6.287
  434   2HB   GLU  53          1HB       GLU  53   0.166  -9.621  -5.598
  435   1HG   GLU  53          2HG       GLU  53   1.460  -9.382  -7.389
  436   2HG   GLU  53          1HG       GLU  53   2.601 -10.453  -6.515
  437    H    THR  54           H        THR  54   1.305 -12.339  -2.342
  438    HA   THR  54           HA       THR  54  -1.236 -11.725  -1.112
  439    HB   THR  54           HB       THR  54  -1.053 -14.287  -2.534
  440    HG1  THR  54           1HG      THR  54  -3.287 -13.520  -2.974
  441   1HG2  THR  54          1HG2      THR  54  -3.008 -15.143  -1.379
  442   2HG2  THR  54          2HG2      THR  54  -1.608 -15.039  -0.285
  443   3HG2  THR  54          3HG2      THR  54  -2.905 -13.823  -0.189
  444    H    SER  55           H        SER  55   1.214 -11.138  -0.191
  445    HA   SER  55           HA       SER  55   1.875 -13.179   1.910
  446   1HB   SER  55          2HB       SER  55   3.994 -11.956   2.108
  447   2HB   SER  55          1HB       SER  55   3.766 -12.748   0.551
  448    HG   SER  55           HG       SER  55   4.594 -10.619   0.371
  449    H    PHE  56           H        PHE  56   1.003  -9.811   1.318
  450    HA   PHE  56           HA       PHE  56   1.047  -9.011   4.129
  451   1HB   PHE  56          2HB       PHE  56   0.226  -6.908   3.304
  452   2HB   PHE  56          1HB       PHE  56   1.732  -7.434   2.486
  453    HD1  PHE  56           1HD      PHE  56   1.662  -8.191   0.113
  454    HD2  PHE  56           2HD      PHE  56  -1.844  -6.744   2.130
  455    HE1  PHE  56           1HE      PHE  56   0.484  -7.971  -2.066
  456    HE2  PHE  56           2HE      PHE  56  -3.017  -6.545  -0.035
  457    HZ   PHE  56           HZ       PHE  56  -1.858  -7.165  -2.132
  458    H    ASN  57           H        ASN  57  -1.510  -9.210   1.541
  459    HA   ASN  57           HA       ASN  57  -3.819  -9.033   3.184
  460   1HB   ASN  57          2HB       ASN  57  -4.886 -10.013   1.144
  461   2HB   ASN  57          1HB       ASN  57  -3.959  -8.571   0.856
  462   1HD2  ASN  57          2HD2      ASN  57  -4.394 -11.864   0.119
  463   2HD2  ASN  57          1HD2      ASN  57  -3.087 -11.940  -1.043
  464    H    GLN  58           H        GLN  58  -1.610 -11.703   2.793
  465    HA   GLN  58           HA       GLN  58  -3.398 -13.771   3.662
  466   1HB   GLN  58          2HB       GLN  58  -0.822 -13.576   2.520
  467   2HB   GLN  58          1HB       GLN  58  -0.578 -14.312   4.101
  468   1HG   GLN  58          2HG       GLN  58  -2.503 -15.291   1.943
  469   2HG   GLN  58          1HG       GLN  58  -1.019 -16.072   2.461
  470   1HE2  GLN  58          2HE2      GLN  58  -0.927 -16.589   4.883
  471   2HE2  GLN  58          1HE2      GLN  58  -2.425 -17.187   5.554
  472    H    ALA  59           H        ALA  59  -0.927 -11.742   5.333
  473    HA   ALA  59           HA       ALA  59  -1.906 -12.749   7.994
  474   1HB   ALA  59          1HB       ALA  59   0.347 -12.533   8.829
  475   2HB   ALA  59          2HB       ALA  59   0.253 -13.730   7.516
  476   3HB   ALA  59          3HB       ALA  59   0.932 -12.116   7.201
  477    H    TYR  60           H        TYR  60   0.041 -10.231   6.498
  478    HA   TYR  60           HA       TYR  60  -0.789  -8.076   8.279
  479   1HB   TYR  60          2HB       TYR  60   1.048  -8.391   5.896
  480   2HB   TYR  60          1HB       TYR  60   0.623  -6.791   6.437
  481    HD1  TYR  60           1HD      TYR  60   2.553  -6.002   7.298
  482    HD2  TYR  60           2HD      TYR  60   1.189  -9.843   8.645
  483    HE1  TYR  60           1HE      TYR  60   4.266  -6.009   9.055
  484    HE2  TYR  60           2HE      TYR  60   2.907  -9.865  10.349
  485    HH   TYR  60           HH       TYR  60   4.780  -8.916  11.082
  486    H    GLY  61           H        GLY  61  -3.096  -9.249   7.158
  487   1HA   GLY  61          2HA       GLY  61  -4.259  -7.774   4.927
  488   2HA   GLY  61          1HA       GLY  61  -5.083  -8.822   6.033
  489    H    ARG  62           H        ARG  62  -3.641  -6.964   8.168
  490    HA   ARG  62           HA       ARG  62  -5.880  -4.980   8.376
  491   1HB   ARG  62          2HB       ARG  62  -4.128  -6.455  10.337
  492   2HB   ARG  62          1HB       ARG  62  -4.987  -4.962  10.771
  493   1HG   ARG  62          2HG       ARG  62  -7.136  -5.960  10.351
  494   2HG   ARG  62          1HG       ARG  62  -6.428  -7.318   9.482
  495   1HD   ARG  62          2HD       ARG  62  -5.392  -8.135  11.564
  496   2HD   ARG  62          1HD       ARG  62  -6.076  -6.753  12.448
  497    HE   ARG  62           HE       ARG  62  -8.044  -7.848  12.539
  498   1HH1  ARG  62          2HH2      ARG  62  -6.381  -9.300   9.787
  499   2HH1  ARG  62          1HH2      ARG  62  -7.651 -10.438   9.482
  500   1HH2  ARG  62          2HH1      ARG  62  -9.662  -9.364  12.093
  501   2HH2  ARG  62          1HH1      ARG  62  -9.467 -10.466  10.774
  502    H    ASP  63           H        ASP  63  -2.841  -5.065   7.157
  503    HA   ASP  63           HA       ASP  63  -1.728  -2.728   8.505
  504   1HB   ASP  63          2HB       ASP  63  -0.689  -4.588   6.301
  505   2HB   ASP  63          1HB       ASP  63   0.230  -3.261   6.951
  506    H    LEU  64           H        LEU  64  -0.472  -1.905   5.760
  507    HA   LEU  64           HA       LEU  64  -1.888   0.061   4.633
  508   1HB   LEU  64          2HB       LEU  64  -0.622  -0.045   2.880
  509   2HB   LEU  64          1HB       LEU  64   0.293  -1.170   3.943
  510    HG   LEU  64           HG       LEU  64  -1.133  -3.017   2.646
  511   1HD1  LEU  64          1HD1      LEU  64  -1.618  -2.393   0.373
  512   2HD1  LEU  64          2HD1      LEU  64  -2.592  -1.446   1.523
  513   3HD1  LEU  64          3HD1      LEU  64  -1.188  -0.702   0.722
  514   1HD2  LEU  64          1HD2      LEU  64   0.611  -3.215   0.994
  515   2HD2  LEU  64          2HD2      LEU  64   1.174  -1.563   1.342
  516   3HD2  LEU  64          3HD2      LEU  64   1.314  -2.830   2.583
  517    H    MET  65           H        MET  65  -2.750  -3.389   4.078
  518    HA   MET  65           HA       MET  65  -4.617  -3.222   2.043
  519   1HB   MET  65          2HB       MET  65  -3.715  -5.276   3.128
  520   2HB   MET  65          1HB       MET  65  -4.793  -4.982   4.498
  521   1HG   MET  65          2HG       MET  65  -6.716  -4.940   2.887
  522   2HG   MET  65          1HG       MET  65  -5.568  -5.455   1.610
  523   1HE   MET  65          1HE       MET  65  -8.189  -8.158   3.694
  524   2HE   MET  65          2HE       MET  65  -8.051  -6.457   4.196
  525   3HE   MET  65          3HE       MET  65  -8.330  -6.859   2.485
  526    H    GLU  66           H        GLU  66  -5.389  -3.041   5.593
  527    HA   GLU  66           HA       GLU  66  -8.001  -1.862   5.018
  528   1HB   GLU  66          2HB       GLU  66  -6.777  -2.960   7.458
  529   2HB   GLU  66          1HB       GLU  66  -8.052  -1.739   7.589
  530   1HG   GLU  66          2HG       GLU  66  -9.205  -3.292   5.709
  531   2HG   GLU  66          1HG       GLU  66  -8.187  -4.522   6.467
  532    H    ALA  67           H        ALA  67  -4.766  -0.735   5.758
  533    HA   ALA  67           HA       ALA  67  -5.349   1.833   6.979
  534   1HB   ALA  67          1HB       ALA  67  -3.073   2.327   6.404
  535   2HB   ALA  67          2HB       ALA  67  -3.199   0.725   7.169
  536   3HB   ALA  67          3HB       ALA  67  -2.976   0.854   5.408
  537    H    GLN  68           H        GLN  68  -5.220   0.688   3.637
  538    HA   GLN  68           HA       GLN  68  -5.797   3.377   2.542
  539   1HB   GLN  68          2HB       GLN  68  -4.027   1.957   1.566
  540   2HB   GLN  68          1HB       GLN  68  -5.241   0.668   1.282
  541   1HG   GLN  68          2HG       GLN  68  -5.154   1.587  -0.790
  542   2HG   GLN  68          1HG       GLN  68  -6.440   2.605  -0.061
  543   1HE2  GLN  68          2HE2      GLN  68  -5.935   4.181  -1.779
  544   2HE2  GLN  68          1HE2      GLN  68  -4.448   5.081  -1.670
  545    H    GLU  69           H        GLU  69  -7.281   0.058   2.791
  546    HA   GLU  69           HA       GLU  69  -9.554   0.430   1.157
  547   1HB   GLU  69          2HB       GLU  69  -8.735  -1.722   2.171
  548   2HB   GLU  69          1HB       GLU  69  -9.466  -1.210   3.682
  549   1HG   GLU  69          2HG       GLU  69 -11.640  -0.989   2.585
  550   2HG   GLU  69          1HG       GLU  69 -10.898  -1.491   1.033
  551    H    TRP  70           H        TRP  70  -8.885   1.767   4.375
  552    HA   TRP  70           HA       TRP  70 -11.496   2.742   5.026
  553   1HB   TRP  70          2HB       TRP  70  -8.735   3.660   5.756
  554   2HB   TRP  70          1HB       TRP  70 -10.276   4.195   6.505
  555    HD1  TRP  70           HD       TRP  70 -10.988   0.718   6.157
  556    HE1  TRP  70           1HE      TRP  70 -10.278  -0.660   8.154
  557    HE3  TRP  70           3HE      TRP  70  -7.918   4.086   8.312
  558    HZ2  TRP  70           2HZ      TRP  70  -8.578  -0.345  10.387
  559    HZ3  TRP  70           3HZ      TRP  70  -6.515   3.413  10.236
  560    HH2  TRP  70           HH       TRP  70  -6.889   1.209  11.315
  561    H    CYS  71           H        CYS  71 -11.540   3.103   2.415
  562    HA   CYS  71           HA       CYS  71 -10.846   5.785   1.538
  563   1HB   CYS  71          2HB       CYS  71 -11.939   5.265  -0.471
  564   2HB   CYS  71          1HB       CYS  71 -10.943   3.856   0.024
  565    HG   CYS  71           HG       CYS  71 -13.183   3.226  -1.278
  566    H    ARG  72           H        ARG  72 -13.917   4.041   2.425
  567    HA   ARG  72           HA       ARG  72 -15.660   6.208   2.414
  568   1HB   ARG  72          2HB       ARG  72 -15.615   3.546   3.684
  569   2HB   ARG  72          1HB       ARG  72 -16.700   4.749   4.407
  570   1HG   ARG  72          2HG       ARG  72 -17.566   5.235   2.059
  571   2HG   ARG  72          1HG       ARG  72 -16.631   3.840   1.499
  572   1HD   ARG  72          2HD       ARG  72 -18.330   2.497   2.113
  573   2HD   ARG  72          1HD       ARG  72 -18.090   2.983   3.800
  574    HE   ARG  72           HE       ARG  72 -19.499   5.057   2.626
  575   1HH1  ARG  72          2HH2      ARG  72 -20.087   1.651   3.217
  576   2HH1  ARG  72          1HH2      ARG  72 -21.812   1.823   3.275
  577   1HH2  ARG  72          2HH1      ARG  72 -21.792   5.245   2.696
  578   2HH2  ARG  72          1HH1      ARG  72 -22.744   3.831   2.984
  579    H    LYS  73           H        LYS  73 -13.025   5.711   4.520
  580    HA   LYS  73           HA       LYS  73 -14.063   7.456   6.688
  581   1HB   LYS  73          2HB       LYS  73 -12.125   5.245   6.556
  582   2HB   LYS  73          1HB       LYS  73 -11.726   6.620   7.603
  583   1HG   LYS  73          2HG       LYS  73 -14.548   5.842   7.810
  584   2HG   LYS  73          1HG       LYS  73 -13.439   4.518   8.239
  585   1HD   LYS  73          2HD       LYS  73 -12.713   5.605  10.151
  586   2HD   LYS  73          1HD       LYS  73 -12.648   7.170   9.353
  587   1HE   LYS  73          2HE       LYS  73 -15.053   7.467   9.618
  588   2HE   LYS  73          1HE       LYS  73 -15.219   5.832  10.271
  589   1HZ   LYS  73          1HZ       LYS  73 -15.101   7.536  11.943
  590   2HZ   LYS  73          2HZ       LYS  73 -13.898   6.444  12.088
  591   3HZ   LYS  73          3HZ       LYS  73 -13.580   7.928  11.484
  592    H    TYR  74           H        TYR  74 -11.233   6.978   4.486
  593    HA   TYR  74           HA       TYR  74 -10.028   9.617   4.919
  594   1HB   TYR  74          2HB       TYR  74  -8.608   8.087   4.178
  595   2HB   TYR  74          1HB       TYR  74  -9.780   7.374   3.019
  596    HD1  TYR  74           1HD      TYR  74  -8.260  10.820   3.494
  597    HD2  TYR  74           2HD      TYR  74  -9.329   7.586   0.890
  598    HE1  TYR  74           1HE      TYR  74  -7.667  12.205   1.543
  599    HE2  TYR  74           2HE      TYR  74  -8.689   8.933  -1.073
  600    HH   TYR  74           HH       TYR  74  -7.552  10.736  -1.722
  601    H    MET  75           H        MET  75 -12.736   8.608   2.868
  602    HA   MET  75           HA       MET  75 -12.843  11.049   1.264
  603   1HB   MET  75          2HB       MET  75 -14.663   8.699   1.566
  604   2HB   MET  75          1HB       MET  75 -15.080  10.140   0.646
  605   1HG   MET  75          2HG       MET  75 -12.730   9.772  -0.499
  606   2HG   MET  75          1HG       MET  75 -12.892   8.131   0.121
  607   1HE   MET  75          1HE       MET  75 -13.825   7.816  -3.664
  608   2HE   MET  75          2HE       MET  75 -12.650   8.938  -2.939
  609   3HE   MET  75          3HE       MET  75 -12.762   7.263  -2.349
  610    H    LYS  76           H        LYS  76 -15.043   9.788   3.869
  611    HA   LYS  76           HA       LYS  76 -16.330  12.364   4.032
  612   1HB   LYS  76          2HB       LYS  76 -16.707   9.807   5.549
  613   2HB   LYS  76          1HB       LYS  76 -17.536  11.306   5.982
  614   1HG   LYS  76          2HG       LYS  76 -18.207  11.417   3.463
  615   2HG   LYS  76          1HG       LYS  76 -17.742   9.710   3.419
  616   1HD   LYS  76          2HD       LYS  76 -19.306   9.255   5.308
  617   2HD   LYS  76          1HD       LYS  76 -19.800  10.959   5.285
  618   1HE   LYS  76          2HE       LYS  76 -20.124  10.303   2.636
  619   2HE   LYS  76          1HE       LYS  76 -20.495   8.756   3.404
  620   1HZ   LYS  76          1HZ       LYS  76 -22.415  10.065   3.226
  621   2HZ   LYS  76          2HZ       LYS  76 -22.038   9.959   4.817
  622   3HZ   LYS  76          3HZ       LYS  76 -21.722  11.329   3.988
  623    H    SER  77           H        SER  77 -14.086  10.540   6.187
  624    HA   SER  77           HA       SER  77 -13.999  12.562   8.261
  625   1HB   SER  77          2HB       SER  77 -13.523  10.071   8.607
  626   2HB   SER  77          1HB       SER  77 -12.016  10.302   7.785
  627    HG   SER  77           HG       SER  77 -12.089  10.430  10.141
  628    H    GLY  78           H        GLY  78 -12.109  11.817   5.207
  629   1HA   GLY  78          2HA       GLY  78 -10.247  12.726   4.343
  630   2HA   GLY  78          1HA       GLY  78 -11.217  14.213   4.597
  631    H    ASN  79           H        ASN  79  -9.883  12.331   7.224
  632    HA   ASN  79           HA       ASN  79  -8.148  14.612   7.934
  633   1HB   ASN  79          2HB       ASN  79 -10.312  13.312   9.276
  634   2HB   ASN  79          1HB       ASN  79  -8.842  12.834  10.136
  635   1HD2  ASN  79          2HD2      ASN  79 -11.098  15.349   9.535
  636   2HD2  ASN  79          1HD2      ASN  79 -10.290  16.580  10.470
  637    H    VAL  80           H        VAL  80  -6.160  14.242   8.775
  638    HA   VAL  80           HA       VAL  80  -4.574  12.005   8.120
  639    HB   VAL  80           HB       VAL  80  -4.012  14.058  10.268
  640   1HG1  VAL  80          1HG1      VAL  80  -1.721  13.458   9.919
  641   2HG1  VAL  80          2HG1      VAL  80  -2.631  12.043  10.495
  642   3HG1  VAL  80          3HG1      VAL  80  -2.184  12.175   8.778
  643   1HG2  VAL  80          1HG2      VAL  80  -2.717  15.122   8.535
  644   2HG2  VAL  80          2HG2      VAL  80  -3.264  13.922   7.341
  645   3HG2  VAL  80          3HG2      VAL  80  -4.431  15.056   8.060
  646    H    LYS  81           H        LYS  81  -7.106  12.166  10.532
  647    HA   LYS  81           HA       LYS  81  -6.236  10.350  12.467
  648   1HB   LYS  81          2HB       LYS  81  -8.945  11.065  11.425
  649   2HB   LYS  81          1HB       LYS  81  -8.721   9.820  12.639
  650   1HG   LYS  81          2HG       LYS  81  -7.798  12.706  12.841
  651   2HG   LYS  81          1HG       LYS  81  -9.135  11.943  13.718
  652   1HD   LYS  81          2HD       LYS  81  -7.164  10.248  14.522
  653   2HD   LYS  81          1HD       LYS  81  -6.148  11.605  14.169
  654   1HE   LYS  81          2HE       LYS  81  -7.264  12.983  15.710
  655   2HE   LYS  81          1HE       LYS  81  -8.557  11.762  15.939
  656   1HZ   LYS  81          1HZ       LYS  81  -6.942  11.522  17.652
  657   2HZ   LYS  81          2HZ       LYS  81  -6.799  10.242  16.647
  658   3HZ   LYS  81          3HZ       LYS  81  -5.709  11.459  16.586
  659    H    ASP  82           H        ASP  82  -7.196   9.713   9.113
  660    HA   ASP  82           HA       ASP  82  -7.026   6.811   9.450
  661   1HB   ASP  82          2HB       ASP  82  -7.660   8.586   7.135
  662   2HB   ASP  82          1HB       ASP  82  -7.026   6.986   6.818
  663    H    LEU  83           H        LEU  83  -4.856   9.445   8.498
  664    HA   LEU  83           HA       LEU  83  -2.811   7.761   7.179
  665   1HB   LEU  83          2HB       LEU  83  -3.544  10.512   7.240
  666   2HB   LEU  83          1HB       LEU  83  -1.824  10.253   7.680
  667    HG   LEU  83           HG       LEU  83  -2.053  10.618   5.232
  668   1HD1  LEU  83          1HD1      LEU  83  -0.856   8.738   4.434
  669   2HD1  LEU  83          2HD1      LEU  83  -0.236   9.308   6.003
  670   3HD1  LEU  83          3HD1      LEU  83  -1.232   7.834   5.921
  671   1HD2  LEU  83          1HD2      LEU  83  -3.209   9.030   3.825
  672   2HD2  LEU  83          2HD2      LEU  83  -3.799   8.146   5.253
  673   3HD2  LEU  83          3HD2      LEU  83  -4.357   9.807   4.942
  674    H    THR  84           H        THR  84  -3.224   9.522  10.301
  675    HA   THR  84           HA       THR  84  -0.743   8.995  11.515
  676    HB   THR  84           HB       THR  84  -2.298  10.542  12.395
  677    HG1  THR  84           1HG      THR  84  -2.165   9.653  14.662
  678   1HG2  THR  84          1HG2      THR  84  -4.192   9.882  13.793
  679   2HG2  THR  84          2HG2      THR  84  -4.459   9.425  12.094
  680   3HG2  THR  84          3HG2      THR  84  -3.993   8.188  13.284
  681    H    GLN  85           H        GLN  85  -3.685   6.943  11.459
  682    HA   GLN  85           HA       GLN  85  -2.455   4.636  12.778
  683   1HB   GLN  85          2HB       GLN  85  -5.070   5.481  11.921
  684   2HB   GLN  85          1HB       GLN  85  -4.705   3.790  11.515
  685   1HG   GLN  85          2HG       GLN  85  -5.632   3.947  13.843
  686   2HG   GLN  85          1HG       GLN  85  -3.975   3.399  13.901
  687   1HE2  GLN  85          2HE2      GLN  85  -6.177   5.998  14.597
  688   2HE2  GLN  85          1HE2      GLN  85  -5.029   6.902  15.558
  689    H    ALA  86           H        ALA  86  -3.404   5.361   9.364
  690    HA   ALA  86           HA       ALA  86  -2.358   3.079   8.141
  691   1HB   ALA  86          1HB       ALA  86  -2.163   4.408   6.150
  692   2HB   ALA  86          2HB       ALA  86  -3.717   4.694   6.969
  693   3HB   ALA  86          3HB       ALA  86  -2.411   5.898   7.091
  694    H    TRP  87           H        TRP  87  -0.558   5.875   9.538
  695    HA   TRP  87           HA       TRP  87   1.928   5.417   8.304
  696   1HB   TRP  87          2HB       TRP  87   0.893   7.339   9.923
  697   2HB   TRP  87          1HB       TRP  87   1.852   6.454  11.096
  698    HD1  TRP  87           HD       TRP  87   4.072   7.661  11.343
  699    HE1  TRP  87           1HE      TRP  87   5.717   8.829   9.797
  700    HE3  TRP  87           3HE      TRP  87   1.518   7.166   7.032
  701    HZ2  TRP  87           2HZ      TRP  87   5.886   9.439   7.035
  702    HZ3  TRP  87           3HZ      TRP  87   2.622   7.680   4.875
  703    HH2  TRP  87           HH       TRP  87   4.772   8.922   4.887
  704    H    ASP  88           H        ASP  88   0.467   4.047  11.290
  705    HA   ASP  88           HA       ASP  88   2.839   2.552  12.056
  706   1HB   ASP  88          2HB       ASP  88   0.770   3.327  13.565
  707   2HB   ASP  88          1HB       ASP  88   0.081   1.826  13.044
  708    H    LEU  89           H        LEU  89  -0.296   1.820  10.357
  709    HA   LEU  89           HA       LEU  89   0.204  -1.009   9.948
  710   1HB   LEU  89          2HB       LEU  89  -1.718   0.915   8.608
  711   2HB   LEU  89          1HB       LEU  89  -1.681  -0.796   8.346
  712    HG   LEU  89           HG       LEU  89  -2.198   0.531  11.027
  713   1HD1  LEU  89          1HD1      LEU  89  -4.462  -0.220  10.643
  714   2HD1  LEU  89          2HD1      LEU  89  -3.940   0.921   9.381
  715   3HD1  LEU  89          3HD1      LEU  89  -4.009  -0.822   9.031
  716   1HD2  LEU  89          1HD2      LEU  89  -2.819  -1.685  11.776
  717   2HD2  LEU  89          2HD2      LEU  89  -2.321  -2.383  10.216
  718   3HD2  LEU  89          3HD2      LEU  89  -1.105  -1.658  11.295
  719    H    TYR  90           H        TYR  90   0.625   1.838   7.889
  720    HA   TYR  90           HA       TYR  90   1.850   0.584   5.617
  721   1HB   TYR  90          2HB       TYR  90   1.080   2.722   5.319
  722   2HB   TYR  90          1HB       TYR  90   1.972   3.343   6.752
  723    HD1  TYR  90           1HD      TYR  90   3.502   1.171   4.178
  724    HD2  TYR  90           2HD      TYR  90   3.023   5.155   5.699
  725    HE1  TYR  90           1HE      TYR  90   5.414   1.889   2.857
  726    HE2  TYR  90           2HE      TYR  90   4.824   5.930   4.214
  727    HH   TYR  90           HH       TYR  90   6.628   3.499   2.185
  728    H    TYR  91           H        TYR  91   3.463   2.237   8.435
  729    HA   TYR  91           HA       TYR  91   6.183   1.455   7.710
  730   1HB   TYR  91          2HB       TYR  91   5.379   3.285   9.296
  731   2HB   TYR  91          1HB       TYR  91   5.119   2.019  10.480
  732    HD1  TYR  91           1HD      TYR  91   7.735   3.195   8.072
  733    HD2  TYR  91           2HD      TYR  91   6.795   1.482  11.897
  734    HE1  TYR  91           1HE      TYR  91  10.070   3.558   8.799
  735    HE2  TYR  91           2HE      TYR  91   9.120   1.850  12.642
  736    HH   TYR  91           HH       TYR  91  11.188   2.336  11.988
  737    H    HIS  92           H        HIS  92   3.787  -0.195   9.816
  738    HA   HIS  92           HA       HIS  92   5.422  -2.340  10.679
  739   1HB   HIS  92          2HB       HIS  92   3.145  -1.668  11.605
  740   2HB   HIS  92          1HB       HIS  92   2.412  -2.400  10.199
  741    HD1  HIS  92           1HD      HIS  92   5.346  -3.999  12.005
  742    HD2  HIS  92           2HD      HIS  92   1.274  -4.384  11.375
  743    HE1  HIS  92           1HE      HIS  92   4.709  -6.311  12.907
  744    H    VAL  93           H        VAL  93   3.509  -1.851   7.714
  745    HA   VAL  93           HA       VAL  93   4.035  -4.572   6.674
  746    HB   VAL  93           HB       VAL  93   1.853  -3.348   6.501
  747   1HG1  VAL  93          1HG1      VAL  93   1.507  -2.103   4.427
  748   2HG1  VAL  93          2HG1      VAL  93   2.585  -1.220   5.534
  749   3HG1  VAL  93          3HG1      VAL  93   3.262  -2.082   4.132
  750   1HG2  VAL  93          1HG2      VAL  93   1.393  -4.495   4.419
  751   2HG2  VAL  93          2HG2      VAL  93   3.139  -4.759   4.191
  752   3HG2  VAL  93          3HG2      VAL  93   2.304  -5.481   5.587
  753    H    PHE  94           H        PHE  94   5.145  -1.193   6.161
  754    HA   PHE  94           HA       PHE  94   6.677  -1.192   3.967
  755   1HB   PHE  94          2HB       PHE  94   6.378   0.717   5.599
  756   2HB   PHE  94          1HB       PHE  94   7.512  -0.026   6.668
  757    HD1  PHE  94           1HD      PHE  94   7.233   0.923   3.091
  758    HD2  PHE  94           2HD      PHE  94   9.709   0.606   6.580
  759    HE1  PHE  94           1HE      PHE  94   9.054   2.100   1.887
  760    HE2  PHE  94           2HE      PHE  94  11.553   1.741   5.365
  761    HZ   PHE  94           HZ       PHE  94  11.218   2.504   3.029
  762    H    ARG  95           H        ARG  95   7.590  -2.864   6.988
  763    HA   ARG  95           HA       ARG  95  10.005  -3.944   5.805
  764   1HB   ARG  95          2HB       ARG  95   8.773  -3.670   8.415
  765   2HB   ARG  95          1HB       ARG  95   9.481  -5.288   8.164
  766   1HG   ARG  95          2HG       ARG  95  11.620  -4.373   7.620
  767   2HG   ARG  95          1HG       ARG  95  10.952  -2.728   7.452
  768   1HD   ARG  95          2HD       ARG  95  10.525  -2.580   9.829
  769   2HD   ARG  95          1HD       ARG  95  10.892  -4.301  10.062
  770    HE   ARG  95           HE       ARG  95  13.149  -3.164   8.902
  771   1HH1  ARG  95          2HH2      ARG  95  11.364  -2.686  11.875
  772   2HH1  ARG  95          1HH2      ARG  95  12.761  -2.265  12.814
  773   1HH2  ARG  95          2HH1      ARG  95  14.985  -2.608  10.162
  774   2HH2  ARG  95          1HH1      ARG  95  14.783  -2.219  11.835
  775    H    ARG  96           H        ARG  96   6.700  -5.107   6.263
  776    HA   ARG  96           HA       ARG  96   7.178  -7.949   5.864
  777   1HB   ARG  96          2HB       ARG  96   5.145  -7.155   7.077
  778   2HB   ARG  96          1HB       ARG  96   4.642  -6.224   5.705
  779   1HG   ARG  96          2HG       ARG  96   3.361  -8.074   5.476
  780   2HG   ARG  96          1HG       ARG  96   4.731  -8.538   4.449
  781   1HD   ARG  96          2HD       ARG  96   5.551  -9.364   6.984
  782   2HD   ARG  96          1HD       ARG  96   3.820  -9.710   6.997
  783    HE   ARG  96           HE       ARG  96   5.286 -10.555   4.625
  784   1HH1  ARG  96          2HH2      ARG  96   3.987 -11.471   7.739
  785   2HH1  ARG  96          1HH2      ARG  96   4.135 -13.178   7.466
  786   1HH2  ARG  96          2HH1      ARG  96   5.506 -12.824   4.286
  787   2HH2  ARG  96          1HH1      ARG  96   4.975 -13.916   5.517
  788    H    ILE  97           H        ILE  97   5.383  -5.565   3.871
  789    HA   ILE  97           HA       ILE  97   5.473  -6.988   1.357
  790    HB   ILE  97           HB       ILE  97   4.795  -4.878   0.346
  791   1HG1  ILE  97          2HG1      ILE  97   3.721  -3.273   2.075
  792   2HG1  ILE  97          1HG1      ILE  97   5.170  -3.677   2.971
  793   1HG2  ILE  97          1HG2      ILE  97   2.539  -5.054   1.263
  794   2HG2  ILE  97          2HG2      ILE  97   3.245  -6.669   1.018
  795   3HG2  ILE  97          3HG2      ILE  97   3.160  -5.975   2.654
  796   1HD1  ILE  97          1HD1      ILE  97   5.529  -1.755   1.546
  797   2HD1  ILE  97          2HD1      ILE  97   6.553  -3.112   1.019
  798   3HD1  ILE  97          3HD1      ILE  97   5.079  -2.701   0.107
  799    H    SER  98           H        SER  98   7.872  -5.166   3.058
  800    HA   SER  98           HA       SER  98   9.475  -4.097   0.988
  801   1HB   SER  98          2HB       SER  98  10.291  -3.306   2.813
  802   2HB   SER  98          1HB       SER  98   9.617  -4.645   3.812
  803    HG   SER  98           HG       SER  98  11.990  -4.287   3.819
  804    H    LYS  99           H        LYS  99  10.444  -6.891   2.892
  805    HA   LYS  99           HA       LYS  99  10.781  -8.798   0.700
  806   1HB   LYS  99          2HB       LYS  99  13.122  -8.719   0.532
  807   2HB   LYS  99          1HB       LYS  99  12.490  -7.068   0.240
  808   1HG   LYS  99          2HG       LYS  99  13.002  -6.705   2.760
  809   2HG   LYS  99          1HG       LYS  99  14.061  -8.140   2.563
  810   1HD   LYS  99          2HD       LYS  99  15.647  -6.872   1.806
  811   2HD   LYS  99          1HD       LYS  99  14.578  -6.351   0.444
  812   1HE   LYS  99          2HE       LYS  99  14.201  -4.276   1.478
  813   2HE   LYS  99          1HE       LYS  99  13.786  -5.060   2.985
  814   1HZ   LYS  99          1HZ       LYS  99  15.593  -3.678   3.243
  815   2HZ   LYS  99          2HZ       LYS  99  16.115  -5.217   3.445
  816   3HZ   LYS  99          3HZ       LYS  99  16.445  -4.414   2.057
  817    H    GLN 100           H        GLN 100   9.410  -8.923   3.260
  818    HA   GLN 100           HA       GLN 100  10.638 -10.061   5.443
  819   1HB   GLN 100          2HB       GLN 100   8.293  -9.607   5.199
  820   2HB   GLN 100          1HB       GLN 100   8.143 -11.002   4.081
  821   1HG   GLN 100          2HG       GLN 100   7.363 -11.606   6.286
  822   2HG   GLN 100          1HG       GLN 100   8.868 -12.498   5.898
  823   1HE2  GLN 100          2HE2      GLN 100   9.320 -12.939   8.089
  824   2HE2  GLN 100          1HE2      GLN 100   9.801 -11.650   9.161
  Start of MODEL   13
    1   1H    GLU   1          1H        GLU   1   2.002 -19.890 -14.055
    2   2H    GLU   1          2H        GLU   1   0.575 -19.108 -13.628
    3    HA   GLU   1           HA       GLU   1   1.614 -17.582 -12.404
    4   1HB   GLU   1          2HB       GLU   1   3.712 -18.261 -11.510
    5   2HB   GLU   1          1HB       GLU   1   2.662 -19.694 -11.745
    6   1HG   GLU   1          2HG       GLU   1   3.998 -20.026 -13.970
    7   2HG   GLU   1          1HG       GLU   1   5.169 -18.917 -13.279
    8    H    LEU   2           H        LEU   2   3.538 -15.856 -12.315
    9    HA   LEU   2           HA       LEU   2   3.751 -14.288 -14.478
   10   1HB   LEU   2          2HB       LEU   2   5.920 -14.731 -12.446
   11   2HB   LEU   2          1HB       LEU   2   5.759 -13.324 -13.558
   12    HG   LEU   2           HG       LEU   2   4.992 -12.510 -11.488
   13   1HD1  LEU   2          1HD1      LEU   2   2.686 -12.082 -11.629
   14   2HD1  LEU   2          2HD1      LEU   2   3.521 -11.841 -13.182
   15   3HD1  LEU   2          3HD1      LEU   2   2.518 -13.288 -12.927
   16   1HD2  LEU   2          1HD2      LEU   2   3.445 -13.700 -10.036
   17   2HD2  LEU   2          2HD2      LEU   2   3.408 -15.074 -11.166
   18   3HD2  LEU   2          3HD2      LEU   2   4.913 -14.667 -10.309
   19    H    ILE   3           H        ILE   3   3.880 -15.505 -16.325
   20    HA   ILE   3           HA       ILE   3   6.619 -16.201 -17.352
   21    HB   ILE   3           HB       ILE   3   5.413 -17.840 -18.767
   22   1HG1  ILE   3          2HG1      ILE   3   3.280 -18.669 -17.531
   23   2HG1  ILE   3          1HG1      ILE   3   3.057 -16.896 -17.401
   24   1HG2  ILE   3          1HG2      ILE   3   5.277 -19.520 -17.006
   25   2HG2  ILE   3          2HG2      ILE   3   6.713 -18.495 -16.775
   26   3HG2  ILE   3          3HG2      ILE   3   5.271 -18.247 -15.762
   27   1HD1  ILE   3          1HD1      ILE   3   1.989 -17.788 -19.419
   28   2HD1  ILE   3          2HD1      ILE   3   3.327 -16.690 -19.834
   29   3HD1  ILE   3          3HD1      ILE   3   3.550 -18.451 -19.962
   30    H    ARG   4           H        ARG   4   4.614 -13.730 -17.505
   31    HA   ARG   4           HA       ARG   4   5.259 -12.952 -20.274
   32   1HB   ARG   4          2HB       ARG   4   2.840 -12.437 -20.779
   33   2HB   ARG   4          1HB       ARG   4   3.179 -14.134 -20.722
   34   1HG   ARG   4          2HG       ARG   4   2.326 -14.101 -18.298
   35   2HG   ARG   4          1HG       ARG   4   1.747 -12.482 -18.641
   36   1HD   ARG   4          2HD       ARG   4   1.016 -14.369 -20.764
   37   2HD   ARG   4          1HD       ARG   4   0.405 -14.844 -19.184
   38    HE   ARG   4           HE       ARG   4   0.014 -12.044 -19.924
   39   1HH1  ARG   4          2HH2      ARG   4  -1.311 -15.272 -19.756
   40   2HH1  ARG   4          1HH2      ARG   4  -2.960 -14.770 -19.941
   41   1HH2  ARG   4          2HH1      ARG   4  -2.197 -11.381 -20.166
   42   2HH2  ARG   4          1HH1      ARG   4  -3.433 -12.589 -20.164
   43    H    VAL   5           H        VAL   5   3.066 -12.027 -17.577
   44    HA   VAL   5           HA       VAL   5   3.616  -9.255 -17.781
   45    HB   VAL   5           HB       VAL   5   1.528 -10.279 -17.247
   46   1HG1  VAL   5          1HG1      VAL   5   0.935 -10.803 -14.941
   47   2HG1  VAL   5          2HG1      VAL   5   2.098 -11.983 -15.592
   48   3HG1  VAL   5          3HG1      VAL   5   2.650 -10.718 -14.468
   49   1HG2  VAL   5          1HG2      VAL   5   0.843  -8.554 -15.751
   50   2HG2  VAL   5          2HG2      VAL   5   2.552  -8.134 -15.486
   51   3HG2  VAL   5          3HG2      VAL   5   1.849  -8.010 -17.116
   52    H    ALA   6           H        ALA   6   4.606 -11.706 -15.287
   53    HA   ALA   6           HA       ALA   6   6.071 -11.564 -13.487
   54   1HB   ALA   6          1HB       ALA   6   8.319 -11.140 -14.125
   55   2HB   ALA   6          2HB       ALA   6   7.476 -12.198 -15.284
   56   3HB   ALA   6          3HB       ALA   6   7.774 -10.491 -15.690
   57    H    ILE   7           H        ILE   7   4.232  -9.199 -13.877
   58    HA   ILE   7           HA       ILE   7   5.794  -7.021 -12.683
   59    HB   ILE   7           HB       ILE   7   4.292  -6.817 -14.674
   60   1HG1  ILE   7          2HG1      ILE   7   5.633  -5.163 -14.027
   61   2HG1  ILE   7          1HG1      ILE   7   3.973  -4.469 -14.070
   62   1HG2  ILE   7          1HG2      ILE   7   2.132  -5.786 -14.227
   63   2HG2  ILE   7          2HG2      ILE   7   2.127  -7.509 -13.781
   64   3HG2  ILE   7          3HG2      ILE   7   2.241  -6.263 -12.516
   65   1HD1  ILE   7          1HD1      ILE   7   5.286  -3.553 -12.229
   66   2HD1  ILE   7          2HD1      ILE   7   3.908  -4.504 -11.625
   67   3HD1  ILE   7          3HD1      ILE   7   5.548  -5.190 -11.584
   68    H    LEU   8           H        LEU   8   5.914  -8.948 -10.917
   69    HA   LEU   8           HA       LEU   8   4.015  -9.454  -8.969
   70   1HB   LEU   8          2HB       LEU   8   6.897  -9.154  -9.102
   71   2HB   LEU   8          1HB       LEU   8   6.199  -8.729  -7.506
   72    HG   LEU   8           HG       LEU   8   6.790 -11.075  -7.437
   73   1HD1  LEU   8          1HD1      LEU   8   4.660 -12.056  -6.965
   74   2HD1  LEU   8          2HD1      LEU   8   4.790 -10.406  -6.313
   75   3HD1  LEU   8          3HD1      LEU   8   3.838 -10.708  -7.785
   76   1HD2  LEU   8          1HD2      LEU   8   5.938 -12.697  -9.012
   77   2HD2  LEU   8          2HD2      LEU   8   5.155 -11.410  -9.959
   78   3HD2  LEU   8          3HD2      LEU   8   6.930 -11.484  -9.854
   79    H    TRP   9           H        TRP   9   2.683  -8.431  -7.708
   80    HA   TRP   9           HA       TRP   9   2.514  -5.574  -7.529
   81   1HB   TRP   9          2HB       TRP   9   1.095  -7.685  -5.993
   82   2HB   TRP   9          1HB       TRP   9   0.913  -5.968  -5.704
   83    HD1  TRP   9           HD       TRP   9   1.259  -5.523  -9.136
   84    HE1  TRP   9           1HE      TRP   9  -0.954  -5.681 -10.355
   85    HE3  TRP   9           3HE      TRP   9  -1.250  -8.162  -5.657
   86    HZ2  TRP   9           2HZ      TRP   9  -3.486  -6.883  -9.896
   87    HZ3  TRP   9           3HZ      TRP   9  -3.698  -8.486  -5.914
   88    HH2  TRP   9           HH       TRP   9  -4.798  -7.875  -8.050
   89    H    HIS  10           H        HIS  10   3.669  -7.949  -5.079
   90    HA   HIS  10           HA       HIS  10   4.455  -6.225  -3.035
   91   1HB   HIS  10          2HB       HIS  10   5.106  -8.033  -2.146
   92   2HB   HIS  10          1HB       HIS  10   4.611  -8.873  -3.658
   93    HD1  HIS  10           1HD      HIS  10   7.503  -8.472  -1.487
   94    HD2  HIS  10           2HD      HIS  10   6.772  -9.053  -5.521
   95    HE1  HIS  10           1HE      HIS  10   9.732  -9.208  -2.518
   96    H    GLU  11           H        GLU  11   5.992  -6.607  -6.193
   97    HA   GLU  11           HA       GLU  11   8.581  -5.469  -5.612
   98   1HB   GLU  11          2HB       GLU  11   6.973  -6.001  -8.139
   99   2HB   GLU  11          1HB       GLU  11   8.535  -5.203  -8.168
  100   1HG   GLU  11          2HG       GLU  11   8.592  -7.685  -6.566
  101   2HG   GLU  11          1HG       GLU  11   8.128  -7.953  -8.230
  102    H    MET  12           H        MET  12   5.543  -4.205  -7.128
  103    HA   MET  12           HA       MET  12   6.483  -1.436  -7.191
  104   1HB   MET  12          2HB       MET  12   4.467  -0.856  -8.086
  105   2HB   MET  12          1HB       MET  12   4.932  -2.405  -8.861
  106   1HG   MET  12          2HG       MET  12   3.332  -3.609  -7.560
  107   2HG   MET  12          1HG       MET  12   2.962  -2.151  -6.581
  108   1HE   MET  12          1HE       MET  12   1.627  -2.980 -10.901
  109   2HE   MET  12          2HE       MET  12   3.339  -2.810 -10.442
  110   3HE   MET  12          3HE       MET  12   2.371  -4.154  -9.791
  111    H    TRP  13           H        TRP  13   4.665  -3.564  -4.970
  112    HA   TRP  13           HA       TRP  13   3.439  -1.554  -3.349
  113   1HB   TRP  13          2HB       TRP  13   3.486  -4.408  -3.388
  114   2HB   TRP  13          1HB       TRP  13   3.761  -3.804  -1.773
  115    HD1  TRP  13           HD       TRP  13   1.066  -5.115  -3.109
  116    HE1  TRP  13           1HE      TRP  13  -1.133  -3.998  -2.508
  117    HE3  TRP  13           3HE      TRP  13   2.811  -0.462  -2.187
  118    HZ2  TRP  13           2HZ      TRP  13  -1.999  -1.414  -1.796
  119    HZ3  TRP  13           3HZ      TRP  13   1.365   1.155  -1.105
  120    HH2  TRP  13           HH       TRP  13  -1.095   0.740  -0.991
  121    H    HIS  14           H        HIS  14   6.563  -3.323  -3.000
  122    HA   HIS  14           HA       HIS  14   7.424  -2.313  -0.551
  123   1HB   HIS  14          2HB       HIS  14   8.917  -2.971  -3.075
  124   2HB   HIS  14          1HB       HIS  14   9.692  -2.589  -1.501
  125    HD1  HIS  14           1HD      HIS  14  10.230  -5.322  -2.721
  126    HD2  HIS  14           2HD      HIS  14   7.024  -4.599  -0.262
  127    HE1  HIS  14           1HE      HIS  14  10.127  -7.308  -1.107
  128    H    GLU  15           H        GLU  15   8.231  -0.915  -3.770
  129    HA   GLU  15           HA       GLU  15   9.203   1.546  -2.596
  130   1HB   GLU  15          2HB       GLU  15   8.857   0.674  -5.457
  131   2HB   GLU  15          1HB       GLU  15   9.370   2.297  -4.997
  132   1HG   GLU  15          2HG       GLU  15  11.182   1.188  -3.586
  133   2HG   GLU  15          1HG       GLU  15  10.752  -0.328  -4.417
  134    H    GLY  16           H        GLY  16   6.144   0.629  -4.447
  135   1HA   GLY  16          2HA       GLY  16   4.989   3.174  -4.618
  136   2HA   GLY  16          1HA       GLY  16   4.126   1.665  -4.496
  137    H    LEU  17           H        LEU  17   5.150   0.947  -1.787
  138    HA   LEU  17           HA       LEU  17   3.557   2.635  -0.065
  139   1HB   LEU  17          2HB       LEU  17   5.095   0.151   0.124
  140   2HB   LEU  17          1HB       LEU  17   5.098   1.165   1.571
  141    HG   LEU  17           HG       LEU  17   2.480   0.912   0.218
  142   1HD1  LEU  17          1HD1      LEU  17   2.047  -1.325   1.201
  143   2HD1  LEU  17          2HD1      LEU  17   3.340  -1.407  -0.020
  144   3HD1  LEU  17          3HD1      LEU  17   3.748  -1.430   1.712
  145   1HD2  LEU  17          1HD2      LEU  17   1.787   0.678   2.598
  146   2HD2  LEU  17          2HD2      LEU  17   3.498   0.597   3.078
  147   3HD2  LEU  17          3HD2      LEU  17   2.843   2.090   2.365
  148    H    GLU  18           H        GLU  18   7.054   2.564  -0.993
  149    HA   GLU  18           HA       GLU  18   7.858   4.403   1.138
  150   1HB   GLU  18          2HB       GLU  18   9.462   2.816   0.174
  151   2HB   GLU  18          1HB       GLU  18   9.315   3.619  -1.385
  152   1HG   GLU  18          2HG       GLU  18  10.030   5.776  -0.273
  153   2HG   GLU  18          1HG       GLU  18  10.321   4.858   1.207
  154    H    GLU  19           H        GLU  19   7.182   4.692  -2.438
  155    HA   GLU  19           HA       GLU  19   7.547   7.520  -2.641
  156   1HB   GLU  19          2HB       GLU  19   7.510   5.837  -4.548
  157   2HB   GLU  19          1HB       GLU  19   5.785   5.783  -4.397
  158   1HG   GLU  19          2HG       GLU  19   6.290   7.276  -6.085
  159   2HG   GLU  19          1HG       GLU  19   5.748   8.266  -4.686
  160    H    ALA  20           H        ALA  20   4.788   5.577  -1.504
  161    HA   ALA  20           HA       ALA  20   2.921   7.841  -1.286
  162   1HB   ALA  20          1HB       ALA  20   1.474   6.220  -0.276
  163   2HB   ALA  20          2HB       ALA  20   2.117   5.619  -1.822
  164   3HB   ALA  20          3HB       ALA  20   2.776   5.008  -0.286
  165    H    SER  21           H        SER  21   4.305   5.576   1.138
  166    HA   SER  21           HA       SER  21   3.631   6.980   3.476
  167   1HB   SER  21          2HB       SER  21   5.958   5.125   3.026
  168   2HB   SER  21          1HB       SER  21   5.292   5.649   4.581
  169    HG   SER  21           HG       SER  21   4.525   3.519   3.649
  170    H    ARG  22           H        ARG  22   6.339   7.586   1.178
  171    HA   ARG  22           HA       ARG  22   7.826   9.415   2.911
  172   1HB   ARG  22          2HB       ARG  22   8.894   8.149   1.085
  173   2HB   ARG  22          1HB       ARG  22   7.991   9.111  -0.069
  174   1HG   ARG  22          2HG       ARG  22   9.056  11.163   0.697
  175   2HG   ARG  22          1HG       ARG  22   9.793  10.344   2.057
  176   1HD   ARG  22          2HD       ARG  22  11.493  10.566   0.361
  177   2HD   ARG  22          1HD       ARG  22  11.057   8.884   0.360
  178    HE   ARG  22           HE       ARG  22   9.449  10.156  -1.534
  179   1HH1  ARG  22          2HH2      ARG  22  12.805   9.389  -0.935
  180   2HH1  ARG  22          1HH2      ARG  22  13.247   9.333  -2.613
  181   1HH2  ARG  22          2HH1      ARG  22  10.059  10.046  -3.773
  182   2HH2  ARG  22          1HH1      ARG  22  11.715   9.765  -4.179
  183    H    LEU  23           H        LEU  23   5.220   9.812   0.472
  184    HA   LEU  23           HA       LEU  23   5.316  12.698   0.269
  185   1HB   LEU  23          2HB       LEU  23   3.644  10.480  -0.578
  186   2HB   LEU  23          1HB       LEU  23   2.780  12.010  -0.197
  187    HG   LEU  23           HG       LEU  23   3.341  11.866  -2.640
  188   1HD1  LEU  23          1HD1      LEU  23   4.342  13.994  -2.884
  189   2HD1  LEU  23          2HD1      LEU  23   3.106  14.009  -1.602
  190   3HD1  LEU  23          3HD1      LEU  23   4.834  13.999  -1.174
  191   1HD2  LEU  23          1HD2      LEU  23   5.587  12.005  -3.415
  192   2HD2  LEU  23          2HD2      LEU  23   6.218  11.858  -1.757
  193   3HD2  LEU  23          3HD2      LEU  23   5.359  10.492  -2.506
  194    H    TYR  24           H        TYR  24   4.277  10.483   2.689
  195    HA   TYR  24           HA       TYR  24   3.060  12.744   4.241
  196   1HB   TYR  24          2HB       TYR  24   1.679  10.663   3.817
  197   2HB   TYR  24          1HB       TYR  24   2.849   9.741   4.750
  198    HD1  TYR  24           1HD      TYR  24   1.509  13.208   5.399
  199    HD2  TYR  24           2HD      TYR  24   1.802   9.117   6.646
  200    HE1  TYR  24           1HE      TYR  24   0.065  13.711   7.333
  201    HE2  TYR  24           2HE      TYR  24   0.397   9.655   8.629
  202    HH   TYR  24           HH       TYR  24  -0.490  11.186   9.843
  203    H    PHE  25           H        PHE  25   5.681  10.338   4.331
  204    HA   PHE  25           HA       PHE  25   6.482  10.214   6.946
  205   1HB   PHE  25          2HB       PHE  25   7.348   8.900   5.081
  206   2HB   PHE  25          1HB       PHE  25   8.118  10.367   4.398
  207    HD1  PHE  25           1HD      PHE  25   8.114   8.051   7.285
  208    HD2  PHE  25           2HD      PHE  25  10.263  11.061   5.102
  209    HE1  PHE  25           1HE      PHE  25  10.129   7.607   8.669
  210    HE2  PHE  25           2HE      PHE  25  12.289  10.600   6.457
  211    HZ   PHE  25           HZ       PHE  25  12.220   8.874   8.237
  212    H    GLY  26           H        GLY  26   7.691  12.573   4.505
  213   1HA   GLY  26          2HA       GLY  26   7.850  14.722   6.536
  214   2HA   GLY  26          1HA       GLY  26   9.362  14.218   5.826
  215    H    GLU  27           H        GLU  27   6.261  14.208   4.071
  216    HA   GLU  27           HA       GLU  27   7.238  16.516   2.386
  217   1HB   GLU  27          2HB       GLU  27   6.256  13.942   1.594
  218   2HB   GLU  27          1HB       GLU  27   5.163  15.195   1.058
  219   1HG   GLU  27          2HG       GLU  27   6.606  15.387  -0.661
  220   2HG   GLU  27          1HG       GLU  27   7.581  16.345   0.453
  221    H    ARG  28           H        ARG  28   4.458  15.237   4.239
  222    HA   ARG  28           HA       ARG  28   2.582  16.249   5.066
  223   1HB   ARG  28          2HB       ARG  28   4.487  18.319   5.129
  224   2HB   ARG  28          1HB       ARG  28   3.106  19.021   4.322
  225   1HG   ARG  28          2HG       ARG  28   1.693  18.041   6.170
  226   2HG   ARG  28          1HG       ARG  28   3.256  17.744   7.015
  227   1HD   ARG  28          2HD       ARG  28   3.793  20.230   6.378
  228   2HD   ARG  28          1HD       ARG  28   2.041  20.395   6.116
  229    HE   ARG  28           HE       ARG  28   2.738  19.181   8.643
  230   1HH1  ARG  28          2HH2      ARG  28   2.192  22.269   7.063
  231   2HH1  ARG  28          1HH2      ARG  28   1.940  23.131   8.546
  232   1HH2  ARG  28          2HH1      ARG  28   2.407  20.340  10.570
  233   2HH2  ARG  28          1HH1      ARG  28   2.054  22.034  10.507
  234    H    ASN  29           H        ASN  29   2.929  15.345   2.238
  235    HA   ASN  29           HA       ASN  29   0.624  16.802   1.096
  236   1HB   ASN  29          2HB       ASN  29   2.900  17.270  -0.020
  237   2HB   ASN  29          1HB       ASN  29   2.898  15.603  -0.541
  238   1HD2  ASN  29          2HD2      ASN  29   3.058  17.198  -2.492
  239   2HD2  ASN  29          1HD2      ASN  29   1.530  17.497  -3.278
  240    H    VAL  30           H        VAL  30  -0.378  15.126   2.499
  241    HA   VAL  30           HA       VAL  30  -0.467  12.356   2.009
  242    HB   VAL  30           HB       VAL  30  -2.614  14.283   3.037
  243   1HG1  VAL  30          1HG1      VAL  30  -3.625  12.397   4.059
  244   2HG1  VAL  30          2HG1      VAL  30  -3.628  12.195   2.290
  245   3HG1  VAL  30          3HG1      VAL  30  -2.460  11.295   3.288
  246   1HG2  VAL  30          1HG2      VAL  30  -1.898  13.492   5.194
  247   2HG2  VAL  30          2HG2      VAL  30  -0.645  12.473   4.447
  248   3HG2  VAL  30          3HG2      VAL  30  -0.524  14.245   4.350
  249    H    LYS  31           H        LYS  31  -1.670  15.056   0.106
  250    HA   LYS  31           HA       LYS  31  -3.615  13.668  -1.545
  251   1HB   LYS  31          2HB       LYS  31  -3.790  15.960  -1.103
  252   2HB   LYS  31          1HB       LYS  31  -2.118  16.255  -1.700
  253   1HG   LYS  31          2HG       LYS  31  -4.228  15.183  -3.550
  254   2HG   LYS  31          1HG       LYS  31  -4.156  16.917  -3.169
  255   1HD   LYS  31          2HD       LYS  31  -1.483  16.418  -3.721
  256   2HD   LYS  31          1HD       LYS  31  -2.223  15.260  -4.782
  257   1HE   LYS  31          2HE       LYS  31  -3.155  18.141  -4.799
  258   2HE   LYS  31          1HE       LYS  31  -1.757  17.623  -5.695
  259   1HZ   LYS  31          1HZ       LYS  31  -3.705  17.605  -6.937
  260   2HZ   LYS  31          2HZ       LYS  31  -3.085  16.099  -6.840
  261   3HZ   LYS  31          3HZ       LYS  31  -4.413  16.491  -5.970
  262    H    GLY  32           H        GLY  32  -0.032  14.059  -1.541
  263   1HA   GLY  32          2HA       GLY  32   0.422  13.203  -4.287
  264   2HA   GLY  32          1HA       GLY  32   1.604  13.377  -3.016
  265    H    MET  33           H        MET  33   1.065  11.621  -1.082
  266    HA   MET  33           HA       MET  33   1.618   9.021  -1.906
  267   1HB   MET  33          2HB       MET  33   1.158   8.301   0.167
  268   2HB   MET  33          1HB       MET  33   1.690  10.011   0.375
  269   1HG   MET  33          2HG       MET  33  -0.643  10.661   0.893
  270   2HG   MET  33          1HG       MET  33  -1.202   9.048   0.618
  271   1HE   MET  33          1HE       MET  33   0.361   7.082   3.610
  272   2HE   MET  33          2HE       MET  33  -0.705   6.991   2.187
  273   3HE   MET  33          3HE       MET  33   1.046   7.232   1.975
  274    H    PHE  34           H        PHE  34  -1.509  10.595  -1.830
  275    HA   PHE  34           HA       PHE  34  -3.219   8.265  -2.099
  276   1HB   PHE  34          2HB       PHE  34  -3.469  11.032  -1.549
  277   2HB   PHE  34          1HB       PHE  34  -4.297  10.764  -3.067
  278    HD1  PHE  34           1HD      PHE  34  -5.202  11.363  -0.104
  279    HD2  PHE  34           2HD      PHE  34  -5.185   7.835  -2.563
  280    HE1  PHE  34           1HE      PHE  34  -7.221  10.524   1.055
  281    HE2  PHE  34           2HE      PHE  34  -7.145   6.979  -1.345
  282    HZ   PHE  34           HZ       PHE  34  -8.194   8.349   0.425
  283    H    GLU  35           H        GLU  35  -1.157   9.942  -4.326
  284    HA   GLU  35           HA       GLU  35  -2.752   9.200  -6.705
  285   1HB   GLU  35          2HB       GLU  35  -1.717  11.502  -6.434
  286   2HB   GLU  35          1HB       GLU  35  -0.147  10.755  -6.556
  287   1HG   GLU  35          2HG       GLU  35  -2.038   9.965  -8.665
  288   2HG   GLU  35          1HG       GLU  35  -1.572  11.696  -8.615
  289    H    VAL  36           H        VAL  36   0.565   8.565  -5.277
  290    HA   VAL  36           HA       VAL  36   1.202   6.459  -7.143
  291    HB   VAL  36           HB       VAL  36   2.906   7.771  -6.044
  292   1HG1  VAL  36          1HG1      VAL  36   3.522   7.303  -3.769
  293   2HG1  VAL  36          2HG1      VAL  36   1.895   8.020  -3.826
  294   3HG1  VAL  36          3HG1      VAL  36   2.087   6.272  -3.556
  295   1HG2  VAL  36          1HG2      VAL  36   4.390   5.995  -5.630
  296   2HG2  VAL  36          2HG2      VAL  36   3.041   4.835  -5.612
  297   3HG2  VAL  36          3HG2      VAL  36   3.423   5.734  -7.099
  298    H    LEU  37           H        LEU  37  -0.647   6.544  -4.101
  299    HA   LEU  37           HA       LEU  37  -0.855   3.631  -3.843
  300   1HB   LEU  37          2HB       LEU  37  -1.066   5.726  -2.048
  301   2HB   LEU  37          1HB       LEU  37  -2.738   5.299  -2.342
  302    HG   LEU  37           HG       LEU  37  -2.046   2.867  -1.961
  303   1HD1  LEU  37          1HD1      LEU  37  -0.011   2.566  -0.605
  304   2HD1  LEU  37          2HD1      LEU  37   0.388   3.199  -2.220
  305   3HD1  LEU  37          3HD1      LEU  37   0.388   4.289  -0.812
  306   1HD2  LEU  37          1HD2      LEU  37  -2.129   3.182   0.486
  307   2HD2  LEU  37          2HD2      LEU  37  -1.756   4.909   0.279
  308   3HD2  LEU  37          3HD2      LEU  37  -3.291   4.251  -0.335
  309    H    GLU  38           H        GLU  38  -2.634   6.207  -5.529
  310    HA   GLU  38           HA       GLU  38  -5.210   5.179  -5.759
  311   1HB   GLU  38          2HB       GLU  38  -3.694   7.225  -6.756
  312   2HB   GLU  38          1HB       GLU  38  -4.090   6.244  -8.205
  313   1HG   GLU  38          2HG       GLU  38  -6.399   6.771  -6.431
  314   2HG   GLU  38          1HG       GLU  38  -5.700   8.217  -7.149
  315    HA   PRO  39           HA       PRO  39  -3.852   2.033  -9.153
  316   1HB   PRO  39          2HB       PRO  39  -1.297   1.516  -9.709
  317   2HB   PRO  39          1HB       PRO  39  -2.175   2.813 -10.518
  318   1HG   PRO  39          2HG       PRO  39  -0.251   3.017  -8.154
  319   2HG   PRO  39          1HG       PRO  39  -0.311   4.023  -9.598
  320   1HD   PRO  39          1HD       PRO  39  -1.563   4.785  -7.223
  321   2HD   PRO  39          2HD       PRO  39  -2.263   5.223  -8.835
  322    H    LEU  40           H        LEU  40  -1.559   2.243  -6.320
  323    HA   LEU  40           HA       LEU  40  -1.370  -0.535  -5.904
  324   1HB   LEU  40          2HB       LEU  40  -1.047   1.773  -3.925
  325   2HB   LEU  40          1HB       LEU  40  -0.401   0.173  -3.739
  326    HG   LEU  40           HG       LEU  40   0.380   2.046  -6.012
  327   1HD1  LEU  40          1HD1      LEU  40   2.394   2.338  -4.716
  328   2HD1  LEU  40          2HD1      LEU  40   0.974   2.899  -3.801
  329   3HD1  LEU  40          3HD1      LEU  40   1.726   1.335  -3.405
  330   1HD2  LEU  40          1HD2      LEU  40   2.207   0.537  -6.350
  331   2HD2  LEU  40          2HD2      LEU  40   1.591  -0.556  -5.089
  332   3HD2  LEU  40          3HD2      LEU  40   0.664  -0.317  -6.589
  333    H    HIS  41           H        HIS  41  -3.948   1.694  -5.089
  334    HA   HIS  41           HA       HIS  41  -5.451   0.032  -3.285
  335   1HB   HIS  41          2HB       HIS  41  -5.833   2.246  -3.067
  336   2HB   HIS  41          1HB       HIS  41  -5.738   2.555  -4.835
  337    HD1  HIS  41           1HD      HIS  41  -8.219   0.125  -3.277
  338    HD2  HIS  41           2HD      HIS  41  -7.944   3.724  -5.294
  339    HE1  HIS  41           1HE      HIS  41 -10.542   0.553  -4.270
  340    H    ALA  42           H        ALA  42  -5.527   0.605  -6.834
  341    HA   ALA  42           HA       ALA  42  -7.860  -1.139  -7.291
  342   1HB   ALA  42          1HB       ALA  42  -7.523  -0.518  -9.591
  343   2HB   ALA  42          2HB       ALA  42  -7.591   0.911  -8.534
  344   3HB   ALA  42          3HB       ALA  42  -6.027   0.342  -9.161
  345    H    MET  43           H        MET  43  -4.334  -1.205  -7.894
  346    HA   MET  43           HA       MET  43  -4.084  -3.885  -8.943
  347   1HB   MET  43          2HB       MET  43  -2.160  -2.008  -7.604
  348   2HB   MET  43          1HB       MET  43  -1.750  -3.586  -8.346
  349   1HG   MET  43          2HG       MET  43  -2.902  -1.172  -9.767
  350   2HG   MET  43          1HG       MET  43  -1.208  -1.749  -9.841
  351   1HE   MET  43          1HE       MET  43  -4.563  -2.834 -12.578
  352   2HE   MET  43          2HE       MET  43  -4.904  -2.327 -10.907
  353   3HE   MET  43          3HE       MET  43  -3.947  -1.277 -11.978
  354    H    MET  44           H        MET  44  -5.049  -2.906  -5.810
  355    HA   MET  44           HA       MET  44  -4.038  -5.464  -4.641
  356   1HB   MET  44          2HB       MET  44  -3.368  -3.429  -3.382
  357   2HB   MET  44          1HB       MET  44  -5.020  -2.951  -3.224
  358   1HG   MET  44          2HG       MET  44  -4.183  -4.064  -1.196
  359   2HG   MET  44          1HG       MET  44  -5.504  -4.966  -1.862
  360   1HE   MET  44          1HE       MET  44  -4.150  -8.357  -1.589
  361   2HE   MET  44          2HE       MET  44  -5.071  -7.157  -0.653
  362   3HE   MET  44          3HE       MET  44  -5.441  -7.416  -2.374
  363    H    GLU  45           H        GLU  45  -6.922  -3.666  -5.657
  364    HA   GLU  45           HA       GLU  45  -8.833  -5.241  -4.084
  365   1HB   GLU  45          2HB       GLU  45  -9.068  -2.780  -4.688
  366   2HB   GLU  45          1HB       GLU  45  -9.471  -3.331  -6.307
  367   1HG   GLU  45          2HG       GLU  45 -10.945  -4.715  -4.082
  368   2HG   GLU  45          1HG       GLU  45 -11.340  -3.041  -4.335
  369    H    ARG  46           H        ARG  46  -7.747  -5.062  -7.552
  370    HA   ARG  46           HA       ARG  46  -9.305  -6.974  -8.779
  371   1HB   ARG  46          2HB       ARG  46  -7.030  -5.589  -9.386
  372   2HB   ARG  46          1HB       ARG  46  -6.433  -7.262  -9.291
  373   1HG   ARG  46          2HG       ARG  46  -7.335  -7.675 -11.299
  374   2HG   ARG  46          1HG       ARG  46  -8.954  -7.346 -10.612
  375   1HD   ARG  46          2HD       ARG  46  -8.246  -4.803 -10.931
  376   2HD   ARG  46          1HD       ARG  46  -7.089  -5.457 -12.095
  377    HE   ARG  46           HE       ARG  46  -9.700  -6.524 -12.530
  378   1HH1  ARG  46          2HH2      ARG  46  -7.821  -3.606 -13.052
  379   2HH1  ARG  46          1HH2      ARG  46  -8.803  -3.050 -14.368
  380   1HH2  ARG  46          2HH1      ARG  46 -10.982  -5.751 -14.274
  381   2HH2  ARG  46          1HH1      ARG  46 -10.558  -4.261 -15.042
  382    H    GLY  47           H        GLY  47  -6.911  -7.595  -6.225
  383   1HA   GLY  47          2HA       GLY  47  -6.572  -9.520  -5.002
  384   2HA   GLY  47          1HA       GLY  47  -7.767 -10.348  -5.958
  385    HA   PRO  48           HA       PRO  48  -3.330 -11.612  -7.074
  386   1HB   PRO  48          2HB       PRO  48  -3.030 -13.872  -5.639
  387   2HB   PRO  48          1HB       PRO  48  -2.630 -12.294  -4.964
  388   1HG   PRO  48          2HG       PRO  48  -5.177 -13.934  -4.571
  389   2HG   PRO  48          1HG       PRO  48  -4.221 -13.097  -3.349
  390   1HD   PRO  48          1HD       PRO  48  -6.493 -11.929  -4.545
  391   2HD   PRO  48          2HD       PRO  48  -5.077 -10.914  -4.006
  392    H    GLN  49           H        GLN  49  -2.792 -13.364  -8.403
  393    HA   GLN  49           HA       GLN  49  -5.088 -14.957  -9.532
  394   1HB   GLN  49          2HB       GLN  49  -3.989 -14.769 -11.703
  395   2HB   GLN  49          1HB       GLN  49  -4.415 -13.206 -11.087
  396   1HG   GLN  49          2HG       GLN  49  -2.052 -13.004 -10.234
  397   2HG   GLN  49          1HG       GLN  49  -1.707 -14.475 -11.198
  398   1HE2  GLN  49          2HE2      GLN  49  -2.989 -11.196 -11.366
  399   2HE2  GLN  49          1HE2      GLN  49  -2.441 -10.893 -12.991
  400    H    THR  50           H        THR  50  -1.540 -15.002  -9.407
  401    HA   THR  50           HA       THR  50  -1.358 -17.886  -9.523
  402    HB   THR  50           HB       THR  50   0.162 -16.981 -10.854
  403    HG1  THR  50           1HG      THR  50   2.241 -17.412  -9.831
  404   1HG2  THR  50          1HG2      THR  50   1.741 -15.182 -10.324
  405   2HG2  THR  50          2HG2      THR  50   0.058 -14.621 -10.182
  406   3HG2  THR  50          3HG2      THR  50   1.000 -14.992  -8.718
  407    H    LEU  51           H        LEU  51   1.068 -16.692  -7.580
  408    HA   LEU  51           HA       LEU  51  -0.074 -16.505  -4.899
  409   1HB   LEU  51          2HB       LEU  51   0.149 -19.091  -5.905
  410   2HB   LEU  51          1HB       LEU  51   1.722 -18.878  -5.176
  411    HG   LEU  51           HG       LEU  51   0.510 -18.068  -3.091
  412   1HD1  LEU  51          1HD1      LEU  51  -1.803 -18.806  -2.811
  413   2HD1  LEU  51          2HD1      LEU  51  -1.655 -17.560  -4.073
  414   3HD1  LEU  51          3HD1      LEU  51  -1.869 -19.266  -4.530
  415   1HD2  LEU  51          1HD2      LEU  51   0.050 -20.417  -2.422
  416   2HD2  LEU  51          2HD2      LEU  51   0.075 -20.905  -4.132
  417   3HD2  LEU  51          3HD2      LEU  51   1.558 -20.300  -3.358
  418    H    LYS  52           H        LYS  52   1.671 -14.926  -6.678
  419    HA   LYS  52           HA       LYS  52   4.205 -14.986  -5.085
  420   1HB   LYS  52          2HB       LYS  52   3.866 -13.950  -7.908
  421   2HB   LYS  52          1HB       LYS  52   5.340 -14.068  -6.998
  422   1HG   LYS  52          2HG       LYS  52   4.491 -16.666  -6.866
  423   2HG   LYS  52          1HG       LYS  52   3.845 -16.161  -8.425
  424   1HD   LYS  52          2HD       LYS  52   5.867 -16.478  -9.269
  425   2HD   LYS  52          1HD       LYS  52   6.416 -15.057  -8.332
  426   1HE   LYS  52          2HE       LYS  52   6.667 -16.724  -6.333
  427   2HE   LYS  52          1HE       LYS  52   6.545 -18.005  -7.537
  428   1HZ   LYS  52          1HZ       LYS  52   8.758 -17.453  -7.130
  429   2HZ   LYS  52          2HZ       LYS  52   8.411 -16.997  -8.659
  430   3HZ   LYS  52          3HZ       LYS  52   8.526 -15.877  -7.470
  431    H    GLU  53           H        GLU  53   1.785 -12.788  -6.632
  432    HA   GLU  53           HA       GLU  53   2.573 -10.381  -5.259
  433   1HB   GLU  53          2HB       GLU  53   0.563  -9.456  -6.029
  434   2HB   GLU  53          1HB       GLU  53   1.602 -10.184  -7.302
  435   1HG   GLU  53          2HG       GLU  53  -0.533 -11.986  -6.354
  436   2HG   GLU  53          1HG       GLU  53  -1.141 -10.507  -7.088
  437    H    THR  54           H        THR  54   2.705 -12.003  -3.224
  438    HA   THR  54           HA       THR  54   0.750 -10.865  -1.295
  439    HB   THR  54           HB       THR  54  -0.269 -12.827  -2.547
  440    HG1  THR  54           1HG      THR  54  -1.488 -13.053  -0.588
  441   1HG2  THR  54          1HG2      THR  54  -0.159 -14.920  -1.297
  442   2HG2  THR  54          2HG2      THR  54   1.391 -14.568  -2.096
  443   3HG2  THR  54          3HG2      THR  54   1.211 -14.296  -0.346
  444    H    SER  55           H        SER  55   3.762 -10.833  -1.797
  445    HA   SER  55           HA       SER  55   5.025 -12.299   0.360
  446   1HB   SER  55          2HB       SER  55   5.820 -10.542  -1.737
  447   2HB   SER  55          1HB       SER  55   6.464  -9.967  -0.179
  448    HG   SER  55           HG       SER  55   7.896 -11.574  -1.086
  449    H    PHE  56           H        PHE  56   3.394  -9.174   0.131
  450    HA   PHE  56           HA       PHE  56   4.278  -8.253   2.779
  451   1HB   PHE  56          2HB       PHE  56   3.079  -6.297   2.256
  452   2HB   PHE  56          1HB       PHE  56   4.085  -6.759   0.839
  453    HD1  PHE  56           1HD      PHE  56   3.134  -7.238  -1.246
  454    HD2  PHE  56           2HD      PHE  56   0.611  -6.573   2.160
  455    HE1  PHE  56           1HE      PHE  56   1.115  -7.280  -2.700
  456    HE2  PHE  56           2HE      PHE  56  -1.365  -6.463   0.705
  457    HZ   PHE  56           HZ       PHE  56  -1.087  -6.815  -1.740
  458    H    ASN  57           H        ASN  57   1.238  -9.259   1.126
  459    HA   ASN  57           HA       ASN  57  -0.537  -8.960   3.318
  460   1HB   ASN  57          2HB       ASN  57  -1.249  -9.032   0.970
  461   2HB   ASN  57          1HB       ASN  57  -0.744 -10.717   0.860
  462   1HD2  ASN  57          2HD2      ASN  57  -2.957  -8.489   2.528
  463   2HD2  ASN  57          1HD2      ASN  57  -4.093  -9.739   2.964
  464    H    GLN  58           H        GLN  58   1.737 -11.528   2.422
  465    HA   GLN  58           HA       GLN  58   0.788 -13.697   3.876
  466   1HB   GLN  58          2HB       GLN  58   2.879 -13.428   2.276
  467   2HB   GLN  58          1HB       GLN  58   3.741 -12.926   3.702
  468   1HG   GLN  58          2HG       GLN  58   2.307 -15.605   3.418
  469   2HG   GLN  58          1HG       GLN  58   4.018 -15.345   3.275
  470   1HE2  GLN  58          2HE2      GLN  58   1.931 -16.676   5.215
  471   2HE2  GLN  58          1HE2      GLN  58   2.628 -16.234   6.753
  472    H    ALA  59           H        ALA  59   2.668 -10.799   4.998
  473    HA   ALA  59           HA       ALA  59   2.302 -11.796   7.790
  474   1HB   ALA  59          1HB       ALA  59   4.156 -10.441   8.393
  475   2HB   ALA  59          2HB       ALA  59   4.571 -11.693   7.199
  476   3HB   ALA  59          3HB       ALA  59   4.399  -9.997   6.687
  477    H    TYR  60           H        TYR  60   2.952  -8.520   6.505
  478    HA   TYR  60           HA       TYR  60   2.013  -6.502   7.440
  479   1HB   TYR  60          2HB       TYR  60   0.627  -7.726   5.192
  480   2HB   TYR  60          1HB       TYR  60  -0.596  -7.022   6.189
  481    HD1  TYR  60           1HD      TYR  60  -0.342  -4.510   6.853
  482    HD2  TYR  60           2HD      TYR  60   2.023  -6.495   3.894
  483    HE1  TYR  60           1HE      TYR  60  -0.047  -2.372   5.649
  484    HE2  TYR  60           2HE      TYR  60   2.254  -4.395   2.616
  485    HH   TYR  60           HH       TYR  60   2.040  -2.156   2.757
  486    H    GLY  61           H        GLY  61   2.002  -7.534   9.795
  487   1HA   GLY  61          2HA       GLY  61  -0.063  -8.650  11.044
  488   2HA   GLY  61          1HA       GLY  61   0.924  -7.346  11.777
  489    H    ARG  62           H        ARG  62  -0.143  -5.554   9.671
  490    HA   ARG  62           HA       ARG  62  -2.548  -4.450  11.003
  491   1HB   ARG  62          2HB       ARG  62  -0.718  -3.406   8.818
  492   2HB   ARG  62          1HB       ARG  62  -1.834  -2.470   9.875
  493   1HG   ARG  62          2HG       ARG  62   0.781  -3.760  10.651
  494   2HG   ARG  62          1HG       ARG  62   0.431  -2.009  10.478
  495   1HD   ARG  62          2HD       ARG  62   0.358  -2.277  12.799
  496   2HD   ARG  62          1HD       ARG  62  -1.339  -2.496  12.391
  497    HE   ARG  62           HE       ARG  62   0.090  -4.976  12.334
  498   1HH1  ARG  62          2HH2      ARG  62  -1.394  -2.707  14.529
  499   2HH1  ARG  62          1HH2      ARG  62  -1.632  -3.877  15.790
  500   1HH2  ARG  62          2HH1      ARG  62  -0.305  -6.525  13.980
  501   2HH2  ARG  62          1HH1      ARG  62  -0.999  -5.999  15.471
  502    H    ASP  63           H        ASP  63  -1.671  -6.217   8.157
  503    HA   ASP  63           HA       ASP  63  -2.640  -6.789   6.199
  504   1HB   ASP  63          2HB       ASP  63  -4.309  -7.437   7.839
  505   2HB   ASP  63          1HB       ASP  63  -5.166  -5.896   7.498
  506    H    LEU  64           H        LEU  64  -2.080  -5.741   4.410
  507    HA   LEU  64           HA       LEU  64  -2.350  -2.892   4.078
  508   1HB   LEU  64          2HB       LEU  64  -0.760  -4.693   2.767
  509   2HB   LEU  64          1HB       LEU  64  -2.065  -4.614   1.627
  510    HG   LEU  64           HG       LEU  64  -0.519  -2.272   2.696
  511   1HD1  LEU  64          1HD1      LEU  64   0.458  -2.287   0.430
  512   2HD1  LEU  64          2HD1      LEU  64   0.802  -3.772   1.348
  513   3HD1  LEU  64          3HD1      LEU  64  -0.442  -3.780   0.076
  514   1HD2  LEU  64          1HD2      LEU  64  -1.494  -0.935   0.909
  515   2HD2  LEU  64          2HD2      LEU  64  -2.564  -2.285   0.464
  516   3HD2  LEU  64          3HD2      LEU  64  -2.741  -1.493   2.048
  517    H    MET  65           H        MET  65  -4.045  -5.749   2.667
  518    HA   MET  65           HA       MET  65  -5.972  -4.628   1.094
  519   1HB   MET  65          2HB       MET  65  -5.435  -7.089   2.027
  520   2HB   MET  65          1HB       MET  65  -6.930  -6.712   2.923
  521   1HG   MET  65          2HG       MET  65  -7.141  -5.774   0.199
  522   2HG   MET  65          1HG       MET  65  -6.684  -7.509   0.220
  523   1HE   MET  65          1HE       MET  65 -10.016  -8.842  -0.187
  524   2HE   MET  65          2HE       MET  65  -8.795  -7.993  -1.166
  525   3HE   MET  65          3HE       MET  65  -8.288  -9.210   0.029
  526    H    GLU  66           H        GLU  66  -5.896  -4.491   4.658
  527    HA   GLU  66           HA       GLU  66  -8.602  -3.280   4.899
  528   1HB   GLU  66          2HB       GLU  66  -6.617  -4.520   6.684
  529   2HB   GLU  66          1HB       GLU  66  -7.588  -3.171   7.314
  530   1HG   GLU  66          2HG       GLU  66  -9.684  -4.343   6.711
  531   2HG   GLU  66          1HG       GLU  66  -8.806  -5.600   5.880
  532    H    ALA  67           H        ALA  67  -5.154  -2.374   5.523
  533    HA   ALA  67           HA       ALA  67  -5.498   0.343   6.223
  534   1HB   ALA  67          1HB       ALA  67  -3.187   0.529   5.476
  535   2HB   ALA  67          2HB       ALA  67  -3.416  -0.968   6.410
  536   3HB   ALA  67          3HB       ALA  67  -3.309  -1.035   4.635
  537    H    GLN  68           H        GLN  68  -5.649  -1.212   3.085
  538    HA   GLN  68           HA       GLN  68  -5.910   1.320   1.541
  539   1HB   GLN  68          2HB       GLN  68  -4.434  -0.170   0.598
  540   2HB   GLN  68          1HB       GLN  68  -5.549  -1.556   0.841
  541   1HG   GLN  68          2HG       GLN  68  -6.558   0.642  -0.914
  542   2HG   GLN  68          1HG       GLN  68  -5.224  -0.303  -1.555
  543   1HE2  GLN  68          2HE2      GLN  68  -8.703  -0.376  -0.806
  544   2HE2  GLN  68          1HE2      GLN  68  -8.850  -1.988  -1.467
  545    H    GLU  69           H        GLU  69  -7.918  -1.758   1.972
  546    HA   GLU  69           HA       GLU  69 -10.117  -1.089   0.638
  547   1HB   GLU  69          2HB       GLU  69  -9.768  -2.608   3.145
  548   2HB   GLU  69          1HB       GLU  69 -11.413  -2.086   2.753
  549   1HG   GLU  69          2HG       GLU  69 -10.402  -2.996   0.295
  550   2HG   GLU  69          1HG       GLU  69  -9.764  -4.147   1.475
  551    H    TRP  70           H        TRP  70  -9.136   0.507   3.603
  552    HA   TRP  70           HA       TRP  70 -11.613   2.002   3.927
  553   1HB   TRP  70          2HB       TRP  70  -8.937   2.373   5.285
  554   2HB   TRP  70          1HB       TRP  70 -10.571   2.819   5.882
  555    HD1  TRP  70           HD       TRP  70 -11.454  -0.450   4.986
  556    HE1  TRP  70           1HE      TRP  70 -10.718  -2.279   6.560
  557    HE3  TRP  70           3HE      TRP  70  -7.950   2.131   7.508
  558    HZ2  TRP  70           2HZ      TRP  70  -8.921  -2.550   8.739
  559    HZ3  TRP  70           3HZ      TRP  70  -6.991   1.181   9.597
  560    HH2  TRP  70           HH       TRP  70  -7.387  -1.209  10.134
  561    H    CYS  71           H        CYS  71 -10.437   2.281   1.345
  562    HA   CYS  71           HA       CYS  71  -8.906   4.795   1.189
  563   1HB   CYS  71          2HB       CYS  71  -8.980   4.312  -1.300
  564   2HB   CYS  71          1HB       CYS  71  -8.183   3.080  -0.375
  565    HG   CYS  71           HG       CYS  71  -9.524   2.153  -2.367
  566    H    ARG  72           H        ARG  72 -12.045   3.501  -0.081
  567    HA   ARG  72           HA       ARG  72 -13.245   5.899  -0.885
  568   1HB   ARG  72          2HB       ARG  72 -13.913   3.370  -1.054
  569   2HB   ARG  72          1HB       ARG  72 -14.805   3.722   0.436
  570   1HG   ARG  72          2HG       ARG  72 -16.039   5.507  -0.638
  571   2HG   ARG  72          1HG       ARG  72 -15.019   5.412  -2.087
  572   1HD   ARG  72          2HD       ARG  72 -15.810   3.055  -2.427
  573   2HD   ARG  72          1HD       ARG  72 -16.919   3.271  -1.053
  574    HE   ARG  72           HE       ARG  72 -17.332   5.423  -2.786
  575   1HH1  ARG  72          2HH2      ARG  72 -17.703   1.942  -2.986
  576   2HH1  ARG  72          1HH2      ARG  72 -19.025   2.013  -4.105
  577   1HH2  ARG  72          2HH1      ARG  72 -19.083   5.482  -4.273
  578   2HH2  ARG  72          1HH1      ARG  72 -19.781   3.996  -4.815
  579    H    LYS  73           H        LYS  73 -12.627   4.737   2.380
  580    HA   LYS  73           HA       LYS  73 -14.241   6.870   3.678
  581   1HB   LYS  73          2HB       LYS  73 -12.919   4.480   4.705
  582   2HB   LYS  73          1HB       LYS  73 -13.163   5.913   5.727
  583   1HG   LYS  73          2HG       LYS  73 -15.271   4.887   6.027
  584   2HG   LYS  73          1HG       LYS  73 -15.646   5.797   4.590
  585   1HD   LYS  73          2HD       LYS  73 -14.848   3.664   3.298
  586   2HD   LYS  73          1HD       LYS  73 -15.066   2.861   4.849
  587   1HE   LYS  73          2HE       LYS  73 -17.216   2.637   4.169
  588   2HE   LYS  73          1HE       LYS  73 -17.393   4.321   4.684
  589   1HZ   LYS  73          1HZ       LYS  73 -18.156   4.025   2.483
  590   2HZ   LYS  73          2HZ       LYS  73 -16.817   4.961   2.433
  591   3HZ   LYS  73          3HZ       LYS  73 -16.740   3.388   2.003
  592    H    TYR  74           H        TYR  74 -10.764   5.872   3.595
  593    HA   TYR  74           HA       TYR  74  -9.743   8.196   4.860
  594   1HB   TYR  74          2HB       TYR  74  -8.369   6.386   4.701
  595   2HB   TYR  74          1HB       TYR  74  -8.678   6.172   2.941
  596    HD1  TYR  74           1HD      TYR  74  -7.459   9.189   4.834
  597    HD2  TYR  74           2HD      TYR  74  -6.836   6.253   1.777
  598    HE1  TYR  74           1HE      TYR  74  -5.634  10.548   3.884
  599    HE2  TYR  74           2HE      TYR  74  -4.918   7.516   0.928
  600    HH   TYR  74           HH       TYR  74  -3.587   9.191   1.227
  601    H    MET  75           H        MET  75 -10.912   7.885   1.562
  602    HA   MET  75           HA       MET  75  -9.783  10.029   0.154
  603   1HB   MET  75          2HB       MET  75 -11.738   8.094  -0.192
  604   2HB   MET  75          1HB       MET  75 -12.619   9.619  -0.286
  605   1HG   MET  75          2HG       MET  75 -10.019   9.209  -1.840
  606   2HG   MET  75          1HG       MET  75 -11.558   8.746  -2.499
  607   1HE   MET  75          1HE       MET  75  -9.839  12.333  -3.720
  608   2HE   MET  75          2HE       MET  75  -8.988  11.224  -2.618
  609   3HE   MET  75          3HE       MET  75  -9.787  10.590  -4.077
  610    H    LYS  76           H        LYS  76 -12.014  10.192   2.820
  611    HA   LYS  76           HA       LYS  76 -11.702  12.779   3.548
  612   1HB   LYS  76          2HB       LYS  76 -13.559  12.761   1.291
  613   2HB   LYS  76          1HB       LYS  76 -14.175  13.567   2.736
  614   1HG   LYS  76          2HG       LYS  76 -12.426  15.164   2.744
  615   2HG   LYS  76          1HG       LYS  76 -11.344  14.145   1.808
  616   1HD   LYS  76          2HD       LYS  76 -12.155  15.952   0.376
  617   2HD   LYS  76          1HD       LYS  76 -12.870  14.466  -0.200
  618   1HE   LYS  76          2HE       LYS  76 -14.719  15.377   1.673
  619   2HE   LYS  76          1HE       LYS  76 -14.141  16.846   0.860
  620   1HZ   LYS  76          1HZ       LYS  76 -15.951  15.794  -0.282
  621   2HZ   LYS  76          2HZ       LYS  76 -14.603  15.821  -1.210
  622   3HZ   LYS  76          3HZ       LYS  76 -15.072  14.431  -0.494
  623    H    SER  77           H        SER  77 -14.044  10.143   3.262
  624    HA   SER  77           HA       SER  77 -15.876  10.730   5.372
  625   1HB   SER  77          2HB       SER  77 -15.790   8.951   3.392
  626   2HB   SER  77          1HB       SER  77 -15.042   7.948   4.633
  627    HG   SER  77           HG       SER  77 -17.359   7.762   4.561
  628    H    GLY  78           H        GLY  78 -12.763   8.854   5.430
  629   1HA   GLY  78          2HA       GLY  78 -12.793   8.594   8.371
  630   2HA   GLY  78          1HA       GLY  78 -11.569   8.029   7.274
  631    H    ASN  79           H        ASN  79 -11.761  11.000   6.085
  632    HA   ASN  79           HA       ASN  79 -10.237  12.726   6.079
  633   1HB   ASN  79          2HB       ASN  79 -11.685  12.685   8.594
  634   2HB   ASN  79          1HB       ASN  79 -10.096  13.335   8.842
  635   1HD2  ASN  79          2HD2      ASN  79 -11.035  15.330   9.293
  636   2HD2  ASN  79          1HD2      ASN  79 -11.540  16.325   7.955
  637    H    VAL  80           H        VAL  80  -8.132  13.646   7.224
  638    HA   VAL  80           HA       VAL  80  -5.957  11.960   7.373
  639    HB   VAL  80           HB       VAL  80  -6.319  14.500   8.958
  640   1HG1  VAL  80          1HG1      VAL  80  -3.922  14.576   8.972
  641   2HG1  VAL  80          2HG1      VAL  80  -4.484  13.125   9.837
  642   3HG1  VAL  80          3HG1      VAL  80  -3.826  12.981   8.190
  643   1HG2  VAL  80          1HG2      VAL  80  -5.119  15.468   7.097
  644   2HG2  VAL  80          2HG2      VAL  80  -5.112  13.904   6.246
  645   3HG2  VAL  80          3HG2      VAL  80  -6.649  14.757   6.531
  646    H    LYS  81           H        LYS  81  -8.561  12.151   9.769
  647    HA   LYS  81           HA       LYS  81  -7.240  10.968  11.988
  648   1HB   LYS  81          2HB       LYS  81  -9.992  11.699  11.318
  649   2HB   LYS  81          1HB       LYS  81  -9.872  10.244  12.274
  650   1HG   LYS  81          2HG       LYS  81  -8.730  12.973  12.971
  651   2HG   LYS  81          1HG       LYS  81  -9.998  12.094  13.796
  652   1HD   LYS  81          2HD       LYS  81  -8.080  10.255  14.121
  653   2HD   LYS  81          1HD       LYS  81  -7.030  11.636  13.875
  654   1HE   LYS  81          2HE       LYS  81  -8.763  12.730  15.639
  655   2HE   LYS  81          1HE       LYS  81  -8.868  11.028  16.118
  656   1HZ   LYS  81          1HZ       LYS  81  -7.132  12.016  17.265
  657   2HZ   LYS  81          2HZ       LYS  81  -6.420  11.057  16.144
  658   3HZ   LYS  81          3HZ       LYS  81  -6.486  12.676  15.922
  659    H    ASP  82           H        ASP  82  -8.519   9.577   9.018
  660    HA   ASP  82           HA       ASP  82  -8.113   6.809   9.954
  661   1HB   ASP  82          2HB       ASP  82  -9.886   7.990   8.154
  662   2HB   ASP  82          1HB       ASP  82  -8.652   7.445   7.069
  663    H    LEU  83           H        LEU  83  -6.474   9.297   7.947
  664    HA   LEU  83           HA       LEU  83  -4.569   7.488   6.676
  665   1HB   LEU  83          2HB       LEU  83  -5.307   9.689   5.806
  666   2HB   LEU  83          1HB       LEU  83  -4.147  10.376   6.991
  667    HG   LEU  83           HG       LEU  83  -3.386   9.952   4.545
  668   1HD1  LEU  83          1HD1      LEU  83  -1.114   9.479   5.237
  669   2HD1  LEU  83          2HD1      LEU  83  -1.902  10.712   6.249
  670   3HD1  LEU  83          3HD1      LEU  83  -1.700   9.054   6.863
  671   1HD2  LEU  83          1HD2      LEU  83  -2.335   7.768   4.142
  672   2HD2  LEU  83          2HD2      LEU  83  -3.028   7.143   5.658
  673   3HD2  LEU  83          3HD2      LEU  83  -4.099   7.607   4.313
  674    H    THR  84           H        THR  84  -4.404   9.663   9.569
  675    HA   THR  84           HA       THR  84  -1.853   9.178  10.561
  676    HB   THR  84           HB       THR  84  -3.321  10.677  11.580
  677    HG1  THR  84           1HG      THR  84  -3.024   9.772  13.832
  678   1HG2  THR  84          1HG2      THR  84  -5.091   9.983  13.124
  679   2HG2  THR  84          2HG2      THR  84  -5.479   9.516  11.451
  680   3HG2  THR  84          3HG2      THR  84  -4.894   8.293  12.604
  681    H    GLN  85           H        GLN  85  -4.442   6.786  10.325
  682    HA   GLN  85           HA       GLN  85  -2.941   4.716  11.883
  683   1HB   GLN  85          2HB       GLN  85  -5.736   5.117  11.013
  684   2HB   GLN  85          1HB       GLN  85  -5.079   3.464  11.142
  685   1HG   GLN  85          2HG       GLN  85  -4.534   3.763  13.476
  686   2HG   GLN  85          1HG       GLN  85  -4.710   5.509  13.382
  687   1HE2  GLN  85          2HE2      GLN  85  -6.019   3.364  15.060
  688   2HE2  GLN  85          1HE2      GLN  85  -7.710   3.764  14.864
  689    H    ALA  86           H        ALA  86  -4.482   5.026   8.594
  690    HA   ALA  86           HA       ALA  86  -3.299   2.803   7.374
  691   1HB   ALA  86          1HB       ALA  86  -3.610   3.956   5.308
  692   2HB   ALA  86          2HB       ALA  86  -5.024   4.137   6.375
  693   3HB   ALA  86          3HB       ALA  86  -3.881   5.488   6.174
  694    H    TRP  87           H        TRP  87  -1.774   5.991   7.991
  695    HA   TRP  87           HA       TRP  87   0.739   5.548   6.734
  696   1HB   TRP  87          2HB       TRP  87   0.488   7.703   7.302
  697   2HB   TRP  87          1HB       TRP  87  -0.493   7.318   8.759
  698    HD1  TRP  87           HD       TRP  87   0.582   7.980  10.893
  699    HE1  TRP  87           1HE      TRP  87   2.926   8.124  11.845
  700    HE3  TRP  87           3HE      TRP  87   3.138   6.353   6.860
  701    HZ2  TRP  87           2HZ      TRP  87   5.555   7.614  10.943
  702    HZ3  TRP  87           3HZ      TRP  87   5.601   6.568   6.800
  703    HH2  TRP  87           HH       TRP  87   6.809   7.186   8.872
  704    H    ASP  88           H        ASP  88  -0.537   4.694   9.998
  705    HA   ASP  88           HA       ASP  88   2.003   3.894  11.084
  706   1HB   ASP  88          2HB       ASP  88  -0.342   4.539  12.277
  707   2HB   ASP  88          1HB       ASP  88  -0.593   2.829  12.181
  708    H    LEU  89           H        LEU  89  -0.689   2.308   9.232
  709    HA   LEU  89           HA       LEU  89   0.310  -0.384   9.595
  710   1HB   LEU  89          2HB       LEU  89  -1.556   0.596   7.501
  711   2HB   LEU  89          1HB       LEU  89  -1.299  -1.073   8.124
  712    HG   LEU  89           HG       LEU  89  -2.884   1.185   9.231
  713   1HD1  LEU  89          1HD1      LEU  89  -4.448  -0.634   9.734
  714   2HD1  LEU  89          2HD1      LEU  89  -3.983  -0.567   8.016
  715   3HD1  LEU  89          3HD1      LEU  89  -3.275  -1.804   9.082
  716   1HD2  LEU  89          1HD2      LEU  89  -3.050   0.200  11.459
  717   2HD2  LEU  89          2HD2      LEU  89  -1.756  -0.954  11.060
  718   3HD2  LEU  89          3HD2      LEU  89  -1.401   0.788  11.137
  719    H    TYR  90           H        TYR  90   0.455   2.049   7.035
  720    HA   TYR  90           HA       TYR  90   2.115   0.689   5.161
  721   1HB   TYR  90          2HB       TYR  90   1.703   3.623   5.797
  722   2HB   TYR  90          1HB       TYR  90   2.556   3.010   4.345
  723    HD1  TYR  90           1HD      TYR  90   0.386   4.822   4.070
  724    HD2  TYR  90           2HD      TYR  90   0.207   0.540   4.470
  725    HE1  TYR  90           1HE      TYR  90  -1.809   4.790   2.926
  726    HE2  TYR  90           2HE      TYR  90  -1.966   0.517   3.373
  727    HH   TYR  90           HH       TYR  90  -3.771   1.825   2.780
  728    H    TYR  91           H        TYR  91   2.978   2.848   7.811
  729    HA   TYR  91           HA       TYR  91   5.858   2.744   7.379
  730   1HB   TYR  91          2HB       TYR  91   4.449   4.616   8.532
  731   2HB   TYR  91          1HB       TYR  91   4.323   3.561   9.917
  732    HD1  TYR  91           1HD      TYR  91   7.190   4.344   7.604
  733    HD2  TYR  91           2HD      TYR  91   5.527   4.471  11.562
  734    HE1  TYR  91           1HE      TYR  91   9.363   5.127   8.478
  735    HE2  TYR  91           2HE      TYR  91   7.694   5.258  12.453
  736    HH   TYR  91           HH       TYR  91   9.693   6.066  11.930
  737    H    HIS  92           H        HIS  92   3.605   1.075   9.630
  738    HA   HIS  92           HA       HIS  92   5.562  -0.216  11.233
  739   1HB   HIS  92          2HB       HIS  92   3.142   0.017  11.882
  740   2HB   HIS  92          1HB       HIS  92   2.688  -1.067  10.585
  741    HD1  HIS  92           1HD      HIS  92   4.920  -1.199  13.663
  742    HD2  HIS  92           2HD      HIS  92   2.655  -3.568  11.147
  743    HE1  HIS  92           1HE      HIS  92   4.772  -3.502  14.797
  744    H    VAL  93           H        VAL  93   3.795  -1.109   8.240
  745    HA   VAL  93           HA       VAL  93   5.112  -3.703   8.056
  746    HB   VAL  93           HB       VAL  93   2.782  -3.245   7.220
  747   1HG1  VAL  93          1HG1      VAL  93   2.577  -2.234   5.013
  748   2HG1  VAL  93          2HG1      VAL  93   3.205  -1.048   6.182
  749   3HG1  VAL  93          3HG1      VAL  93   4.309  -1.819   5.018
  750   1HG2  VAL  93          1HG2      VAL  93   3.101  -4.713   5.348
  751   2HG2  VAL  93          2HG2      VAL  93   4.857  -4.428   5.413
  752   3HG2  VAL  93          3HG2      VAL  93   4.033  -5.218   6.777
  753    H    PHE  94           H        PHE  94   5.472  -0.358   6.639
  754    HA   PHE  94           HA       PHE  94   7.188  -0.349   4.741
  755   1HB   PHE  94          2HB       PHE  94   6.685   1.700   6.002
  756   2HB   PHE  94          1HB       PHE  94   7.860   1.255   7.202
  757    HD1  PHE  94           1HD      PHE  94  10.271   0.815   6.435
  758    HD2  PHE  94           2HD      PHE  94   7.286   2.811   4.072
  759    HE1  PHE  94           1HE      PHE  94  12.053   1.904   5.124
  760    HE2  PHE  94           2HE      PHE  94   9.079   4.004   2.836
  761    HZ   PHE  94           HZ       PHE  94  11.464   3.546   3.360
  762    H    ARG  95           H        ARG  95   8.374  -1.217   8.049
  763    HA   ARG  95           HA       ARG  95  11.032  -1.798   7.310
  764   1HB   ARG  95          2HB       ARG  95   9.265  -2.522   9.582
  765   2HB   ARG  95          1HB       ARG  95  10.870  -3.299   9.401
  766   1HG   ARG  95          2HG       ARG  95  12.024  -1.178   9.561
  767   2HG   ARG  95          1HG       ARG  95  10.607  -0.258   9.133
  768   1HD   ARG  95          2HD       ARG  95  10.790   0.184  11.334
  769   2HD   ARG  95          1HD       ARG  95   9.641  -1.192  11.367
  770    HE   ARG  95           HE       ARG  95  11.112  -2.310  12.628
  771   1HH1  ARG  95          2HH2      ARG  95  13.061   0.020  10.857
  772   2HH1  ARG  95          1HH2      ARG  95  14.508  -0.330  11.745
  773   1HH2  ARG  95          2HH1      ARG  95  13.042  -2.725  13.781
  774   2HH2  ARG  95          1HH1      ARG  95  14.482  -1.866  13.359
  775    H    ARG  96           H        ARG  96   8.173  -3.885   7.186
  776    HA   ARG  96           HA       ARG  96   9.557  -6.403   6.585
  777   1HB   ARG  96          2HB       ARG  96   7.544  -6.743   7.767
  778   2HB   ARG  96          1HB       ARG  96   6.684  -5.512   6.913
  779   1HG   ARG  96          2HG       ARG  96   6.014  -6.909   5.336
  780   2HG   ARG  96          1HG       ARG  96   7.617  -7.638   5.136
  781   1HD   ARG  96          2HD       ARG  96   6.289  -8.265   7.720
  782   2HD   ARG  96          1HD       ARG  96   5.480  -8.913   6.297
  783    HE   ARG  96           HE       ARG  96   7.994  -9.619   5.783
  784   1HH1  ARG  96          2HH2      ARG  96   6.113  -9.933   8.716
  785   2HH1  ARG  96          1HH2      ARG  96   6.884 -11.392   9.236
  786   1HH2  ARG  96          2HH1      ARG  96   8.959 -11.614   6.460
  787   2HH2  ARG  96          1HH1      ARG  96   8.443 -12.325   7.954
  788    H    ILE  97           H        ILE  97   7.325  -4.188   4.809
  789    HA   ILE  97           HA       ILE  97   7.937  -5.293   2.217
  790    HB   ILE  97           HB       ILE  97   6.612  -3.253   1.436
  791   1HG1  ILE  97          2HG1      ILE  97   5.049  -2.850   3.748
  792   2HG1  ILE  97          1HG1      ILE  97   6.678  -2.585   4.266
  793   1HG2  ILE  97          1HG2      ILE  97   4.525  -4.379   2.056
  794   2HG2  ILE  97          2HG2      ILE  97   5.764  -5.560   1.571
  795   3HG2  ILE  97          3HG2      ILE  97   5.391  -5.319   3.294
  796   1HD1  ILE  97          1HD1      ILE  97   5.669  -0.574   3.521
  797   2HD1  ILE  97          2HD1      ILE  97   7.024  -1.001   2.450
  798   3HD1  ILE  97          3HD1      ILE  97   5.348  -1.274   1.916
  799    H    SER  98           H        SER  98   9.926  -3.538   4.089
  800    HA   SER  98           HA       SER  98  10.891  -1.580   2.268
  801   1HB   SER  98          2HB       SER  98  11.210  -1.042   4.490
  802   2HB   SER  98          1HB       SER  98  11.778  -2.687   4.916
  803    HG   SER  98           HG       SER  98  13.528  -1.287   4.994
  804    H    LYS  99           H        LYS  99  12.822  -4.048   3.840
  805    HA   LYS  99           HA       LYS  99  13.667  -5.516   1.448
  806   1HB   LYS  99          2HB       LYS  99  15.980  -4.871   1.627
  807   2HB   LYS  99          1HB       LYS  99  14.928  -3.482   1.205
  808   1HG   LYS  99          2HG       LYS  99  15.376  -2.381   3.123
  809   2HG   LYS  99          1HG       LYS  99  15.583  -3.890   4.073
  810   1HD   LYS  99          2HD       LYS  99  17.806  -4.276   3.057
  811   2HD   LYS  99          1HD       LYS  99  17.584  -2.960   1.926
  812   1HE   LYS  99          2HE       LYS  99  17.478  -1.394   3.873
  813   2HE   LYS  99          1HE       LYS  99  17.940  -2.780   4.907
  814   1HZ   LYS  99          1HZ       LYS  99  19.829  -1.468   4.059
  815   2HZ   LYS  99          2HZ       LYS  99  19.887  -3.047   3.636
  816   3HZ   LYS  99          3HZ       LYS  99  19.433  -1.930   2.538
  817    H    GLN 100           H        GLN 100  12.303  -6.395   3.781
  818    HA   GLN 100           HA       GLN 100  13.772  -7.328   5.963
  819   1HB   GLN 100          2HB       GLN 100  11.279  -7.546   5.690
  820   2HB   GLN 100          1HB       GLN 100  11.497  -8.720   4.441
  821   1HG   GLN 100          2HG       GLN 100  11.050  -9.965   6.260
  822   2HG   GLN 100          1HG       GLN 100  12.841 -10.048   6.180
  823   1HE2  GLN 100          2HE2      GLN 100  11.116 -10.599   8.401
  824   2HE2  GLN 100          1HE2      GLN 100  11.543  -9.453   9.646
  Start of MODEL   14
    1   1H    GLU   1          1H        GLU   1   5.700 -15.275 -19.139
    2   2H    GLU   1          2H        GLU   1   4.266 -16.003 -19.628
    3    HA   GLU   1           HA       GLU   1   3.476 -15.461 -17.195
    4   1HB   GLU   1          2HB       GLU   1   5.329 -17.768 -17.996
    5   2HB   GLU   1          1HB       GLU   1   4.324 -17.758 -16.585
    6   1HG   GLU   1          2HG       GLU   1   2.372 -18.083 -17.803
    7   2HG   GLU   1          1HG       GLU   1   2.968 -17.282 -19.228
    8    H    LEU   2           H        LEU   2   4.730 -16.301 -15.010
    9    HA   LEU   2           HA       LEU   2   6.599 -14.348 -14.253
   10   1HB   LEU   2          2HB       LEU   2   6.623 -15.339 -12.177
   11   2HB   LEU   2          1HB       LEU   2   4.953 -15.416 -12.841
   12    HG   LEU   2           HG       LEU   2   6.423 -17.881 -13.340
   13   1HD1  LEU   2          1HD1      LEU   2   6.569 -18.586 -10.990
   14   2HD1  LEU   2          2HD1      LEU   2   7.647 -17.209 -11.315
   15   3HD1  LEU   2          3HD1      LEU   2   6.106 -16.950 -10.464
   16   1HD2  LEU   2          1HD2      LEU   2   4.432 -18.833 -12.274
   17   2HD2  LEU   2          2HD2      LEU   2   3.926 -17.212 -11.741
   18   3HD2  LEU   2          3HD2      LEU   2   3.972 -17.604 -13.477
   19    H    ILE   3           H        ILE   3   7.878 -15.080 -16.376
   20    HA   ILE   3           HA       ILE   3  10.397 -16.332 -15.486
   21    HB   ILE   3           HB       ILE   3  10.237 -17.564 -17.862
   22   1HG1  ILE   3          2HG1      ILE   3   8.144 -18.692 -18.125
   23   2HG1  ILE   3          1HG1      ILE   3   7.388 -17.424 -17.108
   24   1HG2  ILE   3          1HG2      ILE   3   9.637 -19.577 -16.585
   25   2HG2  ILE   3          2HG2      ILE   3  10.790 -18.572 -15.672
   26   3HG2  ILE   3          3HG2      ILE   3   9.063 -18.565 -15.238
   27   1HD1  ILE   3          1HD1      ILE   3   7.076 -16.964 -19.492
   28   2HD1  ILE   3          2HD1      ILE   3   8.088 -15.717 -18.727
   29   3HD1  ILE   3          3HD1      ILE   3   8.838 -16.976 -19.737
   30    H    ARG   4           H        ARG   4   9.271 -13.651 -16.469
   31    HA   ARG   4           HA       ARG   4  11.496 -12.802 -18.220
   32   1HB   ARG   4          2HB       ARG   4   9.737 -11.679 -19.748
   33   2HB   ARG   4          1HB       ARG   4  10.026 -13.379 -19.990
   34   1HG   ARG   4          2HG       ARG   4   8.004 -14.004 -19.196
   35   2HG   ARG   4          1HG       ARG   4   7.875 -12.604 -18.083
   36   1HD   ARG   4          2HD       ARG   4   6.407 -11.766 -19.594
   37   2HD   ARG   4          1HD       ARG   4   7.807 -11.422 -20.601
   38    HE   ARG   4           HE       ARG   4   5.859 -13.529 -20.934
   39   1HH1  ARG   4          2HH2      ARG   4   9.049 -12.426 -21.919
   40   2HH1  ARG   4          1HH2      ARG   4   9.005 -13.277 -23.426
   41   1HH2  ARG   4          1HH1      ARG   4   5.854 -14.647 -22.921
   42   2HH2  ARG   4          2HH1      ARG   4   7.230 -14.521 -23.960
   43    H    VAL   5           H        VAL   5   8.319 -11.717 -16.935
   44    HA   VAL   5           HA       VAL   5   9.464  -9.775 -15.119
   45    HB   VAL   5           HB       VAL   5   9.837  -8.667 -17.215
   46   1HG1  VAL   5          1HG1      VAL   5   7.999  -7.728 -18.541
   47   2HG1  VAL   5          2HG1      VAL   5   8.002  -9.507 -18.619
   48   3HG1  VAL   5          3HG1      VAL   5   6.821  -8.662 -17.590
   49   1HG2  VAL   5          1HG2      VAL   5   8.909  -6.545 -16.635
   50   2HG2  VAL   5          2HG2      VAL   5   7.900  -7.339 -15.402
   51   3HG2  VAL   5          3HG2      VAL   5   9.675  -7.412 -15.281
   52    H    ALA   6           H        ALA   6   8.029 -11.845 -14.295
   53    HA   ALA   6           HA       ALA   6   5.277 -11.930 -14.152
   54   1HB   ALA   6          1HB       ALA   6   5.592 -12.670 -11.835
   55   2HB   ALA   6          2HB       ALA   6   6.861 -13.377 -12.863
   56   3HB   ALA   6          3HB       ALA   6   7.236 -11.988 -11.816
   57    H    ILE   7           H        ILE   7   7.345  -9.394 -12.987
   58    HA   ILE   7           HA       ILE   7   7.132  -7.690 -11.457
   59    HB   ILE   7           HB       ILE   7   6.825  -6.905 -13.653
   60   1HG1  ILE   7          2HG1      ILE   7   7.209  -5.476 -11.936
   61   2HG1  ILE   7          1HG1      ILE   7   6.140  -4.779 -13.212
   62   1HG2  ILE   7          1HG2      ILE   7   4.642  -6.167 -14.493
   63   2HG2  ILE   7          2HG2      ILE   7   4.713  -7.941 -14.360
   64   3HG2  ILE   7          3HG2      ILE   7   3.832  -6.991 -13.140
   65   1HD1  ILE   7          1HD1      ILE   7   5.554  -3.961 -10.999
   66   2HD1  ILE   7          2HD1      ILE   7   4.240  -4.942 -11.692
   67   3HD1  ILE   7          3HD1      ILE   7   5.294  -5.629 -10.434
   68    H    LEU   8           H        LEU   8   6.543  -9.008  -9.608
   69    HA   LEU   8           HA       LEU   8   3.901  -9.797  -8.926
   70   1HB   LEU   8          2HB       LEU   8   6.489  -9.731  -7.712
   71   2HB   LEU   8          1HB       LEU   8   5.202  -9.229  -6.566
   72    HG   LEU   8           HG       LEU   8   5.501 -11.632  -6.335
   73   1HD1  LEU   8          1HD1      LEU   8   3.296 -12.397  -6.873
   74   2HD1  LEU   8          2HD1      LEU   8   3.267 -10.759  -6.177
   75   3HD1  LEU   8          3HD1      LEU   8   3.042 -10.986  -7.927
   76   1HD2  LEU   8          1HD2      LEU   8   5.259 -13.178  -8.165
   77   2HD2  LEU   8          2HD2      LEU   8   5.082 -11.836  -9.321
   78   3HD2  LEU   8          3HD2      LEU   8   6.626 -12.079  -8.471
   79    H    TRP   9           H        TRP   9   2.584  -8.942  -7.164
   80    HA   TRP   9           HA       TRP   9   1.985  -6.082  -7.527
   81   1HB   TRP   9          2HB       TRP   9   0.611  -8.404  -6.331
   82   2HB   TRP   9          1HB       TRP   9   0.226  -6.818  -5.746
   83    HD1  TRP   9           HD       TRP   9   1.054  -6.305  -9.320
   84    HE1  TRP   9           1HE      TRP   9  -1.120  -6.043 -10.583
   85    HE3  TRP   9           3HE      TRP   9  -2.095  -7.742  -5.692
   86    HZ2  TRP   9           2HZ      TRP   9  -3.860  -6.478 -10.091
   87    HZ3  TRP   9           3HZ      TRP   9  -4.485  -8.148  -6.194
   88    HH2  TRP   9           HH       TRP   9  -5.379  -7.436  -8.401
   89    H    HIS  10           H        HIS  10   3.120  -8.096  -4.776
   90    HA   HIS  10           HA       HIS  10   3.424  -6.023  -2.847
   91   1HB   HIS  10          2HB       HIS  10   3.606  -7.869  -1.774
   92   2HB   HIS  10          1HB       HIS  10   4.032  -8.796  -3.257
   93    HD1  HIS  10           1HD      HIS  10   5.483  -8.093  -0.026
   94    HD2  HIS  10           2HD      HIS  10   6.770  -8.467  -3.932
   95    HE1  HIS  10           1HE      HIS  10   8.025  -8.315   0.091
   96    H    GLU  11           H        GLU  11   5.331  -6.808  -5.705
   97    HA   GLU  11           HA       GLU  11   7.867  -5.655  -4.918
   98   1HB   GLU  11          2HB       GLU  11   6.707  -6.340  -7.673
   99   2HB   GLU  11          1HB       GLU  11   8.327  -5.804  -7.403
  100   1HG   GLU  11          2HG       GLU  11   7.122  -8.266  -6.195
  101   2HG   GLU  11          1HG       GLU  11   8.123  -8.172  -7.683
  102    H    MET  12           H        MET  12   4.950  -4.513  -6.714
  103    HA   MET  12           HA       MET  12   6.061  -1.906  -7.320
  104   1HB   MET  12          2HB       MET  12   4.005  -1.427  -8.335
  105   2HB   MET  12          1HB       MET  12   4.209  -3.126  -8.646
  106   1HG   MET  12          2HG       MET  12   2.897  -3.216  -6.280
  107   2HG   MET  12          1HG       MET  12   2.246  -1.720  -7.025
  108   1HE   MET  12          1HE       MET  12  -0.263  -2.725  -9.325
  109   2HE   MET  12          2HE       MET  12   0.092  -1.923  -7.775
  110   3HE   MET  12          3HE       MET  12   1.092  -1.577  -9.206
  111    H    TRP  13           H        TRP  13   4.297  -3.457  -4.576
  112    HA   TRP  13           HA       TRP  13   3.466  -1.159  -3.121
  113   1HB   TRP  13          2HB       TRP  13   3.931  -3.976  -2.418
  114   2HB   TRP  13          1HB       TRP  13   3.990  -2.790  -1.142
  115    HD1  TRP  13           HD       TRP  13   1.685  -5.024  -2.041
  116    HE1  TRP  13           1HE      TRP  13  -0.723  -4.209  -1.955
  117    HE3  TRP  13           3HE      TRP  13   2.533  -0.046  -2.371
  118    HZ2  TRP  13           2HZ      TRP  13  -2.095  -1.748  -2.058
  119    HZ3  TRP  13           3HZ      TRP  13   0.670   1.503  -2.084
  120    HH2  TRP  13           HH       TRP  13  -1.661   0.674  -1.945
  121    H    HIS  14           H        HIS  14   6.739  -2.697  -3.242
  122    HA   HIS  14           HA       HIS  14   7.960  -1.254  -1.166
  123   1HB   HIS  14          2HB       HIS  14   8.738  -2.982  -3.322
  124   2HB   HIS  14          1HB       HIS  14   9.732  -1.567  -3.444
  125    HD1  HIS  14           1HD      HIS  14  10.669  -4.388  -2.575
  126    HD2  HIS  14           2HD      HIS  14   9.819  -1.149  -0.090
  127    HE1  HIS  14           1HE      HIS  14  12.136  -4.659  -0.471
  128    H    GLU  15           H        GLU  15   8.412  -0.387  -4.609
  129    HA   GLU  15           HA       GLU  15   9.130   2.308  -4.084
  130   1HB   GLU  15          2HB       GLU  15   8.486   0.740  -6.548
  131   2HB   GLU  15          1HB       GLU  15   8.548   2.507  -6.635
  132   1HG   GLU  15          2HG       GLU  15  10.842   1.807  -5.133
  133   2HG   GLU  15          1HG       GLU  15  10.766   0.596  -6.399
  134    H    GLY  16           H        GLY  16   5.909   0.864  -5.146
  135   1HA   GLY  16          2HA       GLY  16   4.519   3.290  -5.518
  136   2HA   GLY  16          1HA       GLY  16   3.827   1.763  -5.052
  137    H    LEU  17           H        LEU  17   5.349   1.549  -2.471
  138    HA   LEU  17           HA       LEU  17   3.837   3.393  -0.803
  139   1HB   LEU  17          2HB       LEU  17   5.781   1.297  -0.121
  140   2HB   LEU  17          1HB       LEU  17   5.074   2.476   1.031
  141    HG   LEU  17           HG       LEU  17   3.689   0.314  -0.555
  142   1HD1  LEU  17          1HD1      LEU  17   2.925  -0.329   1.728
  143   2HD1  LEU  17          2HD1      LEU  17   4.701  -0.289   1.619
  144   3HD1  LEU  17          3HD1      LEU  17   3.828   1.047   2.406
  145   1HD2  LEU  17          1HD2      LEU  17   1.546   1.076   0.355
  146   2HD2  LEU  17          2HD2      LEU  17   2.339   2.516   1.040
  147   3HD2  LEU  17          3HD2      LEU  17   2.257   2.299  -0.724
  148    H    GLU  18           H        GLU  18   7.132   3.307  -2.196
  149    HA   GLU  18           HA       GLU  18   8.200   5.333  -0.369
  150   1HB   GLU  18          2HB       GLU  18   9.584   3.526  -1.362
  151   2HB   GLU  18          1HB       GLU  18   9.420   4.360  -2.918
  152   1HG   GLU  18          2HG       GLU  18  10.261   6.496  -1.692
  153   2HG   GLU  18          1HG       GLU  18  10.694   5.448  -0.358
  154    H    GLU  19           H        GLU  19   7.400   5.266  -3.951
  155    HA   GLU  19           HA       GLU  19   7.575   8.040  -4.529
  156   1HB   GLU  19          2HB       GLU  19   7.494   6.357  -6.179
  157   2HB   GLU  19          1HB       GLU  19   5.819   5.935  -5.690
  158   1HG   GLU  19          2HG       GLU  19   5.905   7.280  -7.734
  159   2HG   GLU  19          1HG       GLU  19   5.037   8.106  -6.394
  160    H    ALA  20           H        ALA  20   5.198   6.402  -2.554
  161    HA   ALA  20           HA       ALA  20   3.317   8.728  -2.631
  162   1HB   ALA  20          1HB       ALA  20   1.873   7.249  -1.384
  163   2HB   ALA  20          2HB       ALA  20   2.381   6.485  -2.907
  164   3HB   ALA  20          3HB       ALA  20   3.131   5.991  -1.372
  165    H    SER  21           H        SER  21   4.830   6.590  -0.140
  166    HA   SER  21           HA       SER  21   4.384   8.263   2.094
  167   1HB   SER  21          2HB       SER  21   5.914   6.916   3.302
  168   2HB   SER  21          1HB       SER  21   5.041   5.841   2.252
  169    HG   SER  21           HG       SER  21   7.228   6.676   0.903
  170    H    ARG  22           H        ARG  22   6.769   8.528  -0.518
  171    HA   ARG  22           HA       ARG  22   8.655  10.263   0.817
  172   1HB   ARG  22          2HB       ARG  22   9.118   8.826  -1.212
  173   2HB   ARG  22          1HB       ARG  22   8.026   9.898  -2.142
  174   1HG   ARG  22          2HG       ARG  22  10.079  10.832  -2.676
  175   2HG   ARG  22          1HG       ARG  22   9.693  11.778  -1.239
  176   1HD   ARG  22          2HD       ARG  22  10.909   9.728  -0.027
  177   2HD   ARG  22          1HD       ARG  22  11.703   9.616  -1.623
  178    HE   ARG  22           HE       ARG  22  12.691  11.699  -1.277
  179   1HH1  ARG  22          2HH2      ARG  22  10.377  11.135   1.307
  180   2HH1  ARG  22          1HH2      ARG  22  10.959  12.441   2.287
  181   1HH2  ARG  22          1HH1      ARG  22  13.402  13.444   0.039
  182   2HH2  ARG  22          2HH1      ARG  22  12.619  13.731   1.555
  183    H    LEU  23           H        LEU  23   5.692  10.666  -1.230
  184    HA   LEU  23           HA       LEU  23   5.899  13.535  -1.567
  185   1HB   LEU  23          2HB       LEU  23   3.609  11.613  -1.920
  186   2HB   LEU  23          1HB       LEU  23   3.530  13.329  -2.238
  187    HG   LEU  23           HG       LEU  23   5.625  11.558  -3.551
  188   1HD1  LEU  23          1HD1      LEU  23   4.139  11.494  -5.478
  189   2HD1  LEU  23          2HD1      LEU  23   3.380  10.701  -4.076
  190   3HD1  LEU  23          3HD1      LEU  23   2.874  12.339  -4.554
  191   1HD2  LEU  23          1HD2      LEU  23   5.680  13.349  -5.194
  192   2HD2  LEU  23          2HD2      LEU  23   4.458  14.261  -4.275
  193   3HD2  LEU  23          3HD2      LEU  23   6.071  13.982  -3.576
  194    H    TYR  24           H        TYR  24   4.850  11.352   0.955
  195    HA   TYR  24           HA       TYR  24   3.637  13.527   2.579
  196   1HB   TYR  24          2HB       TYR  24   2.385  11.583   2.582
  197   2HB   TYR  24          1HB       TYR  24   3.829  10.536   2.746
  198    HD1  TYR  24           1HD      TYR  24   4.152   9.521   4.744
  199    HD2  TYR  24           2HD      TYR  24   2.329  13.403   4.693
  200    HE1  TYR  24           1HE      TYR  24   4.016   9.491   7.214
  201    HE2  TYR  24           2HE      TYR  24   2.124  13.354   7.139
  202    HH   TYR  24           HH       TYR  24   2.330  12.135   8.974
  203    H    PHE  25           H        PHE  25   6.255  11.055   3.152
  204    HA   PHE  25           HA       PHE  25   7.228  12.314   5.518
  205   1HB   PHE  25          2HB       PHE  25   7.277   9.953   5.173
  206   2HB   PHE  25          1HB       PHE  25   8.213  10.144   3.656
  207    HD1  PHE  25           1HD      PHE  25   8.659  11.598   7.096
  208    HD2  PHE  25           2HD      PHE  25  10.319   9.406   3.803
  209    HE1  PHE  25           1HE      PHE  25  10.845  11.537   8.251
  210    HE2  PHE  25           2HE      PHE  25  12.512   9.325   4.960
  211    HZ   PHE  25           HZ       PHE  25  12.769  10.378   7.193
  212    H    GLY  26           H        GLY  26   7.526  13.339   2.323
  213   1HA   GLY  26          2HA       GLY  26  10.153  14.701   2.808
  214   2HA   GLY  26          1HA       GLY  26   9.614  14.155   1.238
  215    H    GLU  27           H        GLU  27   6.884  14.967   1.304
  216    HA   GLU  27           HA       GLU  27   7.127  17.899   1.654
  217   1HB   GLU  27          2HB       GLU  27   5.517  17.781  -0.436
  218   2HB   GLU  27          1HB       GLU  27   7.301  18.034  -0.460
  219   1HG   GLU  27          2HG       GLU  27   6.356  15.202  -0.748
  220   2HG   GLU  27          1HG       GLU  27   6.045  16.254  -2.094
  221    H    ARG  28           H        ARG  28   5.618  15.610   3.256
  222    HA   ARG  28           HA       ARG  28   3.596  15.070   4.055
  223   1HB   ARG  28          2HB       ARG  28   4.044  17.924   4.643
  224   2HB   ARG  28          1HB       ARG  28   2.549  17.135   5.165
  225   1HG   ARG  28          2HG       ARG  28   4.841  15.396   5.686
  226   2HG   ARG  28          1HG       ARG  28   5.083  16.973   6.428
  227   1HD   ARG  28          2HD       ARG  28   2.582  15.263   6.780
  228   2HD   ARG  28          1HD       ARG  28   3.906  15.390   7.940
  229    HE   ARG  28           HE       ARG  28   1.786  17.251   7.497
  230   1HH1  ARG  28          2HH2      ARG  28   5.157  17.187   8.471
  231   2HH1  ARG  28          1HH2      ARG  28   5.068  18.681   9.346
  232   1HH2  ARG  28          1HH1      ARG  28   1.708  19.226   8.643
  233   2HH2  ARG  28          2HH1      ARG  28   3.135  19.803   9.431
  234    H    ASN  29           H        ASN  29   3.465  15.345   1.229
  235    HA   ASN  29           HA       ASN  29   0.866  16.574   0.724
  236   1HB   ASN  29          2HB       ASN  29   2.977  17.137  -0.622
  237   2HB   ASN  29          1HB       ASN  29   2.871  15.527  -1.316
  238   1HD2  ASN  29          2HD2      ASN  29   2.618  16.666  -3.373
  239   2HD2  ASN  29          1HD2      ASN  29   1.042  17.296  -3.767
  240    H    VAL  30           H        VAL  30   0.031  14.836   2.050
  241    HA   VAL  30           HA       VAL  30  -0.163  12.102   1.309
  242    HB   VAL  30           HB       VAL  30  -2.275  13.598   2.821
  243   1HG1  VAL  30          1HG1      VAL  30  -2.571  11.404   3.854
  244   2HG1  VAL  30          2HG1      VAL  30  -2.817  11.302   2.095
  245   3HG1  VAL  30          3HG1      VAL  30  -1.298  10.722   2.815
  246   1HG2  VAL  30          1HG2      VAL  30  -1.079  12.976   4.833
  247   2HG2  VAL  30          2HG2      VAL  30   0.279  12.352   3.867
  248   3HG2  VAL  30          3HG2      VAL  30  -0.103  14.090   3.849
  249    H    LYS  31           H        LYS  31  -1.445  14.981  -0.150
  250    HA   LYS  31           HA       LYS  31  -3.674  13.857  -1.654
  251   1HB   LYS  31          2HB       LYS  31  -3.824  16.084  -1.180
  252   2HB   LYS  31          1HB       LYS  31  -2.105  16.394  -1.609
  253   1HG   LYS  31          2HG       LYS  31  -3.777  17.349  -3.178
  254   2HG   LYS  31          1HG       LYS  31  -2.588  16.233  -3.928
  255   1HD   LYS  31          2HD       LYS  31  -4.323  15.073  -4.840
  256   2HD   LYS  31          1HD       LYS  31  -4.907  14.679  -3.243
  257   1HE   LYS  31          2HE       LYS  31  -5.575  17.373  -4.423
  258   2HE   LYS  31          1HE       LYS  31  -6.462  15.939  -4.908
  259   1HZ   LYS  31          1HZ       LYS  31  -7.422  17.095  -3.093
  260   2HZ   LYS  31          2HZ       LYS  31  -7.040  15.562  -2.696
  261   3HZ   LYS  31          3HZ       LYS  31  -6.122  16.796  -2.144
  262    H    GLY  32           H        GLY  32  -0.200  14.731  -2.409
  263   1HA   GLY  32          2HA       GLY  32  -0.174  13.826  -5.099
  264   2HA   GLY  32          1HA       GLY  32   1.221  14.006  -4.051
  265    H    MET  33           H        MET  33   1.131  12.179  -2.164
  266    HA   MET  33           HA       MET  33   1.734   9.740  -3.177
  267   1HB   MET  33          2HB       MET  33   1.734   8.989  -0.991
  268   2HB   MET  33          1HB       MET  33   1.998  10.767  -0.870
  269   1HG   MET  33          2HG       MET  33  -0.305  11.050  -0.044
  270   2HG   MET  33          1HG       MET  33  -0.633   9.357  -0.241
  271   1HE   MET  33          1HE       MET  33   1.442   7.645   2.443
  272   2HE   MET  33          2HE       MET  33   0.157   7.503   1.220
  273   3HE   MET  33          3HE       MET  33   1.828   7.857   0.720
  274    H    PHE  34           H        PHE  34  -1.489  10.923  -2.448
  275    HA   PHE  34           HA       PHE  34  -2.985   8.486  -2.453
  276   1HB   PHE  34          2HB       PHE  34  -3.430  11.036  -1.668
  277   2HB   PHE  34          1HB       PHE  34  -4.136  11.131  -3.270
  278    HD1  PHE  34           1HD      PHE  34  -6.371  10.847  -3.320
  279    HD2  PHE  34           2HD      PHE  34  -4.044   8.590  -0.499
  280    HE1  PHE  34           1HE      PHE  34  -8.448   9.816  -2.423
  281    HE2  PHE  34           2HE      PHE  34  -6.113   7.555   0.381
  282    HZ   PHE  34           HZ       PHE  34  -8.302   8.101  -0.642
  283    H    GLU  35           H        GLU  35  -1.588  10.434  -5.048
  284    HA   GLU  35           HA       GLU  35  -3.272   9.420  -7.203
  285   1HB   GLU  35          2HB       GLU  35  -2.038  11.629  -7.232
  286   2HB   GLU  35          1HB       GLU  35  -0.542  10.735  -7.351
  287   1HG   GLU  35          2HG       GLU  35  -2.166   9.606  -9.371
  288   2HG   GLU  35          1HG       GLU  35  -2.495  11.319  -9.438
  289    H    VAL  36           H        VAL  36  -0.051   8.457  -5.787
  290    HA   VAL  36           HA       VAL  36   0.249   6.297  -7.801
  291    HB   VAL  36           HB       VAL  36   2.192   7.629  -7.324
  292   1HG1  VAL  36          1HG1      VAL  36   3.389   7.346  -5.284
  293   2HG1  VAL  36          2HG1      VAL  36   1.825   8.133  -4.962
  294   3HG1  VAL  36          3HG1      VAL  36   2.051   6.410  -4.576
  295   1HG2  VAL  36          1HG2      VAL  36   3.700   5.856  -7.133
  296   2HG2  VAL  36          2HG2      VAL  36   2.394   4.749  -6.648
  297   3HG2  VAL  36          3HG2      VAL  36   2.381   5.487  -8.267
  298    H    LEU  37           H        LEU  37  -0.853   6.770  -4.473
  299    HA   LEU  37           HA       LEU  37  -1.087   3.949  -3.876
  300   1HB   LEU  37          2HB       LEU  37  -1.121   6.449  -2.485
  301   2HB   LEU  37          1HB       LEU  37  -2.485   5.389  -1.995
  302    HG   LEU  37           HG       LEU  37  -0.208   5.201  -0.665
  303   1HD1  LEU  37          1HD1      LEU  37  -0.564   2.857  -0.307
  304   2HD1  LEU  37          2HD1      LEU  37  -2.118   3.723  -0.369
  305   3HD1  LEU  37          3HD1      LEU  37  -1.582   2.756  -1.764
  306   1HD2  LEU  37          1HD2      LEU  37   1.349   3.609  -1.545
  307   2HD2  LEU  37          2HD2      LEU  37   0.454   3.522  -3.081
  308   3HD2  LEU  37          3HD2      LEU  37   1.270   5.033  -2.610
  309    H    GLU  38           H        GLU  38  -2.991   6.179  -5.630
  310    HA   GLU  38           HA       GLU  38  -5.650   5.219  -5.086
  311   1HB   GLU  38          2HB       GLU  38  -5.918   7.152  -5.969
  312   2HB   GLU  38          1HB       GLU  38  -4.450   7.045  -6.995
  313   1HG   GLU  38          2HG       GLU  38  -5.584   5.772  -8.635
  314   2HG   GLU  38          1HG       GLU  38  -6.999   5.527  -7.559
  315    HA   PRO  39           HA       PRO  39  -5.083   2.342  -8.817
  316   1HB   PRO  39          2HB       PRO  39  -2.840   2.094 -10.256
  317   2HB   PRO  39          1HB       PRO  39  -3.988   3.398 -10.560
  318   1HG   PRO  39          2HG       PRO  39  -1.359   3.500  -9.031
  319   2HG   PRO  39          1HG       PRO  39  -2.024   4.685 -10.156
  320   1HD   PRO  39          1HD       PRO  39  -2.293   4.851  -7.348
  321   2HD   PRO  39          2HD       PRO  39  -3.419   5.648  -8.509
  322    H    LEU  40           H        LEU  40  -2.453   2.700  -6.443
  323    HA   LEU  40           HA       LEU  40  -1.635  -0.036  -6.419
  324   1HB   LEU  40          2HB       LEU  40  -1.156   2.431  -4.900
  325   2HB   LEU  40          1HB       LEU  40  -0.994   0.910  -3.991
  326    HG   LEU  40           HG       LEU  40   0.281   1.243  -6.735
  327   1HD1  LEU  40          1HD1      LEU  40   2.330   1.891  -5.517
  328   2HD1  LEU  40          2HD1      LEU  40   1.034   3.079  -5.233
  329   3HD1  LEU  40          3HD1      LEU  40   1.428   1.876  -3.982
  330   1HD2  LEU  40          1HD2      LEU  40   1.777  -0.494  -5.900
  331   2HD2  LEU  40          2HD2      LEU  40   0.925  -0.502  -4.336
  332   3HD2  LEU  40          3HD2      LEU  40   0.084  -1.035  -5.810
  333    H    HIS  41           H        HIS  41  -4.268   1.774  -4.757
  334    HA   HIS  41           HA       HIS  41  -5.106  -0.401  -3.073
  335   1HB   HIS  41          2HB       HIS  41  -5.723   1.691  -2.424
  336   2HB   HIS  41          1HB       HIS  41  -6.208   2.179  -4.083
  337    HD1  HIS  41           1HD      HIS  41  -7.626  -0.912  -2.264
  338    HD2  HIS  41           2HD      HIS  41  -8.607   2.868  -3.713
  339    HE1  HIS  41           1HE      HIS  41 -10.198  -0.830  -2.438
  340    H    ALA  42           H        ALA  42  -5.972   0.627  -6.409
  341    HA   ALA  42           HA       ALA  42  -8.182  -1.272  -6.742
  342   1HB   ALA  42          1HB       ALA  42  -8.201  -0.471  -8.994
  343   2HB   ALA  42          2HB       ALA  42  -8.199   0.871  -7.826
  344   3HB   ALA  42          3HB       ALA  42  -6.710   0.455  -8.704
  345    H    MET  43           H        MET  43  -4.790  -1.075  -7.916
  346    HA   MET  43           HA       MET  43  -4.637  -3.670  -9.177
  347   1HB   MET  43          2HB       MET  43  -2.659  -1.664  -8.107
  348   2HB   MET  43          1HB       MET  43  -2.216  -3.188  -8.937
  349   1HG   MET  43          2HG       MET  43  -2.943  -2.394 -11.027
  350   2HG   MET  43          1HG       MET  43  -4.069  -1.246 -10.332
  351   1HE   MET  43          1HE       MET  43  -0.252  -0.163 -12.134
  352   2HE   MET  43          2HE       MET  43  -0.596  -1.865 -11.745
  353   3HE   MET  43          3HE       MET  43  -1.763  -0.917 -12.698
  354    H    MET  44           H        MET  44  -4.816  -2.865  -5.782
  355    HA   MET  44           HA       MET  44  -3.775  -5.570  -5.208
  356   1HB   MET  44          2HB       MET  44  -4.259  -3.189  -3.425
  357   2HB   MET  44          1HB       MET  44  -3.815  -4.813  -2.842
  358   1HG   MET  44          2HG       MET  44  -2.259  -3.179  -4.865
  359   2HG   MET  44          1HG       MET  44  -1.854  -3.341  -3.119
  360   1HE   MET  44          1HE       MET  44   0.797  -4.906  -5.541
  361   2HE   MET  44          2HE       MET  44  -0.469  -3.756  -6.032
  362   3HE   MET  44          3HE       MET  44   0.385  -3.534  -4.487
  363    H    GLU  45           H        GLU  45  -6.720  -3.745  -5.342
  364    HA   GLU  45           HA       GLU  45  -8.263  -5.550  -3.603
  365   1HB   GLU  45          2HB       GLU  45  -8.511  -3.015  -3.796
  366   2HB   GLU  45          1HB       GLU  45  -9.306  -3.348  -5.355
  367   1HG   GLU  45          2HG       GLU  45 -10.668  -5.148  -3.854
  368   2HG   GLU  45          1HG       GLU  45 -10.239  -4.058  -2.554
  369    H    ARG  46           H        ARG  46  -8.028  -4.797  -7.153
  370    HA   ARG  46           HA       ARG  46 -10.022  -6.274  -8.273
  371   1HB   ARG  46          2HB       ARG  46  -7.943  -4.916  -9.218
  372   2HB   ARG  46          1HB       ARG  46  -7.234  -6.517  -9.364
  373   1HG   ARG  46          2HG       ARG  46  -9.051  -7.274 -10.775
  374   2HG   ARG  46          1HG       ARG  46  -9.967  -5.791 -10.480
  375   1HD   ARG  46          2HD       ARG  46  -8.236  -4.459 -11.607
  376   2HD   ARG  46          1HD       ARG  46  -7.239  -5.908 -11.834
  377    HE   ARG  46           HE       ARG  46  -8.578  -6.567 -13.547
  378   1HH1  ARG  46          2HH2      ARG  46 -10.377  -4.008 -11.912
  379   2HH1  ARG  46          1HH2      ARG  46 -11.596  -3.940 -13.143
  380   1HH2  ARG  46          1HH1      ARG  46 -10.204  -6.434 -15.104
  381   2HH2  ARG  46          2HH1      ARG  46 -11.491  -5.295 -14.912
  382    H    GLY  47           H        GLY  47  -7.065  -7.644  -6.759
  383   1HA   GLY  47          2HA       GLY  47  -7.430  -9.690  -5.500
  384   2HA   GLY  47          1HA       GLY  47  -8.395 -10.309  -6.839
  385    HA   PRO  48           HA       PRO  48  -3.726 -11.196  -7.423
  386   1HB   PRO  48          2HB       PRO  48  -3.406 -13.534  -6.269
  387   2HB   PRO  48          1HB       PRO  48  -3.139 -11.930  -5.430
  388   1HG   PRO  48          2HG       PRO  48  -5.564 -13.830  -5.229
  389   2HG   PRO  48          1HG       PRO  48  -4.737 -13.025  -3.897
  390   1HD   PRO  48          1HD       PRO  48  -7.002 -11.907  -5.145
  391   2HD   PRO  48          2HD       PRO  48  -5.674 -10.849  -4.478
  392    H    GLN  49           H        GLN  49  -3.040 -13.682  -8.192
  393    HA   GLN  49           HA       GLN  49  -5.168 -14.734  -9.986
  394   1HB   GLN  49          2HB       GLN  49  -3.425 -14.652 -11.869
  395   2HB   GLN  49          1HB       GLN  49  -4.403 -13.257 -11.522
  396   1HG   GLN  49          2HG       GLN  49  -2.665 -12.021 -11.012
  397   2HG   GLN  49          1HG       GLN  49  -1.952 -13.282  -9.956
  398   1HE2  GLN  49          2HE2      GLN  49  -0.657 -11.462 -11.776
  399   2HE2  GLN  49          1HE2      GLN  49   0.170 -12.453 -12.944
  400    H    THR  50           H        THR  50  -1.792 -15.444 -10.480
  401    HA   THR  50           HA       THR  50  -1.640 -18.139 -10.096
  402    HB   THR  50           HB       THR  50   0.077 -17.278 -11.138
  403    HG1  THR  50           1HG      THR  50   1.923 -17.893  -9.816
  404   1HG2  THR  50          1HG2      THR  50   1.711 -15.663 -10.296
  405   2HG2  THR  50          2HG2      THR  50   0.088 -14.941 -10.394
  406   3HG2  THR  50          3HG2      THR  50   0.748 -15.440  -8.817
  407    H    LEU  51           H        LEU  51   0.281 -16.705  -7.698
  408    HA   LEU  51           HA       LEU  51  -1.109 -16.991  -5.213
  409   1HB   LEU  51          2HB       LEU  51  -0.530 -19.478  -6.434
  410   2HB   LEU  51          1HB       LEU  51   0.656 -19.251  -5.138
  411    HG   LEU  51           HG       LEU  51  -2.192 -18.528  -4.528
  412   1HD1  LEU  51          1HD1      LEU  51  -2.734 -20.873  -4.028
  413   2HD1  LEU  51          2HD1      LEU  51  -2.419 -20.643  -5.764
  414   3HD1  LEU  51          3HD1      LEU  51  -1.180 -21.387  -4.725
  415   1HD2  LEU  51          1HD2      LEU  51  -1.555 -19.467  -2.342
  416   2HD2  LEU  51          2HD2      LEU  51   0.019 -19.968  -3.005
  417   3HD2  LEU  51          3HD2      LEU  51  -0.380 -18.239  -2.868
  418    H    LYS  52           H        LYS  52   0.830 -15.263  -6.606
  419    HA   LYS  52           HA       LYS  52   3.153 -15.474  -4.730
  420   1HB   LYS  52          2HB       LYS  52   3.049 -14.257  -7.508
  421   2HB   LYS  52          1HB       LYS  52   4.421 -14.249  -6.449
  422   1HG   LYS  52          2HG       LYS  52   3.991 -16.919  -6.477
  423   2HG   LYS  52          1HG       LYS  52   3.275 -16.509  -8.014
  424   1HD   LYS  52          2HD       LYS  52   5.568 -17.003  -8.404
  425   2HD   LYS  52          1HD       LYS  52   5.413 -15.257  -8.582
  426   1HE   LYS  52          2HE       LYS  52   6.902 -14.904  -6.912
  427   2HE   LYS  52          1HE       LYS  52   5.999 -15.927  -5.801
  428   1HZ   LYS  52          1HZ       LYS  52   8.134 -16.767  -6.171
  429   2HZ   LYS  52          2HZ       LYS  52   7.053 -17.810  -6.804
  430   3HZ   LYS  52          3HZ       LYS  52   7.921 -16.837  -7.789
  431    H    GLU  53           H        GLU  53   0.947 -13.125  -6.350
  432    HA   GLU  53           HA       GLU  53   1.604 -10.985  -4.575
  433   1HB   GLU  53          2HB       GLU  53  -0.182  -9.787  -5.639
  434   2HB   GLU  53          1HB       GLU  53   1.080 -10.459  -6.734
  435   1HG   GLU  53          2HG       GLU  53  -1.366 -12.118  -6.532
  436   2HG   GLU  53          1HG       GLU  53  -1.630 -10.535  -7.227
  437    H    THR  54           H        THR  54   1.243 -12.491  -2.657
  438    HA   THR  54           HA       THR  54  -1.153 -11.744  -1.170
  439    HB   THR  54           HB       THR  54  -0.913 -14.550  -2.138
  440    HG1  THR  54           1HG      THR  54  -3.198 -13.968  -2.704
  441   1HG2  THR  54          1HG2      THR  54  -2.876 -15.112  -0.807
  442   2HG2  THR  54          2HG2      THR  54  -1.491 -14.699   0.233
  443   3HG2  THR  54          3HG2      THR  54  -2.806 -13.524  -0.008
  444    H    SER  55           H        SER  55   1.559 -11.129  -0.725
  445    HA   SER  55           HA       SER  55   2.426 -12.857   1.508
  446   1HB   SER  55          2HB       SER  55   3.671 -10.340   0.409
  447   2HB   SER  55          1HB       SER  55   4.328 -11.371   1.692
  448    HG   SER  55           HG       SER  55   5.296 -12.138  -0.147
  449    H    PHE  56           H        PHE  56   1.422  -9.432   1.007
  450    HA   PHE  56           HA       PHE  56   1.186  -8.781   3.795
  451   1HB   PHE  56          2HB       PHE  56   0.276  -6.774   3.133
  452   2HB   PHE  56          1HB       PHE  56   1.569  -7.173   1.958
  453    HD1  PHE  56           1HD      PHE  56   1.045  -7.640  -0.363
  454    HD2  PHE  56           2HD      PHE  56  -2.076  -6.973   2.514
  455    HE1  PHE  56           1HE      PHE  56  -0.625  -7.481  -2.198
  456    HE2  PHE  56           2HE      PHE  56  -3.736  -6.799   0.689
  457    HZ   PHE  56           HZ       PHE  56  -3.001  -7.019  -1.669
  458    H    ASN  57           H        ASN  57  -1.329  -9.637   1.255
  459    HA   ASN  57           HA       ASN  57  -3.540  -9.634   3.023
  460   1HB   ASN  57          2HB       ASN  57  -3.147  -9.891   0.347
  461   2HB   ASN  57          1HB       ASN  57  -3.656 -11.518   0.815
  462   1HD2  ASN  57          2HD2      ASN  57  -5.240  -9.837  -0.756
  463   2HD2  ASN  57          1HD2      ASN  57  -6.615  -9.336   0.193
  464    H    GLN  58           H        GLN  58  -0.940 -11.892   2.946
  465    HA   GLN  58           HA       GLN  58  -2.410 -14.202   3.987
  466   1HB   GLN  58          2HB       GLN  58  -0.093 -13.900   2.565
  467   2HB   GLN  58          1HB       GLN  58   0.534 -14.050   4.195
  468   1HG   GLN  58          2HG       GLN  58  -1.320 -16.023   2.794
  469   2HG   GLN  58          1HG       GLN  58   0.360 -16.269   3.220
  470   1HE2  GLN  58          2HE2      GLN  58   0.935 -16.609   5.435
  471   2HE2  GLN  58          1HE2      GLN  58  -0.326 -16.958   6.599
  472    H    ALA  59           H        ALA  59  -0.151 -11.735   5.345
  473    HA   ALA  59           HA       ALA  59  -0.929 -12.635   8.127
  474   1HB   ALA  59          1HB       ALA  59   1.267 -11.992   8.832
  475   2HB   ALA  59          2HB       ALA  59   1.340 -13.266   7.593
  476   3HB   ALA  59          3HB       ALA  59   1.714 -11.582   7.159
  477    H    TYR  60           H        TYR  60   0.063  -9.957   6.121
  478    HA   TYR  60           HA       TYR  60  -0.691  -7.833   8.052
  479   1HB   TYR  60          2HB       TYR  60   0.096  -7.551   5.154
  480   2HB   TYR  60          1HB       TYR  60   0.348  -6.408   6.523
  481    HD1  TYR  60           1HD      TYR  60   2.363  -7.144   4.451
  482    HD2  TYR  60           2HD      TYR  60   1.548  -8.866   8.292
  483    HE1  TYR  60           1HE      TYR  60   4.697  -7.945   4.592
  484    HE2  TYR  60           2HE      TYR  60   3.831  -9.714   8.410
  485    HH   TYR  60           HH       TYR  60   5.761  -9.968   7.356
  486    H    GLY  61           H        GLY  61  -2.882  -9.603   7.321
  487   1HA   GLY  61          2HA       GLY  61  -4.704  -8.574   5.396
  488   2HA   GLY  61          1HA       GLY  61  -5.124  -9.472   6.830
  489    H    ARG  62           H        ARG  62  -3.954  -7.487   8.705
  490    HA   ARG  62           HA       ARG  62  -6.078  -5.467   8.600
  491   1HB   ARG  62          2HB       ARG  62  -4.125  -6.348  10.677
  492   2HB   ARG  62          1HB       ARG  62  -5.035  -4.812  10.819
  493   1HG   ARG  62          2HG       ARG  62  -7.145  -5.940  10.768
  494   2HG   ARG  62          1HG       ARG  62  -6.422  -7.441  10.158
  495   1HD   ARG  62          2HD       ARG  62  -5.030  -7.205  12.404
  496   2HD   ARG  62          1HD       ARG  62  -6.532  -6.321  12.891
  497    HE   ARG  62           HE       ARG  62  -7.353  -8.605  11.518
  498   1HH1  ARG  62          2HH2      ARG  62  -5.596  -8.098  14.512
  499   2HH1  ARG  62          1HH2      ARG  62  -6.122  -9.591  15.221
  500   1HH2  ARG  62          1HH1      ARG  62  -8.012 -10.565  12.472
  501   2HH2  ARG  62          2HH1      ARG  62  -7.479 -10.960  14.069
  502    H    ASP  63           H        ASP  63  -3.066  -5.647   7.213
  503    HA   ASP  63           HA       ASP  63  -2.188  -2.938   7.936
  504   1HB   ASP  63          2HB       ASP  63  -0.639  -4.953   7.964
  505   2HB   ASP  63          1HB       ASP  63  -0.756  -4.962   6.199
  506    H    LEU  64           H        LEU  64  -1.029  -2.878   4.961
  507    HA   LEU  64           HA       LEU  64  -2.268  -1.406   3.425
  508   1HB   LEU  64          2HB       LEU  64  -0.905  -3.861   2.840
  509   2HB   LEU  64          1HB       LEU  64  -2.017  -3.341   1.547
  510    HG   LEU  64           HG       LEU  64  -0.045  -1.450   2.917
  511   1HD1  LEU  64          1HD1      LEU  64   1.374  -1.725   0.960
  512   2HD1  LEU  64          2HD1      LEU  64   1.192  -3.249   1.859
  513   3HD1  LEU  64          3HD1      LEU  64   0.293  -2.997   0.343
  514   1HD2  LEU  64          1HD2      LEU  64  -0.488  -0.039   0.954
  515   2HD2  LEU  64          2HD2      LEU  64  -1.623  -1.253   0.320
  516   3HD2  LEU  64          3HD2      LEU  64  -1.998  -0.388   1.829
  517    H    MET  65           H        MET  65  -3.655  -4.713   3.365
  518    HA   MET  65           HA       MET  65  -6.031  -4.483   2.018
  519   1HB   MET  65          2HB       MET  65  -4.812  -6.090   4.071
  520   2HB   MET  65          1HB       MET  65  -6.476  -5.773   4.540
  521   1HG   MET  65          2HG       MET  65  -6.561  -6.363   1.762
  522   2HG   MET  65          1HG       MET  65  -5.481  -7.544   2.488
  523   1HE   MET  65          1HE       MET  65  -9.968  -7.037   3.158
  524   2HE   MET  65          2HE       MET  65  -8.854  -5.657   3.307
  525   3HE   MET  65          3HE       MET  65  -8.992  -6.528   1.761
  526    H    GLU  66           H        GLU  66  -5.812  -3.620   5.529
  527    HA   GLU  66           HA       GLU  66  -8.366  -2.201   5.396
  528   1HB   GLU  66          2HB       GLU  66  -6.736  -3.289   7.553
  529   2HB   GLU  66          1HB       GLU  66  -7.508  -1.739   7.888
  530   1HG   GLU  66          2HG       GLU  66  -9.189  -3.379   8.479
  531   2HG   GLU  66          1HG       GLU  66  -9.704  -2.851   6.917
  532    H    ALA  67           H        ALA  67  -4.919  -1.449   5.252
  533    HA   ALA  67           HA       ALA  67  -4.965   1.348   6.049
  534   1HB   ALA  67          1HB       ALA  67  -2.820   1.444   4.996
  535   2HB   ALA  67          2HB       ALA  67  -2.942   0.042   6.086
  536   3HB   ALA  67          3HB       ALA  67  -3.046  -0.190   4.324
  537    H    GLN  68           H        GLN  68  -5.761  -0.377   3.062
  538    HA   GLN  68           HA       GLN  68  -6.327   2.166   1.635
  539   1HB   GLN  68          2HB       GLN  68  -6.190   0.919  -0.366
  540   2HB   GLN  68          1HB       GLN  68  -4.921   0.227   0.594
  541   1HG   GLN  68          2HG       GLN  68  -6.607  -1.515   1.332
  542   2HG   GLN  68          1HG       GLN  68  -7.626  -0.880  -0.005
  543   1HE2  GLN  68          2HE2      GLN  68  -7.673  -2.644  -1.227
  544   2HE2  GLN  68          1HE2      GLN  68  -6.251  -3.428  -1.855
  545    H    GLU  69           H        GLU  69  -8.022  -0.893   2.776
  546    HA   GLU  69           HA       GLU  69 -10.540  -0.426   1.707
  547   1HB   GLU  69          2HB       GLU  69  -9.434  -2.309   3.306
  548   2HB   GLU  69          1HB       GLU  69 -10.446  -1.468   4.473
  549   1HG   GLU  69          2HG       GLU  69 -12.027  -1.818   2.062
  550   2HG   GLU  69          1HG       GLU  69 -11.300  -3.340   2.437
  551    H    TRP  70           H        TRP  70  -8.996   1.277   4.396
  552    HA   TRP  70           HA       TRP  70 -11.314   2.797   5.237
  553   1HB   TRP  70          2HB       TRP  70  -8.379   3.381   5.521
  554   2HB   TRP  70          1HB       TRP  70  -9.748   4.057   6.465
  555    HD1  TRP  70           HD       TRP  70 -10.632   0.570   6.405
  556    HE1  TRP  70           1HE      TRP  70  -9.464  -0.850   8.114
  557    HE3  TRP  70           3HE      TRP  70  -6.946   3.774   7.636
  558    HZ2  TRP  70           2HZ      TRP  70  -7.231  -0.623   9.831
  559    HZ3  TRP  70           3HZ      TRP  70  -5.555   3.319   9.644
  560    HH2  TRP  70           HH       TRP  70  -5.651   1.079  10.702
  561    H    CYS  71           H        CYS  71  -9.708   2.866   2.212
  562    HA   CYS  71           HA       CYS  71  -9.545   5.486   1.420
  563   1HB   CYS  71          2HB       CYS  71 -10.298   4.672  -0.837
  564   2HB   CYS  71          1HB       CYS  71  -9.082   3.650  -0.160
  565    HG   CYS  71           HG       CYS  71 -10.631   2.199  -1.413
  566    H    ARG  72           H        ARG  72 -12.624   3.563   1.523
  567    HA   ARG  72           HA       ARG  72 -14.446   5.598   0.865
  568   1HB   ARG  72          2HB       ARG  72 -14.747   3.087   1.234
  569   2HB   ARG  72          1HB       ARG  72 -14.976   3.523   2.949
  570   1HG   ARG  72          2HG       ARG  72 -16.730   5.252   2.144
  571   2HG   ARG  72          1HG       ARG  72 -16.617   4.539   0.555
  572   1HD   ARG  72          2HD       ARG  72 -17.292   2.363   1.479
  573   2HD   ARG  72          1HD       ARG  72 -17.453   3.129   3.086
  574    HE   ARG  72           HE       ARG  72 -19.395   4.135   2.392
  575   1HH1  ARG  72          2HH2      ARG  72 -17.757   3.094  -0.538
  576   2HH1  ARG  72          1HH2      ARG  72 -19.083   3.512  -1.575
  577   1HH2  ARG  72          1HH1      ARG  72 -21.113   4.670   0.991
  578   2HH2  ARG  72          2HH1      ARG  72 -20.944   4.392  -0.708
  579    H    LYS  73           H        LYS  73 -12.597   5.233   3.828
  580    HA   LYS  73           HA       LYS  73 -14.247   7.101   5.390
  581   1HB   LYS  73          2HB       LYS  73 -13.193   5.019   6.466
  582   2HB   LYS  73          1HB       LYS  73 -11.632   5.722   6.185
  583   1HG   LYS  73          2HG       LYS  73 -11.931   6.525   8.263
  584   2HG   LYS  73          1HG       LYS  73 -12.831   7.807   7.459
  585   1HD   LYS  73          2HD       LYS  73 -14.660   5.612   7.848
  586   2HD   LYS  73          1HD       LYS  73 -13.817   5.870   9.356
  587   1HE   LYS  73          2HE       LYS  73 -14.381   8.324   9.175
  588   2HE   LYS  73          1HE       LYS  73 -15.382   7.921   7.773
  589   1HZ   LYS  73          1HZ       LYS  73 -16.656   7.916   9.743
  590   2HZ   LYS  73          2HZ       LYS  73 -16.566   6.387   9.176
  591   3HZ   LYS  73          3HZ       LYS  73 -15.667   6.834  10.463
  592    H    TYR  74           H        TYR  74 -10.854   6.765   4.131
  593    HA   TYR  74           HA       TYR  74  -9.947   9.483   4.611
  594   1HB   TYR  74          2HB       TYR  74  -8.481   7.521   4.125
  595   2HB   TYR  74          1HB       TYR  74  -9.046   7.513   2.479
  596    HD1  TYR  74           1HD      TYR  74  -8.686   9.503   1.036
  597    HD2  TYR  74           2HD      TYR  74  -6.850   9.150   4.885
  598    HE1  TYR  74           1HE      TYR  74  -7.004  11.143   0.352
  599    HE2  TYR  74           2HE      TYR  74  -5.209  10.886   4.252
  600    HH   TYR  74           HH       TYR  74  -5.079  12.068   0.850
  601    H    MET  75           H        MET  75 -12.068   8.231   2.102
  602    HA   MET  75           HA       MET  75 -11.951  10.470   0.260
  603   1HB   MET  75          2HB       MET  75 -13.209   7.851   0.513
  604   2HB   MET  75          1HB       MET  75 -14.278   9.087  -0.166
  605   1HG   MET  75          2HG       MET  75 -11.526   9.217  -1.257
  606   2HG   MET  75          1HG       MET  75 -12.336   7.695  -1.595
  607   1HE   MET  75          1HE       MET  75 -14.825   8.380  -4.203
  608   2HE   MET  75          2HE       MET  75 -13.425   7.403  -3.699
  609   3HE   MET  75          3HE       MET  75 -14.818   7.594  -2.607
  610    H    LYS  76           H        LYS  76 -14.692   9.342   2.325
  611    HA   LYS  76           HA       LYS  76 -15.990  11.898   2.130
  612   1HB   LYS  76          2HB       LYS  76 -16.613   9.198   3.139
  613   2HB   LYS  76          1HB       LYS  76 -17.436  10.528   3.959
  614   1HG   LYS  76          2HG       LYS  76 -17.323  10.642   0.969
  615   2HG   LYS  76          1HG       LYS  76 -18.382   9.420   1.707
  616   1HD   LYS  76          2HD       LYS  76 -19.784  11.067   2.703
  617   2HD   LYS  76          1HD       LYS  76 -18.519  12.258   2.791
  618   1HE   LYS  76          2HE       LYS  76 -19.486  13.200   1.072
  619   2HE   LYS  76          1HE       LYS  76 -18.794  11.882   0.076
  620   1HZ   LYS  76          1HZ       LYS  76 -21.113  12.219  -0.258
  621   2HZ   LYS  76          2HZ       LYS  76 -20.813  10.718   0.307
  622   3HZ   LYS  76          3HZ       LYS  76 -21.441  11.859   1.298
  623    H    SER  77           H        SER  77 -14.189  10.209   4.735
  624    HA   SER  77           HA       SER  77 -14.769  12.211   6.780
  625   1HB   SER  77          2HB       SER  77 -14.379   9.757   7.191
  626   2HB   SER  77          1HB       SER  77 -12.662  10.056   6.778
  627    HG   SER  77           HG       SER  77 -13.345  10.080   9.105
  628    H    GLY  78           H        GLY  78 -12.171  11.434   4.334
  629   1HA   GLY  78          2HA       GLY  78 -10.147  12.324   3.945
  630   2HA   GLY  78          1HA       GLY  78 -11.127  13.824   3.940
  631    H    ASN  79           H        ASN  79 -10.529  11.935   6.832
  632    HA   ASN  79           HA       ASN  79  -9.112  14.246   7.965
  633   1HB   ASN  79          2HB       ASN  79 -11.400  12.746   8.740
  634   2HB   ASN  79          1HB       ASN  79 -10.127  12.313   9.893
  635   1HD2  ASN  79          2HD2      ASN  79 -12.028  14.947   8.532
  636   2HD2  ASN  79          1HD2      ASN  79 -11.669  16.094   9.797
  637    H    VAL  80           H        VAL  80  -7.046  14.024   8.361
  638    HA   VAL  80           HA       VAL  80  -5.378  11.805   8.288
  639    HB   VAL  80           HB       VAL  80  -5.071  14.281   9.896
  640   1HG1  VAL  80          1HG1      VAL  80  -2.674  13.740   9.928
  641   2HG1  VAL  80          2HG1      VAL  80  -3.616  12.523  10.822
  642   3HG1  VAL  80          3HG1      VAL  80  -3.010  12.158   9.187
  643   1HG2  VAL  80          1HG2      VAL  80  -3.552  14.842   8.000
  644   2HG2  VAL  80          2HG2      VAL  80  -3.984  13.308   7.208
  645   3HG2  VAL  80          3HG2      VAL  80  -5.218  14.571   7.434
  646    H    LYS  81           H        LYS  81  -7.763  12.554  10.860
  647    HA   LYS  81           HA       LYS  81  -6.987  10.894  12.883
  648   1HB   LYS  81          2HB       LYS  81  -9.476  11.983  11.920
  649   2HB   LYS  81          1HB       LYS  81  -9.687  10.404  12.671
  650   1HG   LYS  81          2HG       LYS  81  -8.260  12.800  13.878
  651   2HG   LYS  81          1HG       LYS  81  -9.840  12.132  14.359
  652   1HD   LYS  81          2HD       LYS  81  -8.384   9.892  14.574
  653   2HD   LYS  81          1HD       LYS  81  -7.079  11.088  14.851
  654   1HE   LYS  81          2HE       LYS  81  -7.907  11.757  16.815
  655   2HE   LYS  81          1HE       LYS  81  -9.612  11.374  16.350
  656   1HZ   LYS  81          1HZ       LYS  81  -8.753   9.712  17.898
  657   2HZ   LYS  81          2HZ       LYS  81  -8.995   9.054  16.422
  658   3HZ   LYS  81          3HZ       LYS  81  -7.482   9.407  16.912
  659    H    ASP  82           H        ASP  82  -7.915   9.766   9.666
  660    HA   ASP  82           HA       ASP  82  -7.763   6.898  10.528
  661   1HB   ASP  82          2HB       ASP  82  -8.504   6.269   8.481
  662   2HB   ASP  82          1HB       ASP  82  -9.544   7.631   9.020
  663    H    LEU  83           H        LEU  83  -5.973   9.350   8.625
  664    HA   LEU  83           HA       LEU  83  -3.948   7.631   7.512
  665   1HB   LEU  83          2HB       LEU  83  -4.867  10.076   7.004
  666   2HB   LEU  83          1HB       LEU  83  -3.360  10.436   7.910
  667    HG   LEU  83           HG       LEU  83  -2.936  10.368   5.466
  668   1HD1  LEU  83          1HD1      LEU  83  -1.097   8.878   5.371
  669   2HD1  LEU  83          2HD1      LEU  83  -1.117   9.816   6.883
  670   3HD1  LEU  83          3HD1      LEU  83  -1.611   8.107   6.891
  671   1HD2  LEU  83          1HD2      LEU  83  -3.138   8.282   4.227
  672   2HD2  LEU  83          2HD2      LEU  83  -3.859   7.483   5.644
  673   3HD2  LEU  83          3HD2      LEU  83  -4.730   8.803   4.827
  674    H    THR  84           H        THR  84  -4.058   9.575  10.557
  675    HA   THR  84           HA       THR  84  -1.519   9.200  11.629
  676    HB   THR  84           HB       THR  84  -3.039  10.511  12.759
  677    HG1  THR  84           1HG      THR  84  -2.981   9.333  14.904
  678   1HG2  THR  84          1HG2      THR  84  -4.947   9.666  14.040
  679   2HG2  THR  84          2HG2      THR  84  -5.184   9.415  12.294
  680   3HG2  THR  84          3HG2      THR  84  -4.717   8.048  13.335
  681    H    GLN  85           H        GLN  85  -4.073   6.738  11.328
  682    HA   GLN  85           HA       GLN  85  -2.449   4.647  12.684
  683   1HB   GLN  85          2HB       GLN  85  -5.287   5.157  12.182
  684   2HB   GLN  85          1HB       GLN  85  -4.796   3.538  11.718
  685   1HG   GLN  85          2HG       GLN  85  -4.046   4.763  14.371
  686   2HG   GLN  85          1HG       GLN  85  -5.559   3.846  14.087
  687   1HE2  GLN  85          2HE2      GLN  85  -3.647   3.096  16.019
  688   2HE2  GLN  85          1HE2      GLN  85  -3.005   1.562  15.490
  689    H    ALA  86           H        ALA  86  -3.763   5.477   9.429
  690    HA   ALA  86           HA       ALA  86  -2.818   3.206   7.995
  691   1HB   ALA  86          1HB       ALA  86  -3.042   4.588   6.058
  692   2HB   ALA  86          2HB       ALA  86  -4.459   4.726   7.126
  693   3HB   ALA  86          3HB       ALA  86  -3.248   6.029   7.081
  694    H    TRP  87           H        TRP  87  -1.115   6.277   8.879
  695    HA   TRP  87           HA       TRP  87   1.387   5.818   7.655
  696   1HB   TRP  87          2HB       TRP  87   1.394   7.863   8.413
  697   2HB   TRP  87          1HB       TRP  87   0.199   7.501   9.705
  698    HD1  TRP  87           HD       TRP  87   1.079   7.643  12.070
  699    HE1  TRP  87           1HE      TRP  87   3.323   7.548  13.226
  700    HE3  TRP  87           3HE      TRP  87   3.952   6.980   7.985
  701    HZ2  TRP  87           2HZ      TRP  87   6.032   7.287  12.457
  702    HZ3  TRP  87           3HZ      TRP  87   6.369   6.471   8.263
  703    HH2  TRP  87           HH       TRP  87   7.422   6.693  10.492
  704    H    ASP  88           H        ASP  88   0.050   4.612  10.753
  705    HA   ASP  88           HA       ASP  88   2.463   3.510  11.789
  706   1HB   ASP  88          2HB       ASP  88   0.006   3.958  12.838
  707   2HB   ASP  88          1HB       ASP  88  -0.130   2.232  12.491
  708    H    LEU  89           H        LEU  89  -0.279   2.210   9.794
  709    HA   LEU  89           HA       LEU  89   0.802  -0.487   9.478
  710   1HB   LEU  89          2HB       LEU  89  -1.409   0.980   8.030
  711   2HB   LEU  89          1HB       LEU  89  -0.974  -0.691   7.786
  712    HG   LEU  89           HG       LEU  89  -1.826   0.435  10.484
  713   1HD1  LEU  89          1HD1      LEU  89  -3.955  -0.623   9.983
  714   2HD1  LEU  89          2HD1      LEU  89  -3.587   0.650   8.795
  715   3HD1  LEU  89          3HD1      LEU  89  -3.376  -1.062   8.359
  716   1HD2  LEU  89          1HD2      LEU  89  -2.145  -1.892  11.074
  717   2HD2  LEU  89          2HD2      LEU  89  -1.531  -2.409   9.487
  718   3HD2  LEU  89          3HD2      LEU  89  -0.444  -1.597  10.638
  719    H    TYR  90           H        TYR  90   1.072   2.563   7.786
  720    HA   TYR  90           HA       TYR  90   2.172   1.639   5.285
  721   1HB   TYR  90          2HB       TYR  90   1.327   4.086   6.341
  722   2HB   TYR  90          1HB       TYR  90   3.062   4.299   6.359
  723    HD1  TYR  90           1HD      TYR  90   0.240   4.830   4.592
  724    HD2  TYR  90           2HD      TYR  90   4.228   3.315   4.018
  725    HE1  TYR  90           1HE      TYR  90   0.130   5.452   2.205
  726    HE2  TYR  90           2HE      TYR  90   4.184   4.090   1.686
  727    HH   TYR  90           HH       TYR  90   2.873   4.696   0.014
  728    H    TYR  91           H        TYR  91   3.717   3.067   8.173
  729    HA   TYR  91           HA       TYR  91   6.512   2.442   7.402
  730   1HB   TYR  91          2HB       TYR  91   5.642   4.383   8.843
  731   2HB   TYR  91          1HB       TYR  91   5.432   3.205  10.123
  732    HD1  TYR  91           1HD      TYR  91   8.038   4.133   7.573
  733    HD2  TYR  91           2HD      TYR  91   7.138   2.967  11.608
  734    HE1  TYR  91           1HE      TYR  91  10.377   4.588   8.221
  735    HE2  TYR  91           2HE      TYR  91   9.469   3.431  12.267
  736    HH   TYR  91           HH       TYR  91  11.536   3.836  11.538
  737    H    HIS  92           H        HIS  92   4.166   0.950   9.695
  738    HA   HIS  92           HA       HIS  92   5.902  -0.984  10.814
  739   1HB   HIS  92          2HB       HIS  92   3.655  -0.316  11.652
  740   2HB   HIS  92          1HB       HIS  92   2.931  -1.188  10.263
  741    HD1  HIS  92           1HD      HIS  92   4.510  -1.816  13.607
  742    HD2  HIS  92           2HD      HIS  92   2.835  -3.818  10.396
  743    HE1  HIS  92           1HE      HIS  92   4.080  -4.208  14.413
  744    H    VAL  93           H        VAL  93   3.959  -0.918   7.793
  745    HA   VAL  93           HA       VAL  93   4.734  -3.674   7.045
  746    HB   VAL  93           HB       VAL  93   2.473  -2.569   6.695
  747   1HG1  VAL  93          1HG1      VAL  93   2.087  -1.868   4.387
  748   2HG1  VAL  93          2HG1      VAL  93   3.092  -0.684   5.258
  749   3HG1  VAL  93          3HG1      VAL  93   3.843  -1.806   4.097
  750   1HG2  VAL  93          1HG2      VAL  93   2.155  -4.244   4.967
  751   2HG2  VAL  93          2HG2      VAL  93   3.921  -4.449   4.877
  752   3HG2  VAL  93          3HG2      VAL  93   3.059  -4.815   6.390
  753    H    PHE  94           H        PHE  94   5.458  -0.275   5.994
  754    HA   PHE  94           HA       PHE  94   7.072  -0.454   3.891
  755   1HB   PHE  94          2HB       PHE  94   6.682   1.570   5.070
  756   2HB   PHE  94          1HB       PHE  94   7.580   0.967   6.500
  757    HD1  PHE  94           1HD      PHE  94   7.830   2.457   3.159
  758    HD2  PHE  94           2HD      PHE  94   9.999   0.690   6.417
  759    HE1  PHE  94           1HE      PHE  94   9.957   3.335   2.224
  760    HE2  PHE  94           2HE      PHE  94  12.126   1.544   5.480
  761    HZ   PHE  94           HZ       PHE  94  12.103   2.877   3.386
  762    H    ARG  95           H        ARG  95   8.055  -1.648   7.115
  763    HA   ARG  95           HA       ARG  95  10.527  -2.770   6.031
  764   1HB   ARG  95          2HB       ARG  95   9.357  -2.425   8.749
  765   2HB   ARG  95          1HB       ARG  95  10.618  -3.647   8.483
  766   1HG   ARG  95          2HG       ARG  95  12.082  -1.925   7.476
  767   2HG   ARG  95          1HG       ARG  95  10.819  -0.702   7.723
  768   1HD   ARG  95          2HD       ARG  95  11.595  -0.360   9.819
  769   2HD   ARG  95          1HD       ARG  95  11.203  -2.037  10.227
  770    HE   ARG  95           HE       ARG  95  13.567  -2.238   8.865
  771   1HH1  ARG  95          2HH2      ARG  95  12.552  -0.442  11.689
  772   2HH1  ARG  95          1HH2      ARG  95  14.123  -0.436  12.428
  773   1HH2  ARG  95          1HH1      ARG  95  15.650  -2.205   9.853
  774   2HH2  ARG  95          2HH1      ARG  95  15.843  -1.422  11.384
  775    H    ARG  96           H        ARG  96   7.329  -3.978   6.964
  776    HA   ARG  96           HA       ARG  96   7.924  -6.820   7.143
  777   1HB   ARG  96          2HB       ARG  96   5.313  -5.290   6.888
  778   2HB   ARG  96          1HB       ARG  96   5.441  -7.009   7.095
  779   1HG   ARG  96          2HG       ARG  96   6.522  -4.969   9.068
  780   2HG   ARG  96          1HG       ARG  96   5.012  -5.836   9.211
  781   1HD   ARG  96          2HD       ARG  96   6.018  -7.817   9.725
  782   2HD   ARG  96          1HD       ARG  96   7.505  -7.431   8.820
  783    HE   ARG  96           HE       ARG  96   8.330  -6.336  10.648
  784   1HH1  ARG  96          2HH2      ARG  96   4.888  -6.697  11.263
  785   2HH1  ARG  96          1HH2      ARG  96   5.004  -6.207  12.908
  786   1HH2  ARG  96          1HH1      ARG  96   8.431  -5.626  12.805
  787   2HH2  ARG  96          2HH1      ARG  96   6.980  -5.560  13.747
  788    H    ILE  97           H        ILE  97   6.081  -4.909   4.715
  789    HA   ILE  97           HA       ILE  97   6.090  -6.986   2.639
  790    HB   ILE  97           HB       ILE  97   5.349  -5.153   1.141
  791   1HG1  ILE  97          2HG1      ILE  97   4.264  -3.365   2.950
  792   2HG1  ILE  97          1HG1      ILE  97   6.004  -3.396   3.181
  793   1HG2  ILE  97          1HG2      ILE  97   3.075  -5.265   1.995
  794   2HG2  ILE  97          2HG2      ILE  97   3.862  -6.857   2.110
  795   3HG2  ILE  97          3HG2      ILE  97   3.672  -5.852   3.566
  796   1HD1  ILE  97          1HD1      ILE  97   5.378  -1.811   1.454
  797   2HD1  ILE  97          2HD1      ILE  97   6.343  -3.134   0.759
  798   3HD1  ILE  97          3HD1      ILE  97   4.580  -3.101   0.524
  799    H    SER  98           H        SER  98   8.413  -4.752   3.821
  800    HA   SER  98           HA       SER  98   9.902  -4.180   1.389
  801   1HB   SER  98          2HB       SER  98  10.266  -2.690   3.123
  802   2HB   SER  98          1HB       SER  98  10.363  -3.997   4.351
  803    HG   SER  98           HG       SER  98  12.393  -2.972   3.876
  804    H    LYS  99           H        LYS  99  10.253  -6.496   4.140
  805    HA   LYS  99           HA       LYS  99  11.608  -8.373   4.404
  806   1HB   LYS  99          2HB       LYS  99  10.844  -8.486   1.579
  807   2HB   LYS  99          1HB       LYS  99  12.214  -9.475   2.114
  808   1HG   LYS  99          2HG       LYS  99   9.642  -9.380   3.699
  809   2HG   LYS  99          1HG       LYS  99   9.840 -10.476   2.307
  810   1HD   LYS  99          2HD       LYS  99  11.357 -11.834   3.448
  811   2HD   LYS  99          1HD       LYS  99  12.113 -10.481   4.269
  812   1HE   LYS  99          2HE       LYS  99   9.326 -11.062   5.128
  813   2HE   LYS  99          1HE       LYS  99  10.522 -12.301   5.500
  814   1HZ   LYS  99          1HZ       LYS  99  10.341 -10.674   7.194
  815   2HZ   LYS  99          2HZ       LYS  99  11.837 -10.654   6.541
  816   3HZ   LYS  99          3HZ       LYS  99  10.773  -9.470   6.178
  817    H    GLN 100           H        GLN 100  12.834  -5.667   4.266
  818    HA   GLN 100           HA       GLN 100  15.393  -5.692   3.117
  819   1HB   GLN 100          2HB       GLN 100  14.200  -3.818   4.206
  820   2HB   GLN 100          1HB       GLN 100  14.654  -4.536   5.784
  821   1HG   GLN 100          2HG       GLN 100  16.239  -2.851   5.353
  822   2HG   GLN 100          1HG       GLN 100  17.058  -4.401   4.985
  823   1HE2  GLN 100          2HE2      GLN 100  18.633  -3.288   3.700
  824   2HE2  GLN 100          1HE2      GLN 100  18.172  -2.660   2.142
  Start of MODEL   15
    1   1H    GLU   1          1H        GLU   1  11.519  -7.122  -9.243
    2   2H    GLU   1          2H        GLU   1  12.295  -8.277 -10.188
    3    HA   GLU   1           HA       GLU   1   9.701  -7.837 -10.474
    4   1HB   GLU   1          2HB       GLU   1   9.186  -6.313 -12.150
    5   2HB   GLU   1          1HB       GLU   1  10.002  -5.459 -10.800
    6   1HG   GLU   1          2HG       GLU   1  11.924  -6.197 -12.916
    7   2HG   GLU   1          1HG       GLU   1  10.650  -5.216 -13.555
    8    H    LEU   2           H        LEU   2   8.976  -9.385 -11.697
    9    HA   LEU   2           HA       LEU   2   8.831 -11.103 -13.224
   10   1HB   LEU   2          2HB       LEU   2  10.053  -8.960 -14.828
   11   2HB   LEU   2          1HB       LEU   2  10.249 -10.607 -15.434
   12    HG   LEU   2           HG       LEU   2   7.541  -9.848 -14.420
   13   1HD1  LEU   2          1HD1      LEU   2   6.975  -8.794 -16.581
   14   2HD1  LEU   2          2HD1      LEU   2   8.215  -7.857 -15.715
   15   3HD1  LEU   2          3HD1      LEU   2   8.679  -8.899 -17.082
   16   1HD2  LEU   2          1HD2      LEU   2   6.888 -11.272 -16.345
   17   2HD2  LEU   2          2HD2      LEU   2   8.594 -11.394 -16.835
   18   3HD2  LEU   2          3HD2      LEU   2   8.056 -12.112 -15.298
   19    H    ILE   3           H        ILE   3  10.540 -12.606 -14.674
   20    HA   ILE   3           HA       ILE   3  12.433 -13.959 -14.713
   21    HB   ILE   3           HB       ILE   3  13.650 -11.943 -12.887
   22   1HG1  ILE   3          2HG1      ILE   3  14.760 -11.826 -15.512
   23   2HG1  ILE   3          1HG1      ILE   3  13.033 -11.818 -15.738
   24   1HG2  ILE   3          1HG2      ILE   3  15.786 -12.868 -13.672
   25   2HG2  ILE   3          2HG2      ILE   3  14.841 -14.094 -12.794
   26   3HG2  ILE   3          3HG2      ILE   3  14.917 -14.134 -14.572
   27   1HD1  ILE   3          1HD1      ILE   3  13.894  -9.580 -15.529
   28   2HD1  ILE   3          2HD1      ILE   3  12.815  -9.947 -14.162
   29   3HD1  ILE   3          3HD1      ILE   3  14.579  -9.954 -13.931
   30    H    ARG   4           H        ARG   4  11.044 -13.040 -11.617
   31    HA   ARG   4           HA       ARG   4  10.736 -15.757 -10.548
   32   1HB   ARG   4          2HB       ARG   4  12.267 -15.334  -8.624
   33   2HB   ARG   4          1HB       ARG   4  13.104 -15.591 -10.137
   34   1HG   ARG   4          2HG       ARG   4  13.587 -13.223 -10.368
   35   2HG   ARG   4          1HG       ARG   4  12.508 -12.803  -9.056
   36   1HD   ARG   4          2HD       ARG   4  14.351 -12.876  -7.745
   37   2HD   ARG   4          1HD       ARG   4  14.249 -14.620  -7.844
   38    HE   ARG   4           HE       ARG   4  16.102 -12.875  -9.160
   39   1HH1  ARG   4          2HH2      ARG   4  14.694 -16.083  -9.454
   40   2HH1  ARG   4          1HH2      ARG   4  16.114 -16.767 -10.173
   41   1HH2  ARG   4          2HH1      ARG   4  17.933 -13.812 -10.107
   42   2HH2  ARG   4          1HH1      ARG   4  17.903 -15.482 -10.556
   43    H    VAL   5           H        VAL   5   8.765 -13.915 -11.042
   44    HA   VAL   5           HA       VAL   5   7.456 -13.524  -8.558
   45    HB   VAL   5           HB       VAL   5   9.149 -11.924  -8.051
   46   1HG1  VAL   5          1HG1      VAL   5   9.100  -9.700  -9.080
   47   2HG1  VAL   5          2HG1      VAL   5   9.614 -10.937 -10.250
   48   3HG1  VAL   5          3HG1      VAL   5   7.959 -10.285 -10.314
   49   1HG2  VAL   5          1HG2      VAL   5   7.657 -10.255  -7.211
   50   2HG2  VAL   5          2HG2      VAL   5   6.347 -10.941  -8.200
   51   3HG2  VAL   5          3HG2      VAL   5   7.112 -11.925  -6.931
   52    H    ALA   6           H        ALA   6   7.844 -12.207 -11.864
   53    HA   ALA   6           HA       ALA   6   6.365 -11.930 -13.624
   54   1HB   ALA   6          1HB       ALA   6   4.257 -12.980 -13.688
   55   2HB   ALA   6          2HB       ALA   6   5.562 -14.102 -13.238
   56   3HB   ALA   6          3HB       ALA   6   4.438 -13.502 -11.996
   57    H    ILE   7           H        ILE   7   6.883  -9.910 -11.755
   58    HA   ILE   7           HA       ILE   7   6.202  -7.880 -10.920
   59    HB   ILE   7           HB       ILE   7   6.612  -7.482 -13.185
   60   1HG1  ILE   7          2HG1      ILE   7   6.405  -5.790 -11.686
   61   2HG1  ILE   7          1HG1      ILE   7   5.810  -5.366 -13.337
   62   1HG2  ILE   7          1HG2      ILE   7   4.794  -7.023 -14.770
   63   2HG2  ILE   7          2HG2      ILE   7   4.841  -8.748 -14.332
   64   3HG2  ILE   7          3HG2      ILE   7   3.608  -7.682 -13.617
   65   1HD1  ILE   7          1HD1      ILE   7   4.543  -4.235 -11.601
   66   2HD1  ILE   7          2HD1      ILE   7   3.522  -5.381 -12.502
   67   3HD1  ILE   7          3HD1      ILE   7   4.108  -5.800 -10.874
   68    H    LEU   8           H        LEU   8   5.069  -8.895  -9.118
   69    HA   LEU   8           HA       LEU   8   2.196  -9.392  -9.343
   70   1HB   LEU   8          2HB       LEU   8   4.115  -9.481  -7.052
   71   2HB   LEU   8          1HB       LEU   8   2.389  -9.966  -7.019
   72    HG   LEU   8           HG       LEU   8   4.664 -11.237  -8.544
   73   1HD1  LEU   8          1HD1      LEU   8   4.058 -13.183  -7.164
   74   2HD1  LEU   8          2HD1      LEU   8   4.549 -11.770  -6.200
   75   3HD1  LEU   8          3HD1      LEU   8   2.827 -12.194  -6.344
   76   1HD2  LEU   8          1HD2      LEU   8   3.086 -12.900  -9.417
   77   2HD2  LEU   8          2HD2      LEU   8   1.723 -11.976  -8.739
   78   3HD2  LEU   8          3HD2      LEU   8   2.714 -11.274 -10.041
   79    H    TRP   9           H        TRP   9   1.359  -8.408  -6.839
   80    HA   TRP   9           HA       TRP   9   1.159  -5.467  -7.290
   81   1HB   TRP   9          2HB       TRP   9  -0.569  -7.358  -5.755
   82   2HB   TRP   9          1HB       TRP   9  -0.672  -5.623  -5.639
   83    HD1  TRP   9           HD       TRP   9   0.021  -5.474  -9.035
   84    HE1  TRP   9           1HE      TRP   9  -2.140  -5.316 -10.333
   85    HE3  TRP   9           3HE      TRP   9  -3.102  -7.328  -5.572
   86    HZ2  TRP   9           2HZ      TRP   9  -4.832  -5.993  -9.939
   87    HZ3  TRP   9           3HZ      TRP   9  -5.418  -7.903  -6.161
   88    HH2  TRP   9           HH       TRP   9  -6.297  -7.214  -8.381
   89    H    HIS  10           H        HIS  10   2.892  -7.723  -5.402
   90    HA   HIS  10           HA       HIS  10   3.448  -6.075  -3.065
   91   1HB   HIS  10          2HB       HIS  10   3.560  -8.308  -2.624
   92   2HB   HIS  10          1HB       HIS  10   4.189  -8.710  -4.260
   93    HD1  HIS  10           1HD      HIS  10   5.431  -8.131  -0.755
   94    HD2  HIS  10           2HD      HIS  10   6.776  -8.432  -4.663
   95    HE1  HIS  10           1HE      HIS  10   7.945  -8.474  -0.622
   96    H    GLU  11           H        GLU  11   5.171  -7.028  -6.094
   97    HA   GLU  11           HA       GLU  11   7.602  -5.695  -5.726
   98   1HB   GLU  11          2HB       GLU  11   6.085  -6.223  -8.298
   99   2HB   GLU  11          1HB       GLU  11   7.777  -5.746  -8.185
  100   1HG   GLU  11          2HG       GLU  11   6.714  -8.265  -6.799
  101   2HG   GLU  11          1HG       GLU  11   7.364  -8.286  -8.400
  102    H    MET  12           H        MET  12   4.744  -4.433  -7.534
  103    HA   MET  12           HA       MET  12   5.648  -1.777  -7.829
  104   1HB   MET  12          2HB       MET  12   3.441  -1.328  -8.566
  105   2HB   MET  12          1HB       MET  12   3.703  -2.972  -9.030
  106   1HG   MET  12          2HG       MET  12   2.590  -3.637  -6.870
  107   2HG   MET  12          1HG       MET  12   2.100  -1.909  -6.760
  108   1HE   MET  12          1HE       MET  12   0.112  -1.927 -10.377
  109   2HE   MET  12          2HE       MET  12   0.910  -0.829  -9.224
  110   3HE   MET  12          3HE       MET  12   1.888  -1.894 -10.263
  111    H    TRP  13           H        TRP  13   4.179  -3.424  -4.972
  112    HA   TRP  13           HA       TRP  13   3.380  -1.087  -3.492
  113   1HB   TRP  13          2HB       TRP  13   3.443  -3.986  -3.070
  114   2HB   TRP  13          1HB       TRP  13   3.906  -3.085  -1.667
  115    HD1  TRP  13           HD       TRP  13   1.110  -4.680  -2.447
  116    HE1  TRP  13           1HE      TRP  13  -1.059  -3.454  -1.916
  117    HE3  TRP  13           3HE      TRP  13   2.970  -0.037  -1.887
  118    HZ2  TRP  13           2HZ      TRP  13  -1.915  -0.770  -1.773
  119    HZ3  TRP  13           3HZ      TRP  13   1.464   1.860  -1.579
  120    HH2  TRP  13           HH       TRP  13  -0.987   1.454  -1.270
  121    H    HIS  14           H        HIS  14   6.460  -2.861  -3.817
  122    HA   HIS  14           HA       HIS  14   7.930  -1.874  -1.703
  123   1HB   HIS  14          2HB       HIS  14   8.358  -3.502  -3.735
  124   2HB   HIS  14          1HB       HIS  14   9.099  -2.031  -4.455
  125    HD1  HIS  14           1HD      HIS  14  10.749  -4.574  -3.806
  126    HD2  HIS  14           2HD      HIS  14  10.229  -1.388  -1.225
  127    HE1  HIS  14           1HE      HIS  14  12.672  -4.708  -2.125
  128    H    GLU  15           H        GLU  15   8.157  -0.458  -5.021
  129    HA   GLU  15           HA       GLU  15   8.997   2.113  -4.024
  130   1HB   GLU  15          2HB       GLU  15   8.441   1.059  -6.763
  131   2HB   GLU  15          1HB       GLU  15   8.658   2.792  -6.462
  132   1HG   GLU  15          2HG       GLU  15  10.794   1.854  -5.064
  133   2HG   GLU  15          1HG       GLU  15  10.658   0.561  -6.245
  134    H    GLY  16           H        GLY  16   5.782   0.790  -5.128
  135   1HA   GLY  16          2HA       GLY  16   4.405   3.217  -5.472
  136   2HA   GLY  16          1HA       GLY  16   3.708   1.690  -4.991
  137    H    LEU  17           H        LEU  17   5.187   1.392  -2.480
  138    HA   LEU  17           HA       LEU  17   3.914   3.371  -0.724
  139   1HB   LEU  17          2HB       LEU  17   5.199   0.820  -0.276
  140   2HB   LEU  17          1HB       LEU  17   5.437   2.072   0.939
  141    HG   LEU  17           HG       LEU  17   2.727   1.170  -0.158
  142   1HD1  LEU  17          1HD1      LEU  17   2.387   0.291   2.070
  143   2HD1  LEU  17          2HD1      LEU  17   3.789  -0.482   1.292
  144   3HD1  LEU  17          3HD1      LEU  17   4.037   0.769   2.534
  145   1HD2  LEU  17          1HD2      LEU  17   1.770   2.588   1.562
  146   2HD2  LEU  17          2HD2      LEU  17   3.387   3.170   2.022
  147   3HD2  LEU  17          3HD2      LEU  17   2.722   3.565   0.419
  148    H    GLU  18           H        GLU  18   7.283   2.824  -2.011
  149    HA   GLU  18           HA       GLU  18   8.501   4.849  -0.347
  150   1HB   GLU  18          2HB       GLU  18   9.692   3.043  -1.523
  151   2HB   GLU  18          1HB       GLU  18   9.412   3.920  -3.034
  152   1HG   GLU  18          2HG       GLU  18  10.913   5.583  -2.494
  153   2HG   GLU  18          1HG       GLU  18  10.483   5.571  -0.784
  154    H    GLU  19           H        GLU  19   7.018   5.049  -3.634
  155    HA   GLU  19           HA       GLU  19   7.511   7.852  -4.023
  156   1HB   GLU  19          2HB       GLU  19   7.116   6.157  -5.861
  157   2HB   GLU  19          1HB       GLU  19   5.443   6.125  -5.419
  158   1HG   GLU  19          2HG       GLU  19   5.691   7.578  -7.204
  159   2HG   GLU  19          1HG       GLU  19   5.356   8.587  -5.754
  160    H    ALA  20           H        ALA  20   4.686   6.038  -2.603
  161    HA   ALA  20           HA       ALA  20   3.182   8.435  -2.177
  162   1HB   ALA  20          1HB       ALA  20   1.817   6.976  -0.703
  163   2HB   ALA  20          2HB       ALA  20   2.152   6.182  -2.261
  164   3HB   ALA  20          3HB       ALA  20   3.065   5.710  -0.809
  165    H    SER  21           H        SER  21   5.165   6.371  -0.019
  166    HA   SER  21           HA       SER  21   4.611   7.713   2.399
  167   1HB   SER  21          2HB       SER  21   6.941   5.979   1.669
  168   2HB   SER  21          1HB       SER  21   6.619   6.645   3.290
  169    HG   SER  21           HG       SER  21   5.730   4.428   2.760
  170    H    ARG  22           H        ARG  22   7.500   7.962   0.138
  171    HA   ARG  22           HA       ARG  22   8.912  10.081   1.246
  172   1HB   ARG  22          2HB       ARG  22   9.723   8.858  -0.643
  173   2HB   ARG  22          1HB       ARG  22   8.485   9.531  -1.666
  174   1HG   ARG  22          2HG       ARG  22   9.443  11.661  -1.657
  175   2HG   ARG  22          1HG       ARG  22  10.282  11.409  -0.139
  176   1HD   ARG  22          2HD       ARG  22  11.148   9.439  -2.035
  177   2HD   ARG  22          1HD       ARG  22  11.257  11.085  -2.737
  178    HE   ARG  22           HE       ARG  22  12.795   9.994  -0.530
  179   1HH1  ARG  22          2HH2      ARG  22  11.541  13.068  -1.709
  180   2HH1  ARG  22          1HH2      ARG  22  12.753  14.005  -0.903
  181   1HH2  ARG  22          2HH1      ARG  22  14.361  11.273   0.510
  182   2HH2  ARG  22          1HH1      ARG  22  14.315  12.994   0.327
  183    H    LEU  23           H        LEU  23   5.817  10.379  -0.531
  184    HA   LEU  23           HA       LEU  23   5.784  13.245  -0.786
  185   1HB   LEU  23          2HB       LEU  23   3.885  11.081  -1.081
  186   2HB   LEU  23          1HB       LEU  23   3.221  12.652  -0.507
  187    HG   LEU  23           HG       LEU  23   2.994  12.673  -2.921
  188   1HD1  LEU  23          1HD1      LEU  23   4.317  14.454  -3.650
  189   2HD1  LEU  23          2HD1      LEU  23   3.664  14.747  -2.021
  190   3HD1  LEU  23          3HD1      LEU  23   5.375  14.303  -2.227
  191   1HD2  LEU  23          1HD2      LEU  23   4.765  12.269  -4.452
  192   2HD2  LEU  23          2HD2      LEU  23   5.884  11.872  -3.127
  193   3HD2  LEU  23          3HD2      LEU  23   4.488  10.820  -3.458
  194    H    TYR  24           H        TYR  24   4.014  11.196   1.657
  195    HA   TYR  24           HA       TYR  24   3.730  13.519   3.402
  196   1HB   TYR  24          2HB       TYR  24   2.090  11.909   3.474
  197   2HB   TYR  24          1HB       TYR  24   3.276  10.574   3.642
  198    HD1  TYR  24           1HD      TYR  24   4.303  10.073   5.774
  199    HD2  TYR  24           2HD      TYR  24   1.422  13.221   5.383
  200    HE1  TYR  24           1HE      TYR  24   4.100  10.192   8.233
  201    HE2  TYR  24           2HE      TYR  24   1.122  13.282   7.818
  202    HH   TYR  24           HH       TYR  24   1.643  12.333   9.753
  203    H    PHE  25           H        PHE  25   6.386  11.355   2.941
  204    HA   PHE  25           HA       PHE  25   7.490  11.111   5.537
  205   1HB   PHE  25          2HB       PHE  25   7.904   9.822   3.363
  206   2HB   PHE  25          1HB       PHE  25   8.906  11.223   2.853
  207    HD1  PHE  25           1HD      PHE  25   8.937   8.033   4.271
  208    HD2  PHE  25           2HD      PHE  25  10.820  11.885   4.549
  209    HE1  PHE  25           1HE      PHE  25  10.842   7.018   5.499
  210    HE2  PHE  25           2HE      PHE  25  12.673  10.895   5.842
  211    HZ   PHE  25           HZ       PHE  25  12.726   8.445   6.257
  212    H    GLY  26           H        GLY  26   8.114  13.443   2.829
  213   1HA   GLY  26          2HA       GLY  26   8.706  15.547   4.747
  214   2HA   GLY  26          1HA       GLY  26  10.099  14.972   3.773
  215    H    GLU  27           H        GLU  27   6.867  14.993   2.334
  216    HA   GLU  27           HA       GLU  27   7.464  17.541   0.868
  217   1HB   GLU  27          2HB       GLU  27   6.967  14.952  -0.075
  218   2HB   GLU  27          1HB       GLU  27   5.457  15.887  -0.313
  219   1HG   GLU  27          2HG       GLU  27   6.590  16.350  -2.314
  220   2HG   GLU  27          1HG       GLU  27   7.141  17.691  -1.338
  221    H    ARG  28           H        ARG  28   5.528  16.342   3.383
  222    HA   ARG  28           HA       ARG  28   3.311  16.627   4.119
  223   1HB   ARG  28          2HB       ARG  28   4.915  18.911   4.114
  224   2HB   ARG  28          1HB       ARG  28   3.325  19.436   3.562
  225   1HG   ARG  28          2HG       ARG  28   2.336  18.127   5.490
  226   2HG   ARG  28          1HG       ARG  28   4.006  17.928   6.089
  227   1HD   ARG  28          2HD       ARG  28   4.276  20.432   6.015
  228   2HD   ARG  28          1HD       ARG  28   2.572  20.575   5.551
  229    HE   ARG  28           HE       ARG  28   3.038  19.028   7.956
  230   1HH1  ARG  28          2HH2      ARG  28   2.402  22.256   6.726
  231   2HH1  ARG  28          1HH2      ARG  28   1.870  22.874   8.256
  232   1HH2  ARG  28          2HH1      ARG  28   2.325  19.879   9.957
  233   2HH2  ARG  28          1HH1      ARG  28   1.822  21.532  10.047
  234    H    ASN  29           H        ASN  29   3.408  15.862   1.282
  235    HA   ASN  29           HA       ASN  29   0.925  17.192   0.337
  236   1HB   ASN  29          2HB       ASN  29   3.236  17.597  -0.844
  237   2HB   ASN  29          1HB       ASN  29   3.001  16.007  -1.512
  238   1HD2  ASN  29          2HD2      ASN  29   2.916  16.990  -3.591
  239   2HD2  ASN  29          1HD2      ASN  29   1.462  17.825  -4.066
  240    H    VAL  30           H        VAL  30   0.049  15.515   1.828
  241    HA   VAL  30           HA       VAL  30  -0.169  12.759   1.228
  242    HB   VAL  30           HB       VAL  30  -2.212  14.530   2.584
  243   1HG1  VAL  30          1HG1      VAL  30  -2.952  12.492   3.608
  244   2HG1  VAL  30          2HG1      VAL  30  -3.144  12.386   1.842
  245   3HG1  VAL  30          3HG1      VAL  30  -1.797  11.541   2.643
  246   1HG2  VAL  30          1HG2      VAL  30  -1.185  13.720   4.611
  247   2HG2  VAL  30          2HG2      VAL  30   0.054  12.851   3.675
  248   3HG2  VAL  30          3HG2      VAL  30   0.003  14.629   3.648
  249    H    LYS  31           H        LYS  31  -1.364  15.549  -0.513
  250    HA   LYS  31           HA       LYS  31  -3.513  14.315  -2.025
  251   1HB   LYS  31          2HB       LYS  31  -3.480  16.633  -1.694
  252   2HB   LYS  31          1HB       LYS  31  -1.804  16.760  -2.328
  253   1HG   LYS  31          2HG       LYS  31  -3.665  17.570  -3.900
  254   2HG   LYS  31          1HG       LYS  31  -2.558  16.402  -4.587
  255   1HD   LYS  31          2HD       LYS  31  -4.204  14.823  -4.837
  256   2HD   LYS  31          1HD       LYS  31  -4.939  15.169  -3.295
  257   1HE   LYS  31          2HE       LYS  31  -5.941  17.194  -4.217
  258   2HE   LYS  31          1HE       LYS  31  -5.217  16.787  -5.808
  259   1HZ   LYS  31          1HZ       LYS  31  -7.490  15.934  -5.499
  260   2HZ   LYS  31          2HZ       LYS  31  -6.393  14.757  -5.786
  261   3HZ   LYS  31          3HZ       LYS  31  -6.958  14.989  -4.275
  262    H    GLY  32           H        GLY  32   0.043  14.810  -2.542
  263   1HA   GLY  32          2HA       GLY  32   0.211  13.788  -5.206
  264   2HA   GLY  32          1HA       GLY  32   1.519  13.912  -4.054
  265    H    MET  33           H        MET  33   1.206  12.190  -2.123
  266    HA   MET  33           HA       MET  33   1.596   9.562  -3.010
  267   1HB   MET  33          2HB       MET  33   1.228   8.894  -0.702
  268   2HB   MET  33          1HB       MET  33   2.089  10.391  -0.679
  269   1HG   MET  33          2HG       MET  33   0.074  11.608  -0.221
  270   2HG   MET  33          1HG       MET  33  -0.864  10.081  -0.311
  271   1HE   MET  33          1HE       MET  33  -0.540   8.442   2.938
  272   2HE   MET  33          2HE       MET  33  -1.630   9.002   1.648
  273   3HE   MET  33          3HE       MET  33  -0.221   7.993   1.245
  274    H    PHE  34           H        PHE  34  -1.520  11.140  -2.265
  275    HA   PHE  34           HA       PHE  34  -3.233   8.891  -2.386
  276   1HB   PHE  34          2HB       PHE  34  -3.480  11.599  -1.865
  277   2HB   PHE  34          1HB       PHE  34  -4.272  11.448  -3.407
  278    HD1  PHE  34           1HD      PHE  34  -5.510  12.229  -0.902
  279    HD2  PHE  34           2HD      PHE  34  -5.036   8.298  -2.608
  280    HE1  PHE  34           1HE      PHE  34  -7.557  11.450   0.261
  281    HE2  PHE  34           2HE      PHE  34  -7.026   7.530  -1.415
  282    HZ   PHE  34           HZ       PHE  34  -8.284   9.087   0.008
  283    H    GLU  35           H        GLU  35  -1.555  10.564  -5.004
  284    HA   GLU  35           HA       GLU  35  -3.307   9.497  -7.113
  285   1HB   GLU  35          2HB       GLU  35  -2.129  11.749  -7.153
  286   2HB   GLU  35          1HB       GLU  35  -0.627  10.870  -7.366
  287   1HG   GLU  35          2HG       GLU  35  -1.493   9.829  -9.429
  288   2HG   GLU  35          1HG       GLU  35  -3.047  10.617  -9.201
  289    H    VAL  36           H        VAL  36  -0.024   8.698  -5.744
  290    HA   VAL  36           HA       VAL  36   0.328   6.454  -7.588
  291    HB   VAL  36           HB       VAL  36   2.114   7.875  -6.755
  292   1HG1  VAL  36          1HG1      VAL  36   3.215   7.206  -4.674
  293   2HG1  VAL  36          2HG1      VAL  36   1.619   7.926  -4.353
  294   3HG1  VAL  36          3HG1      VAL  36   1.832   6.161  -4.269
  295   1HG2  VAL  36          1HG2      VAL  36   3.691   6.060  -6.743
  296   2HG2  VAL  36          2HG2      VAL  36   2.347   4.902  -6.599
  297   3HG2  VAL  36          3HG2      VAL  36   2.476   5.942  -8.038
  298    H    LEU  37           H        LEU  37  -0.840   6.864  -4.203
  299    HA   LEU  37           HA       LEU  37  -1.308   4.088  -3.762
  300   1HB   LEU  37          2HB       LEU  37  -1.780   6.602  -2.339
  301   2HB   LEU  37          1HB       LEU  37  -2.791   5.177  -1.915
  302    HG   LEU  37           HG       LEU  37  -0.267   5.843  -0.941
  303   1HD1  LEU  37          1HD1      LEU  37  -0.566   3.636   0.219
  304   2HD1  LEU  37          2HD1      LEU  37  -2.094   4.546   0.152
  305   3HD1  LEU  37          3HD1      LEU  37  -1.811   3.199  -0.975
  306   1HD2  LEU  37          1HD2      LEU  37   1.131   3.899  -1.403
  307   2HD2  LEU  37          2HD2      LEU  37  -0.022   3.350  -2.643
  308   3HD2  LEU  37          3HD2      LEU  37   0.876   4.870  -2.871
  309    H    GLU  38           H        GLU  38  -3.338   6.656  -5.196
  310    HA   GLU  38           HA       GLU  38  -5.873   5.544  -5.157
  311   1HB   GLU  38          2HB       GLU  38  -4.491   7.550  -6.614
  312   2HB   GLU  38          1HB       GLU  38  -5.346   6.549  -7.768
  313   1HG   GLU  38          2HG       GLU  38  -7.115   6.947  -5.567
  314   2HG   GLU  38          1HG       GLU  38  -6.400   8.509  -5.979
  315    HA   PRO  39           HA       PRO  39  -5.034   2.426  -8.666
  316   1HB   PRO  39          2HB       PRO  39  -2.614   1.923  -9.680
  317   2HB   PRO  39          1HB       PRO  39  -3.630   3.216 -10.309
  318   1HG   PRO  39          2HG       PRO  39  -1.308   3.420  -8.338
  319   2HG   PRO  39          1HG       PRO  39  -1.650   4.445  -9.729
  320   1HD   PRO  39          1HD       PRO  39  -2.439   5.142  -7.137
  321   2HD   PRO  39          2HD       PRO  39  -3.409   5.628  -8.588
  322    H    LEU  40           H        LEU  40  -2.199   2.631  -6.343
  323    HA   LEU  40           HA       LEU  40  -1.981  -0.116  -5.908
  324   1HB   LEU  40          2HB       LEU  40  -1.294   2.288  -4.211
  325   2HB   LEU  40          1HB       LEU  40  -0.814   0.643  -3.820
  326    HG   LEU  40           HG       LEU  40  -0.166   1.910  -6.516
  327   1HD1  LEU  40          1HD1      LEU  40   2.032   2.359  -5.539
  328   2HD1  LEU  40          2HD1      LEU  40   0.770   3.248  -4.653
  329   3HD1  LEU  40          3HD1      LEU  40   1.469   1.767  -3.958
  330   1HD2  LEU  40          1HD2      LEU  40   1.555   0.212  -6.586
  331   2HD2  LEU  40          2HD2      LEU  40   1.033  -0.422  -5.006
  332   3HD2  LEU  40          3HD2      LEU  40  -0.049  -0.542  -6.414
  333    H    HIS  41           H        HIS  41  -4.421   2.077  -4.644
  334    HA   HIS  41           HA       HIS  41  -5.513   0.290  -2.661
  335   1HB   HIS  41          2HB       HIS  41  -6.477   2.102  -2.028
  336   2HB   HIS  41          1HB       HIS  41  -5.671   2.962  -3.393
  337    HD1  HIS  41           1HD      HIS  41  -8.821   0.814  -3.495
  338    HD2  HIS  41           2HD      HIS  41  -7.377   4.580  -4.362
  339    HE1  HIS  41           1HE      HIS  41 -10.675   1.984  -4.823
  340    H    ALA  42           H        ALA  42  -6.381   1.164  -6.090
  341    HA   ALA  42           HA       ALA  42  -8.720  -0.585  -6.173
  342   1HB   ALA  42          1HB       ALA  42  -8.795   0.034  -8.486
  343   2HB   ALA  42          2HB       ALA  42  -8.632   1.458  -7.432
  344   3HB   ALA  42          3HB       ALA  42  -7.225   0.857  -8.339
  345    H    MET  43           H        MET  43  -5.337  -0.767  -7.218
  346    HA   MET  43           HA       MET  43  -5.375  -3.356  -8.492
  347   1HB   MET  43          2HB       MET  43  -3.128  -1.621  -7.372
  348   2HB   MET  43          1HB       MET  43  -2.865  -3.153  -8.137
  349   1HG   MET  43          2HG       MET  43  -4.517  -1.586  -9.903
  350   2HG   MET  43          1HG       MET  43  -3.168  -0.618  -9.373
  351   1HE   MET  43          1HE       MET  43  -3.167  -3.936 -12.378
  352   2HE   MET  43          2HE       MET  43  -4.241  -4.029 -10.963
  353   3HE   MET  43          3HE       MET  43  -4.337  -2.633 -12.061
  354    H    MET  44           H        MET  44  -5.579  -2.422  -5.081
  355    HA   MET  44           HA       MET  44  -4.806  -5.200  -4.297
  356   1HB   MET  44          2HB       MET  44  -3.603  -3.349  -3.340
  357   2HB   MET  44          1HB       MET  44  -5.143  -2.726  -2.665
  358   1HG   MET  44          2HG       MET  44  -4.333  -5.559  -1.972
  359   2HG   MET  44          1HG       MET  44  -3.506  -4.261  -1.171
  360   1HE   MET  44          1HE       MET  44  -6.554  -6.061   0.929
  361   2HE   MET  44          2HE       MET  44  -5.942  -6.727  -0.604
  362   3HE   MET  44          3HE       MET  44  -4.801  -6.169   0.643
  363    H    GLU  45           H        GLU  45  -7.599  -3.276  -4.970
  364    HA   GLU  45           HA       GLU  45  -9.403  -4.874  -3.208
  365   1HB   GLU  45          2HB       GLU  45  -9.429  -2.300  -3.458
  366   2HB   GLU  45          1HB       GLU  45 -10.228  -2.636  -5.001
  367   1HG   GLU  45          2HG       GLU  45 -11.394  -4.288  -2.852
  368   2HG   GLU  45          1HG       GLU  45 -11.483  -2.599  -2.446
  369    H    ARG  46           H        ARG  46  -8.750  -4.281  -6.710
  370    HA   ARG  46           HA       ARG  46 -10.893  -5.554  -7.926
  371   1HB   ARG  46          2HB       ARG  46  -8.330  -4.536  -8.627
  372   2HB   ARG  46          1HB       ARG  46  -8.356  -6.179  -9.217
  373   1HG   ARG  46          2HG       ARG  46 -10.800  -4.525  -9.758
  374   2HG   ARG  46          1HG       ARG  46  -9.333  -4.146 -10.644
  375   1HD   ARG  46          2HD       ARG  46  -9.196  -6.386 -11.534
  376   2HD   ARG  46          1HD       ARG  46 -10.502  -6.944 -10.477
  377    HE   ARG  46           HE       ARG  46 -11.398  -4.733 -12.008
  378   1HH1  ARG  46          2HH2      ARG  46 -10.576  -8.112 -12.467
  379   2HH1  ARG  46          1HH2      ARG  46 -11.695  -8.347 -13.769
  380   1HH2  ARG  46          2HH1      ARG  46 -12.901  -5.090 -13.717
  381   2HH2  ARG  46          1HH1      ARG  46 -12.981  -6.653 -14.453
  382    H    GLY  47           H        GLY  47  -8.079  -7.067  -6.301
  383   1HA   GLY  47          2HA       GLY  47  -8.391  -9.117  -5.123
  384   2HA   GLY  47          1HA       GLY  47  -9.534  -9.657  -6.354
  385    HA   PRO  48           HA       PRO  48  -4.977 -10.796  -7.420
  386   1HB   PRO  48          2HB       PRO  48  -4.590 -13.184  -6.208
  387   2HB   PRO  48          1HB       PRO  48  -4.196 -11.662  -5.408
  388   1HG   PRO  48          2HG       PRO  48  -6.700 -13.381  -5.086
  389   2HG   PRO  48          1HG       PRO  48  -5.725 -12.626  -3.826
  390   1HD   PRO  48          1HD       PRO  48  -8.058 -11.415  -4.854
  391   2HD   PRO  48          2HD       PRO  48  -6.642 -10.412  -4.283
  392    H    GLN  49           H        GLN  49  -4.485 -12.253  -9.055
  393    HA   GLN  49           HA       GLN  49  -6.788 -13.584 -10.338
  394   1HB   GLN  49          2HB       GLN  49  -5.521 -11.952 -11.592
  395   2HB   GLN  49          1HB       GLN  49  -4.020 -12.895 -11.323
  396   1HG   GLN  49          2HG       GLN  49  -4.524 -13.623 -13.406
  397   2HG   GLN  49          1HG       GLN  49  -5.501 -14.797 -12.465
  398   1HE2  GLN  49          2HE2      GLN  49  -6.782 -15.113 -14.420
  399   2HE2  GLN  49          1HE2      GLN  49  -7.920 -13.872 -14.874
  400    H    THR  50           H        THR  50  -3.320 -14.421 -10.367
  401    HA   THR  50           HA       THR  50  -3.642 -17.237 -10.557
  402    HB   THR  50           HB       THR  50  -1.843 -16.622 -11.572
  403    HG1  THR  50           1HG      THR  50  -0.053 -17.512 -10.334
  404   1HG2  THR  50          1HG2      THR  50   0.012 -15.272 -10.725
  405   2HG2  THR  50          2HG2      THR  50  -1.504 -14.340 -10.744
  406   3HG2  THR  50          3HG2      THR  50  -0.874 -14.984  -9.210
  407    H    LEU  51           H        LEU  51  -1.458 -16.385  -8.112
  408    HA   LEU  51           HA       LEU  51  -2.874 -16.551  -5.626
  409   1HB   LEU  51          2HB       LEU  51  -2.774 -19.009  -7.006
  410   2HB   LEU  51          1HB       LEU  51  -1.518 -19.097  -5.760
  411    HG   LEU  51           HG       LEU  51  -4.193 -17.953  -4.985
  412   1HD1  LEU  51          1HD1      LEU  51  -5.061 -20.209  -4.563
  413   2HD1  LEU  51          2HD1      LEU  51  -4.772 -19.947  -6.299
  414   3HD1  LEU  51          3HD1      LEU  51  -3.626 -20.916  -5.343
  415   1HD2  LEU  51          1HD2      LEU  51  -3.633 -19.078  -2.868
  416   2HD2  LEU  51          2HD2      LEU  51  -2.173 -19.773  -3.612
  417   3HD2  LEU  51          3HD2      LEU  51  -2.305 -18.013  -3.386
  418    H    LYS  52           H        LYS  52  -0.783 -15.008  -6.796
  419    HA   LYS  52           HA       LYS  52   1.598 -15.794  -5.149
  420   1HB   LYS  52          2HB       LYS  52   1.779 -14.372  -7.763
  421   2HB   LYS  52          1HB       LYS  52   3.078 -15.062  -6.739
  422   1HG   LYS  52          2HG       LYS  52   1.583 -17.269  -7.231
  423   2HG   LYS  52          1HG       LYS  52   1.330 -16.338  -8.741
  424   1HD   LYS  52          2HD       LYS  52   3.207 -17.506  -9.355
  425   2HD   LYS  52          1HD       LYS  52   4.005 -16.134  -8.570
  426   1HE   LYS  52          2HE       LYS  52   4.388 -17.387  -6.551
  427   2HE   LYS  52          1HE       LYS  52   3.264 -18.658  -7.030
  428   1HZ   LYS  52          1HZ       LYS  52   5.445 -19.350  -7.374
  429   2HZ   LYS  52          2HZ       LYS  52   4.759 -19.153  -8.840
  430   3HZ   LYS  52          3HZ       LYS  52   5.825 -18.047  -8.277
  431    H    GLU  53           H        GLU  53  -0.268 -13.087  -6.632
  432    HA   GLU  53           HA       GLU  53   0.834 -10.988  -4.956
  433   1HB   GLU  53          2HB       GLU  53  -1.775 -10.950  -6.415
  434   2HB   GLU  53          1HB       GLU  53  -0.706  -9.585  -5.919
  435   1HG   GLU  53          2HG       GLU  53  -0.078  -9.516  -8.046
  436   2HG   GLU  53          1HG       GLU  53   0.828 -11.002  -7.729
  437    H    THR  54           H        THR  54   0.313 -12.794  -3.069
  438    HA   THR  54           HA       THR  54  -1.583 -11.677  -1.210
  439    HB   THR  54           HB       THR  54  -2.643 -13.860  -2.800
  440    HG1  THR  54           1HG      THR  54  -4.461 -12.397  -2.567
  441   1HG2  THR  54          1HG2      THR  54  -4.422 -14.285  -1.215
  442   2HG2  THR  54          2HG2      THR  54  -2.853 -14.850  -0.592
  443   3HG2  THR  54          3HG2      THR  54  -3.566 -13.341   0.027
  444    H    SER  55           H        SER  55   1.125 -12.076  -1.027
  445    HA   SER  55           HA       SER  55   1.355 -14.365   0.861
  446   1HB   SER  55          2HB       SER  55   3.479 -13.038  -0.763
  447   2HB   SER  55          1HB       SER  55   3.799 -14.133   0.610
  448    HG   SER  55           HG       SER  55   3.704 -15.448  -1.244
  449    H    PHE  56           H        PHE  56   1.373 -10.953   0.622
  450    HA   PHE  56           HA       PHE  56   2.500 -10.415   3.313
  451   1HB   PHE  56          2HB       PHE  56   2.437  -8.057   2.371
  452   2HB   PHE  56          1HB       PHE  56   3.518  -9.136   1.537
  453    HD1  PHE  56           1HD      PHE  56   0.518  -7.119   1.313
  454    HD2  PHE  56           2HD      PHE  56   2.907 -10.078  -0.684
  455    HE1  PHE  56           1HE      PHE  56  -0.567  -6.545  -0.835
  456    HE2  PHE  56           2HE      PHE  56   1.742  -9.575  -2.816
  457    HZ   PHE  56           HZ       PHE  56   0.040  -7.768  -2.902
  458    H    ASN  57           H        ASN  57  -0.557 -10.283   1.454
  459    HA   ASN  57           HA       ASN  57  -2.109  -8.865   3.425
  460   1HB   ASN  57          2HB       ASN  57  -2.795  -8.881   1.112
  461   2HB   ASN  57          1HB       ASN  57  -2.869 -10.633   1.089
  462   1HD2  ASN  57          2HD2      ASN  57  -4.679 -11.683   1.846
  463   2HD2  ASN  57          1HD2      ASN  57  -6.003 -10.820   2.563
  464    H    GLN  58           H        GLN  58  -1.261 -12.329   2.938
  465    HA   GLN  58           HA       GLN  58  -3.260 -13.376   4.802
  466   1HB   GLN  58          2HB       GLN  58  -1.237 -14.438   2.990
  467   2HB   GLN  58          1HB       GLN  58  -1.438 -15.314   4.510
  468   1HG   GLN  58          2HG       GLN  58  -3.734 -14.538   2.650
  469   2HG   GLN  58          1HG       GLN  58  -2.989 -16.131   2.726
  470   1HE2  GLN  58          2HE2      GLN  58  -3.216 -17.392   4.691
  471   2HE2  GLN  58          1HE2      GLN  58  -4.545 -17.026   5.761
  472    H    ALA  59           H        ALA  59   0.228 -12.583   4.978
  473    HA   ALA  59           HA       ALA  59   0.550 -13.544   7.693
  474   1HB   ALA  59          1HB       ALA  59   2.734 -12.500   7.483
  475   2HB   ALA  59          2HB       ALA  59   2.365 -13.555   6.097
  476   3HB   ALA  59          3HB       ALA  59   2.251 -11.787   5.925
  477    H    TYR  60           H        TYR  60  -0.227 -10.490   6.079
  478    HA   TYR  60           HA       TYR  60  -0.777  -9.285   8.780
  479   1HB   TYR  60          2HB       TYR  60   0.291  -7.911   6.288
  480   2HB   TYR  60          1HB       TYR  60  -0.126  -7.107   7.839
  481    HD1  TYR  60           1HD      TYR  60   2.131  -9.841   6.536
  482    HD2  TYR  60           2HD      TYR  60   1.650  -6.479   9.134
  483    HE1  TYR  60           1HE      TYR  60   4.255 -10.415   7.624
  484    HE2  TYR  60           2HE      TYR  60   3.839  -6.973  10.167
  485    HH   TYR  60           HH       TYR  60   5.610  -8.253  10.136
  486    H    GLY  61           H        GLY  61  -3.017 -10.379   8.242
  487   1HA   GLY  61          2HA       GLY  61  -4.685  -9.580   6.230
  488   2HA   GLY  61          1HA       GLY  61  -5.199  -9.983   7.897
  489    H    ARG  62           H        ARG  62  -3.527  -7.647   8.774
  490    HA   ARG  62           HA       ARG  62  -5.519  -5.510   8.576
  491   1HB   ARG  62          2HB       ARG  62  -4.174  -4.578  10.542
  492   2HB   ARG  62          1HB       ARG  62  -4.871  -6.144  10.858
  493   1HG   ARG  62          2HG       ARG  62  -2.087  -6.114   9.749
  494   2HG   ARG  62          1HG       ARG  62  -2.330  -5.592  11.410
  495   1HD   ARG  62          2HD       ARG  62  -3.790  -8.051  10.695
  496   2HD   ARG  62          1HD       ARG  62  -2.007  -8.167  10.610
  497    HE   ARG  62           HE       ARG  62  -3.638  -7.880  12.984
  498   1HH1  ARG  62          2HH2      ARG  62  -0.469  -7.151  11.676
  499   2HH1  ARG  62          1HH2      ARG  62   0.289  -6.982  13.229
  500   1HH2  ARG  62          2HH1      ARG  62  -2.602  -7.671  15.029
  501   2HH2  ARG  62          1HH1      ARG  62  -0.918  -7.279  15.087
  502    H    ASP  63           H        ASP  63  -2.652  -6.314   6.960
  503    HA   ASP  63           HA       ASP  63  -1.145  -3.935   6.687
  504   1HB   ASP  63          2HB       ASP  63  -0.204  -4.958   4.836
  505   2HB   ASP  63          1HB       ASP  63  -0.575  -6.260   6.025
  506    H    LEU  64           H        LEU  64  -1.454  -3.925   3.605
  507    HA   LEU  64           HA       LEU  64  -2.996  -1.843   2.957
  508   1HB   LEU  64          2HB       LEU  64  -2.130  -4.239   1.464
  509   2HB   LEU  64          1HB       LEU  64  -3.465  -3.359   0.770
  510    HG   LEU  64           HG       LEU  64  -1.589  -2.306  -0.159
  511   1HD1  LEU  64          1HD1      LEU  64  -1.504  -0.109   0.677
  512   2HD1  LEU  64          2HD1      LEU  64  -3.166  -0.731   0.557
  513   3HD1  LEU  64          3HD1      LEU  64  -2.374  -0.609   2.146
  514   1HD2  LEU  64          1HD2      LEU  64   0.396  -1.660   1.049
  515   2HD2  LEU  64          2HD2      LEU  64  -0.276  -2.305   2.565
  516   3HD2  LEU  64          3HD2      LEU  64   0.117  -3.409   1.225
  517    H    MET  65           H        MET  65  -4.396  -5.087   3.663
  518    HA   MET  65           HA       MET  65  -7.039  -4.735   2.798
  519   1HB   MET  65          2HB       MET  65  -5.475  -6.513   4.288
  520   2HB   MET  65          1HB       MET  65  -6.689  -5.952   5.438
  521   1HG   MET  65          2HG       MET  65  -8.106  -6.421   3.015
  522   2HG   MET  65          1HG       MET  65  -7.016  -7.780   3.201
  523   1HE   MET  65          1HE       MET  65 -10.091  -9.484   4.509
  524   2HE   MET  65          2HE       MET  65  -9.859  -8.431   3.094
  525   3HE   MET  65          3HE       MET  65  -8.593  -9.594   3.555
  526    H    GLU  66           H        GLU  66  -5.574  -3.562   5.898
  527    HA   GLU  66           HA       GLU  66  -8.091  -2.128   6.592
  528   1HB   GLU  66          2HB       GLU  66  -6.359  -3.547   8.132
  529   2HB   GLU  66          1HB       GLU  66  -5.803  -1.889   8.368
  530   1HG   GLU  66          2HG       GLU  66  -8.153  -1.197   8.875
  531   2HG   GLU  66          1HG       GLU  66  -8.667  -2.880   8.700
  532    H    ALA  67           H        ALA  67  -4.699  -1.520   5.578
  533    HA   ALA  67           HA       ALA  67  -4.725   1.302   5.742
  534   1HB   ALA  67          1HB       ALA  67  -2.783   1.156   4.265
  535   2HB   ALA  67          2HB       ALA  67  -2.697   0.036   5.645
  536   3HB   ALA  67          3HB       ALA  67  -3.110  -0.577   4.027
  537    H    GLN  68           H        GLN  68  -6.395  -0.735   3.561
  538    HA   GLN  68           HA       GLN  68  -7.088   1.486   1.702
  539   1HB   GLN  68          2HB       GLN  68  -6.089  -0.592   0.646
  540   2HB   GLN  68          1HB       GLN  68  -7.324  -1.564   1.379
  541   1HG   GLN  68          2HG       GLN  68  -9.014  -0.053   0.136
  542   2HG   GLN  68          1HG       GLN  68  -7.613   0.479  -0.802
  543   1HE2  GLN  68          2HE2      GLN  68 -10.034  -1.933  -0.528
  544   2HE2  GLN  68          1HE2      GLN  68  -9.253  -3.038  -1.629
  545    H    GLU  69           H        GLU  69  -8.561  -1.100   3.858
  546    HA   GLU  69           HA       GLU  69 -11.232  -0.906   3.296
  547   1HB   GLU  69          2HB       GLU  69  -9.655  -1.534   5.620
  548   2HB   GLU  69          1HB       GLU  69 -11.172  -0.721   6.044
  549   1HG   GLU  69          2HG       GLU  69 -12.196  -2.408   4.223
  550   2HG   GLU  69          1HG       GLU  69 -10.765  -3.349   4.602
  551    H    TRP  70           H        TRP  70  -9.368   1.603   4.974
  552    HA   TRP  70           HA       TRP  70 -11.654   3.459   5.129
  553   1HB   TRP  70          2HB       TRP  70  -9.904   4.912   6.083
  554   2HB   TRP  70          1HB       TRP  70 -10.318   3.423   6.999
  555    HD1  TRP  70           HD       TRP  70  -7.615   3.817   4.172
  556    HE1  TRP  70           1HE      TRP  70  -5.439   2.997   5.128
  557    HE3  TRP  70           3HE      TRP  70  -9.142   3.026   8.917
  558    HZ2  TRP  70           2HZ      TRP  70  -4.450   2.146   7.650
  559    HZ3  TRP  70           3HZ      TRP  70  -7.626   1.878  10.512
  560    HH2  TRP  70           HH       TRP  70  -5.241   1.588   9.929
  561    H    CYS  71           H        CYS  71 -11.090   2.603   2.407
  562    HA   CYS  71           HA       CYS  71  -9.558   4.574   1.001
  563   1HB   CYS  71          2HB       CYS  71 -10.741   3.600  -1.019
  564   2HB   CYS  71          1HB       CYS  71  -9.810   2.477  -0.089
  565    HG   CYS  71           HG       CYS  71 -11.877   1.363  -1.010
  566    H    ARG  72           H        ARG  72 -13.125   4.046   0.954
  567    HA   ARG  72           HA       ARG  72 -13.960   6.593   0.059
  568   1HB   ARG  72          2HB       ARG  72 -16.123   5.946   0.884
  569   2HB   ARG  72          1HB       ARG  72 -15.374   4.544   0.171
  570   1HG   ARG  72          2HG       ARG  72 -14.803   3.655   2.340
  571   2HG   ARG  72          1HG       ARG  72 -15.372   5.139   3.135
  572   1HD   ARG  72          2HD       ARG  72 -17.593   4.672   1.857
  573   2HD   ARG  72          1HD       ARG  72 -16.946   3.009   1.710
  574    HE   ARG  72           HE       ARG  72 -16.646   3.947   4.383
  575   1HH1  ARG  72          2HH2      ARG  72 -19.175   2.833   2.238
  576   2HH1  ARG  72          1HH2      ARG  72 -20.221   2.305   3.517
  577   1HH2  ARG  72          2HH1      ARG  72 -18.039   3.246   6.062
  578   2HH2  ARG  72          1HH1      ARG  72 -19.568   2.545   5.655
  579    H    LYS  73           H        LYS  73 -12.640   5.722   3.168
  580    HA   LYS  73           HA       LYS  73 -13.732   8.083   4.588
  581   1HB   LYS  73          2HB       LYS  73 -12.618   5.498   5.361
  582   2HB   LYS  73          1HB       LYS  73 -12.020   6.873   6.293
  583   1HG   LYS  73          2HG       LYS  73 -14.106   7.429   7.095
  584   2HG   LYS  73          1HG       LYS  73 -14.955   6.695   5.703
  585   1HD   LYS  73          2HD       LYS  73 -15.051   4.611   6.787
  586   2HD   LYS  73          1HD       LYS  73 -13.379   4.676   7.224
  587   1HE   LYS  73          2HE       LYS  73 -14.311   4.631   9.235
  588   2HE   LYS  73          1HE       LYS  73 -14.225   6.406   9.011
  589   1HZ   LYS  73          1HZ       LYS  73 -16.298   5.686   9.861
  590   2HZ   LYS  73          2HZ       LYS  73 -16.509   6.365   8.391
  591   3HZ   LYS  73          3HZ       LYS  73 -16.574   4.740   8.566
  592    H    TYR  74           H        TYR  74 -10.529   6.685   3.623
  593    HA   TYR  74           HA       TYR  74  -9.007   9.147   4.147
  594   1HB   TYR  74          2HB       TYR  74  -8.012   7.013   4.070
  595   2HB   TYR  74          1HB       TYR  74  -8.534   6.799   2.363
  596    HD1  TYR  74           1HD      TYR  74  -6.512   6.417   1.385
  597    HD2  TYR  74           2HD      TYR  74  -7.085   9.943   3.763
  598    HE1  TYR  74           1HE      TYR  74  -4.356   7.306   0.575
  599    HE2  TYR  74           2HE      TYR  74  -4.992  10.884   2.885
  600    HH   TYR  74           HH       TYR  74  -3.085   9.101   0.436
  601    H    MET  75           H        MET  75 -11.002   8.172   1.336
  602    HA   MET  75           HA       MET  75 -10.009  10.327  -0.384
  603   1HB   MET  75          2HB       MET  75 -10.988   9.369  -2.017
  604   2HB   MET  75          1HB       MET  75 -10.776   7.952  -0.923
  605   1HG   MET  75          2HG       MET  75 -12.939   7.675  -1.870
  606   2HG   MET  75          1HG       MET  75 -13.265   8.338  -0.291
  607   1HE   MET  75          1HE       MET  75 -16.039   9.872  -2.609
  608   2HE   MET  75          2HE       MET  75 -15.278   8.273  -2.782
  609   3HE   MET  75          3HE       MET  75 -15.707   8.884  -1.167
  610    H    LYS  76           H        LYS  76 -12.889   9.856   1.685
  611    HA   LYS  76           HA       LYS  76 -13.987  12.447   0.703
  612   1HB   LYS  76          2HB       LYS  76 -15.280  10.186   0.714
  613   2HB   LYS  76          1HB       LYS  76 -15.432  10.477   2.451
  614   1HG   LYS  76          2HG       LYS  76 -16.347  12.780   1.902
  615   2HG   LYS  76          1HG       LYS  76 -16.360  12.305   0.199
  616   1HD   LYS  76          2HD       LYS  76 -17.796  10.338   0.821
  617   2HD   LYS  76          1HD       LYS  76 -17.878  10.984   2.474
  618   1HE   LYS  76          2HE       LYS  76 -18.905  13.052   1.658
  619   2HE   LYS  76          1HE       LYS  76 -18.715  12.522  -0.025
  620   1HZ   LYS  76          1HZ       LYS  76 -20.883  12.082   0.711
  621   2HZ   LYS  76          2HZ       LYS  76 -20.113  10.650   0.529
  622   3HZ   LYS  76          3HZ       LYS  76 -20.364  11.260   2.025
  623    H    SER  77           H        SER  77 -13.117  10.678   3.727
  624    HA   SER  77           HA       SER  77 -13.730  12.971   5.429
  625   1HB   SER  77          2HB       SER  77 -13.974  10.438   6.063
  626   2HB   SER  77          1HB       SER  77 -12.244  10.466   6.282
  627    HG   SER  77           HG       SER  77 -13.518  10.887   8.171
  628    H    GLY  78           H        GLY  78 -10.852  11.282   3.888
  629   1HA   GLY  78          2HA       GLY  78  -8.646  11.912   3.666
  630   2HA   GLY  78          1HA       GLY  78  -9.263  13.527   3.468
  631    H    ASN  79           H        ASN  79  -9.578  11.595   6.398
  632    HA   ASN  79           HA       ASN  79  -8.548  13.828   7.909
  633   1HB   ASN  79          2HB       ASN  79  -9.435  12.509   9.835
  634   2HB   ASN  79          1HB       ASN  79 -10.649  12.932   8.577
  635   1HD2  ASN  79          2HD2      ASN  79 -10.963  10.927  10.626
  636   2HD2  ASN  79          1HD2      ASN  79 -11.032   9.397   9.791
  637    H    VAL  80           H        VAL  80  -6.466  13.859   8.535
  638    HA   VAL  80           HA       VAL  80  -4.495  11.940   8.132
  639    HB   VAL  80           HB       VAL  80  -4.439  14.101  10.218
  640   1HG1  VAL  80          1HG1      VAL  80  -2.051  13.847  10.086
  641   2HG1  VAL  80          2HG1      VAL  80  -2.789  12.338  10.676
  642   3HG1  VAL  80          3HG1      VAL  80  -2.222  12.453   8.993
  643   1HG2  VAL  80          1HG2      VAL  80  -3.175  15.265   8.506
  644   2HG2  VAL  80          2HG2      VAL  80  -3.425  13.920   7.367
  645   3HG2  VAL  80          3HG2      VAL  80  -4.811  14.895   7.911
  646    H    LYS  81           H        LYS  81  -6.955  11.977  10.682
  647    HA   LYS  81           HA       LYS  81  -5.972  10.146  12.512
  648   1HB   LYS  81          2HB       LYS  81  -8.635  11.053  11.610
  649   2HB   LYS  81          1HB       LYS  81  -8.507   9.641  12.704
  650   1HG   LYS  81          2HG       LYS  81  -8.830  11.944  13.772
  651   2HG   LYS  81          1HG       LYS  81  -7.512  10.913  14.411
  652   1HD   LYS  81          2HD       LYS  81  -5.854  12.209  13.347
  653   2HD   LYS  81          1HD       LYS  81  -7.074  13.083  12.360
  654   1HE   LYS  81          2HE       LYS  81  -7.841  14.278  14.271
  655   2HE   LYS  81          1HE       LYS  81  -6.784  13.314  15.350
  656   1HZ   LYS  81          1HZ       LYS  81  -5.853  15.482  14.660
  657   2HZ   LYS  81          2HZ       LYS  81  -4.909  14.208  14.295
  658   3HZ   LYS  81          3HZ       LYS  81  -5.773  14.943  13.121
  659    H    ASP  82           H        ASP  82  -6.948   9.523   9.217
  660    HA   ASP  82           HA       ASP  82  -6.947   6.572   9.541
  661   1HB   ASP  82          2HB       ASP  82  -7.572   8.454   7.277
  662   2HB   ASP  82          1HB       ASP  82  -7.433   6.673   7.103
  663    H    LEU  83           H        LEU  83  -4.937   9.271   8.394
  664    HA   LEU  83           HA       LEU  83  -3.007   7.660   6.879
  665   1HB   LEU  83          2HB       LEU  83  -3.116  10.523   7.625
  666   2HB   LEU  83          1HB       LEU  83  -1.704   9.712   6.877
  667    HG   LEU  83           HG       LEU  83  -2.867  10.682   5.064
  668   1HD1  LEU  83          1HD1      LEU  83  -3.622   8.875   3.719
  669   2HD1  LEU  83          2HD1      LEU  83  -2.099   8.529   4.571
  670   3HD1  LEU  83          3HD1      LEU  83  -3.621   7.805   5.142
  671   1HD2  LEU  83          1HD2      LEU  83  -5.298  10.461   4.741
  672   2HD2  LEU  83          2HD2      LEU  83  -5.426   9.541   6.258
  673   3HD2  LEU  83          3HD2      LEU  83  -4.937  11.252   6.293
  674    H    THR  84           H        THR  84  -2.977   9.452  10.016
  675    HA   THR  84           HA       THR  84  -0.491   8.699  11.083
  676    HB   THR  84           HB       THR  84  -1.918  10.329  12.056
  677    HG1  THR  84           1HG      THR  84  -1.630   9.454  14.295
  678   1HG2  THR  84          1HG2      THR  84  -3.739   9.723  13.578
  679   2HG2  THR  84          2HG2      THR  84  -4.138   9.294  11.897
  680   3HG2  THR  84          3HG2      THR  84  -3.636   8.028  13.044
  681    H    GLN  85           H        GLN  85  -3.388   6.700  10.724
  682    HA   GLN  85           HA       GLN  85  -2.200   4.447  12.163
  683   1HB   GLN  85          2HB       GLN  85  -4.887   5.242  11.265
  684   2HB   GLN  85          1HB       GLN  85  -4.520   3.506  11.167
  685   1HG   GLN  85          2HG       GLN  85  -4.050   5.224  13.662
  686   2HG   GLN  85          1HG       GLN  85  -5.450   4.184  13.423
  687   1HE2  GLN  85          2HE2      GLN  85  -2.825   4.265  15.180
  688   2HE2  GLN  85          1HE2      GLN  85  -2.392   2.577  15.145
  689    H    ALA  86           H        ALA  86  -3.383   5.149   8.803
  690    HA   ALA  86           HA       ALA  86  -2.563   2.761   7.525
  691   1HB   ALA  86          1HB       ALA  86  -2.663   4.047   5.502
  692   2HB   ALA  86          2HB       ALA  86  -4.078   4.354   6.536
  693   3HB   ALA  86          3HB       ALA  86  -2.770   5.557   6.439
  694    H    TRP  87           H        TRP  87  -0.671   5.621   8.507
  695    HA   TRP  87           HA       TRP  87   1.740   5.142   7.056
  696   1HB   TRP  87          2HB       TRP  87   1.074   6.679   9.584
  697   2HB   TRP  87          1HB       TRP  87   2.708   6.541   8.977
  698    HD1  TRP  87           HD       TRP  87   0.336   9.025   8.984
  699    HE1  TRP  87           1HE      TRP  87   0.190  10.390   6.849
  700    HE3  TRP  87           3HE      TRP  87   3.098   6.073   5.991
  701    HZ2  TRP  87           2HZ      TRP  87   0.823  10.053   4.203
  702    HZ3  TRP  87           3HZ      TRP  87   3.299   6.604   3.576
  703    HH2  TRP  87           HH       TRP  87   2.448   8.789   2.775
  704    H    ASP  88           H        ASP  88   0.514   4.023  10.213
  705    HA   ASP  88           HA       ASP  88   2.938   2.661  11.004
  706   1HB   ASP  88          2HB       ASP  88   0.623   3.450  12.318
  707   2HB   ASP  88          1HB       ASP  88   0.420   1.714  12.187
  708    H    LEU  89           H        LEU  89  -0.170   1.780   9.312
  709    HA   LEU  89           HA       LEU  89   0.416  -1.077   9.096
  710   1HB   LEU  89          2HB       LEU  89  -1.613   0.614   7.678
  711   2HB   LEU  89          1HB       LEU  89  -1.435  -1.110   7.529
  712    HG   LEU  89           HG       LEU  89  -2.062   0.359  10.126
  713   1HD1  LEU  89          1HD1      LEU  89  -4.226  -0.688   9.818
  714   2HD1  LEU  89          2HD1      LEU  89  -3.846   0.379   8.445
  715   3HD1  LEU  89          3HD1      LEU  89  -3.695  -1.386   8.270
  716   1HD2  LEU  89          1HD2      LEU  89  -2.443  -1.817  11.070
  717   2HD2  LEU  89          2HD2      LEU  89  -1.887  -2.605   9.575
  718   3HD2  LEU  89          3HD2      LEU  89  -0.744  -1.665  10.563
  719    H    TYR  90           H        TYR  90   0.905   1.713   6.987
  720    HA   TYR  90           HA       TYR  90   1.965   0.356   4.651
  721   1HB   TYR  90          2HB       TYR  90   2.226   3.157   5.725
  722   2HB   TYR  90          1HB       TYR  90   2.936   2.603   4.177
  723    HD1  TYR  90           1HD      TYR  90   0.596   4.702   5.053
  724    HD2  TYR  90           2HD      TYR  90   0.759   0.862   3.131
  725    HE1  TYR  90           1HE      TYR  90  -1.427   5.263   3.753
  726    HE2  TYR  90           2HE      TYR  90  -1.140   1.515   1.732
  727    HH   TYR  90           HH       TYR  90  -3.004   2.805   1.671
  728    H    TYR  91           H        TYR  91   3.523   1.894   7.444
  729    HA   TYR  91           HA       TYR  91   6.305   1.190   6.692
  730   1HB   TYR  91          2HB       TYR  91   5.458   3.174   8.081
  731   2HB   TYR  91          1HB       TYR  91   5.238   2.022   9.392
  732    HD1  TYR  91           1HD      TYR  91   7.692   3.511   7.073
  733    HD2  TYR  91           2HD      TYR  91   7.097   1.125  10.593
  734    HE1  TYR  91           1HE      TYR  91  10.047   3.897   7.725
  735    HE2  TYR  91           2HE      TYR  91   9.443   1.498  11.252
  736    HH   TYR  91           HH       TYR  91  11.431   2.243  10.598
  737    H    HIS  92           H        HIS  92   4.017  -0.140   9.173
  738    HA   HIS  92           HA       HIS  92   5.668  -2.206  10.148
  739   1HB   HIS  92          2HB       HIS  92   3.637  -1.460  11.232
  740   2HB   HIS  92          1HB       HIS  92   2.664  -2.031   9.834
  741    HD1  HIS  92           1HD      HIS  92   1.326  -3.874  10.907
  742    HD2  HIS  92           2HD      HIS  92   5.362  -4.043  11.811
  743    HE1  HIS  92           1HE      HIS  92   1.662  -6.038  12.230
  744    H    VAL  93           H        VAL  93   3.482  -2.079   7.294
  745    HA   VAL  93           HA       VAL  93   3.867  -4.873   6.647
  746    HB   VAL  93           HB       VAL  93   1.820  -3.791   6.148
  747   1HG1  VAL  93          1HG1      VAL  93   1.504  -2.745   3.970
  748   2HG1  VAL  93          2HG1      VAL  93   2.474  -1.710   5.046
  749   3HG1  VAL  93          3HG1      VAL  93   3.268  -2.637   3.750
  750   1HG2  VAL  93          1HG2      VAL  93   1.580  -5.145   4.127
  751   2HG2  VAL  93          2HG2      VAL  93   3.351  -5.304   4.048
  752   3HG2  VAL  93          3HG2      VAL  93   2.459  -5.967   5.438
  753    H    PHE  94           H        PHE  94   4.935  -1.701   5.170
  754    HA   PHE  94           HA       PHE  94   6.434  -1.592   3.251
  755   1HB   PHE  94          2HB       PHE  94   7.002  -0.009   4.836
  756   2HB   PHE  94          1HB       PHE  94   7.721  -1.160   5.905
  757    HD1  PHE  94           1HD      PHE  94   8.164  -0.756   2.177
  758    HD2  PHE  94           2HD      PHE  94   9.869  -0.898   6.114
  759    HE1  PHE  94           1HE      PHE  94  10.417  -0.469   1.202
  760    HE2  PHE  94           2HE      PHE  94  12.133  -0.620   5.140
  761    HZ   PHE  94           HZ       PHE  94  12.401  -0.369   2.685
  762    H    ARG  95           H        ARG  95   8.837  -3.084   5.303
  763    HA   ARG  95           HA       ARG  95  10.214  -4.633   3.720
  764   1HB   ARG  95          2HB       ARG  95   9.754  -4.380   6.425
  765   2HB   ARG  95          1HB       ARG  95   9.536  -6.131   6.111
  766   1HG   ARG  95          2HG       ARG  95  11.712  -6.036   4.763
  767   2HG   ARG  95          1HG       ARG  95  11.952  -4.398   5.396
  768   1HD   ARG  95          2HD       ARG  95  12.658  -5.141   7.338
  769   2HD   ARG  95          1HD       ARG  95  11.260  -6.278   7.484
  770    HE   ARG  95           HE       ARG  95  12.852  -7.355   5.506
  771   1HH1  ARG  95          2HH2      ARG  95  13.424  -6.663   8.891
  772   2HH1  ARG  95          1HH2      ARG  95  14.637  -7.891   9.074
  773   1HH2  ARG  95          2HH1      ARG  95  14.458  -8.948   5.763
  774   2HH2  ARG  95          1HH1      ARG  95  15.209  -9.163   7.307
  775    H    ARG  96           H        ARG  96   7.127  -5.896   5.039
  776    HA   ARG  96           HA       ARG  96   6.980  -8.444   3.716
  777   1HB   ARG  96          2HB       ARG  96   4.724  -6.605   4.582
  778   2HB   ARG  96          1HB       ARG  96   4.587  -8.281   4.168
  779   1HG   ARG  96          2HG       ARG  96   6.101  -7.144   6.524
  780   2HG   ARG  96          1HG       ARG  96   4.610  -8.065   6.542
  781   1HD   ARG  96          2HD       ARG  96   6.026  -9.774   6.992
  782   2HD   ARG  96          1HD       ARG  96   6.191  -9.831   5.227
  783    HE   ARG  96           HE       ARG  96   8.352  -9.135   5.445
  784   1HH1  ARG  96          2HH2      ARG  96   6.776  -8.428   8.479
  785   2HH1  ARG  96          1HH2      ARG  96   8.220  -7.826   9.238
  786   1HH2  ARG  96          2HH1      ARG  96  10.247  -8.507   6.508
  787   2HH2  ARG  96          1HH1      ARG  96  10.159  -7.911   8.132
  788    H    ILE  97           H        ILE  97   5.431  -5.345   2.710
  789    HA   ILE  97           HA       ILE  97   4.654  -6.398   0.059
  790    HB   ILE  97           HB       ILE  97   3.897  -4.140  -0.391
  791   1HG1  ILE  97          2HG1      ILE  97   3.519  -2.651   1.640
  792   2HG1  ILE  97          1HG1      ILE  97   4.958  -3.392   2.274
  793   1HG2  ILE  97          1HG2      ILE  97   1.969  -4.276   1.086
  794   2HG2  ILE  97          2HG2      ILE  97   2.397  -5.891   0.473
  795   3HG2  ILE  97          3HG2      ILE  97   2.828  -5.428   2.137
  796   1HD1  ILE  97          1HD1      ILE  97   5.470  -1.372   1.088
  797   2HD1  ILE  97          2HD1      ILE  97   6.196  -2.764   0.251
  798   3HD1  ILE  97          3HD1      ILE  97   4.723  -2.006  -0.397
  799    H    SER  98           H        SER  98   7.504  -5.143   1.504
  800    HA   SER  98           HA       SER  98   8.686  -3.805  -0.693
  801   1HB   SER  98          2HB       SER  98  10.127  -3.127   0.670
  802   2HB   SER  98          1HB       SER  98   9.122  -3.911   1.941
  803    HG   SER  98           HG       SER  98  11.565  -4.248   1.866
  804    H    LYS  99           H        LYS  99  10.068  -6.658   0.862
  805    HA   LYS  99           HA       LYS  99  10.030  -8.442  -1.482
  806   1HB   LYS  99          2HB       LYS  99  12.464  -8.402  -1.834
  807   2HB   LYS  99          1HB       LYS  99  11.806  -6.832  -2.141
  808   1HG   LYS  99          2HG       LYS  99  12.587  -6.032   0.053
  809   2HG   LYS  99          1HG       LYS  99  13.191  -7.632   0.437
  810   1HD   LYS  99          2HD       LYS  99  14.376  -7.204  -2.006
  811   2HD   LYS  99          1HD       LYS  99  14.323  -5.570  -1.335
  812   1HE   LYS  99          2HE       LYS  99  16.286  -6.270  -0.349
  813   2HE   LYS  99          1HE       LYS  99  15.179  -6.903   0.871
  814   1HZ   LYS  99          1HZ       LYS  99  16.693  -8.545   0.193
  815   2HZ   LYS  99          2HZ       LYS  99  15.208  -8.988  -0.329
  816   3HZ   LYS  99          3HZ       LYS  99  16.294  -8.368  -1.379
  817    H    GLN 100           H        GLN 100   8.927  -8.838   1.117
  818    HA   GLN 100           HA       GLN 100  10.295 -10.034   3.035
  819   1HB   GLN 100          2HB       GLN 100   7.950  -9.775   3.030
  820   2HB   GLN 100          1HB       GLN 100   7.774 -11.110   1.848
  821   1HG   GLN 100          2HG       GLN 100   7.274 -11.715   4.230
  822   2HG   GLN 100          1HG       GLN 100   8.531 -12.718   3.436
  823   1HE2  GLN 100          2HE2      GLN 100   9.208 -13.365   5.612
  824   2HE2  GLN 100          1HE2      GLN 100  10.119 -12.219   6.562
  Start of MODEL   16
    1   1H    GLU   1          1H        GLU   1  11.475 -16.702  -8.739
    2   2H    GLU   1          2H        GLU   1  10.631 -16.348 -10.150
    3    HA   GLU   1           HA       GLU   1   9.962 -14.972  -8.254
    4   1HB   GLU   1          2HB       GLU   1  11.552 -13.426  -7.231
    5   2HB   GLU   1          1HB       GLU   1  12.278 -14.995  -7.207
    6   1HG   GLU   1          2HG       GLU   1  13.491 -14.291  -9.391
    7   2HG   GLU   1          1HG       GLU   1  12.975 -12.667  -8.990
    8    H    LEU   2           H        LEU   2  10.049 -15.087 -11.270
    9    HA   LEU   2           HA       LEU   2   8.932 -12.534 -11.927
   10   1HB   LEU   2          2HB       LEU   2  10.427 -11.610 -13.343
   11   2HB   LEU   2          1HB       LEU   2  11.429 -12.094 -11.917
   12    HG   LEU   2           HG       LEU   2  11.432 -13.603 -14.551
   13   1HD1  LEU   2          1HD1      LEU   2  13.488 -12.364 -14.982
   14   2HD1  LEU   2          2HD1      LEU   2  12.101 -11.255 -14.859
   15   3HD1  LEU   2          3HD1      LEU   2  13.243 -11.407 -13.502
   16   1HD2  LEU   2          1HD2      LEU   2  13.502 -14.502 -13.721
   17   2HD2  LEU   2          2HD2      LEU   2  13.331 -13.591 -12.203
   18   3HD2  LEU   2          3HD2      LEU   2  12.178 -14.889 -12.597
   19    H    ILE   3           H        ILE   3   7.373 -13.079 -13.243
   20    HA   ILE   3           HA       ILE   3   7.603 -15.464 -14.937
   21    HB   ILE   3           HB       ILE   3   5.198 -13.889 -13.957
   22   1HG1  ILE   3          2HG1      ILE   3   4.618 -16.109 -13.103
   23   2HG1  ILE   3          1HG1      ILE   3   6.273 -16.651 -13.528
   24   1HG2  ILE   3          1HG2      ILE   3   3.796 -15.438 -15.112
   25   2HG2  ILE   3          2HG2      ILE   3   4.754 -14.505 -16.287
   26   3HG2  ILE   3          3HG2      ILE   3   5.201 -16.185 -15.909
   27   1HD1  ILE   3          1HD1      ILE   3   6.092 -16.099 -11.147
   28   2HD1  ILE   3          2HD1      ILE   3   7.207 -14.989 -11.979
   29   3HD1  ILE   3          3HD1      ILE   3   5.562 -14.451 -11.559
   30    H    ARG   4           H        ARG   4   6.359 -12.116 -15.242
   31    HA   ARG   4           HA       ARG   4   6.990 -12.011 -18.142
   32   1HB   ARG   4          2HB       ARG   4   5.109 -10.546 -16.277
   33   2HB   ARG   4          1HB       ARG   4   5.574  -9.835 -17.805
   34   1HG   ARG   4          2HG       ARG   4   4.564 -12.673 -17.730
   35   2HG   ARG   4          1HG       ARG   4   3.446 -11.303 -17.679
   36   1HD   ARG   4          2HD       ARG   4   3.682 -11.015 -19.944
   37   2HD   ARG   4          1HD       ARG   4   5.410 -10.818 -19.779
   38    HE   ARG   4           HE       ARG   4   5.688 -12.865 -20.587
   39   1HH1  ARG   4          2HH2      ARG   4   2.369 -12.835 -19.406
   40   2HH1  ARG   4          1HH2      ARG   4   2.021 -14.422 -20.018
   41   1HH2  ARG   4          1HH1      ARG   4   5.170 -14.918 -21.385
   42   2HH2  ARG   4          2HH1      ARG   4   3.588 -15.567 -21.123
   43    H    VAL   5           H        VAL   5   7.407 -10.055 -15.180
   44    HA   VAL   5           HA       VAL   5  10.100  -9.125 -15.933
   45    HB   VAL   5           HB       VAL   5   8.617  -7.815 -17.358
   46   1HG1  VAL   5          1HG1      VAL   5   7.256  -6.004 -16.410
   47   2HG1  VAL   5          2HG1      VAL   5   6.609  -7.598 -15.955
   48   3HG1  VAL   5          3HG1      VAL   5   7.532  -6.642 -14.771
   49   1HG2  VAL   5          1HG2      VAL   5   9.595  -5.685 -16.911
   50   2HG2  VAL   5          2HG2      VAL   5  10.211  -6.304 -15.359
   51   3HG2  VAL   5          3HG2      VAL   5  10.747  -7.041 -16.887
   52    H    ALA   6           H        ALA   6   8.944 -10.652 -13.645
   53    HA   ALA   6           HA       ALA   6   8.542 -10.619 -11.349
   54   1HB   ALA   6          1HB       ALA   6  10.185  -9.433 -10.061
   55   2HB   ALA   6          2HB       ALA   6  10.937 -10.296 -11.425
   56   3HB   ALA   6          3HB       ALA   6  10.707  -8.533 -11.504
   57    H    ILE   7           H        ILE   7   7.077  -8.405 -13.127
   58    HA   ILE   7           HA       ILE   7   6.387  -6.185 -11.867
   59    HB   ILE   7           HB       ILE   7   5.241  -6.449 -13.826
   60   1HG1  ILE   7          2HG1      ILE   7   3.058  -5.973 -13.413
   61   2HG1  ILE   7          1HG1      ILE   7   3.146  -6.648 -11.752
   62   1HG2  ILE   7          1HG2      ILE   7   3.614  -8.135 -14.297
   63   2HG2  ILE   7          2HG2      ILE   7   5.185  -8.897 -13.962
   64   3HG2  ILE   7          3HG2      ILE   7   3.904  -8.919 -12.727
   65   1HD1  ILE   7          1HD1      ILE   7   3.140  -4.201 -11.726
   66   2HD1  ILE   7          2HD1      ILE   7   4.680  -4.845 -11.108
   67   3HD1  ILE   7          3HD1      ILE   7   4.592  -4.175 -12.755
   68    H    LEU   8           H        LEU   8   4.542  -9.173 -11.086
   69    HA   LEU   8           HA       LEU   8   3.272  -9.739  -9.248
   70   1HB   LEU   8          2HB       LEU   8   6.029  -9.296  -8.639
   71   2HB   LEU   8          1HB       LEU   8   5.024  -8.851  -7.217
   72    HG   LEU   8           HG       LEU   8   5.748 -11.211  -7.046
   73   1HD1  LEU   8          1HD1      LEU   8   3.590 -12.162  -6.687
   74   2HD1  LEU   8          2HD1      LEU   8   3.684 -10.491  -6.081
   75   3HD1  LEU   8          3HD1      LEU   8   2.830 -10.839  -7.604
   76   1HD2  LEU   8          1HD2      LEU   8   5.019 -12.885  -8.607
   77   2HD2  LEU   8          2HD2      LEU   8   4.299 -11.644  -9.660
   78   3HD2  LEU   8          3HD2      LEU   8   6.063 -11.701  -9.431
   79    H    TRP   9           H        TRP   9   3.170  -8.584  -6.680
   80    HA   TRP   9           HA       TRP   9   2.050  -5.805  -7.071
   81   1HB   TRP   9          2HB       TRP   9   0.816  -8.024  -5.582
   82   2HB   TRP   9          1HB       TRP   9   0.525  -6.287  -5.243
   83    HD1  TRP   9           HD       TRP   9   0.761  -6.007  -8.759
   84    HE1  TRP   9           1HE      TRP   9  -1.490  -6.121  -9.870
   85    HE3  TRP   9           3HE      TRP   9  -1.741  -8.351  -5.052
   86    HZ2  TRP   9           2HZ      TRP   9  -4.069  -7.084  -9.238
   87    HZ3  TRP   9           3HZ      TRP   9  -4.211  -8.508  -5.187
   88    HH2  TRP   9           HH       TRP   9  -5.368  -7.855  -7.282
   89    H    HIS  10           H        HIS  10   3.626  -8.101  -4.803
   90    HA   HIS  10           HA       HIS  10   4.218  -6.365  -2.670
   91   1HB   HIS  10          2HB       HIS  10   4.646  -8.461  -2.136
   92   2HB   HIS  10          1HB       HIS  10   5.071  -8.918  -3.826
   93    HD1  HIS  10           1HD      HIS  10   6.701  -8.714  -0.583
   94    HD2  HIS  10           2HD      HIS  10   7.647  -8.131  -4.556
   95    HE1  HIS  10           1HE      HIS  10   9.243  -8.469  -0.670
   96    H    GLU  11           H        GLU  11   5.795  -6.774  -5.841
   97    HA   GLU  11           HA       GLU  11   8.203  -5.364  -5.390
   98   1HB   GLU  11          2HB       GLU  11   6.627  -5.711  -7.986
   99   2HB   GLU  11          1HB       GLU  11   8.341  -5.366  -7.842
  100   1HG   GLU  11          2HG       GLU  11   7.425  -7.752  -6.372
  101   2HG   GLU  11          1HG       GLU  11   7.292  -7.817  -8.159
  102    H    MET  12           H        MET  12   5.081  -4.285  -6.879
  103    HA   MET  12           HA       MET  12   5.815  -1.533  -7.148
  104   1HB   MET  12          2HB       MET  12   3.623  -1.204  -7.913
  105   2HB   MET  12          1HB       MET  12   3.915  -2.847  -8.375
  106   1HG   MET  12          2HG       MET  12   2.895  -3.321  -5.978
  107   2HG   MET  12          1HG       MET  12   2.137  -1.730  -6.336
  108   1HE   MET  12          1HE       MET  12  -0.030  -2.464  -9.436
  109   2HE   MET  12          2HE       MET  12   0.381  -1.310  -8.145
  110   3HE   MET  12          3HE       MET  12   1.599  -1.753  -9.366
  111    H    TRP  13           H        TRP  13   4.581  -3.514  -4.404
  112    HA   TRP  13           HA       TRP  13   3.646  -1.449  -2.662
  113   1HB   TRP  13          2HB       TRP  13   4.556  -4.234  -2.404
  114   2HB   TRP  13          1HB       TRP  13   4.474  -3.179  -0.956
  115    HD1  TRP  13           HD       TRP  13   1.763  -2.634  -3.597
  116    HE1  TRP  13           1HE      TRP  13  -0.445  -3.311  -2.558
  117    HE3  TRP  13           3HE      TRP  13   3.548  -5.008   0.443
  118    HZ2  TRP  13           2HZ      TRP  13  -1.308  -4.742  -0.238
  119    HZ3  TRP  13           3HZ      TRP  13   2.016  -5.554   2.323
  120    HH2  TRP  13           HH       TRP  13  -0.431  -5.381   1.963
  121    H    HIS  14           H        HIS  14   6.986  -2.717  -3.161
  122    HA   HIS  14           HA       HIS  14   8.387  -1.396  -1.178
  123   1HB   HIS  14          2HB       HIS  14   8.955  -2.631  -3.740
  124   2HB   HIS  14          1HB       HIS  14   9.879  -1.171  -3.608
  125    HD1  HIS  14           1HD      HIS  14  11.242  -3.882  -3.501
  126    HD2  HIS  14           2HD      HIS  14  10.065  -1.628  -0.231
  127    HE1  HIS  14           1HE      HIS  14  12.996  -4.296  -1.688
  128    H    GLU  15           H        GLU  15   8.268  -0.002  -4.452
  129    HA   GLU  15           HA       GLU  15   8.687   2.754  -3.599
  130   1HB   GLU  15          2HB       GLU  15   8.403   3.285  -5.945
  131   2HB   GLU  15          1HB       GLU  15   9.580   2.016  -5.713
  132   1HG   GLU  15          2HG       GLU  15   8.175   0.362  -6.588
  133   2HG   GLU  15          1HG       GLU  15   6.709   1.308  -6.310
  134    H    GLY  16           H        GLY  16   5.639   0.918  -4.613
  135   1HA   GLY  16          2HA       GLY  16   3.925   3.113  -4.736
  136   2HA   GLY  16          1HA       GLY  16   3.480   1.484  -4.287
  137    H    LEU  17           H        LEU  17   5.141   1.340  -1.824
  138    HA   LEU  17           HA       LEU  17   3.655   3.129  -0.004
  139   1HB   LEU  17          2HB       LEU  17   5.464   0.872   0.510
  140   2HB   LEU  17          1HB       LEU  17   5.056   2.066   1.723
  141    HG   LEU  17           HG       LEU  17   3.100   0.296   0.195
  142   1HD1  LEU  17          1HD1      LEU  17   2.651  -0.495   2.456
  143   2HD1  LEU  17          2HD1      LEU  17   4.373  -0.700   2.058
  144   3HD1  LEU  17          3HD1      LEU  17   3.856   0.636   3.113
  145   1HD2  LEU  17          1HD2      LEU  17   1.338   1.329   1.463
  146   2HD2  LEU  17          2HD2      LEU  17   2.476   2.506   2.158
  147   3HD2  LEU  17          3HD2      LEU  17   2.120   2.535   0.414
  148    H    GLU  18           H        GLU  18   6.988   2.973  -1.355
  149    HA   GLU  18           HA       GLU  18   7.992   5.018   0.345
  150   1HB   GLU  18          2HB       GLU  18   9.286   3.268  -0.854
  151   2HB   GLU  18          1HB       GLU  18   9.119   4.270  -2.315
  152   1HG   GLU  18          2HG       GLU  18  10.419   6.003  -1.440
  153   2HG   GLU  18          1HG       GLU  18  10.018   5.599   0.240
  154    H    GLU  19           H        GLU  19   7.033   5.233  -3.162
  155    HA   GLU  19           HA       GLU  19   7.276   8.050  -3.532
  156   1HB   GLU  19          2HB       GLU  19   7.158   6.385  -5.313
  157   2HB   GLU  19          1HB       GLU  19   5.460   6.039  -4.853
  158   1HG   GLU  19          2HG       GLU  19   5.456   7.563  -6.801
  159   2HG   GLU  19          1HG       GLU  19   4.902   8.465  -5.425
  160    H    ALA  20           H        ALA  20   4.727   6.067  -1.963
  161    HA   ALA  20           HA       ALA  20   2.821   8.327  -1.804
  162   1HB   ALA  20          1HB       ALA  20   1.554   6.763  -0.461
  163   2HB   ALA  20          2HB       ALA  20   2.070   5.972  -1.970
  164   3HB   ALA  20          3HB       ALA  20   2.921   5.623  -0.446
  165    H    SER  21           H        SER  21   4.632   6.326   0.556
  166    HA   SER  21           HA       SER  21   4.088   7.811   2.845
  167   1HB   SER  21          2HB       SER  21   5.906   6.752   3.927
  168   2HB   SER  21          1HB       SER  21   5.171   5.563   2.867
  169    HG   SER  21           HG       SER  21   6.964   6.576   1.304
  170    H    ARG  22           H        ARG  22   6.505   8.387   0.237
  171    HA   ARG  22           HA       ARG  22   7.981  10.498   1.503
  172   1HB   ARG  22          2HB       ARG  22   8.728   9.057  -0.373
  173   2HB   ARG  22          1HB       ARG  22   7.598   9.928  -1.422
  174   1HG   ARG  22          2HG       ARG  22   8.743  11.981  -1.148
  175   2HG   ARG  22          1HG       ARG  22   9.597  11.420   0.299
  176   1HD   ARG  22          2HD       ARG  22  10.112   9.671  -1.939
  177   2HD   ARG  22          1HD       ARG  22  10.501  11.378  -2.340
  178    HE   ARG  22           HE       ARG  22  11.403  10.534   0.295
  179   1HH1  ARG  22          2HH2      ARG  22  12.334  10.729  -3.064
  180   2HH1  ARG  22          1HH2      ARG  22  14.039  10.700  -2.748
  181   1HH2  ARG  22          1HH1      ARG  22  13.668  10.517   0.711
  182   2HH2  ARG  22          2HH1      ARG  22  14.767  10.582  -0.622
  183    H    LEU  23           H        LEU  23   5.119  10.525  -0.725
  184    HA   LEU  23           HA       LEU  23   4.826  13.295  -0.916
  185   1HB   LEU  23          2HB       LEU  23   3.223  10.941  -1.450
  186   2HB   LEU  23          1HB       LEU  23   2.317  12.457  -1.125
  187    HG   LEU  23           HG       LEU  23   2.667  12.144  -3.503
  188   1HD1  LEU  23          1HD1      LEU  23   3.663  14.293  -4.055
  189   2HD1  LEU  23          2HD1      LEU  23   2.525  14.392  -2.689
  190   3HD1  LEU  23          3HD1      LEU  23   4.278  14.432  -2.390
  191   1HD2  LEU  23          1HD2      LEU  23   4.881  12.300  -4.542
  192   2HD2  LEU  23          2HD2      LEU  23   5.647  12.263  -2.936
  193   3HD2  LEU  23          3HD2      LEU  23   4.750  10.845  -3.526
  194    H    TYR  24           H        TYR  24   4.380  11.287   1.793
  195    HA   TYR  24           HA       TYR  24   3.041  13.527   3.279
  196   1HB   TYR  24          2HB       TYR  24   1.750  11.406   3.342
  197   2HB   TYR  24          1HB       TYR  24   3.159  10.475   3.708
  198    HD1  TYR  24           1HD      TYR  24   0.748  12.890   5.007
  199    HD2  TYR  24           2HD      TYR  24   3.960  10.191   5.879
  200    HE1  TYR  24           1HE      TYR  24   0.087  12.886   7.396
  201    HE2  TYR  24           2HE      TYR  24   3.329  10.194   8.254
  202    HH   TYR  24           HH       TYR  24   2.098  11.180   9.824
  203    H    PHE  25           H        PHE  25   5.771  11.225   3.419
  204    HA   PHE  25           HA       PHE  25   6.850  11.459   5.857
  205   1HB   PHE  25          2HB       PHE  25   7.654  10.020   4.044
  206   2HB   PHE  25          1HB       PHE  25   8.224  11.455   3.134
  207    HD1  PHE  25           1HD      PHE  25  10.106  12.833   4.098
  208    HD2  PHE  25           2HD      PHE  25   9.061   8.935   5.582
  209    HE1  PHE  25           1HE      PHE  25  12.239  12.742   5.326
  210    HE2  PHE  25           2HE      PHE  25  11.243   8.814   6.760
  211    HZ   PHE  25           HZ       PHE  25  12.840  10.706   6.614
  212    H    GLY  26           H        GLY  26   7.699  13.561   3.058
  213   1HA   GLY  26          2HA       GLY  26   7.971  15.942   4.823
  214   2HA   GLY  26          1HA       GLY  26   9.365  15.465   3.889
  215    H    GLU  27           H        GLU  27   6.137  14.894   2.532
  216    HA   GLU  27           HA       GLU  27   6.527  17.257   0.710
  217   1HB   GLU  27          2HB       GLU  27   5.792  14.522   0.153
  218   2HB   GLU  27          1HB       GLU  27   4.603  15.656  -0.417
  219   1HG   GLU  27          2HG       GLU  27   5.878  16.106  -2.118
  220   2HG   GLU  27          1HG       GLU  27   7.114  16.787  -1.013
  221    H    ARG  28           H        ARG  28   4.490  16.042   3.304
  222    HA   ARG  28           HA       ARG  28   2.372  16.604   4.077
  223   1HB   ARG  28          2HB       ARG  28   3.596  19.265   3.401
  224   2HB   ARG  28          1HB       ARG  28   2.112  19.051   4.321
  225   1HG   ARG  28          2HG       ARG  28   3.249  18.034   6.147
  226   2HG   ARG  28          1HG       ARG  28   4.621  17.565   5.178
  227   1HD   ARG  28          2HD       ARG  28   5.534  19.298   6.244
  228   2HD   ARG  28          1HD       ARG  28   4.831  20.202   4.865
  229    HE   ARG  28           HE       ARG  28   4.133  20.356   7.644
  230   1HH1  ARG  28          2HH2      ARG  28   2.885  21.062   4.431
  231   2HH1  ARG  28          1HH2      ARG  28   1.777  22.265   5.005
  232   1HH2  ARG  28          1HH1      ARG  28   2.667  21.931   8.341
  233   2HH2  ARG  28          2HH1      ARG  28   1.657  22.726   7.185
  234    H    ASN  29           H        ASN  29   2.525  15.839   1.225
  235    HA   ASN  29           HA       ASN  29   0.076  17.151   0.266
  236   1HB   ASN  29          2HB       ASN  29   2.300  17.707  -0.927
  237   2HB   ASN  29          1HB       ASN  29   2.327  16.029  -1.467
  238   1HD2  ASN  29          2HD2      ASN  29   1.982  18.680  -2.853
  239   2HD2  ASN  29          1HD2      ASN  29   0.529  18.474  -3.794
  240    H    VAL  30           H        VAL  30  -0.616  15.338   1.783
  241    HA   VAL  30           HA       VAL  30  -0.740  12.631   1.180
  242    HB   VAL  30           HB       VAL  30  -3.004  14.319   2.294
  243   1HG1  VAL  30          1HG1      VAL  30  -3.690  12.270   3.355
  244   2HG1  VAL  30          2HG1      VAL  30  -3.718  12.078   1.585
  245   3HG1  VAL  30          3HG1      VAL  30  -2.391  11.369   2.537
  246   1HG2  VAL  30          1HG2      VAL  30  -2.132  13.701   4.445
  247   2HG2  VAL  30          2HG2      VAL  30  -0.738  12.896   3.686
  248   3HG2  VAL  30          3HG2      VAL  30  -0.935  14.659   3.541
  249    H    LYS  31           H        LYS  31  -2.030  15.315  -0.710
  250    HA   LYS  31           HA       LYS  31  -3.975  13.911  -2.334
  251   1HB   LYS  31          2HB       LYS  31  -4.189  16.172  -2.196
  252   2HB   LYS  31          1HB       LYS  31  -2.437  16.456  -2.486
  253   1HG   LYS  31          2HG       LYS  31  -4.001  17.100  -4.405
  254   2HG   LYS  31          1HG       LYS  31  -2.692  16.020  -4.841
  255   1HD   LYS  31          2HD       LYS  31  -4.181  14.433  -5.545
  256   2HD   LYS  31          1HD       LYS  31  -5.037  14.450  -4.040
  257   1HE   LYS  31          2HE       LYS  31  -6.226  16.465  -4.767
  258   2HE   LYS  31          1HE       LYS  31  -5.413  16.277  -6.365
  259   1HZ   LYS  31          1HZ       LYS  31  -7.532  15.100  -6.286
  260   2HZ   LYS  31          2HZ       LYS  31  -6.286  14.050  -6.448
  261   3HZ   LYS  31          3HZ       LYS  31  -7.022  14.223  -5.004
  262    H    GLY  32           H        GLY  32  -0.389  14.532  -2.633
  263   1HA   GLY  32          2HA       GLY  32  -0.023  13.345  -5.195
  264   2HA   GLY  32          1HA       GLY  32   1.201  13.530  -3.967
  265    H    MET  33           H        MET  33   0.580  11.873  -1.933
  266    HA   MET  33           HA       MET  33   1.150   9.238  -2.784
  267   1HB   MET  33          2HB       MET  33   0.604   8.488  -0.631
  268   2HB   MET  33          1HB       MET  33   1.500  10.035  -0.510
  269   1HG   MET  33          2HG       MET  33  -0.340  11.193   0.236
  270   2HG   MET  33          1HG       MET  33  -1.494   9.996  -0.437
  271   1HE   MET  33          1HE       MET  33  -2.526   8.106   2.545
  272   2HE   MET  33          2HE       MET  33  -3.042   9.400   1.438
  273   3HE   MET  33          3HE       MET  33  -2.326   7.907   0.789
  274    H    PHE  34           H        PHE  34  -1.934  10.926  -2.513
  275    HA   PHE  34           HA       PHE  34  -3.717   8.715  -2.486
  276   1HB   PHE  34          2HB       PHE  34  -3.963  11.422  -2.155
  277   2HB   PHE  34          1HB       PHE  34  -4.427  11.311  -3.833
  278    HD1  PHE  34           1HD      PHE  34  -6.208   9.388  -4.397
  279    HD2  PHE  34           2HD      PHE  34  -5.439  11.113  -0.528
  280    HE1  PHE  34           1HE      PHE  34  -8.446   8.654  -3.617
  281    HE2  PHE  34           2HE      PHE  34  -7.720  10.466   0.197
  282    HZ   PHE  34           HZ       PHE  34  -9.090   9.103  -1.307
  283    H    GLU  35           H        GLU  35  -1.704  10.137  -5.062
  284    HA   GLU  35           HA       GLU  35  -3.325   8.992  -7.264
  285   1HB   GLU  35          2HB       GLU  35  -2.140  11.305  -7.301
  286   2HB   GLU  35          1HB       GLU  35  -0.646  10.413  -7.428
  287   1HG   GLU  35          2HG       GLU  35  -0.988  10.374  -9.631
  288   2HG   GLU  35          1HG       GLU  35  -2.299   9.224  -9.359
  289    H    VAL  36           H        VAL  36  -0.411   8.227  -5.336
  290    HA   VAL  36           HA       VAL  36   0.389   6.090  -7.245
  291    HB   VAL  36           HB       VAL  36   1.960   7.765  -6.318
  292   1HG1  VAL  36          1HG1      VAL  36   3.071   7.140  -4.231
  293   2HG1  VAL  36          2HG1      VAL  36   1.391   7.647  -3.938
  294   3HG1  VAL  36          3HG1      VAL  36   1.814   5.919  -3.918
  295   1HG2  VAL  36          1HG2      VAL  36   3.739   6.137  -6.320
  296   2HG2  VAL  36          2HG2      VAL  36   2.532   4.830  -6.261
  297   3HG2  VAL  36          3HG2      VAL  36   2.583   5.930  -7.659
  298    H    LEU  37           H        LEU  37  -0.952   6.522  -3.928
  299    HA   LEU  37           HA       LEU  37  -1.313   3.669  -3.433
  300   1HB   LEU  37          2HB       LEU  37  -1.324   5.998  -1.912
  301   2HB   LEU  37          1HB       LEU  37  -2.922   5.183  -1.775
  302    HG   LEU  37           HG       LEU  37  -1.579   4.292   0.034
  303   1HD1  LEU  37          1HD1      LEU  37  -1.171   2.016  -0.378
  304   2HD1  LEU  37          2HD1      LEU  37  -2.728   2.490  -1.097
  305   3HD1  LEU  37          3HD1      LEU  37  -1.303   2.254  -2.136
  306   1HD2  LEU  37          1HD2      LEU  37   0.582   3.353  -0.226
  307   2HD2  LEU  37          2HD2      LEU  37   0.606   3.776  -1.953
  308   3HD2  LEU  37          3HD2      LEU  37   0.599   5.061  -0.723
  309    H    GLU  38           H        GLU  38  -3.299   6.251  -5.019
  310    HA   GLU  38           HA       GLU  38  -5.858   5.144  -4.983
  311   1HB   GLU  38          2HB       GLU  38  -4.474   6.995  -6.735
  312   2HB   GLU  38          1HB       GLU  38  -5.511   5.927  -7.638
  313   1HG   GLU  38          2HG       GLU  38  -6.747   6.982  -5.166
  314   2HG   GLU  38          1HG       GLU  38  -6.335   8.185  -6.382
  315    HA   PRO  39           HA       PRO  39  -4.864   1.942  -8.392
  316   1HB   PRO  39          2HB       PRO  39  -2.394   1.417  -9.246
  317   2HB   PRO  39          1HB       PRO  39  -3.359   2.709  -9.956
  318   1HG   PRO  39          2HG       PRO  39  -1.165   2.926  -7.844
  319   2HG   PRO  39          1HG       PRO  39  -1.404   3.928  -9.273
  320   1HD   PRO  39          1HD       PRO  39  -2.357   4.681  -6.752
  321   2HD   PRO  39          2HD       PRO  39  -3.229   5.142  -8.271
  322    H    LEU  40           H        LEU  40  -2.553   2.285  -5.621
  323    HA   LEU  40           HA       LEU  40  -2.160  -0.565  -5.362
  324   1HB   LEU  40          2HB       LEU  40  -1.669   1.719  -3.467
  325   2HB   LEU  40          1HB       LEU  40  -1.136   0.021  -3.253
  326    HG   LEU  40           HG       LEU  40  -0.284   1.650  -5.667
  327   1HD1  LEU  40          1HD1      LEU  40   1.747   2.167  -4.338
  328   2HD1  LEU  40          2HD1      LEU  40   0.307   2.851  -3.545
  329   3HD1  LEU  40          3HD1      LEU  40   1.037   1.351  -2.924
  330   1HD2  LEU  40          1HD2      LEU  40   1.580   0.093  -5.654
  331   2HD2  LEU  40          2HD2      LEU  40   0.932  -0.707  -4.202
  332   3HD2  LEU  40          3HD2      LEU  40   0.036  -0.788  -5.738
  333    H    HIS  41           H        HIS  41  -4.726   1.630  -4.463
  334    HA   HIS  41           HA       HIS  41  -5.993  -0.080  -2.496
  335   1HB   HIS  41          2HB       HIS  41  -7.043   2.261  -4.098
  336   2HB   HIS  41          1HB       HIS  41  -7.846   1.483  -2.745
  337    HD1  HIS  41           1HD      HIS  41  -4.961   1.228  -1.102
  338    HD2  HIS  41           2HD      HIS  41  -6.829   4.544  -2.810
  339    HE1  HIS  41           1HE      HIS  41  -3.939   3.315  -0.008
  340    H    ALA  42           H        ALA  42  -6.150   0.244  -6.017
  341    HA   ALA  42           HA       ALA  42  -8.485  -1.591  -6.247
  342   1HB   ALA  42          1HB       ALA  42  -8.404  -0.996  -8.586
  343   2HB   ALA  42          2HB       ALA  42  -8.501   0.451  -7.554
  344   3HB   ALA  42          3HB       ALA  42  -6.952  -0.005  -8.303
  345    H    MET  43           H        MET  43  -5.016  -1.365  -7.198
  346    HA   MET  43           HA       MET  43  -4.646  -3.996  -8.279
  347   1HB   MET  43          2HB       MET  43  -2.813  -1.901  -7.107
  348   2HB   MET  43          1HB       MET  43  -2.241  -3.470  -7.624
  349   1HG   MET  43          2HG       MET  43  -3.781  -1.561  -9.425
  350   2HG   MET  43          1HG       MET  43  -2.037  -1.709  -9.376
  351   1HE   MET  43          1HE       MET  43  -3.047  -3.350 -12.756
  352   2HE   MET  43          2HE       MET  43  -3.859  -1.997 -11.933
  353   3HE   MET  43          3HE       MET  43  -2.082  -2.094 -11.943
  354    H    MET  44           H        MET  44  -5.180  -3.002  -4.935
  355    HA   MET  44           HA       MET  44  -4.352  -5.718  -4.113
  356   1HB   MET  44          2HB       MET  44  -4.132  -3.034  -2.920
  357   2HB   MET  44          1HB       MET  44  -4.769  -4.233  -1.803
  358   1HG   MET  44          2HG       MET  44  -2.297  -3.971  -1.839
  359   2HG   MET  44          1HG       MET  44  -2.909  -5.648  -2.089
  360   1HE   MET  44          1HE       MET  44  -0.890  -3.111  -5.396
  361   2HE   MET  44          2HE       MET  44  -2.509  -2.732  -4.762
  362   3HE   MET  44          3HE       MET  44  -1.079  -2.559  -3.715
  363    H    GLU  45           H        GLU  45  -7.109  -4.273  -5.104
  364    HA   GLU  45           HA       GLU  45  -8.887  -5.645  -3.111
  365   1HB   GLU  45          2HB       GLU  45  -8.963  -3.078  -3.299
  366   2HB   GLU  45          1HB       GLU  45  -9.706  -3.354  -4.877
  367   1HG   GLU  45          2HG       GLU  45 -11.448  -4.818  -3.732
  368   2HG   GLU  45          1HG       GLU  45 -10.750  -4.387  -2.190
  369    H    ARG  46           H        ARG  46  -8.278  -4.987  -6.619
  370    HA   ARG  46           HA       ARG  46 -10.402  -6.255  -7.824
  371   1HB   ARG  46          2HB       ARG  46  -8.240  -5.033  -8.671
  372   2HB   ARG  46          1HB       ARG  46  -7.588  -6.700  -8.765
  373   1HG   ARG  46          2HG       ARG  46 -10.165  -5.849 -10.093
  374   2HG   ARG  46          1HG       ARG  46  -8.564  -5.753 -10.893
  375   1HD   ARG  46          2HD       ARG  46  -8.316  -8.216 -10.591
  376   2HD   ARG  46          1HD       ARG  46  -9.943  -8.278  -9.896
  377    HE   ARG  46           HE       ARG  46 -10.838  -8.052 -11.972
  378   1HH1  ARG  46          2HH2      ARG  46  -7.443  -7.223 -12.238
  379   2HH1  ARG  46          1HH2      ARG  46  -7.463  -7.106 -13.969
  380   1HH2  ARG  46          1HH1      ARG  46 -10.839  -7.887 -14.256
  381   2HH2  ARG  46          2HH1      ARG  46  -9.373  -7.484 -15.084
  382    H    GLY  47           H        GLY  47  -7.550  -7.752  -6.226
  383   1HA   GLY  47          2HA       GLY  47  -7.960  -9.821  -5.024
  384   2HA   GLY  47          1HA       GLY  47  -8.928 -10.391  -6.379
  385    HA   PRO  48           HA       PRO  48  -4.271 -11.402  -6.871
  386   1HB   PRO  48          2HB       PRO  48  -4.167 -13.880  -5.966
  387   2HB   PRO  48          1HB       PRO  48  -3.827 -12.400  -4.948
  388   1HG   PRO  48          2HG       PRO  48  -6.374 -14.138  -5.038
  389   2HG   PRO  48          1HG       PRO  48  -5.577 -13.493  -3.603
  390   1HD   PRO  48          1HD       PRO  48  -7.718 -12.161  -4.870
  391   2HD   PRO  48          2HD       PRO  48  -6.392 -11.238  -4.022
  392    H    GLN  49           H        GLN  49  -3.502 -12.790  -8.483
  393    HA   GLN  49           HA       GLN  49  -5.642 -13.888 -10.226
  394   1HB   GLN  49          2HB       GLN  49  -4.479 -12.080 -11.325
  395   2HB   GLN  49          1HB       GLN  49  -2.916 -12.738 -10.930
  396   1HG   GLN  49          2HG       GLN  49  -2.966 -13.780 -12.942
  397   2HG   GLN  49          1HG       GLN  49  -4.211 -14.834 -12.340
  398   1HE2  GLN  49          2HE2      GLN  49  -6.480 -14.245 -12.705
  399   2HE2  GLN  49          1HE2      GLN  49  -6.786 -13.238 -14.092
  400    H    THR  50           H        THR  50  -2.178 -14.532 -10.365
  401    HA   THR  50           HA       THR  50  -2.342 -17.334 -10.652
  402    HB   THR  50           HB       THR  50  -0.620 -16.548 -11.723
  403    HG1  THR  50           1HG      THR  50   1.292 -17.343 -10.611
  404   1HG2  THR  50          1HG2      THR  50   1.128 -15.035 -10.917
  405   2HG2  THR  50          2HG2      THR  50  -0.473 -14.265 -10.832
  406   3HG2  THR  50          3HG2      THR  50   0.294 -14.886  -9.352
  407    H    LEU  51           H        LEU  51  -0.015 -16.577  -8.326
  408    HA   LEU  51           HA       LEU  51  -1.441 -16.770  -5.786
  409   1HB   LEU  51          2HB       LEU  51  -1.087 -19.182  -7.153
  410   2HB   LEU  51          1HB       LEU  51   0.336 -19.117  -6.133
  411    HG   LEU  51           HG       LEU  51  -2.408 -18.558  -4.969
  412   1HD1  LEU  51          1HD1      LEU  51  -2.518 -20.944  -4.435
  413   2HD1  LEU  51          2HD1      LEU  51  -2.507 -20.693  -6.197
  414   3HD1  LEU  51          3HD1      LEU  51  -1.030 -21.236  -5.367
  415   1HD2  LEU  51          1HD2      LEU  51  -1.349 -19.365  -2.932
  416   2HD2  LEU  51          2HD2      LEU  51   0.172 -19.658  -3.809
  417   3HD2  LEU  51          3HD2      LEU  51  -0.432 -17.996  -3.604
  418    H    LYS  52           H        LYS  52   0.470 -14.977  -7.068
  419    HA   LYS  52           HA       LYS  52   2.852 -15.363  -5.300
  420   1HB   LYS  52          2HB       LYS  52   2.667 -13.893  -7.967
  421   2HB   LYS  52          1HB       LYS  52   4.108 -14.131  -7.021
  422   1HG   LYS  52          2HG       LYS  52   4.240 -16.374  -7.505
  423   2HG   LYS  52          1HG       LYS  52   2.503 -16.502  -7.901
  424   1HD   LYS  52          2HD       LYS  52   3.126 -14.729  -9.812
  425   2HD   LYS  52          1HD       LYS  52   4.754 -15.327  -9.586
  426   1HE   LYS  52          2HE       LYS  52   2.387 -17.163 -10.214
  427   2HE   LYS  52          1HE       LYS  52   3.469 -16.530 -11.407
  428   1HZ   LYS  52          1HZ       LYS  52   4.037 -18.647 -10.768
  429   2HZ   LYS  52          2HZ       LYS  52   5.232 -17.636 -10.321
  430   3HZ   LYS  52          3HZ       LYS  52   4.210 -18.237  -9.199
  431    H    GLU  53           H        GLU  53   0.723 -12.852  -6.773
  432    HA   GLU  53           HA       GLU  53   1.437 -10.810  -4.913
  433   1HB   GLU  53          2HB       GLU  53  -0.339  -9.544  -5.949
  434   2HB   GLU  53          1HB       GLU  53   0.929 -10.186  -7.052
  435   1HG   GLU  53          2HG       GLU  53  -1.492 -11.876  -6.951
  436   2HG   GLU  53          1HG       GLU  53  -1.809 -10.261  -7.531
  437    H    THR  54           H        THR  54   0.974 -12.567  -3.146
  438    HA   THR  54           HA       THR  54  -1.359 -11.775  -1.553
  439    HB   THR  54           HB       THR  54  -1.356 -14.350  -2.967
  440    HG1  THR  54           1HG      THR  54  -3.636 -13.503  -3.146
  441   1HG2  THR  54          1HG2      THR  54  -3.211 -15.155  -1.630
  442   2HG2  THR  54          2HG2      THR  54  -1.715 -15.068  -0.671
  443   3HG2  THR  54          3HG2      THR  54  -2.974 -13.826  -0.469
  444    H    SER  55           H        SER  55   1.272 -11.279  -0.992
  445    HA   SER  55           HA       SER  55   2.072 -13.287   1.071
  446   1HB   SER  55          2HB       SER  55   3.842 -12.685  -0.300
  447   2HB   SER  55          1HB       SER  55   3.443 -10.951  -0.199
  448    HG   SER  55           HG       SER  55   3.746 -12.130   2.318
  449    H    PHE  56           H        PHE  56   0.675 -10.089   0.742
  450    HA   PHE  56           HA       PHE  56   0.989  -9.396   3.579
  451   1HB   PHE  56          2HB       PHE  56  -0.059  -7.348   2.866
  452   2HB   PHE  56          1HB       PHE  56   1.347  -7.757   1.832
  453    HD1  PHE  56           1HD      PHE  56   1.080  -8.151  -0.523
  454    HD2  PHE  56           2HD      PHE  56  -2.351  -7.537   1.993
  455    HE1  PHE  56           1HE      PHE  56  -0.384  -8.041  -2.526
  456    HE2  PHE  56           2HE      PHE  56  -3.801  -7.471  -0.013
  457    HZ   PHE  56           HZ       PHE  56  -2.823  -7.710  -2.260
  458    H    ASN  57           H        ASN  57  -1.801 -10.081   1.273
  459    HA   ASN  57           HA       ASN  57  -3.762  -9.758   3.355
  460   1HB   ASN  57          2HB       ASN  57  -5.329 -10.556   1.774
  461   2HB   ASN  57          1HB       ASN  57  -4.210  -9.479   0.930
  462   1HD2  ASN  57          2HD2      ASN  57  -5.123 -12.791   1.533
  463   2HD2  ASN  57          1HD2      ASN  57  -4.369 -13.472   0.118
  464    H    GLN  58           H        GLN  58  -1.550 -12.295   2.515
  465    HA   GLN  58           HA       GLN  58  -2.947 -14.589   3.572
  466   1HB   GLN  58          2HB       GLN  58  -0.786 -14.269   1.958
  467   2HB   GLN  58          1HB       GLN  58   0.018 -14.539   3.484
  468   1HG   GLN  58          2HG       GLN  58  -1.962 -16.392   2.104
  469   2HG   GLN  58          1HG       GLN  58  -0.290 -16.701   2.502
  470   1HE2  GLN  58          2HE2      GLN  58  -3.526 -16.981   3.508
  471   2HE2  GLN  58          1HE2      GLN  58  -3.180 -17.450   5.150
  472    H    ALA  59           H        ALA  59  -0.595 -12.236   4.972
  473    HA   ALA  59           HA       ALA  59  -1.042 -13.462   7.682
  474   1HB   ALA  59          1HB       ALA  59   1.235 -12.933   8.232
  475   2HB   ALA  59          2HB       ALA  59   1.135 -14.093   6.885
  476   3HB   ALA  59          3HB       ALA  59   1.532 -12.387   6.565
  477    H    TYR  60           H        TYR  60   0.390 -10.598   6.204
  478    HA   TYR  60           HA       TYR  60  -0.610  -8.653   8.104
  479   1HB   TYR  60          2HB       TYR  60   0.824  -8.604   5.402
  480   2HB   TYR  60          1HB       TYR  60   0.325  -7.117   6.156
  481    HD1  TYR  60           1HD      TYR  60   2.246 -10.266   6.976
  482    HD2  TYR  60           2HD      TYR  60   1.767  -6.054   7.523
  483    HE1  TYR  60           1HE      TYR  60   4.341 -10.156   8.257
  484    HE2  TYR  60           2HE      TYR  60   3.838  -5.929   8.769
  485    HH   TYR  60           HH       TYR  60   5.409  -7.079   9.791
  486    H    GLY  61           H        GLY  61  -2.873 -10.204   7.119
  487   1HA   GLY  61          2HA       GLY  61  -4.535  -8.863   5.209
  488   2HA   GLY  61          1HA       GLY  61  -5.081  -9.871   6.507
  489    H    ARG  62           H        ARG  62  -3.544  -7.882   8.356
  490    HA   ARG  62           HA       ARG  62  -5.727  -5.868   8.672
  491   1HB   ARG  62          2HB       ARG  62  -3.604  -7.007  10.494
  492   2HB   ARG  62          1HB       ARG  62  -4.700  -5.648  10.910
  493   1HG   ARG  62          2HG       ARG  62  -5.750  -8.409  10.151
  494   2HG   ARG  62          1HG       ARG  62  -5.381  -7.971  11.804
  495   1HD   ARG  62          2HD       ARG  62  -6.914  -5.929  11.400
  496   2HD   ARG  62          1HD       ARG  62  -7.480  -6.844   9.980
  497    HE   ARG  62           HE       ARG  62  -7.640  -8.733  11.836
  498   1HH1  ARG  62          2HH2      ARG  62  -8.681  -5.392  12.158
  499   2HH1  ARG  62          1HH2      ARG  62  -9.917  -5.760  13.319
  500   1HH2  ARG  62          1HH1      ARG  62  -9.276  -9.171  13.370
  501   2HH2  ARG  62          2HH1      ARG  62 -10.239  -7.870  13.980
  502    H    ASP  63           H        ASP  63  -2.580  -6.100   7.340
  503    HA   ASP  63           HA       ASP  63  -1.593  -3.484   8.243
  504   1HB   ASP  63          2HB       ASP  63  -0.230  -5.592   7.878
  505   2HB   ASP  63          1HB       ASP  63  -0.395  -5.260   6.156
  506    H    LEU  64           H        LEU  64  -0.586  -3.387   5.167
  507    HA   LEU  64           HA       LEU  64  -1.894  -1.280   4.186
  508   1HB   LEU  64          2HB       LEU  64   0.092  -2.682   3.334
  509   2HB   LEU  64          1HB       LEU  64  -1.158  -3.430   2.288
  510    HG   LEU  64           HG       LEU  64  -0.726  -0.446   2.442
  511   1HD1  LEU  64          1HD1      LEU  64   0.619  -0.679   0.375
  512   2HD1  LEU  64          2HD1      LEU  64   1.387  -1.500   1.755
  513   3HD1  LEU  64          3HD1      LEU  64   0.523  -2.449   0.522
  514   1HD2  LEU  64          1HD2      LEU  64  -1.755  -0.427   0.216
  515   2HD2  LEU  64          2HD2      LEU  64  -1.966  -2.192   0.290
  516   3HD2  LEU  64          3HD2      LEU  64  -2.850  -1.143   1.422
  517    H    MET  65           H        MET  65  -3.124  -4.677   3.776
  518    HA   MET  65           HA       MET  65  -5.469  -4.363   2.365
  519   1HB   MET  65          2HB       MET  65  -4.361  -6.323   3.837
  520   2HB   MET  65          1HB       MET  65  -5.530  -5.769   5.021
  521   1HG   MET  65          2HG       MET  65  -6.575  -7.494   3.754
  522   2HG   MET  65          1HG       MET  65  -7.314  -5.984   3.218
  523   1HE   MET  65          1HE       MET  65  -7.191  -8.137  -0.059
  524   2HE   MET  65          2HE       MET  65  -7.456  -8.716   1.603
  525   3HE   MET  65          3HE       MET  65  -8.210  -7.198   1.060
  526    H    GLU  66           H        GLU  66  -5.207  -3.499   5.902
  527    HA   GLU  66           HA       GLU  66  -7.912  -2.283   5.875
  528   1HB   GLU  66          2HB       GLU  66  -6.380  -3.589   7.724
  529   2HB   GLU  66          1HB       GLU  66  -6.253  -1.863   8.172
  530   1HG   GLU  66          2HG       GLU  66  -8.536  -1.699   8.640
  531   2HG   GLU  66          1HG       GLU  66  -8.985  -2.796   7.340
  532    H    ALA  67           H        ALA  67  -4.493  -1.264   5.855
  533    HA   ALA  67           HA       ALA  67  -4.936   1.519   6.225
  534   1HB   ALA  67          1HB       ALA  67  -2.629   1.701   5.381
  535   2HB   ALA  67          2HB       ALA  67  -2.806   0.450   6.635
  536   3HB   ALA  67          3HB       ALA  67  -2.676  -0.018   4.923
  537    H    GLN  68           H        GLN  68  -5.371  -0.508   3.446
  538    HA   GLN  68           HA       GLN  68  -5.794   1.665   1.494
  539   1HB   GLN  68          2HB       GLN  68  -4.696   0.190   0.374
  540   2HB   GLN  68          1HB       GLN  68  -5.110  -1.153   1.509
  541   1HG   GLN  68          2HG       GLN  68  -7.070  -0.226  -0.607
  542   2HG   GLN  68          1HG       GLN  68  -5.811  -1.384  -0.978
  543   1HE2  GLN  68          2HE2      GLN  68  -5.656  -3.268   0.524
  544   2HE2  GLN  68          1HE2      GLN  68  -7.181  -3.912   1.103
  545    H    GLU  69           H        GLU  69  -7.664  -0.813   3.322
  546    HA   GLU  69           HA       GLU  69 -10.177  -0.414   2.019
  547   1HB   GLU  69          2HB       GLU  69  -9.103  -2.055   4.012
  548   2HB   GLU  69          1HB       GLU  69 -10.536  -1.241   4.668
  549   1HG   GLU  69          2HG       GLU  69 -10.654  -2.399   1.852
  550   2HG   GLU  69          1HG       GLU  69 -10.853  -3.464   3.219
  551    H    TRP  70           H        TRP  70  -8.454   1.565   4.320
  552    HA   TRP  70           HA       TRP  70 -10.716   3.189   5.177
  553   1HB   TRP  70          2HB       TRP  70  -9.309   4.232   6.448
  554   2HB   TRP  70          1HB       TRP  70  -8.351   2.723   6.182
  555    HD1  TRP  70           HD       TRP  70  -7.341   5.729   7.062
  556    HE1  TRP  70           1HE      TRP  70  -5.475   6.826   5.723
  557    HE3  TRP  70           3HE      TRP  70  -7.563   2.871   2.974
  558    HZ2  TRP  70           2HZ      TRP  70  -4.230   6.445   3.195
  559    HZ3  TRP  70           3HZ      TRP  70  -6.498   3.568   0.931
  560    HH2  TRP  70           HH       TRP  70  -4.623   5.275   1.075
  561    H    CYS  71           H        CYS  71 -10.148   2.690   2.075
  562    HA   CYS  71           HA       CYS  71  -9.416   5.145   0.877
  563   1HB   CYS  71          2HB       CYS  71 -10.569   4.229  -1.125
  564   2HB   CYS  71          1HB       CYS  71  -9.429   3.125  -0.436
  565    HG   CYS  71           HG       CYS  71 -11.452   1.934  -1.404
  566    H    ARG  72           H        ARG  72 -12.744   3.842   1.541
  567    HA   ARG  72           HA       ARG  72 -14.119   6.255   1.068
  568   1HB   ARG  72          2HB       ARG  72 -14.772   3.702   2.575
  569   2HB   ARG  72          1HB       ARG  72 -15.898   5.027   2.555
  570   1HG   ARG  72          2HG       ARG  72 -14.852   4.353  -0.110
  571   2HG   ARG  72          1HG       ARG  72 -15.751   3.055   0.700
  572   1HD   ARG  72          2HD       ARG  72 -17.529   4.851   1.238
  573   2HD   ARG  72          1HD       ARG  72 -16.689   5.866   0.045
  574    HE   ARG  72           HE       ARG  72 -16.997   3.601  -1.343
  575   1HH1  ARG  72          2HH2      ARG  72 -19.392   5.289   0.601
  576   2HH1  ARG  72          1HH2      ARG  72 -20.732   4.755  -0.362
  577   1HH2  ARG  72          1HH1      ARG  72 -18.795   2.914  -2.577
  578   2HH2  ARG  72          2HH1      ARG  72 -20.383   3.436  -2.132
  579    H    LYS  73           H        LYS  73 -11.849   5.894   3.433
  580    HA   LYS  73           HA       LYS  73 -13.187   7.616   5.472
  581   1HB   LYS  73          2HB       LYS  73 -11.685   5.137   5.753
  582   2HB   LYS  73          1HB       LYS  73 -10.850   6.429   6.563
  583   1HG   LYS  73          2HG       LYS  73 -13.814   6.070   6.997
  584   2HG   LYS  73          1HG       LYS  73 -12.639   5.092   7.853
  585   1HD   LYS  73          2HD       LYS  73 -11.507   7.289   8.532
  586   2HD   LYS  73          1HD       LYS  73 -12.975   8.090   7.931
  587   1HE   LYS  73          2HE       LYS  73 -14.356   6.653   9.478
  588   2HE   LYS  73          1HE       LYS  73 -12.891   5.914  10.094
  589   1HZ   LYS  73          1HZ       LYS  73 -13.627   7.616  11.466
  590   2HZ   LYS  73          2HZ       LYS  73 -12.195   8.064  10.820
  591   3HZ   LYS  73          3HZ       LYS  73 -13.596   8.722  10.269
  592    H    TYR  74           H        TYR  74  -9.865   6.868   4.202
  593    HA   TYR  74           HA       TYR  74  -8.827   9.506   4.682
  594   1HB   TYR  74          2HB       TYR  74  -6.921   8.689   4.016
  595   2HB   TYR  74          1HB       TYR  74  -7.800   7.116   4.079
  596    HD1  TYR  74           1HD      TYR  74  -9.173   6.944   1.556
  597    HD2  TYR  74           2HD      TYR  74  -5.338   8.558   2.443
  598    HE1  TYR  74           1HE      TYR  74  -8.534   6.635  -0.808
  599    HE2  TYR  74           2HE      TYR  74  -4.614   8.123   0.134
  600    HH   TYR  74           HH       TYR  74  -5.462   7.823  -1.992
  601    H    MET  75           H        MET  75 -10.810   8.325   2.029
  602    HA   MET  75           HA       MET  75 -10.165  10.506   0.177
  603   1HB   MET  75          2HB       MET  75 -10.656   8.128  -0.448
  604   2HB   MET  75          1HB       MET  75 -12.348   8.429   0.081
  605   1HG   MET  75          2HG       MET  75 -11.085  10.125  -2.111
  606   2HG   MET  75          1HG       MET  75 -11.815   8.602  -2.485
  607   1HE   MET  75          1HE       MET  75 -14.231  11.332  -3.751
  608   2HE   MET  75          2HE       MET  75 -12.466  11.478  -3.583
  609   3HE   MET  75          3HE       MET  75 -13.179   9.960  -4.179
  610    H    LYS  76           H        LYS  76 -12.863   9.579   2.371
  611    HA   LYS  76           HA       LYS  76 -14.423  11.924   1.456
  612   1HB   LYS  76          2HB       LYS  76 -15.243   9.381   1.874
  613   2HB   LYS  76          1HB       LYS  76 -15.467   9.998   3.500
  614   1HG   LYS  76          2HG       LYS  76 -17.492  10.582   2.645
  615   2HG   LYS  76          1HG       LYS  76 -16.613  12.029   2.136
  616   1HD   LYS  76          2HD       LYS  76 -16.168  10.933  -0.089
  617   2HD   LYS  76          1HD       LYS  76 -17.121   9.547   0.423
  618   1HE   LYS  76          2HE       LYS  76 -19.103  11.039   0.720
  619   2HE   LYS  76          1HE       LYS  76 -18.140  12.404   0.150
  620   1HZ   LYS  76          1HZ       LYS  76 -19.352  11.493  -1.606
  621   2HZ   LYS  76          2HZ       LYS  76 -17.775  11.158  -1.872
  622   3HZ   LYS  76          3HZ       LYS  76 -18.782   9.987  -1.342
  623    H    SER  77           H        SER  77 -13.150  10.429   4.490
  624    HA   SER  77           HA       SER  77 -13.773  12.760   6.149
  625   1HB   SER  77          2HB       SER  77 -13.950  10.504   7.140
  626   2HB   SER  77          1HB       SER  77 -12.280  10.176   6.766
  627    HG   SER  77           HG       SER  77 -12.784  10.888   8.954
  628    H    GLY  78           H        GLY  78 -10.925  11.206   4.485
  629   1HA   GLY  78          2HA       GLY  78  -8.752  11.907   4.165
  630   2HA   GLY  78          1HA       GLY  78  -9.451  13.486   3.913
  631    H    ASN  79           H        ASN  79  -9.608  11.715   6.973
  632    HA   ASN  79           HA       ASN  79  -8.469  14.069   8.197
  633   1HB   ASN  79          2HB       ASN  79 -10.694  12.701   8.872
  634   2HB   ASN  79          1HB       ASN  79  -9.575  11.748   9.815
  635   1HD2  ASN  79          2HD2      ASN  79 -10.975  12.641  11.577
  636   2HD2  ASN  79          1HD2      ASN  79 -10.494  14.194  12.204
  637    H    VAL  80           H        VAL  80  -6.320  14.051   8.451
  638    HA   VAL  80           HA       VAL  80  -4.437  12.031   8.395
  639    HB   VAL  80           HB       VAL  80  -4.244  14.569  10.000
  640   1HG1  VAL  80          1HG1      VAL  80  -1.872  14.232   9.848
  641   2HG1  VAL  80          2HG1      VAL  80  -2.614  12.897  10.761
  642   3HG1  VAL  80          3HG1      VAL  80  -2.105  12.647   9.074
  643   1HG2  VAL  80          1HG2      VAL  80  -3.025  15.320   8.046
  644   2HG2  VAL  80          2HG2      VAL  80  -3.344  13.778   7.217
  645   3HG2  VAL  80          3HG2      VAL  80  -4.690  14.881   7.594
  646    H    LYS  81           H        LYS  81  -6.782  12.601  10.968
  647    HA   LYS  81           HA       LYS  81  -5.622  11.104  13.063
  648   1HB   LYS  81          2HB       LYS  81  -8.110  12.431  12.600
  649   2HB   LYS  81          1HB       LYS  81  -8.443  10.817  13.176
  650   1HG   LYS  81          2HG       LYS  81  -6.791  12.962  14.550
  651   2HG   LYS  81          1HG       LYS  81  -8.209  12.135  15.138
  652   1HD   LYS  81          2HD       LYS  81  -6.503   9.984  14.857
  653   2HD   LYS  81          1HD       LYS  81  -5.366  11.241  15.208
  654   1HE   LYS  81          2HE       LYS  81  -5.841  11.102  17.303
  655   2HE   LYS  81          1HE       LYS  81  -7.540  11.569  16.983
  656   1HZ   LYS  81          1HZ       LYS  81  -7.372   9.378  17.974
  657   2HZ   LYS  81          2HZ       LYS  81  -7.992   9.289  16.463
  658   3HZ   LYS  81          3HZ       LYS  81  -6.447   8.855  16.729
  659    H    ASP  82           H        ASP  82  -6.861  10.011  10.031
  660    HA   ASP  82           HA       ASP  82  -6.962   7.158  10.913
  661   1HB   ASP  82          2HB       ASP  82  -7.953   8.569   8.404
  662   2HB   ASP  82          1HB       ASP  82  -7.837   6.828   8.542
  663    H    LEU  83           H        LEU  83  -5.416   9.403   8.514
  664    HA   LEU  83           HA       LEU  83  -3.667   7.581   7.338
  665   1HB   LEU  83          2HB       LEU  83  -3.977  10.393   7.319
  666   2HB   LEU  83          1HB       LEU  83  -2.247   9.944   7.450
  667    HG   LEU  83           HG       LEU  83  -2.665  10.059   5.111
  668   1HD1  LEU  83          1HD1      LEU  83  -2.439   7.868   4.225
  669   2HD1  LEU  83          2HD1      LEU  83  -1.381   8.140   5.630
  670   3HD1  LEU  83          3HD1      LEU  83  -2.859   7.163   5.804
  671   1HD2  LEU  83          1HD2      LEU  83  -4.578   8.988   4.023
  672   2HD2  LEU  83          2HD2      LEU  83  -5.180   8.427   5.602
  673   3HD2  LEU  83          3HD2      LEU  83  -5.125  10.169   5.237
  674    H    THR  84           H        THR  84  -3.158   9.482  10.380
  675    HA   THR  84           HA       THR  84  -0.593   8.833  11.191
  676    HB   THR  84           HB       THR  84  -1.884  10.223  12.490
  677    HG1  THR  84           1HG      THR  84  -1.656   9.038  14.586
  678   1HG2  THR  84          1HG2      THR  84  -3.706   9.479  13.946
  679   2HG2  THR  84          2HG2      THR  84  -4.140   9.296  12.229
  680   3HG2  THR  84          3HG2      THR  84  -3.670   7.870  13.186
  681    H    GLN  85           H        GLN  85  -3.375   6.582  11.274
  682    HA   GLN  85           HA       GLN  85  -1.751   4.423  12.385
  683   1HB   GLN  85          2HB       GLN  85  -4.586   5.017  12.006
  684   2HB   GLN  85          1HB       GLN  85  -4.128   3.317  11.689
  685   1HG   GLN  85          2HG       GLN  85  -3.515   2.950  13.918
  686   2HG   GLN  85          1HG       GLN  85  -2.881   4.573  14.120
  687   1HE2  GLN  85          2HE2      GLN  85  -3.840   5.078  15.969
  688   2HE2  GLN  85          1HE2      GLN  85  -5.574   5.245  16.120
  689    H    ALA  86           H        ALA  86  -3.319   5.270   9.258
  690    HA   ALA  86           HA       ALA  86  -2.650   2.915   7.773
  691   1HB   ALA  86          1HB       ALA  86  -2.949   4.311   5.849
  692   2HB   ALA  86          2HB       ALA  86  -4.259   4.541   7.034
  693   3HB   ALA  86          3HB       ALA  86  -2.973   5.762   6.878
  694    H    TRP  87           H        TRP  87  -0.711   5.721   8.750
  695    HA   TRP  87           HA       TRP  87   1.646   5.151   7.173
  696   1HB   TRP  87          2HB       TRP  87   1.106   6.928   9.564
  697   2HB   TRP  87          1HB       TRP  87   2.679   6.769   8.799
  698    HD1  TRP  87           HD       TRP  87   0.148   9.130   8.811
  699    HE1  TRP  87           1HE      TRP  87  -0.118  10.368   6.621
  700    HE3  TRP  87           3HE      TRP  87   2.808   6.037   5.843
  701    HZ2  TRP  87           2HZ      TRP  87   0.475   9.942   3.952
  702    HZ3  TRP  87           3HZ      TRP  87   2.755   6.362   3.382
  703    HH2  TRP  87           HH       TRP  87   1.788   8.444   2.462
  704    H    ASP  88           H        ASP  88   0.386   4.173  10.346
  705    HA   ASP  88           HA       ASP  88   2.817   3.035  11.385
  706   1HB   ASP  88          2HB       ASP  88   0.364   3.659  12.456
  707   2HB   ASP  88          1HB       ASP  88   0.259   1.906  12.309
  708    H    LEU  89           H        LEU  89  -0.033   1.792   9.461
  709    HA   LEU  89           HA       LEU  89   0.902  -0.974   9.382
  710   1HB   LEU  89          2HB       LEU  89  -1.217   0.466   7.786
  711   2HB   LEU  89          1HB       LEU  89  -0.857  -1.236   7.680
  712    HG   LEU  89           HG       LEU  89  -1.674   0.143  10.267
  713   1HD1  LEU  89          1HD1      LEU  89  -3.841  -0.870   9.868
  714   2HD1  LEU  89          2HD1      LEU  89  -3.432   0.286   8.579
  715   3HD1  LEU  89          3HD1      LEU  89  -3.294  -1.464   8.283
  716   1HD2  LEU  89          1HD2      LEU  89  -2.086  -2.123  11.043
  717   2HD2  LEU  89          2HD2      LEU  89  -1.484  -2.786   9.505
  718   3HD2  LEU  89          3HD2      LEU  89  -0.374  -1.925  10.597
  719    H    TYR  90           H        TYR  90   0.989   1.780   7.140
  720    HA   TYR  90           HA       TYR  90   2.420   0.555   4.928
  721   1HB   TYR  90          2HB       TYR  90   2.198   3.363   5.931
  722   2HB   TYR  90          1HB       TYR  90   3.097   2.881   4.457
  723    HD1  TYR  90           1HD      TYR  90   1.447   4.702   3.688
  724    HD2  TYR  90           2HD      TYR  90   0.316   0.667   4.597
  725    HE1  TYR  90           1HE      TYR  90  -0.417   4.870   2.090
  726    HE2  TYR  90           2HE      TYR  90  -1.557   0.850   3.049
  727    HH   TYR  90           HH       TYR  90  -2.827   2.197   1.844
  728    H    TYR  91           H        TYR  91   3.593   2.058   7.882
  729    HA   TYR  91           HA       TYR  91   6.493   1.796   7.157
  730   1HB   TYR  91          2HB       TYR  91   5.397   3.752   8.396
  731   2HB   TYR  91          1HB       TYR  91   5.225   2.670   9.765
  732    HD1  TYR  91           1HD      TYR  91   7.672   4.147   7.414
  733    HD2  TYR  91           2HD      TYR  91   7.038   2.150  11.165
  734    HE1  TYR  91           1HE      TYR  91  10.016   4.607   8.048
  735    HE2  TYR  91           2HE      TYR  91   9.388   2.573  11.794
  736    HH   TYR  91           HH       TYR  91  11.232   3.700  11.305
  737    H    HIS  92           H        HIS  92   4.222   0.277   9.499
  738    HA   HIS  92           HA       HIS  92   6.018  -1.500  10.764
  739   1HB   HIS  92          2HB       HIS  92   3.668  -0.975  11.556
  740   2HB   HIS  92          1HB       HIS  92   3.017  -1.830  10.197
  741    HD1  HIS  92           1HD      HIS  92   5.329  -2.654  13.114
  742    HD2  HIS  92           2HD      HIS  92   2.487  -4.261  10.565
  743    HE1  HIS  92           1HE      HIS  92   4.949  -5.066  13.906
  744    H    VAL  93           H        VAL  93   4.212  -1.706   7.692
  745    HA   VAL  93           HA       VAL  93   5.332  -4.361   7.045
  746    HB   VAL  93           HB       VAL  93   2.962  -3.541   6.663
  747   1HG1  VAL  93          1HG1      VAL  93   2.526  -2.747   4.391
  748   2HG1  VAL  93          2HG1      VAL  93   3.398  -1.521   5.341
  749   3HG1  VAL  93          3HG1      VAL  93   4.269  -2.494   4.132
  750   1HG2  VAL  93          1HG2      VAL  93   2.777  -5.114   4.854
  751   2HG2  VAL  93          2HG2      VAL  93   4.552  -5.156   4.730
  752   3HG2  VAL  93          3HG2      VAL  93   3.751  -5.689   6.228
  753    H    PHE  94           H        PHE  94   6.004  -0.899   6.258
  754    HA   PHE  94           HA       PHE  94   7.417  -1.003   3.923
  755   1HB   PHE  94          2HB       PHE  94   6.929   1.004   5.118
  756   2HB   PHE  94          1HB       PHE  94   7.957   0.483   6.495
  757    HD1  PHE  94           1HD      PHE  94   7.873   2.109   3.228
  758    HD2  PHE  94           2HD      PHE  94  10.395   0.318   6.200
  759    HE1  PHE  94           1HE      PHE  94   9.859   3.216   2.225
  760    HE2  PHE  94           2HE      PHE  94  12.379   1.386   5.191
  761    HZ   PHE  94           HZ       PHE  94  12.108   2.852   3.201
  762    H    ARG  95           H        ARG  95   8.565  -2.074   7.118
  763    HA   ARG  95           HA       ARG  95  11.148  -2.934   6.069
  764   1HB   ARG  95          2HB       ARG  95   9.922  -2.902   8.796
  765   2HB   ARG  95          1HB       ARG  95  11.324  -3.918   8.458
  766   1HG   ARG  95          2HG       ARG  95  12.518  -1.986   8.927
  767   2HG   ARG  95          1HG       ARG  95  12.127  -1.528   7.296
  768   1HD   ARG  95          2HD       ARG  95  11.576   0.304   8.642
  769   2HD   ARG  95          1HD       ARG  95  10.021  -0.435   8.224
  770    HE   ARG  95           HE       ARG  95   9.711  -1.026  10.403
  771   1HH1  ARG  95          2HH2      ARG  95  13.092  -0.095  10.108
  772   2HH1  ARG  95          1HH2      ARG  95  13.383  -0.132  11.815
  773   1HH2  ARG  95          1HH1      ARG  95  10.147  -1.085  12.643
  774   2HH2  ARG  95          2HH1      ARG  95  11.728  -0.676  13.217
  775    H    ARG  96           H        ARG  96   8.024  -4.476   6.741
  776    HA   ARG  96           HA       ARG  96   8.984  -7.239   6.771
  777   1HB   ARG  96          2HB       ARG  96   6.949  -6.795   7.988
  778   2HB   ARG  96          1HB       ARG  96   6.209  -6.017   6.618
  779   1HG   ARG  96          2HG       ARG  96   5.305  -8.151   6.752
  780   2HG   ARG  96          1HG       ARG  96   6.445  -8.192   5.369
  781   1HD   ARG  96          2HD       ARG  96   7.174  -9.275   8.140
  782   2HD   ARG  96          1HD       ARG  96   6.499 -10.274   6.892
  783    HE   ARG  96           HE       ARG  96   8.805  -8.833   5.995
  784   1HH1  ARG  96          2HH2      ARG  96   7.750 -11.594   7.859
  785   2HH1  ARG  96          1HH2      ARG  96   9.184 -12.525   7.553
  786   1HH2  ARG  96          1HH1      ARG  96  10.709 -10.041   5.642
  787   2HH2  ARG  96          2HH1      ARG  96  10.841 -11.632   6.306
  788    H    ILE  97           H        ILE  97   6.967  -5.301   4.482
  789    HA   ILE  97           HA       ILE  97   7.201  -7.209   2.262
  790    HB   ILE  97           HB       ILE  97   6.183  -5.433   0.956
  791   1HG1  ILE  97          2HG1      ILE  97   5.290  -4.078   3.399
  792   2HG1  ILE  97          1HG1      ILE  97   6.908  -3.690   2.721
  793   1HG2  ILE  97          1HG2      ILE  97   3.955  -5.987   1.968
  794   2HG2  ILE  97          2HG2      ILE  97   5.016  -7.414   1.914
  795   3HG2  ILE  97          3HG2      ILE  97   4.778  -6.538   3.446
  796   1HD1  ILE  97          1HD1      ILE  97   5.211  -2.121   1.952
  797   2HD1  ILE  97          2HD1      ILE  97   5.862  -3.079   0.600
  798   3HD1  ILE  97          3HD1      ILE  97   4.260  -3.463   1.273
  799    H    SER  98           H        SER  98   9.401  -4.934   3.609
  800    HA   SER  98           HA       SER  98  10.566  -3.796   1.287
  801   1HB   SER  98          2HB       SER  98  12.366  -3.168   2.488
  802   2HB   SER  98          1HB       SER  98  11.060  -3.207   3.716
  803    HG   SER  98           HG       SER  98  13.094  -4.107   4.459
  804    H    LYS  99           H        LYS  99  11.464  -6.705   3.227
  805    HA   LYS  99           HA       LYS  99  12.396  -8.104   0.742
  806   1HB   LYS  99          2HB       LYS  99  14.064  -7.378   3.087
  807   2HB   LYS  99          1HB       LYS  99  14.387  -8.823   2.117
  808   1HG   LYS  99          2HG       LYS  99  14.364  -7.419   0.070
  809   2HG   LYS  99          1HG       LYS  99  14.155  -5.972   1.113
  810   1HD   LYS  99          2HD       LYS  99  16.509  -7.794   1.462
  811   2HD   LYS  99          1HD       LYS  99  16.487  -6.548   0.175
  812   1HE   LYS  99          2HE       LYS  99  17.416  -5.212   1.809
  813   2HE   LYS  99          1HE       LYS  99  15.776  -5.052   2.385
  814   1HZ   LYS  99          1HZ       LYS  99  17.283  -5.656   4.058
  815   2HZ   LYS  99          2HZ       LYS  99  16.159  -6.827   3.862
  816   3HZ   LYS  99          3HZ       LYS  99  17.675  -7.046   3.292
  817    H    GLN 100           H        GLN 100   9.909  -8.567   1.963
  818    HA   GLN 100           HA       GLN 100   9.735 -10.573   3.929
  819   1HB   GLN 100          2HB       GLN 100   7.875  -9.394   3.209
  820   2HB   GLN 100          1HB       GLN 100   8.064  -9.993   1.527
  821   1HG   GLN 100          2HG       GLN 100   7.610 -12.029   3.713
  822   2HG   GLN 100          1HG       GLN 100   6.248 -11.080   3.185
  823   1HE2  GLN 100          2HE2      GLN 100   6.466 -13.864   2.892
  824   2HE2  GLN 100          1HE2      GLN 100   6.441 -14.137   1.168
  Start of MODEL   17
    1   1H    GLU   1          1H        GLU   1   7.758 -10.157 -20.151
    2   2H    GLU   1          2H        GLU   1   8.539  -8.703 -19.833
    3    HA   GLU   1           HA       GLU   1  10.113 -10.539 -18.575
    4   1HB   GLU   1          2HB       GLU   1   8.038  -8.811 -17.327
    5   2HB   GLU   1          1HB       GLU   1   9.483  -9.559 -16.563
    6   1HG   GLU   1          2HG       GLU   1  10.141  -7.324 -16.886
    7   2HG   GLU   1          1HG       GLU   1  10.821  -8.124 -18.297
    8    H    LEU   2           H        LEU   2   7.416 -10.558 -16.518
    9    HA   LEU   2           HA       LEU   2   6.520 -12.382 -15.435
   10   1HB   LEU   2          2HB       LEU   2   4.486 -12.893 -16.351
   11   2HB   LEU   2          1HB       LEU   2   4.893 -11.196 -16.785
   12    HG   LEU   2           HG       LEU   2   5.696 -12.726 -19.012
   13   1HD1  LEU   2          1HD1      LEU   2   3.745 -14.027 -19.593
   14   2HD1  LEU   2          2HD1      LEU   2   4.538 -14.668 -18.133
   15   3HD1  LEU   2          3HD1      LEU   2   3.038 -13.720 -17.988
   16   1HD2  LEU   2          1HD2      LEU   2   3.839 -11.626 -20.124
   17   2HD2  LEU   2          2HD2      LEU   2   3.122 -11.196 -18.553
   18   3HD2  LEU   2          3HD2      LEU   2   4.678 -10.486 -19.045
   19    H    ILE   3           H        ILE   3   8.443 -13.712 -15.333
   20    HA   ILE   3           HA       ILE   3   8.183 -16.319 -16.762
   21    HB   ILE   3           HB       ILE   3  10.793 -16.115 -16.942
   22   1HG1  ILE   3          2HG1      ILE   3  10.095 -13.358 -17.739
   23   2HG1  ILE   3          1HG1      ILE   3  10.757 -13.779 -16.127
   24   1HG2  ILE   3          1HG2      ILE   3  10.359 -15.726 -19.352
   25   2HG2  ILE   3          2HG2      ILE   3   9.161 -16.849 -18.665
   26   3HG2  ILE   3          3HG2      ILE   3   8.720 -15.152 -18.968
   27   1HD1  ILE   3          1HD1      ILE   3  12.528 -13.063 -17.662
   28   2HD1  ILE   3          2HD1      ILE   3  12.731 -14.770 -17.204
   29   3HD1  ILE   3          3HD1      ILE   3  12.074 -14.351 -18.803
   30    H    ARG   4           H        ARG   4  10.337 -14.568 -14.524
   31    HA   ARG   4           HA       ARG   4  10.092 -16.779 -12.527
   32   1HB   ARG   4          2HB       ARG   4  12.409 -14.816 -13.004
   33   2HB   ARG   4          1HB       ARG   4  12.413 -16.152 -11.905
   34   1HG   ARG   4          2HG       ARG   4  11.762 -17.063 -14.574
   35   2HG   ARG   4          1HG       ARG   4  13.268 -16.130 -14.528
   36   1HD   ARG   4          2HD       ARG   4  13.817 -17.525 -12.424
   37   2HD   ARG   4          1HD       ARG   4  12.523 -18.618 -13.012
   38    HE   ARG   4           HE       ARG   4  14.120 -18.061 -15.216
   39   1HH1  ARG   4          2HH2      ARG   4  14.627 -19.663 -12.142
   40   2HH1  ARG   4          1HH2      ARG   4  15.924 -20.658 -12.722
   41   1HH2  ARG   4          1HH1      ARG   4  15.843 -19.373 -15.954
   42   2HH2  ARG   4          2HH1      ARG   4  16.587 -20.487 -14.859
   43    H    VAL   5           H        VAL   5  10.540 -13.229 -12.865
   44    HA   VAL   5           HA       VAL   5  10.056 -12.552 -10.123
   45    HB   VAL   5           HB       VAL   5  11.383 -11.160 -11.473
   46   1HG1  VAL   5          1HG1      VAL   5  10.462  -9.704 -13.224
   47   2HG1  VAL   5          2HG1      VAL   5  10.353 -11.418 -13.694
   48   3HG1  VAL   5          3HG1      VAL   5   8.903 -10.557 -13.126
   49   1HG2  VAL   5          1HG2      VAL   5  10.421  -9.012 -10.934
   50   2HG2  VAL   5          2HG2      VAL   5   8.874  -9.807 -10.553
   51   3HG2  VAL   5          3HG2      VAL   5  10.326 -10.183  -9.597
   52    H    ALA   6           H        ALA   6   8.009 -12.744 -13.034
   53    HA   ALA   6           HA       ALA   6   5.745 -12.788 -13.431
   54   1HB   ALA   6          1HB       ALA   6   4.293 -13.730 -11.786
   55   2HB   ALA   6          2HB       ALA   6   5.769 -14.701 -12.004
   56   3HB   ALA   6          3HB       ALA   6   5.589 -13.663 -10.570
   57    H    ILE   7           H        ILE   7   7.168 -10.327 -12.465
   58    HA   ILE   7           HA       ILE   7   6.763  -8.106 -12.103
   59    HB   ILE   7           HB       ILE   7   4.768  -8.755 -13.581
   60   1HG1  ILE   7          2HG1      ILE   7   6.174  -6.963 -13.816
   61   2HG1  ILE   7          1HG1      ILE   7   4.447  -6.464 -13.901
   62   1HG2  ILE   7          1HG2      ILE   7   2.729  -7.673 -12.785
   63   2HG2  ILE   7          2HG2      ILE   7   3.086  -9.140 -11.843
   64   3HG2  ILE   7          3HG2      ILE   7   3.422  -7.534 -11.152
   65   1HD1  ILE   7          1HD1      ILE   7   5.820  -4.771 -12.811
   66   2HD1  ILE   7          2HD1      ILE   7   4.636  -5.465 -11.678
   67   3HD1  ILE   7          3HD1      ILE   7   6.345  -5.960 -11.593
   68    H    LEU   8           H        LEU   8   4.434 -10.075 -10.283
   69    HA   LEU   8           HA       LEU   8   3.735 -10.171  -8.096
   70   1HB   LEU   8          2HB       LEU   8   6.605  -9.839  -7.978
   71   2HB   LEU   8          1HB       LEU   8   5.727  -9.245  -6.526
   72    HG   LEU   8           HG       LEU   8   6.463 -11.623  -6.263
   73   1HD1  LEU   8          1HD1      LEU   8   4.356 -12.465  -5.515
   74   2HD1  LEU   8          2HD1      LEU   8   4.572 -10.757  -5.064
   75   3HD1  LEU   8          3HD1      LEU   8   3.500 -11.189  -6.417
   76   1HD2  LEU   8          1HD2      LEU   8   5.436 -13.377  -7.538
   77   2HD2  LEU   8          2HD2      LEU   8   4.606 -12.191  -8.571
   78   3HD2  LEU   8          3HD2      LEU   8   6.380 -12.317  -8.613
   79    H    TRP   9           H        TRP   9   2.324  -8.970  -7.003
   80    HA   TRP   9           HA       TRP   9   2.221  -6.080  -7.213
   81   1HB   TRP   9          2HB       TRP   9   0.594  -7.939  -5.606
   82   2HB   TRP   9          1HB       TRP   9   0.446  -6.196  -5.600
   83    HD1  TRP   9           HD       TRP   9   1.146  -6.151  -8.949
   84    HE1  TRP   9           1HE      TRP   9  -0.889  -6.434 -10.418
   85    HE3  TRP   9           3HE      TRP   9  -1.745  -8.566  -5.628
   86    HZ2  TRP   9           2HZ      TRP   9  -3.418  -7.665 -10.210
   87    HZ3  TRP   9           3HZ      TRP   9  -4.134  -8.975  -6.183
   88    HH2  TRP   9           HH       TRP   9  -4.955  -8.520  -8.477
   89    H    HIS  10           H        HIS  10   3.982  -8.223  -5.113
   90    HA   HIS  10           HA       HIS  10   4.422  -6.479  -2.840
   91   1HB   HIS  10          2HB       HIS  10   4.749  -8.581  -2.253
   92   2HB   HIS  10          1HB       HIS  10   5.169  -9.101  -3.927
   93    HD1  HIS  10           1HD      HIS  10   6.685  -8.855  -0.652
   94    HD2  HIS  10           2HD      HIS  10   7.833  -8.333  -4.612
   95    HE1  HIS  10           1HE      HIS  10   9.264  -8.867  -0.691
   96    H    GLU  11           H        GLU  11   5.912  -6.897  -6.066
   97    HA   GLU  11           HA       GLU  11   8.485  -5.736  -5.434
   98   1HB   GLU  11          2HB       GLU  11   7.100  -6.304  -8.081
   99   2HB   GLU  11          1HB       GLU  11   8.737  -5.717  -7.923
  100   1HG   GLU  11          2HG       GLU  11   7.871  -8.294  -6.548
  101   2HG   GLU  11          1HG       GLU  11   8.431  -8.267  -8.187
  102    H    MET  12           H        MET  12   5.650  -4.564  -7.350
  103    HA   MET  12           HA       MET  12   6.426  -1.794  -7.379
  104   1HB   MET  12          2HB       MET  12   4.247  -1.365  -8.227
  105   2HB   MET  12          1HB       MET  12   4.870  -2.798  -9.015
  106   1HG   MET  12          2HG       MET  12   3.631  -4.123  -7.214
  107   2HG   MET  12          1HG       MET  12   2.780  -2.574  -6.887
  108   1HE   MET  12          1HE       MET  12   2.613  -5.079 -10.702
  109   2HE   MET  12          2HE       MET  12   4.062  -4.206 -10.148
  110   3HE   MET  12          3HE       MET  12   3.395  -5.536  -9.170
  111    H    TRP  13           H        TRP  13   4.747  -3.802  -4.867
  112    HA   TRP  13           HA       TRP  13   3.597  -1.777  -3.323
  113   1HB   TRP  13          2HB       TRP  13   4.516  -4.491  -2.822
  114   2HB   TRP  13          1HB       TRP  13   4.215  -3.386  -1.439
  115    HD1  TRP  13           HD       TRP  13   2.253  -5.081  -0.795
  116    HE1  TRP  13           1HE      TRP  13  -0.135  -5.349  -1.627
  117    HE3  TRP  13           3HE      TRP  13   2.624  -2.451  -5.093
  118    HZ2  TRP  13           2HZ      TRP  13  -1.646  -4.555  -3.879
  119    HZ3  TRP  13           3HZ      TRP  13   0.708  -2.203  -6.559
  120    HH2  TRP  13           HH       TRP  13  -1.480  -3.139  -5.900
  121    H    HIS  14           H        HIS  14   7.008  -2.898  -3.256
  122    HA   HIS  14           HA       HIS  14   7.961  -1.328  -1.117
  123   1HB   HIS  14          2HB       HIS  14   9.018  -2.949  -3.223
  124   2HB   HIS  14          1HB       HIS  14   9.906  -1.431  -3.198
  125    HD1  HIS  14           1HD      HIS  14  10.508  -4.496  -1.937
  126    HD2  HIS  14           2HD      HIS  14  10.046  -0.811  -0.110
  127    HE1  HIS  14           1HE      HIS  14  12.058  -4.520   0.101
  128    H    GLU  15           H        GLU  15   8.307  -0.453  -4.580
  129    HA   GLU  15           HA       GLU  15   8.980   2.269  -4.071
  130   1HB   GLU  15          2HB       GLU  15   8.335   0.652  -6.516
  131   2HB   GLU  15          1HB       GLU  15   8.383   2.413  -6.625
  132   1HG   GLU  15          2HG       GLU  15  10.699   1.529  -5.123
  133   2HG   GLU  15          1HG       GLU  15  10.600   0.602  -6.612
  134    H    GLY  16           H        GLY  16   5.819   0.724  -5.163
  135   1HA   GLY  16          2HA       GLY  16   4.287   3.051  -5.420
  136   2HA   GLY  16          1HA       GLY  16   3.696   1.478  -4.944
  137    H    LEU  17           H        LEU  17   5.202   1.246  -2.423
  138    HA   LEU  17           HA       LEU  17   3.743   3.063  -0.665
  139   1HB   LEU  17          2HB       LEU  17   5.644   0.834  -0.230
  140   2HB   LEU  17          1HB       LEU  17   5.029   1.911   1.061
  141    HG   LEU  17           HG       LEU  17   3.145   0.570  -0.920
  142   1HD1  LEU  17          1HD1      LEU  17   2.744  -1.186   0.741
  143   2HD1  LEU  17          2HD1      LEU  17   4.430  -1.223   0.169
  144   3HD1  LEU  17          3HD1      LEU  17   4.045  -0.530   1.762
  145   1HD2  LEU  17          1HD2      LEU  17   1.529   0.921   0.903
  146   2HD2  LEU  17          2HD2      LEU  17   2.814   1.618   1.917
  147   3HD2  LEU  17          3HD2      LEU  17   2.299   2.455   0.433
  148    H    GLU  18           H        GLU  18   6.989   2.997  -2.120
  149    HA   GLU  18           HA       GLU  18   8.156   4.877  -0.246
  150   1HB   GLU  18          2HB       GLU  18   9.439   3.215  -1.677
  151   2HB   GLU  18          1HB       GLU  18   9.151   4.319  -3.029
  152   1HG   GLU  18          2HG       GLU  18  10.983   5.476  -2.319
  153   2HG   GLU  18          1HG       GLU  18  10.031   6.006  -0.938
  154    H    GLU  19           H        GLU  19   7.076   5.154  -3.736
  155    HA   GLU  19           HA       GLU  19   7.248   7.976  -4.010
  156   1HB   GLU  19          2HB       GLU  19   6.940   6.268  -5.869
  157   2HB   GLU  19          1HB       GLU  19   5.266   6.169  -5.423
  158   1HG   GLU  19          2HG       GLU  19   5.409   7.671  -7.172
  159   2HG   GLU  19          1HG       GLU  19   5.128   8.663  -5.709
  160    H    ALA  20           H        ALA  20   4.840   6.013  -2.323
  161    HA   ALA  20           HA       ALA  20   2.902   8.172  -2.100
  162   1HB   ALA  20          1HB       ALA  20   1.706   6.387  -0.802
  163   2HB   ALA  20          2HB       ALA  20   2.243   5.798  -2.394
  164   3HB   ALA  20          3HB       ALA  20   3.153   5.357  -0.930
  165    H    SER  21           H        SER  21   4.700   6.113   0.263
  166    HA   SER  21           HA       SER  21   4.176   7.629   2.587
  167   1HB   SER  21          2HB       SER  21   6.463   5.767   1.985
  168   2HB   SER  21          1HB       SER  21   5.991   6.391   3.581
  169    HG   SER  21           HG       SER  21   5.112   4.198   2.834
  170    H    ARG  22           H        ARG  22   6.625   8.007  -0.008
  171    HA   ARG  22           HA       ARG  22   8.100  10.188   1.258
  172   1HB   ARG  22          2HB       ARG  22   9.007   8.516  -0.483
  173   2HB   ARG  22          1HB       ARG  22   8.060   9.384  -1.668
  174   1HG   ARG  22          2HG       ARG  22   9.613  10.910  -1.836
  175   2HG   ARG  22          1HG       ARG  22   9.479  11.289  -0.092
  176   1HD   ARG  22          2HD       ARG  22  10.778   8.831  -0.128
  177   2HD   ARG  22          1HD       ARG  22  11.493   9.691  -1.523
  178    HE   ARG  22           HE       ARG  22  11.335  11.474   0.662
  179   1HH1  ARG  22          2HH2      ARG  22  13.162   8.619  -0.223
  180   2HH1  ARG  22          1HH2      ARG  22  14.541   9.034   0.743
  181   1HH2  ARG  22          1HH1      ARG  22  13.154  11.996   1.938
  182   2HH2  ARG  22          2HH1      ARG  22  14.523  10.937   1.947
  183    H    LEU  23           H        LEU  23   5.283   9.972  -1.058
  184    HA   LEU  23           HA       LEU  23   5.188  12.740  -1.750
  185   1HB   LEU  23          2HB       LEU  23   3.315  10.504  -1.834
  186   2HB   LEU  23          1HB       LEU  23   2.643  12.136  -1.764
  187    HG   LEU  23           HG       LEU  23   4.927  11.526  -3.652
  188   1HD1  LEU  23          1HD1      LEU  23   3.309  11.011  -5.412
  189   2HD1  LEU  23          2HD1      LEU  23   3.244   9.802  -4.107
  190   3HD1  LEU  23          3HD1      LEU  23   1.986  11.055  -4.223
  191   1HD2  LEU  23          1HD2      LEU  23   3.858  13.349  -4.929
  192   2HD2  LEU  23          2HD2      LEU  23   2.565  13.455  -3.711
  193   3HD2  LEU  23          3HD2      LEU  23   4.238  13.876  -3.273
  194    H    TYR  24           H        TYR  24   4.247  11.028   1.192
  195    HA   TYR  24           HA       TYR  24   3.335  13.592   2.422
  196   1HB   TYR  24          2HB       TYR  24   1.801  11.884   2.996
  197   2HB   TYR  24          1HB       TYR  24   3.013  10.655   3.097
  198    HD1  TYR  24           1HD      TYR  24   4.017  10.062   5.111
  199    HD2  TYR  24           2HD      TYR  24   1.706  13.668   4.806
  200    HE1  TYR  24           1HE      TYR  24   4.110  10.318   7.559
  201    HE2  TYR  24           2HE      TYR  24   1.779  13.931   7.254
  202    HH   TYR  24           HH       TYR  24   2.302  12.964   9.186
  203    H    PHE  25           H        PHE  25   5.653  10.910   3.370
  204    HA   PHE  25           HA       PHE  25   6.813  12.409   5.547
  205   1HB   PHE  25          2HB       PHE  25   6.674   9.781   4.769
  206   2HB   PHE  25          1HB       PHE  25   8.327  10.196   4.344
  207    HD1  PHE  25           1HD      PHE  25   9.786  11.316   6.067
  208    HD2  PHE  25           2HD      PHE  25   6.083   9.352   6.997
  209    HE1  PHE  25           1HE      PHE  25  10.506  11.106   8.412
  210    HE2  PHE  25           2HE      PHE  25   6.844   9.048   9.341
  211    HZ   PHE  25           HZ       PHE  25   9.043   9.952  10.056
  212    H    GLY  26           H        GLY  26   7.193  12.769   2.144
  213   1HA   GLY  26          2HA       GLY  26   9.804  14.193   2.499
  214   2HA   GLY  26          1HA       GLY  26   9.299  13.400   1.029
  215    H    GLU  27           H        GLU  27   6.545  14.314   0.857
  216    HA   GLU  27           HA       GLU  27   7.064  17.212   0.498
  217   1HB   GLU  27          2HB       GLU  27   4.978  15.884  -1.100
  218   2HB   GLU  27          1HB       GLU  27   6.157  17.182  -1.520
  219   1HG   GLU  27          2HG       GLU  27   6.568  14.201  -1.532
  220   2HG   GLU  27          1HG       GLU  27   6.563  15.340  -2.923
  221    H    ARG  28           H        ARG  28   5.402  15.405   2.672
  222    HA   ARG  28           HA       ARG  28   3.412  15.300   3.686
  223   1HB   ARG  28          2HB       ARG  28   4.004  18.191   3.696
  224   2HB   ARG  28          1HB       ARG  28   2.630  17.462   4.566
  225   1HG   ARG  28          2HG       ARG  28   4.412  15.742   5.439
  226   2HG   ARG  28          1HG       ARG  28   5.601  16.959   4.938
  227   1HD   ARG  28          2HD       ARG  28   5.137  18.275   6.668
  228   2HD   ARG  28          1HD       ARG  28   3.366  18.117   6.406
  229    HE   ARG  28           HE       ARG  28   4.231  15.654   7.363
  230   1HH1  ARG  28          2HH2      ARG  28   4.304  18.900   8.661
  231   2HH1  ARG  28          1HH2      ARG  28   4.210  18.397  10.317
  232   1HH2  ARG  28          1HH1      ARG  28   4.147  14.998   9.568
  233   2HH2  ARG  28          2HH1      ARG  28   4.086  16.208  10.804
  234    H    ASN  29           H        ASN  29   3.178  15.206   0.803
  235    HA   ASN  29           HA       ASN  29   0.608  16.506   0.325
  236   1HB   ASN  29          2HB       ASN  29   2.817  16.613  -1.211
  237   2HB   ASN  29          1HB       ASN  29   2.192  15.101  -1.842
  238   1HD2  ASN  29          2HD2      ASN  29  -0.684  16.167  -1.215
  239   2HD2  ASN  29          1HD2      ASN  29  -0.933  17.187  -2.606
  240    H    VAL  30           H        VAL  30  -0.238  14.935   1.841
  241    HA   VAL  30           HA       VAL  30  -0.519  12.180   1.480
  242    HB   VAL  30           HB       VAL  30  -2.497  14.219   2.543
  243   1HG1  VAL  30          1HG1      VAL  30  -3.512  12.287   3.686
  244   2HG1  VAL  30          2HG1      VAL  30  -3.600  12.097   1.920
  245   3HG1  VAL  30          3HG1      VAL  30  -2.383  11.193   2.851
  246   1HG2  VAL  30          1HG2      VAL  30  -1.684  13.536   4.732
  247   2HG2  VAL  30          2HG2      VAL  30  -0.477  12.476   3.967
  248   3HG2  VAL  30          3HG2      VAL  30  -0.381  14.240   3.745
  249    H    LYS  31           H        LYS  31  -2.292  14.875  -0.060
  250    HA   LYS  31           HA       LYS  31  -4.221  13.486  -1.569
  251   1HB   LYS  31          2HB       LYS  31  -4.269  15.810  -1.153
  252   2HB   LYS  31          1HB       LYS  31  -2.665  16.036  -1.947
  253   1HG   LYS  31          2HG       LYS  31  -5.144  15.202  -3.481
  254   2HG   LYS  31          1HG       LYS  31  -4.700  16.882  -3.229
  255   1HD   LYS  31          2HD       LYS  31  -2.301  15.814  -4.164
  256   2HD   LYS  31          1HD       LYS  31  -3.474  14.883  -5.047
  257   1HE   LYS  31          2HE       LYS  31  -4.593  17.168  -5.509
  258   2HE   LYS  31          1HE       LYS  31  -2.983  17.806  -5.053
  259   1HZ   LYS  31          1HZ       LYS  31  -3.060  17.298  -7.378
  260   2HZ   LYS  31          2HZ       LYS  31  -2.045  16.236  -6.654
  261   3HZ   LYS  31          3HZ       LYS  31  -3.551  15.771  -7.077
  262    H    GLY  32           H        GLY  32  -0.684  14.023  -2.162
  263   1HA   GLY  32          2HA       GLY  32  -0.650  13.117  -4.903
  264   2HA   GLY  32          1HA       GLY  32   0.718  13.385  -3.830
  265    H    MET  33           H        MET  33   0.626  11.686  -1.821
  266    HA   MET  33           HA       MET  33   1.185   9.096  -2.573
  267   1HB   MET  33          2HB       MET  33   1.429   8.753  -0.451
  268   2HB   MET  33          1HB       MET  33   1.217  10.544  -0.364
  269   1HG   MET  33          2HG       MET  33  -0.027   9.657   1.480
  270   2HG   MET  33          1HG       MET  33  -1.233  10.024   0.293
  271   1HE   MET  33          1HE       MET  33   0.343   5.878   1.343
  272   2HE   MET  33          2HE       MET  33   1.313   7.098   0.483
  273   3HE   MET  33          3HE       MET  33   0.773   7.404   2.151
  274    H    PHE  34           H        PHE  34  -2.008  10.459  -2.043
  275    HA   PHE  34           HA       PHE  34  -3.581   8.052  -1.983
  276   1HB   PHE  34          2HB       PHE  34  -3.895  10.747  -1.460
  277   2HB   PHE  34          1HB       PHE  34  -4.760  10.553  -2.994
  278    HD1  PHE  34           1HD      PHE  34  -4.776   9.922   0.555
  279    HD2  PHE  34           2HD      PHE  34  -6.502   8.712  -3.186
  280    HE1  PHE  34           1HE      PHE  34  -6.652   8.866   1.764
  281    HE2  PHE  34           2HE      PHE  34  -8.427   7.708  -1.974
  282    HZ   PHE  34           HZ       PHE  34  -8.502   7.788   0.503
  283    H    GLU  35           H        GLU  35  -2.038   9.795  -4.591
  284    HA   GLU  35           HA       GLU  35  -3.838   8.743  -6.693
  285   1HB   GLU  35          2HB       GLU  35  -2.926  11.159  -6.627
  286   2HB   GLU  35          1HB       GLU  35  -1.371  10.474  -7.035
  287   1HG   GLU  35          2HG       GLU  35  -3.362   9.364  -8.834
  288   2HG   GLU  35          1HG       GLU  35  -3.495  11.106  -8.809
  289    H    VAL  36           H        VAL  36  -0.582   8.167  -5.261
  290    HA   VAL  36           HA       VAL  36   0.144   6.255  -7.398
  291    HB   VAL  36           HB       VAL  36   1.843   7.782  -6.589
  292   1HG1  VAL  36          1HG1      VAL  36   2.862   7.422  -4.451
  293   2HG1  VAL  36          2HG1      VAL  36   1.178   7.960  -4.241
  294   3HG1  VAL  36          3HG1      VAL  36   1.602   6.247  -4.007
  295   1HG2  VAL  36          1HG2      VAL  36   3.564   6.199  -6.404
  296   2HG2  VAL  36          2HG2      VAL  36   2.378   4.892  -6.169
  297   3HG2  VAL  36          3HG2      VAL  36   2.418   5.792  -7.704
  298    H    LEU  37           H        LEU  37  -1.233   6.275  -4.101
  299    HA   LEU  37           HA       LEU  37  -1.166   3.364  -3.750
  300   1HB   LEU  37          2HB       LEU  37  -1.409   5.621  -2.123
  301   2HB   LEU  37          1HB       LEU  37  -2.939   4.683  -2.016
  302    HG   LEU  37           HG       LEU  37  -1.490   3.908  -0.231
  303   1HD1  LEU  37          1HD1      LEU  37  -1.181   1.614  -0.670
  304   2HD1  LEU  37          2HD1      LEU  37  -2.765   2.188  -1.246
  305   3HD1  LEU  37          3HD1      LEU  37  -1.453   1.878  -2.410
  306   1HD2  LEU  37          1HD2      LEU  37   0.721   3.036  -0.605
  307   2HD2  LEU  37          2HD2      LEU  37   0.631   3.457  -2.332
  308   3HD2  LEU  37          3HD2      LEU  37   0.642   4.743  -1.101
  309    H    GLU  38           H        GLU  38  -3.488   5.804  -4.989
  310    HA   GLU  38           HA       GLU  38  -5.878   4.412  -5.128
  311   1HB   GLU  38          2HB       GLU  38  -4.707   6.655  -6.467
  312   2HB   GLU  38          1HB       GLU  38  -5.499   5.640  -7.645
  313   1HG   GLU  38          2HG       GLU  38  -7.372   5.613  -5.678
  314   2HG   GLU  38          1HG       GLU  38  -6.637   7.209  -5.433
  315    HA   PRO  39           HA       PRO  39  -4.588   1.699  -8.863
  316   1HB   PRO  39          2HB       PRO  39  -2.105   1.585  -9.818
  317   2HB   PRO  39          1HB       PRO  39  -3.249   2.807 -10.369
  318   1HG   PRO  39          2HG       PRO  39  -1.024   3.092  -8.297
  319   2HG   PRO  39          1HG       PRO  39  -1.439   4.193  -9.608
  320   1HD   PRO  39          1HD       PRO  39  -2.385   4.567  -7.009
  321   2HD   PRO  39          2HD       PRO  39  -3.365   5.052  -8.449
  322    H    LEU  40           H        LEU  40  -1.955   2.011  -6.333
  323    HA   LEU  40           HA       LEU  40  -1.353  -0.788  -6.145
  324   1HB   LEU  40          2HB       LEU  40  -1.268   1.249  -3.975
  325   2HB   LEU  40          1HB       LEU  40  -0.342  -0.274  -4.151
  326    HG   LEU  40           HG       LEU  40  -0.120   2.038  -6.073
  327   1HD1  LEU  40          1HD1      LEU  40   1.915   2.612  -4.716
  328   2HD1  LEU  40          2HD1      LEU  40   0.421   2.722  -3.755
  329   3HD1  LEU  40          3HD1      LEU  40   1.490   1.312  -3.577
  330   1HD2  LEU  40          1HD2      LEU  40   2.068   1.100  -6.636
  331   2HD2  LEU  40          2HD2      LEU  40   1.789  -0.252  -5.513
  332   3HD2  LEU  40          3HD2      LEU  40   0.766  -0.070  -6.958
  333    H    HIS  41           H        HIS  41  -4.122   1.029  -4.835
  334    HA   HIS  41           HA       HIS  41  -5.153  -1.215  -3.285
  335   1HB   HIS  41          2HB       HIS  41  -5.714   0.848  -2.518
  336   2HB   HIS  41          1HB       HIS  41  -5.994   1.503  -4.174
  337    HD1  HIS  41           1HD      HIS  41  -8.343   2.146  -4.333
  338    HD2  HIS  41           2HD      HIS  41  -7.828  -1.346  -2.174
  339    HE1  HIS  41           1HE      HIS  41 -10.698   1.214  -3.933
  340    H    ALA  42           H        ALA  42  -5.901   0.187  -6.530
  341    HA   ALA  42           HA       ALA  42  -8.102  -1.595  -7.134
  342   1HB   ALA  42          1HB       ALA  42  -7.855  -0.727  -9.368
  343   2HB   ALA  42          2HB       ALA  42  -7.858   0.580  -8.160
  344   3HB   ALA  42          3HB       ALA  42  -6.328   0.067  -8.912
  345    H    MET  43           H        MET  43  -4.599  -1.624  -7.853
  346    HA   MET  43           HA       MET  43  -4.390  -4.134  -9.237
  347   1HB   MET  43          2HB       MET  43  -2.417  -2.431  -7.650
  348   2HB   MET  43          1HB       MET  43  -1.975  -3.891  -8.479
  349   1HG   MET  43          2HG       MET  43  -2.391  -2.954 -10.607
  350   2HG   MET  43          1HG       MET  43  -3.339  -1.631  -9.946
  351   1HE   MET  43          1HE       MET  43  -0.001  -0.123 -11.472
  352   2HE   MET  43          2HE       MET  43  -0.773  -1.644 -11.979
  353   3HE   MET  43          3HE       MET  43  -1.772  -0.214 -11.624
  354    H    MET  44           H        MET  44  -5.333  -3.603  -5.957
  355    HA   MET  44           HA       MET  44  -4.325  -6.281  -5.147
  356   1HB   MET  44          2HB       MET  44  -3.601  -4.769  -3.630
  357   2HB   MET  44          1HB       MET  44  -5.097  -3.777  -3.737
  358   1HG   MET  44          2HG       MET  44  -5.135  -6.542  -2.479
  359   2HG   MET  44          1HG       MET  44  -4.691  -5.134  -1.550
  360   1HE   MET  44          1HE       MET  44  -8.604  -6.601  -1.278
  361   2HE   MET  44          2HE       MET  44  -7.367  -7.434  -2.249
  362   3HE   MET  44          3HE       MET  44  -6.983  -6.887  -0.599
  363    H    GLU  45           H        GLU  45  -7.228  -4.331  -5.842
  364    HA   GLU  45           HA       GLU  45  -9.194  -6.170  -4.734
  365   1HB   GLU  45          2HB       GLU  45  -9.373  -3.633  -4.964
  366   2HB   GLU  45          1HB       GLU  45  -9.701  -3.924  -6.660
  367   1HG   GLU  45          2HG       GLU  45 -11.210  -5.618  -4.767
  368   2HG   GLU  45          1HG       GLU  45 -11.569  -3.859  -4.751
  369    H    ARG  46           H        ARG  46  -7.962  -5.509  -8.087
  370    HA   ARG  46           HA       ARG  46  -9.488  -7.054  -9.696
  371   1HB   ARG  46          2HB       ARG  46  -7.038  -5.904  -9.938
  372   2HB   ARG  46          1HB       ARG  46  -6.602  -7.620  -9.971
  373   1HG   ARG  46          2HG       ARG  46  -7.045  -7.084 -12.220
  374   2HG   ARG  46          1HG       ARG  46  -8.537  -7.890 -11.662
  375   1HD   ARG  46          2HD       ARG  46  -9.163  -5.315 -11.003
  376   2HD   ARG  46          1HD       ARG  46  -8.084  -4.985 -12.351
  377    HE   ARG  46           HE       ARG  46  -9.938  -7.014 -13.054
  378   1HH1  ARG  46          2HH2      ARG  46  -9.827  -3.559 -12.445
  379   2HH1  ARG  46          1HH2      ARG  46 -11.190  -3.199 -13.456
  380   1HH2  ARG  46          1HH1      ARG  46 -11.742  -6.500 -14.382
  381   2HH2  ARG  46          2HH1      ARG  46 -12.244  -4.852 -14.537
  382    H    GLY  47           H        GLY  47  -7.149  -8.394  -7.326
  383   1HA   GLY  47          2HA       GLY  47  -7.743 -10.418  -6.181
  384   2HA   GLY  47          1HA       GLY  47  -8.463 -11.043  -7.661
  385    HA   PRO  48           HA       PRO  48  -3.785 -12.041  -7.321
  386   1HB   PRO  48          2HB       PRO  48  -3.754 -14.378  -6.098
  387   2HB   PRO  48          1HB       PRO  48  -3.595 -12.769  -5.242
  388   1HG   PRO  48          2HG       PRO  48  -6.065 -14.607  -5.456
  389   2HG   PRO  48          1HG       PRO  48  -5.489 -13.764  -4.018
  390   1HD   PRO  48          1HD       PRO  48  -7.462 -12.675  -5.727
  391   2HD   PRO  48          2HD       PRO  48  -6.289 -11.607  -4.823
  392    H    GLN  49           H        GLN  49  -2.955 -13.149  -8.957
  393    HA   GLN  49           HA       GLN  49  -4.696 -14.842 -10.610
  394   1HB   GLN  49          2HB       GLN  49  -3.565 -13.031 -11.739
  395   2HB   GLN  49          1HB       GLN  49  -2.008 -13.538 -11.142
  396   1HG   GLN  49          2HG       GLN  49  -1.784 -14.672 -12.993
  397   2HG   GLN  49          1HG       GLN  49  -3.010 -15.820 -12.358
  398   1HE2  GLN  49          2HE2      GLN  49  -2.653 -15.724 -14.992
  399   2HE2  GLN  49          1HE2      GLN  49  -3.939 -14.822 -15.753
  400    H    THR  50           H        THR  50  -1.235 -15.297 -10.519
  401    HA   THR  50           HA       THR  50  -1.061 -18.035 -10.392
  402    HB   THR  50           HB       THR  50   0.734 -17.099 -11.215
  403    HG1  THR  50           1HG      THR  50   2.484 -17.721  -9.808
  404   1HG2  THR  50          1HG2      THR  50   2.207 -15.441 -10.176
  405   2HG2  THR  50          2HG2      THR  50   0.563 -14.792 -10.396
  406   3HG2  THR  50          3HG2      THR  50   1.105 -15.318  -8.784
  407    H    LEU  51           H        LEU  51   0.763 -17.003  -7.793
  408    HA   LEU  51           HA       LEU  51  -0.981 -17.112  -5.474
  409   1HB   LEU  51          2HB       LEU  51  -0.290 -19.584  -6.678
  410   2HB   LEU  51          1HB       LEU  51   0.752 -19.410  -5.257
  411    HG   LEU  51           HG       LEU  51  -2.157 -18.702  -4.967
  412   1HD1  LEU  51          1HD1      LEU  51  -2.706 -21.058  -4.530
  413   2HD1  LEU  51          2HD1      LEU  51  -2.191 -20.820  -6.217
  414   3HD1  LEU  51          3HD1      LEU  51  -1.069 -21.540  -5.037
  415   1HD2  LEU  51          1HD2      LEU  51  -1.761 -19.628  -2.719
  416   2HD2  LEU  51          2HD2      LEU  51  -0.111 -20.095  -3.192
  417   3HD2  LEU  51          3HD2      LEU  51  -0.558 -18.374  -3.106
  418    H    LYS  52           H        LYS  52   1.112 -15.396  -6.606
  419    HA   LYS  52           HA       LYS  52   3.214 -15.655  -4.485
  420   1HB   LYS  52          2HB       LYS  52   3.410 -14.379  -7.179
  421   2HB   LYS  52          1HB       LYS  52   4.681 -14.491  -5.922
  422   1HG   LYS  52          2HG       LYS  52   4.435 -17.054  -6.147
  423   2HG   LYS  52          1HG       LYS  52   3.506 -16.741  -7.603
  424   1HD   LYS  52          2HD       LYS  52   5.457 -15.418  -8.500
  425   2HD   LYS  52          1HD       LYS  52   6.383 -15.907  -7.078
  426   1HE   LYS  52          2HE       LYS  52   5.757 -18.351  -7.747
  427   2HE   LYS  52          1HE       LYS  52   5.297 -17.667  -9.302
  428   1HZ   LYS  52          1HZ       LYS  52   7.512 -18.373  -9.333
  429   2HZ   LYS  52          2HZ       LYS  52   7.525 -16.741  -9.433
  430   3HZ   LYS  52          3HZ       LYS  52   7.904 -17.480  -8.031
  431    H    GLU  53           H        GLU  53   1.234 -13.244  -6.313
  432    HA   GLU  53           HA       GLU  53   1.731 -11.119  -4.461
  433   1HB   GLU  53          2HB       GLU  53   0.090  -9.884  -5.707
  434   2HB   GLU  53          1HB       GLU  53   1.411 -10.597  -6.690
  435   1HG   GLU  53          2HG       GLU  53  -0.927 -12.342  -6.628
  436   2HG   GLU  53          1HG       GLU  53  -1.345 -10.729  -7.219
  437    H    THR  54           H        THR  54   1.024 -12.967  -2.693
  438    HA   THR  54           HA       THR  54  -1.540 -12.003  -1.531
  439    HB   THR  54           HB       THR  54  -1.121 -14.854  -2.268
  440    HG1  THR  54           1HG      THR  54  -2.311 -12.609  -3.405
  441   1HG2  THR  54          1HG2      THR  54  -3.366 -15.277  -1.417
  442   2HG2  THR  54          2HG2      THR  54  -2.267 -14.776  -0.110
  443   3HG2  THR  54          3HG2      THR  54  -3.447 -13.621  -0.772
  444    H    SER  55           H        SER  55   1.337 -11.607  -0.830
  445    HA   SER  55           HA       SER  55   1.661 -13.081   1.676
  446   1HB   SER  55          2HB       SER  55   3.220 -10.747   0.584
  447   2HB   SER  55          1HB       SER  55   3.651 -11.791   1.957
  448    HG   SER  55           HG       SER  55   4.736 -12.644   0.199
  449    H    PHE  56           H        PHE  56   0.674  -9.821   0.668
  450    HA   PHE  56           HA       PHE  56   0.461  -8.736   3.368
  451   1HB   PHE  56          2HB       PHE  56  -0.394  -6.737   2.275
  452   2HB   PHE  56          1HB       PHE  56   1.110  -7.236   1.558
  453    HD1  PHE  56           1HD      PHE  56   1.209  -8.184  -0.673
  454    HD2  PHE  56           2HD      PHE  56  -2.533  -7.043   1.108
  455    HE1  PHE  56           1HE      PHE  56   0.109  -8.287  -2.901
  456    HE2  PHE  56           2HE      PHE  56  -3.641  -7.253  -1.080
  457    HZ   PHE  56           HZ       PHE  56  -2.315  -7.802  -3.106
  458    H    ASN  57           H        ASN  57  -1.947  -9.564   0.729
  459    HA   ASN  57           HA       ASN  57  -4.295  -9.377   2.261
  460   1HB   ASN  57          2HB       ASN  57  -4.180  -9.508  -0.200
  461   2HB   ASN  57          1HB       ASN  57  -3.706 -11.189  -0.089
  462   1HD2  ASN  57          2HD2      ASN  57  -5.396 -12.301  -0.815
  463   2HD2  ASN  57          1HD2      ASN  57  -6.999 -12.123  -0.151
  464    H    GLN  58           H        GLN  58  -1.778 -11.718   2.670
  465    HA   GLN  58           HA       GLN  58  -3.435 -13.949   3.633
  466   1HB   GLN  58          2HB       GLN  58  -0.816 -13.655   2.651
  467   2HB   GLN  58          1HB       GLN  58  -0.652 -14.025   4.359
  468   1HG   GLN  58          2HG       GLN  58  -2.222 -15.639   2.303
  469   2HG   GLN  58          1HG       GLN  58  -0.747 -16.114   3.127
  470   1HE2  GLN  58          2HE2      GLN  58  -4.139 -16.182   3.191
  471   2HE2  GLN  58          1HE2      GLN  58  -4.296 -16.756   4.831
  472    H    ALA  59           H        ALA  59  -1.360 -11.387   5.047
  473    HA   ALA  59           HA       ALA  59  -2.512 -11.977   7.771
  474   1HB   ALA  59          1HB       ALA  59  -0.377 -11.362   8.697
  475   2HB   ALA  59          2HB       ALA  59  -0.230 -12.771   7.619
  476   3HB   ALA  59          3HB       ALA  59   0.302 -11.166   7.063
  477    H    TYR  60           H        TYR  60  -0.815  -9.554   5.882
  478    HA   TYR  60           HA       TYR  60  -1.936  -7.217   7.294
  479   1HB   TYR  60          2HB       TYR  60  -0.462  -7.208   4.664
  480   2HB   TYR  60          1HB       TYR  60  -0.395  -6.026   6.020
  481    HD1  TYR  60           1HD      TYR  60   1.783  -7.525   4.262
  482    HD2  TYR  60           2HD      TYR  60   0.238  -8.062   8.241
  483    HE1  TYR  60           1HE      TYR  60   3.772  -8.865   4.855
  484    HE2  TYR  60           2HE      TYR  60   2.186  -9.426   8.822
  485    HH   TYR  60           HH       TYR  60   4.261  -9.995   8.203
  486    H    GLY  61           H        GLY  61  -4.048  -8.889   6.216
  487   1HA   GLY  61          2HA       GLY  61  -5.199  -8.059   3.763
  488   2HA   GLY  61          1HA       GLY  61  -6.086  -8.591   5.157
  489    H    ARG  62           H        ARG  62  -4.646  -6.201   6.580
  490    HA   ARG  62           HA       ARG  62  -6.581  -4.034   5.803
  491   1HB   ARG  62          2HB       ARG  62  -5.310  -4.816   8.467
  492   2HB   ARG  62          1HB       ARG  62  -6.242  -3.352   8.199
  493   1HG   ARG  62          2HG       ARG  62  -8.201  -4.605   7.655
  494   2HG   ARG  62          1HG       ARG  62  -7.272  -6.141   7.718
  495   1HD   ARG  62          2HD       ARG  62  -6.720  -5.713  10.084
  496   2HD   ARG  62          1HD       ARG  62  -7.631  -4.177  10.025
  497    HE   ARG  62           HE       ARG  62  -9.194  -6.450   9.178
  498   1HH1  ARG  62          2HH2      ARG  62  -8.132  -4.731  12.042
  499   2HH1  ARG  62          1HH2      ARG  62  -9.459  -5.265  13.022
  500   1HH2  ARG  62          1HH1      ARG  62 -10.935  -7.136  10.484
  501   2HH2  ARG  62          2HH1      ARG  62 -11.024  -6.616  12.134
  502    H    ASP  63           H        ASP  63  -3.514  -4.789   5.108
  503    HA   ASP  63           HA       ASP  63  -1.992  -2.532   6.005
  504   1HB   ASP  63          2HB       ASP  63  -1.356  -4.895   5.218
  505   2HB   ASP  63          1HB       ASP  63  -1.517  -4.240   3.574
  506    H    LEU  64           H        LEU  64  -1.032  -2.032   2.999
  507    HA   LEU  64           HA       LEU  64  -2.193   0.360   2.339
  508   1HB   LEU  64          2HB       LEU  64  -1.283   0.168   0.231
  509   2HB   LEU  64          1HB       LEU  64  -0.265  -0.881   1.156
  510    HG   LEU  64           HG       LEU  64  -2.641  -2.106  -0.200
  511   1HD1  LEU  64          1HD1      LEU  64  -1.373  -2.249  -2.254
  512   2HD1  LEU  64          2HD1      LEU  64  -1.750  -0.561  -1.840
  513   3HD1  LEU  64          3HD1      LEU  64  -0.112  -1.198  -1.567
  514   1HD2  LEU  64          1HD2      LEU  64  -1.070  -3.943  -0.463
  515   2HD2  LEU  64          2HD2      LEU  64   0.223  -2.975   0.282
  516   3HD2  LEU  64          3HD2      LEU  64  -1.188  -3.467   1.248
  517    H    MET  65           H        MET  65  -3.660  -2.825   1.611
  518    HA   MET  65           HA       MET  65  -5.899  -2.278   0.129
  519   1HB   MET  65          2HB       MET  65  -5.230  -4.457   0.881
  520   2HB   MET  65          1HB       MET  65  -5.602  -4.013   2.578
  521   1HG   MET  65          2HG       MET  65  -7.704  -3.931   0.427
  522   2HG   MET  65          1HG       MET  65  -7.287  -5.451   1.287
  523   1HE   MET  65          1HE       MET  65 -10.837  -4.056   2.601
  524   2HE   MET  65          2HE       MET  65 -10.129  -3.657   1.018
  525   3HE   MET  65          3HE       MET  65 -10.055  -5.327   1.632
  526    H    GLU  66           H        GLU  66  -5.850  -2.038   3.770
  527    HA   GLU  66           HA       GLU  66  -8.427  -0.589   3.756
  528   1HB   GLU  66          2HB       GLU  66  -7.696  -2.469   5.407
  529   2HB   GLU  66          1HB       GLU  66  -6.793  -1.182   6.194
  530   1HG   GLU  66          2HG       GLU  66  -8.697  -0.457   7.176
  531   2HG   GLU  66          1HG       GLU  66  -9.423  -0.157   5.605
  532    H    ALA  67           H        ALA  67  -4.962   0.060   3.910
  533    HA   ALA  67           HA       ALA  67  -5.007   2.683   5.124
  534   1HB   ALA  67          1HB       ALA  67  -2.809   2.866   4.192
  535   2HB   ALA  67          2HB       ALA  67  -3.031   1.311   5.028
  536   3HB   ALA  67          3HB       ALA  67  -3.057   1.377   3.250
  537    H    GLN  68           H        GLN  68  -5.656   1.553   1.791
  538    HA   GLN  68           HA       GLN  68  -6.257   4.333   0.939
  539   1HB   GLN  68          2HB       GLN  68  -4.868   2.893  -0.459
  540   2HB   GLN  68          1HB       GLN  68  -6.174   1.667  -0.493
  541   1HG   GLN  68          2HG       GLN  68  -6.349   2.780  -2.533
  542   2HG   GLN  68          1HG       GLN  68  -7.624   3.515  -1.501
  543   1HE2  GLN  68          2HE2      GLN  68  -7.702   5.239  -3.020
  544   2HE2  GLN  68          1HE2      GLN  68  -6.416   6.428  -3.012
  545    H    GLU  69           H        GLU  69  -7.953   1.133   1.379
  546    HA   GLU  69           HA       GLU  69 -10.560   2.013   0.611
  547   1HB   GLU  69          2HB       GLU  69  -9.432  -0.319   1.266
  548   2HB   GLU  69          1HB       GLU  69 -10.429   0.052   2.710
  549   1HG   GLU  69          2HG       GLU  69 -12.062   0.847   0.552
  550   2HG   GLU  69          1HG       GLU  69 -11.319  -0.628  -0.049
  551    H    TRP  70           H        TRP  70  -8.688   2.991   3.350
  552    HA   TRP  70           HA       TRP  70 -10.677   3.726   5.191
  553   1HB   TRP  70          2HB       TRP  70  -9.075   5.210   6.043
  554   2HB   TRP  70          1HB       TRP  70  -8.184   3.764   5.460
  555    HD1  TRP  70           HD       TRP  70  -8.541   5.479   2.329
  556    HE1  TRP  70           1HE      TRP  70  -6.430   6.684   1.767
  557    HE3  TRP  70           3HE      TRP  70  -6.711   5.736   6.988
  558    HZ2  TRP  70           2HZ      TRP  70  -4.158   7.506   3.103
  559    HZ3  TRP  70           3HZ      TRP  70  -4.402   6.581   7.258
  560    HH2  TRP  70           HH       TRP  70  -3.198   7.508   5.352
  561    H    CYS  71           H        CYS  71 -10.407   4.760   1.894
  562    HA   CYS  71           HA       CYS  71 -11.023   7.412   1.733
  563   1HB   CYS  71          2HB       CYS  71 -12.337   6.809  -0.291
  564   2HB   CYS  71          1HB       CYS  71 -10.846   5.931  -0.246
  565    HG   CYS  71           HG       CYS  71 -12.799   4.578  -1.237
  566    H    ARG  72           H        ARG  72 -13.331   4.780   2.700
  567    HA   ARG  72           HA       ARG  72 -15.620   6.311   3.070
  568   1HB   ARG  72          2HB       ARG  72 -14.671   3.728   3.717
  569   2HB   ARG  72          1HB       ARG  72 -15.277   4.431   5.242
  570   1HG   ARG  72          2HG       ARG  72 -17.350   5.176   3.807
  571   2HG   ARG  72          1HG       ARG  72 -16.785   3.992   2.629
  572   1HD   ARG  72          2HD       ARG  72 -18.237   2.707   3.896
  573   2HD   ARG  72          1HD       ARG  72 -16.710   2.377   4.728
  574    HE   ARG  72           HE       ARG  72 -17.935   4.680   5.850
  575   1HH1  ARG  72          2HH2      ARG  72 -18.296   1.196   5.810
  576   2HH1  ARG  72          1HH2      ARG  72 -19.182   1.133   7.298
  577   1HH2  ARG  72          1HH1      ARG  72 -19.122   4.566   7.824
  578   2HH2  ARG  72          2HH1      ARG  72 -19.623   3.020   8.413
  579    H    LYS  73           H        LYS  73 -12.869   5.953   5.292
  580    HA   LYS  73           HA       LYS  73 -14.022   7.580   7.467
  581   1HB   LYS  73          2HB       LYS  73 -11.484   5.993   7.098
  582   2HB   LYS  73          1HB       LYS  73 -11.783   7.062   8.476
  583   1HG   LYS  73          2HG       LYS  73 -13.764   5.726   9.140
  584   2HG   LYS  73          1HG       LYS  73 -13.683   4.776   7.692
  585   1HD   LYS  73          2HD       LYS  73 -11.189   4.701   9.254
  586   2HD   LYS  73          1HD       LYS  73 -12.611   4.086  10.090
  587   1HE   LYS  73          2HE       LYS  73 -13.085   2.764   7.902
  588   2HE   LYS  73          1HE       LYS  73 -11.403   3.140   7.486
  589   1HZ   LYS  73          1HZ       LYS  73 -11.639   1.068   8.663
  590   2HZ   LYS  73          2HZ       LYS  73 -10.729   2.126   9.513
  591   3HZ   LYS  73          3HZ       LYS  73 -12.272   1.837   9.952
  592    H    TYR  74           H        TYR  74 -11.316   7.677   5.105
  593    HA   TYR  74           HA       TYR  74 -10.393  10.318   5.709
  594   1HB   TYR  74          2HB       TYR  74  -9.234   8.448   4.389
  595   2HB   TYR  74          1HB       TYR  74 -10.212   8.918   3.010
  596    HD1  TYR  74           1HD      TYR  74  -8.998  10.103   1.494
  597    HD2  TYR  74           2HD      TYR  74  -8.361  10.846   5.671
  598    HE1  TYR  74           1HE      TYR  74  -7.153  11.651   0.939
  599    HE2  TYR  74           2HE      TYR  74  -6.618  12.490   5.119
  600    HH   TYR  74           HH       TYR  74  -5.602  13.609   3.524
  601    H    MET  75           H        MET  75 -13.228   9.319   3.934
  602    HA   MET  75           HA       MET  75 -13.790  11.838   2.585
  603   1HB   MET  75          2HB       MET  75 -15.217   9.215   2.920
  604   2HB   MET  75          1HB       MET  75 -16.051  10.640   2.311
  605   1HG   MET  75          2HG       MET  75 -13.561  10.493   0.901
  606   2HG   MET  75          1HG       MET  75 -14.251   8.880   0.899
  607   1HE   MET  75          1HE       MET  75 -14.979  11.097  -2.449
  608   2HE   MET  75          2HE       MET  75 -13.782  11.564  -1.216
  609   3HE   MET  75          3HE       MET  75 -13.883   9.873  -1.764
  610    H    LYS  76           H        LYS  76 -15.539  10.055   5.217
  611    HA   LYS  76           HA       LYS  76 -16.974  12.452   5.915
  612   1HB   LYS  76          2HB       LYS  76 -17.214   9.645   6.203
  613   2HB   LYS  76          1HB       LYS  76 -17.316  10.383   7.821
  614   1HG   LYS  76          2HG       LYS  76 -19.211  11.647   7.267
  615   2HG   LYS  76          1HG       LYS  76 -18.810  11.689   5.544
  616   1HD   LYS  76          2HD       LYS  76 -19.704   9.580   5.143
  617   2HD   LYS  76          1HD       LYS  76 -19.464   9.041   6.817
  618   1HE   LYS  76          2HE       LYS  76 -21.565   9.755   7.403
  619   2HE   LYS  76          1HE       LYS  76 -21.282  11.345   6.729
  620   1HZ   LYS  76          1HZ       LYS  76 -23.050  10.154   5.729
  621   2HZ   LYS  76          2HZ       LYS  76 -21.905  10.571   4.648
  622   3HZ   LYS  76          3HZ       LYS  76 -22.023   9.020   5.148
  623    H    SER  77           H        SER  77 -14.358  10.556   7.458
  624    HA   SER  77           HA       SER  77 -14.258  12.175   9.884
  625   1HB   SER  77          2HB       SER  77 -13.659   9.673   9.819
  626   2HB   SER  77          1HB       SER  77 -12.248  10.083   8.909
  627    HG   SER  77           HG       SER  77 -12.076   9.845  11.232
  628    H    GLY  78           H        GLY  78 -12.626  11.929   6.622
  629   1HA   GLY  78          2HA       GLY  78 -10.828  12.992   5.751
  630   2HA   GLY  78          1HA       GLY  78 -11.884  14.380   6.160
  631    H    ASN  79           H        ASN  79 -10.057  12.304   8.382
  632    HA   ASN  79           HA       ASN  79  -8.629  14.716   9.309
  633   1HB   ASN  79          2HB       ASN  79 -10.676  13.380  10.670
  634   2HB   ASN  79          1HB       ASN  79  -9.259  12.629  11.352
  635   1HD2  ASN  79          2HD2      ASN  79 -10.382  13.804  13.247
  636   2HD2  ASN  79          1HD2      ASN  79  -9.759  15.406  13.528
  637    H    VAL  80           H        VAL  80  -6.527  14.484   9.698
  638    HA   VAL  80           HA       VAL  80  -4.881  12.396   8.779
  639    HB   VAL  80           HB       VAL  80  -4.161  14.492  10.834
  640   1HG1  VAL  80          1HG1      VAL  80  -1.916  14.107  10.129
  641   2HG1  VAL  80          2HG1      VAL  80  -2.586  12.615  10.830
  642   3HG1  VAL  80          3HG1      VAL  80  -2.428  12.775   9.065
  643   1HG2  VAL  80          1HG2      VAL  80  -3.266  15.653   8.927
  644   2HG2  VAL  80          2HG2      VAL  80  -3.886  14.400   7.826
  645   3HG2  VAL  80          3HG2      VAL  80  -5.020  15.430   8.733
  646    H    LYS  81           H        LYS  81  -6.930  12.342  11.587
  647    HA   LYS  81           HA       LYS  81  -5.640  10.685  13.392
  648   1HB   LYS  81          2HB       LYS  81  -8.615  10.689  12.751
  649   2HB   LYS  81          1HB       LYS  81  -7.874  10.148  14.221
  650   1HG   LYS  81          2HG       LYS  81  -8.043  12.995  13.200
  651   2HG   LYS  81          1HG       LYS  81  -8.690  12.324  14.673
  652   1HD   LYS  81          2HD       LYS  81  -6.396  12.063  15.593
  653   2HD   LYS  81          1HD       LYS  81  -5.708  12.644  14.108
  654   1HE   LYS  81          2HE       LYS  81  -6.774  14.765  14.372
  655   2HE   LYS  81          1HE       LYS  81  -7.583  14.172  15.870
  656   1HZ   LYS  81          1HZ       LYS  81  -5.561  15.225  16.515
  657   2HZ   LYS  81          2HZ       LYS  81  -5.320  13.611  16.638
  658   3HZ   LYS  81          3HZ       LYS  81  -4.694  14.440  15.380
  659    H    ASP  82           H        ASP  82  -6.890   9.898  10.240
  660    HA   ASP  82           HA       ASP  82  -6.477   6.966  10.542
  661   1HB   ASP  82          2HB       ASP  82  -7.919   8.730   8.703
  662   2HB   ASP  82          1HB       ASP  82  -6.943   7.497   7.896
  663    H    LEU  83           H        LEU  83  -5.166   9.720   8.577
  664    HA   LEU  83           HA       LEU  83  -3.105   8.476   7.284
  665   1HB   LEU  83          2HB       LEU  83  -3.672  11.227   8.209
  666   2HB   LEU  83          1HB       LEU  83  -2.015  10.849   7.631
  667    HG   LEU  83           HG       LEU  83  -3.457  11.786   5.796
  668   1HD1  LEU  83          1HD1      LEU  83  -2.956  10.088   4.181
  669   2HD1  LEU  83          2HD1      LEU  83  -1.599  10.303   5.312
  670   3HD1  LEU  83          3HD1      LEU  83  -2.679   8.898   5.475
  671   1HD2  LEU  83          1HD2      LEU  83  -5.245  10.504   4.868
  672   2HD2  LEU  83          2HD2      LEU  83  -5.108   9.295   6.167
  673   3HD2  LEU  83          3HD2      LEU  83  -5.631  10.953   6.547
  674    H    THR  84           H        THR  84  -2.885   9.978  10.530
  675    HA   THR  84           HA       THR  84  -0.227   9.431  11.324
  676    HB   THR  84           HB       THR  84  -1.517  10.851  12.584
  677    HG1  THR  84           1HG      THR  84  -1.347   9.558  14.706
  678   1HG2  THR  84          1HG2      THR  84  -3.304  10.140  14.087
  679   2HG2  THR  84          2HG2      THR  84  -3.773   9.926  12.384
  680   3HG2  THR  84          3HG2      THR  84  -3.287   8.517  13.357
  681    H    GLN  85           H        GLN  85  -2.828   7.167  10.756
  682    HA   GLN  85           HA       GLN  85  -1.378   4.969  12.062
  683   1HB   GLN  85          2HB       GLN  85  -4.205   5.550  11.583
  684   2HB   GLN  85          1HB       GLN  85  -3.723   3.906  11.132
  685   1HG   GLN  85          2HG       GLN  85  -3.172   5.208  13.867
  686   2HG   GLN  85          1HG       GLN  85  -4.374   3.997  13.563
  687   1HE2  GLN  85          2HE2      GLN  85  -2.883   3.345  15.467
  688   2HE2  GLN  85          1HE2      GLN  85  -1.605   2.251  14.985
  689    H    ALA  86           H        ALA  86  -2.473   6.095   8.814
  690    HA   ALA  86           HA       ALA  86  -1.817   3.649   7.410
  691   1HB   ALA  86          1HB       ALA  86  -1.620   5.022   5.446
  692   2HB   ALA  86          2HB       ALA  86  -3.089   5.469   6.348
  693   3HB   ALA  86          3HB       ALA  86  -1.640   6.499   6.437
  694    H    TRP  87           H        TRP  87   0.134   6.600   8.267
  695    HA   TRP  87           HA       TRP  87   2.542   5.862   7.091
  696   1HB   TRP  87          2HB       TRP  87   2.269   7.139   9.838
  697   2HB   TRP  87          1HB       TRP  87   3.596   7.302   8.712
  698    HD1  TRP  87           HD       TRP  87   1.325   9.386   9.988
  699    HE1  TRP  87           1HE      TRP  87   0.206  11.026   8.409
  700    HE3  TRP  87           3HE      TRP  87   2.478   7.111   5.642
  701    HZ2  TRP  87           2HZ      TRP  87  -0.128  11.296   5.639
  702    HZ3  TRP  87           3HZ      TRP  87   1.855   8.172   3.494
  703    HH2  TRP  87           HH       TRP  87   0.417  10.193   3.496
  704    H    ASP  88           H        ASP  88   0.876   4.483   9.888
  705    HA   ASP  88           HA       ASP  88   3.146   2.917  10.867
  706   1HB   ASP  88          2HB       ASP  88   1.238   3.870  12.345
  707   2HB   ASP  88          1HB       ASP  88   0.261   2.587  11.707
  708    H    LEU  89           H        LEU  89   0.117   2.380   8.834
  709    HA   LEU  89           HA       LEU  89   0.526  -0.478   8.468
  710   1HB   LEU  89          2HB       LEU  89  -1.163   1.573   7.035
  711   2HB   LEU  89          1HB       LEU  89  -1.067  -0.098   6.550
  712    HG   LEU  89           HG       LEU  89  -1.814   0.733   9.368
  713   1HD1  LEU  89          1HD1      LEU  89  -4.127   0.375   8.639
  714   2HD1  LEU  89          2HD1      LEU  89  -3.375   1.709   7.733
  715   3HD1  LEU  89          3HD1      LEU  89  -3.572   0.115   6.969
  716   1HD2  LEU  89          1HD2      LEU  89  -2.765  -1.523   9.443
  717   2HD2  LEU  89          2HD2      LEU  89  -2.196  -1.836   7.786
  718   3HD2  LEU  89          3HD2      LEU  89  -1.020  -1.593   9.098
  719    H    TYR  90           H        TYR  90   1.235   2.343   6.458
  720    HA   TYR  90           HA       TYR  90   2.610   1.040   4.279
  721   1HB   TYR  90          2HB       TYR  90   2.982   3.868   5.373
  722   2HB   TYR  90          1HB       TYR  90   3.498   3.304   3.814
  723    HD1  TYR  90           1HD      TYR  90   0.931   1.594   3.188
  724    HD2  TYR  90           2HD      TYR  90   1.547   5.480   4.849
  725    HE1  TYR  90           1HE      TYR  90  -1.033   2.427   1.951
  726    HE2  TYR  90           2HE      TYR  90  -0.545   6.266   3.820
  727    HH   TYR  90           HH       TYR  90  -2.399   5.654   2.650
  728    H    TYR  91           H        TYR  91   3.892   2.475   7.301
  729    HA   TYR  91           HA       TYR  91   6.650   1.726   6.753
  730   1HB   TYR  91          2HB       TYR  91   5.944   3.648   8.257
  731   2HB   TYR  91          1HB       TYR  91   5.304   2.520   9.401
  732    HD1  TYR  91           1HD      TYR  91   8.435   3.198   7.523
  733    HD2  TYR  91           2HD      TYR  91   6.560   1.889  11.160
  734    HE1  TYR  91           1HE      TYR  91  10.657   3.015   8.593
  735    HE2  TYR  91           2HE      TYR  91   8.772   1.706  12.245
  736    HH   TYR  91           HH       TYR  91  10.922   2.218  12.091
  737    H    HIS  92           H        HIS  92   4.083   0.266   8.825
  738    HA   HIS  92           HA       HIS  92   5.564  -1.770  10.039
  739   1HB   HIS  92          2HB       HIS  92   3.297  -1.113  10.698
  740   2HB   HIS  92          1HB       HIS  92   2.663  -1.776   9.159
  741    HD1  HIS  92           1HD      HIS  92   4.261  -3.003  12.394
  742    HD2  HIS  92           2HD      HIS  92   2.087  -4.297   9.116
  743    HE1  HIS  92           1HE      HIS  92   3.635  -5.443  12.880
  744    H    VAL  93           H        VAL  93   3.874  -1.569   6.873
  745    HA   VAL  93           HA       VAL  93   4.583  -4.321   6.098
  746    HB   VAL  93           HB       VAL  93   2.453  -3.083   5.599
  747   1HG1  VAL  93          1HG1      VAL  93   2.368  -2.113   3.353
  748   2HG1  VAL  93          2HG1      VAL  93   3.346  -1.109   4.449
  749   3HG1  VAL  93          3HG1      VAL  93   4.145  -2.160   3.255
  750   1HG2  VAL  93          1HG2      VAL  93   2.194  -4.567   3.721
  751   2HG2  VAL  93          2HG2      VAL  93   3.944  -4.885   3.756
  752   3HG2  VAL  93          3HG2      VAL  93   2.934  -5.314   5.157
  753    H    PHE  94           H        PHE  94   5.651  -0.958   5.165
  754    HA   PHE  94           HA       PHE  94   7.528  -1.265   3.297
  755   1HB   PHE  94          2HB       PHE  94   7.134   0.807   4.357
  756   2HB   PHE  94          1HB       PHE  94   7.709   0.178   5.935
  757    HD1  PHE  94           1HD      PHE  94  10.056  -0.175   6.361
  758    HD2  PHE  94           2HD      PHE  94   8.710   1.395   2.600
  759    HE1  PHE  94           1HE      PHE  94  12.376   0.514   5.830
  760    HE2  PHE  94           2HE      PHE  94  11.031   2.109   2.069
  761    HZ   PHE  94           HZ       PHE  94  12.856   1.682   3.690
  762    H    ARG  95           H        ARG  95   7.975  -2.453   6.625
  763    HA   ARG  95           HA       ARG  95  10.526  -3.698   5.962
  764   1HB   ARG  95          2HB       ARG  95   9.068  -2.806   8.329
  765   2HB   ARG  95          1HB       ARG  95   9.655  -4.443   8.553
  766   1HG   ARG  95          2HG       ARG  95  11.502  -2.357   7.418
  767   2HG   ARG  95          1HG       ARG  95  11.179  -2.428   9.160
  768   1HD   ARG  95          2HD       ARG  95  11.589  -5.073   8.513
  769   2HD   ARG  95          1HD       ARG  95  12.753  -4.202   7.451
  770    HE   ARG  95           HE       ARG  95  12.969  -2.949   9.885
  771   1HH1  ARG  95          2HH2      ARG  95  13.401  -6.326   8.996
  772   2HH1  ARG  95          1HH2      ARG  95  14.561  -6.627  10.247
  773   1HH2  ARG  95          1HH1      ARG  95  14.482  -3.400  11.522
  774   2HH2  ARG  95          2HH1      ARG  95  15.146  -4.991  11.654
  775    H    ARG  96           H        ARG  96   7.185  -4.792   6.679
  776    HA   ARG  96           HA       ARG  96   7.521  -7.631   6.724
  777   1HB   ARG  96          2HB       ARG  96   5.187  -5.906   5.920
  778   2HB   ARG  96          1HB       ARG  96   5.155  -7.658   6.296
  779   1HG   ARG  96          2HG       ARG  96   6.030  -5.580   8.344
  780   2HG   ARG  96          1HG       ARG  96   4.360  -6.069   8.168
  781   1HD   ARG  96          2HD       ARG  96   4.787  -8.258   8.854
  782   2HD   ARG  96          1HD       ARG  96   6.530  -8.119   8.538
  783    HE   ARG  96           HE       ARG  96   6.062  -6.169  10.375
  784   1HH1  ARG  96          2HH2      ARG  96   5.141  -9.531  10.362
  785   2HH1  ARG  96          1HH2      ARG  96   5.402  -9.777  12.058
  786   1HH2  ARG  96          1HH1      ARG  96   6.497  -6.520  12.621
  787   2HH2  ARG  96          2HH1      ARG  96   6.148  -8.069  13.313
  788    H    ILE  97           H        ILE  97   6.185  -5.642   4.032
  789    HA   ILE  97           HA       ILE  97   6.379  -7.765   2.011
  790    HB   ILE  97           HB       ILE  97   5.899  -5.905   0.421
  791   1HG1  ILE  97          2HG1      ILE  97   4.775  -4.112   2.388
  792   2HG1  ILE  97          1HG1      ILE  97   6.504  -4.153   2.438
  793   1HG2  ILE  97          1HG2      ILE  97   3.523  -5.943   0.993
  794   2HG2  ILE  97          2HG2      ILE  97   4.239  -7.560   1.199
  795   3HG2  ILE  97          3HG2      ILE  97   3.906  -6.546   2.623
  796   1HD1  ILE  97          1HD1      ILE  97   5.720  -2.491   0.931
  797   2HD1  ILE  97          2HD1      ILE  97   6.608  -3.745   0.035
  798   3HD1  ILE  97          3HD1      ILE  97   4.829  -3.704  -0.017
  799    H    SER  98           H        SER  98   8.635  -5.627   3.474
  800    HA   SER  98           HA       SER  98  10.476  -5.330   1.219
  801   1HB   SER  98          2HB       SER  98  10.638  -3.663   2.850
  802   2HB   SER  98          1HB       SER  98  10.596  -4.860   4.188
  803    HG   SER  98           HG       SER  98  12.652  -3.748   3.571
  804    H    LYS  99           H        LYS  99  10.354  -7.212   4.285
  805    HA   LYS  99           HA       LYS  99  11.489  -9.058   5.026
  806   1HB   LYS  99          2HB       LYS  99  11.197  -9.634   2.139
  807   2HB   LYS  99          1HB       LYS  99  12.227 -10.668   3.177
  808   1HG   LYS  99          2HG       LYS  99   9.479 -10.067   4.184
  809   2HG   LYS  99          1HG       LYS  99   9.597 -11.143   2.786
  810   1HD   LYS  99          2HD       LYS  99   9.818 -12.701   4.573
  811   2HD   LYS  99          1HD       LYS  99  11.491 -12.354   4.288
  812   1HE   LYS  99          2HE       LYS  99  11.099 -10.456   6.085
  813   2HE   LYS  99          1HE       LYS  99   9.742 -11.502   6.533
  814   1HZ   LYS  99          1HZ       LYS  99  11.618 -12.186   7.693
  815   2HZ   LYS  99          2HZ       LYS  99  11.377 -13.328   6.541
  816   3HZ   LYS  99          3HZ       LYS  99  12.554 -12.211   6.361
  817    H    GLN 100           H        GLN 100  12.958  -6.504   4.535
  818    HA   GLN 100           HA       GLN 100  15.531  -6.641   3.626
  819   1HB   GLN 100          2HB       GLN 100  14.492  -4.734   4.903
  820   2HB   GLN 100          1HB       GLN 100  14.812  -5.606   6.386
  821   1HG   GLN 100          2HG       GLN 100  17.266  -5.613   5.848
  822   2HG   GLN 100          1HG       GLN 100  16.944  -4.737   4.375
  823   1HE2  GLN 100          2HE2      GLN 100  15.887  -2.638   4.562
  824   2HE2  GLN 100          1HE2      GLN 100  16.321  -1.682   5.960
  Start of MODEL   18
    1   1H    GLU   1          1H        GLU   1   6.177  -6.909 -19.665
    2   2H    GLU   1          2H        GLU   1   5.805  -6.449 -18.092
    3    HA   GLU   1           HA       GLU   1   3.837  -7.531 -18.180
    4   1HB   GLU   1          2HB       GLU   1   4.820  -7.658 -20.989
    5   2HB   GLU   1          1HB       GLU   1   3.490  -8.715 -20.559
    6   1HG   GLU   1          2HG       GLU   1   2.032  -7.001 -20.373
    7   2HG   GLU   1          1HG       GLU   1   3.188  -5.960 -19.532
    8    H    LEU   2           H        LEU   2   4.734  -8.920 -16.491
    9    HA   LEU   2           HA       LEU   2   5.184 -11.009 -15.523
   10   1HB   LEU   2          2HB       LEU   2   3.545 -12.650 -15.982
   11   2HB   LEU   2          1HB       LEU   2   2.888 -11.014 -15.624
   12    HG   LEU   2           HG       LEU   2   3.124 -11.722 -18.502
   13   1HD1  LEU   2          1HD1      LEU   2   1.072 -13.072 -18.434
   14   2HD1  LEU   2          2HD1      LEU   2   2.383 -13.869 -17.530
   15   3HD1  LEU   2          3HD1      LEU   2   1.085 -13.022 -16.654
   16   1HD2  LEU   2          1HD2      LEU   2   0.936 -10.609 -18.542
   17   2HD2  LEU   2          2HD2      LEU   2   0.932 -10.523 -16.764
   18   3HD2  LEU   2          3HD2      LEU   2   2.136  -9.602 -17.696
   19    H    ILE   3           H        ILE   3   7.368 -10.908 -16.626
   20    HA   ILE   3           HA       ILE   3   7.895 -12.435 -19.027
   21    HB   ILE   3           HB       ILE   3  10.240 -12.236 -18.301
   22   1HG1  ILE   3          2HG1      ILE   3   9.369 -10.170 -16.280
   23   2HG1  ILE   3          1HG1      ILE   3   9.727 -11.795 -15.818
   24   1HG2  ILE   3          1HG2      ILE   3  10.226  -9.856 -19.059
   25   2HG2  ILE   3          2HG2      ILE   3   9.086 -10.839 -20.007
   26   3HG2  ILE   3          3HG2      ILE   3   8.479  -9.766 -18.723
   27   1HD1  ILE   3          1HD1      ILE   3  11.616 -10.379 -15.531
   28   2HD1  ILE   3          2HD1      ILE   3  11.969 -11.603 -16.774
   29   3HD1  ILE   3          3HD1      ILE   3  11.599  -9.928 -17.253
   30    H    ARG   4           H        ARG   4   8.188 -13.102 -15.593
   31    HA   ARG   4           HA       ARG   4   7.847 -16.014 -15.804
   32   1HB   ARG   4          2HB       ARG   4  10.064 -16.445 -14.673
   33   2HB   ARG   4          1HB       ARG   4  10.181 -16.020 -16.361
   34   1HG   ARG   4          2HG       ARG   4  10.760 -13.693 -15.749
   35   2HG   ARG   4          1HG       ARG   4  10.636 -14.120 -14.040
   36   1HD   ARG   4          2HD       ARG   4  12.526 -15.364 -14.056
   37   2HD   ARG   4          1HD       ARG   4  12.343 -15.820 -15.781
   38    HE   ARG   4           HE       ARG   4  12.723 -12.986 -15.472
   39   1HH1  ARG   4          2HH2      ARG   4  14.488 -15.993 -15.527
   40   2HH1  ARG   4          1HH2      ARG   4  15.977 -15.284 -16.065
   41   1HH2  ARG   4          1HH1      ARG   4  14.698 -12.044 -16.205
   42   2HH2  ARG   4          2HH1      ARG   4  16.072 -13.068 -16.436
   43    H    VAL   5           H        VAL   5   9.147 -13.464 -13.617
   44    HA   VAL   5           HA       VAL   5   8.079 -14.417 -11.192
   45    HB   VAL   5           HB       VAL   5   9.927 -12.979 -11.300
   46   1HG1  VAL   5          1HG1      VAL   5   9.721 -10.568 -11.720
   47   2HG1  VAL   5          2HG1      VAL   5   9.353 -11.507 -13.187
   48   3HG1  VAL   5          3HG1      VAL   5   8.031 -10.794 -12.233
   49   1HG2  VAL   5          1HG2      VAL   5   9.378 -11.451  -9.534
   50   2HG2  VAL   5          2HG2      VAL   5   7.651 -11.807  -9.768
   51   3HG2  VAL   5          3HG2      VAL   5   8.764 -13.099  -9.264
   52    H    ALA   6           H        ALA   6   6.498 -12.729 -13.826
   53    HA   ALA   6           HA       ALA   6   4.342 -12.028 -14.222
   54   1HB   ALA   6          1HB       ALA   6   2.520 -12.864 -12.978
   55   2HB   ALA   6          2HB       ALA   6   3.644 -14.145 -13.489
   56   3HB   ALA   6          3HB       ALA   6   3.633 -13.595 -11.798
   57    H    ILE   7           H        ILE   7   6.288 -10.391 -12.804
   58    HA   ILE   7           HA       ILE   7   6.555  -8.497 -11.576
   59    HB   ILE   7           HB       ILE   7   5.756  -7.750 -13.664
   60   1HG1  ILE   7          2HG1      ILE   7   6.768  -6.341 -12.223
   61   2HG1  ILE   7          1HG1      ILE   7   5.452  -5.543 -13.165
   62   1HG2  ILE   7          1HG2      ILE   7   3.531  -6.754 -13.913
   63   2HG2  ILE   7          2HG2      ILE   7   3.424  -8.519 -13.715
   64   3HG2  ILE   7          3HG2      ILE   7   3.033  -7.446 -12.351
   65   1HD1  ILE   7          1HD1      ILE   7   5.653  -4.616 -10.928
   66   2HD1  ILE   7          2HD1      ILE   7   4.091  -5.440 -11.144
   67   3HD1  ILE   7          3HD1      ILE   7   5.390  -6.227 -10.217
   68    H    LEU   8           H        LEU   8   6.280  -9.818  -9.565
   69    HA   LEU   8           HA       LEU   8   3.872 -10.256  -8.186
   70   1HB   LEU   8          2HB       LEU   8   6.715 -10.286  -7.687
   71   2HB   LEU   8          1HB       LEU   8   5.779  -9.687  -6.271
   72    HG   LEU   8           HG       LEU   8   6.168 -12.093  -6.054
   73   1HD1  LEU   8          1HD1      LEU   8   3.909 -12.811  -5.756
   74   2HD1  LEU   8          2HD1      LEU   8   4.159 -11.155  -5.153
   75   3HD1  LEU   8          3HD1      LEU   8   3.321 -11.422  -6.700
   76   1HD2  LEU   8          1HD2      LEU   8   5.255 -13.678  -7.630
   77   2HD2  LEU   8          2HD2      LEU   8   4.727 -12.356  -8.699
   78   3HD2  LEU   8          3HD2      LEU   8   6.462 -12.641  -8.428
   79    H    TRP   9           H        TRP   9   2.883  -9.222  -6.408
   80    HA   TRP   9           HA       TRP   9   2.593  -6.294  -6.762
   81   1HB   TRP   9          2HB       TRP   9   1.035  -8.237  -5.123
   82   2HB   TRP   9          1HB       TRP   9   0.892  -6.523  -4.957
   83    HD1  TRP   9           HD       TRP   9   1.350  -6.361  -8.420
   84    HE1  TRP   9           1HE      TRP   9  -0.865  -6.503  -9.639
   85    HE3  TRP   9           3HE      TRP   9  -1.340  -8.581  -4.768
   86    HZ2  TRP   9           2HZ      TRP   9  -3.473  -7.473  -9.093
   87    HZ3  TRP   9           3HZ      TRP   9  -3.801  -8.726  -4.994
   88    HH2  TRP   9           HH       TRP   9  -4.858  -8.154  -7.164
   89    H    HIS  10           H        HIS  10   3.613  -8.445  -4.063
   90    HA   HIS  10           HA       HIS  10   4.455  -6.581  -2.179
   91   1HB   HIS  10          2HB       HIS  10   4.627  -8.561  -1.324
   92   2HB   HIS  10          1HB       HIS  10   4.893  -9.341  -2.927
   93    HD1  HIS  10           1HD      HIS  10   6.687  -8.794   0.224
   94    HD2  HIS  10           2HD      HIS  10   7.521  -9.189  -3.803
   95    HE1  HIS  10           1HE      HIS  10   9.216  -9.101   0.059
   96    H    GLU  11           H        GLU  11   6.081  -7.487  -5.207
   97    HA   GLU  11           HA       GLU  11   8.626  -6.242  -4.831
   98   1HB   GLU  11          2HB       GLU  11   7.055  -6.861  -7.372
   99   2HB   GLU  11          1HB       GLU  11   8.726  -6.367  -7.323
  100   1HG   GLU  11          2HG       GLU  11   7.661  -8.800  -5.905
  101   2HG   GLU  11          1HG       GLU  11   8.358  -8.784  -7.555
  102    H    MET  12           H        MET  12   5.517  -5.007  -6.185
  103    HA   MET  12           HA       MET  12   6.643  -2.376  -6.798
  104   1HB   MET  12          2HB       MET  12   4.568  -1.821  -7.715
  105   2HB   MET  12          1HB       MET  12   4.848  -3.465  -8.212
  106   1HG   MET  12          2HG       MET  12   3.508  -4.169  -6.198
  107   2HG   MET  12          1HG       MET  12   3.029  -2.429  -6.094
  108   1HE   MET  12          1HE       MET  12   0.847  -2.015  -9.290
  109   2HE   MET  12          2HE       MET  12   1.466  -1.236  -7.815
  110   3HE   MET  12          3HE       MET  12   2.587  -1.674  -9.127
  111    H    TRP  13           H        TRP  13   5.203  -4.083  -4.000
  112    HA   TRP  13           HA       TRP  13   4.155  -1.861  -2.605
  113   1HB   TRP  13          2HB       TRP  13   4.749  -4.654  -2.066
  114   2HB   TRP  13          1HB       TRP  13   4.622  -3.531  -0.670
  115    HD1  TRP  13           HD       TRP  13   2.440  -5.050  -0.037
  116    HE1  TRP  13           1HE      TRP  13   0.037  -4.990  -0.846
  117    HE3  TRP  13           3HE      TRP  13   2.985  -1.899  -3.965
  118    HZ2  TRP  13           2HZ      TRP  13  -1.343  -4.016  -3.109
  119    HZ3  TRP  13           3HZ      TRP  13   1.197  -1.706  -5.600
  120    HH2  TRP  13           HH       TRP  13  -1.091  -2.407  -4.956
  121    H    HIS  14           H        HIS  14   7.432  -2.877  -3.152
  122    HA   HIS  14           HA       HIS  14   8.859  -1.509  -1.077
  123   1HB   HIS  14          2HB       HIS  14   9.349  -2.715  -3.700
  124   2HB   HIS  14          1HB       HIS  14  10.449  -1.386  -3.219
  125    HD1  HIS  14           1HD      HIS  14  12.365  -3.226  -3.048
  126    HD2  HIS  14           2HD      HIS  14   9.211  -3.545  -0.342
  127    HE1  HIS  14           1HE      HIS  14  13.208  -4.682  -1.093
  128    H    GLU  15           H        GLU  15   8.212  -0.400  -4.440
  129    HA   GLU  15           HA       GLU  15   8.894   2.339  -3.593
  130   1HB   GLU  15          2HB       GLU  15   8.807   1.017  -6.267
  131   2HB   GLU  15          1HB       GLU  15   8.744   2.783  -6.103
  132   1HG   GLU  15          2HG       GLU  15  10.770   2.198  -4.369
  133   2HG   GLU  15          1HG       GLU  15  10.974   0.896  -5.567
  134    H    GLY  16           H        GLY  16   6.087   0.495  -4.997
  135   1HA   GLY  16          2HA       GLY  16   4.334   2.602  -5.538
  136   2HA   GLY  16          1HA       GLY  16   3.901   0.986  -4.979
  137    H    LEU  17           H        LEU  17   5.247   1.080  -2.346
  138    HA   LEU  17           HA       LEU  17   3.489   2.928  -0.938
  139   1HB   LEU  17          2HB       LEU  17   5.154   0.638  -0.036
  140   2HB   LEU  17          1HB       LEU  17   4.828   1.920   1.095
  141    HG   LEU  17           HG       LEU  17   2.701   0.416  -0.463
  142   1HD1  LEU  17          1HD1      LEU  17   2.273  -0.567   1.762
  143   2HD1  LEU  17          2HD1      LEU  17   3.940  -0.915   1.246
  144   3HD1  LEU  17          3HD1      LEU  17   3.628   0.362   2.445
  145   1HD2  LEU  17          1HD2      LEU  17   1.151   1.507   1.056
  146   2HD2  LEU  17          2HD2      LEU  17   2.482   2.437   1.785
  147   3HD2  LEU  17          3HD2      LEU  17   2.025   2.717   0.087
  148    H    GLU  18           H        GLU  18   7.025   2.700  -1.703
  149    HA   GLU  18           HA       GLU  18   7.883   4.822   0.071
  150   1HB   GLU  18          2HB       GLU  18   9.293   3.003  -0.913
  151   2HB   GLU  18          1HB       GLU  18   9.225   3.870  -2.433
  152   1HG   GLU  18          2HG       GLU  18  10.261   5.805  -1.483
  153   2HG   GLU  18          1HG       GLU  18  10.111   5.146   0.163
  154    H    GLU  19           H        GLU  19   6.960   4.902  -3.439
  155    HA   GLU  19           HA       GLU  19   7.326   7.739  -3.814
  156   1HB   GLU  19          2HB       GLU  19   7.371   5.996  -5.530
  157   2HB   GLU  19          1HB       GLU  19   5.599   5.827  -5.319
  158   1HG   GLU  19          2HG       GLU  19   6.240   7.321  -7.263
  159   2HG   GLU  19          1HG       GLU  19   5.261   8.146  -6.071
  160    H    ALA  20           H        ALA  20   5.010   6.076  -1.907
  161    HA   ALA  20           HA       ALA  20   3.068   8.362  -2.038
  162   1HB   ALA  20          1HB       ALA  20   1.530   6.842  -0.947
  163   2HB   ALA  20          2HB       ALA  20   2.112   6.130  -2.470
  164   3HB   ALA  20          3HB       ALA  20   2.770   5.566  -0.916
  165    H    SER  21           H        SER  21   4.467   6.028   0.322
  166    HA   SER  21           HA       SER  21   3.889   7.408   2.680
  167   1HB   SER  21          2HB       SER  21   6.194   5.554   2.075
  168   2HB   SER  21          1HB       SER  21   5.705   6.110   3.684
  169    HG   SER  21           HG       SER  21   4.809   4.009   3.034
  170    H    ARG  22           H        ARG  22   6.429   8.017   0.215
  171    HA   ARG  22           HA       ARG  22   7.973   9.847   1.746
  172   1HB   ARG  22          2HB       ARG  22   8.847   8.744  -0.233
  173   2HB   ARG  22          1HB       ARG  22   7.677   9.579  -1.249
  174   1HG   ARG  22          2HG       ARG  22   8.610  11.744  -0.573
  175   2HG   ARG  22          1HG       ARG  22   9.787  10.906   0.474
  176   1HD   ARG  22          2HD       ARG  22  10.893   9.933  -1.332
  177   2HD   ARG  22          1HD       ARG  22   9.505  10.202  -2.440
  178    HE   ARG  22           HE       ARG  22  10.243  12.724  -1.579
  179   1HH1  ARG  22          2HH2      ARG  22  11.958  10.145  -3.189
  180   2HH1  ARG  22          1HH2      ARG  22  12.970  11.194  -4.130
  181   1HH2  ARG  22          1HH1      ARG  22  11.578  14.118  -2.825
  182   2HH2  ARG  22          2HH1      ARG  22  12.744  13.433  -3.909
  183    H    LEU  23           H        LEU  23   5.456  10.582  -0.834
  184    HA   LEU  23           HA       LEU  23   5.199  13.341  -0.549
  185   1HB   LEU  23          2HB       LEU  23   3.274  11.228  -1.190
  186   2HB   LEU  23          1HB       LEU  23   2.737  12.915  -0.857
  187    HG   LEU  23           HG       LEU  23   2.924  12.796  -3.229
  188   1HD1  LEU  23          1HD1      LEU  23   4.640  14.244  -3.874
  189   2HD1  LEU  23          2HD1      LEU  23   3.801  14.799  -2.407
  190   3HD1  LEU  23          3HD1      LEU  23   5.422  14.075  -2.285
  191   1HD2  LEU  23          1HD2      LEU  23   4.821  11.913  -4.413
  192   2HD2  LEU  23          2HD2      LEU  23   5.610  11.464  -2.882
  193   3HD2  LEU  23          3HD2      LEU  23   4.106  10.654  -3.379
  194    H    TYR  24           H        TYR  24   4.226  10.922   1.786
  195    HA   TYR  24           HA       TYR  24   3.092  13.051   3.638
  196   1HB   TYR  24          2HB       TYR  24   1.761  11.041   3.321
  197   2HB   TYR  24          1HB       TYR  24   3.128  10.020   3.720
  198    HD1  TYR  24           1HD      TYR  24   1.244  12.931   5.179
  199    HD2  TYR  24           2HD      TYR  24   3.464   9.322   5.828
  200    HE1  TYR  24           1HE      TYR  24   0.668  13.035   7.580
  201    HE2  TYR  24           2HE      TYR  24   3.089   9.543   8.252
  202    HH   TYR  24           HH       TYR  24   1.691  10.356   9.767
  203    H    PHE  25           H        PHE  25   5.791  10.679   3.500
  204    HA   PHE  25           HA       PHE  25   7.033  10.791   5.884
  205   1HB   PHE  25          2HB       PHE  25   7.741   9.518   3.940
  206   2HB   PHE  25          1HB       PHE  25   8.238  11.032   3.118
  207    HD1  PHE  25           1HD      PHE  25   8.817   9.200   6.309
  208    HD2  PHE  25           2HD      PHE  25  10.480  11.605   3.160
  209    HE1  PHE  25           1HE      PHE  25  11.052   9.042   7.374
  210    HE2  PHE  25           2HE      PHE  25  12.719  11.450   4.222
  211    HZ   PHE  25           HZ       PHE  25  13.006  10.148   6.314
  212    H    GLY  26           H        GLY  26   7.652  13.233   3.299
  213   1HA   GLY  26          2HA       GLY  26   7.871  15.414   5.288
  214   2HA   GLY  26          1HA       GLY  26   9.358  15.009   4.494
  215    H    GLU  27           H        GLU  27   6.210  14.719   2.837
  216    HA   GLU  27           HA       GLU  27   6.861  17.227   1.285
  217   1HB   GLU  27          2HB       GLU  27   6.240  14.570   0.305
  218   2HB   GLU  27          1HB       GLU  27   5.088  15.735  -0.240
  219   1HG   GLU  27          2HG       GLU  27   6.577  15.991  -1.830
  220   2HG   GLU  27          1HG       GLU  27   7.290  17.158  -0.672
  221    H    ARG  28           H        ARG  28   4.780  16.098   3.711
  222    HA   ARG  28           HA       ARG  28   2.505  16.358   4.247
  223   1HB   ARG  28          2HB       ARG  28   3.364  19.126   3.585
  224   2HB   ARG  28          1HB       ARG  28   1.948  18.615   4.561
  225   1HG   ARG  28          2HG       ARG  28   3.466  19.077   6.253
  226   2HG   ARG  28          1HG       ARG  28   3.845  17.379   5.987
  227   1HD   ARG  28          2HD       ARG  28   5.702  18.028   4.477
  228   2HD   ARG  28          1HD       ARG  28   5.320  19.736   4.756
  229    HE   ARG  28           HE       ARG  28   5.591  18.754   7.273
  230   1HH1  ARG  28          2HH2      ARG  28   7.732  18.710   4.475
  231   2HH1  ARG  28          1HH2      ARG  28   9.173  18.668   5.430
  232   1HH2  ARG  28          1HH1      ARG  28   7.529  18.690   8.488
  233   2HH2  ARG  28          2HH1      ARG  28   9.047  18.665   7.660
  234    H    ASN  29           H        ASN  29   2.831  15.525   1.446
  235    HA   ASN  29           HA       ASN  29   0.441  16.832   0.267
  236   1HB   ASN  29          2HB       ASN  29   2.800  17.260  -0.763
  237   2HB   ASN  29          1HB       ASN  29   2.691  15.608  -1.351
  238   1HD2  ASN  29          2HD2      ASN  29   2.522  16.139  -3.536
  239   2HD2  ASN  29          1HD2      ASN  29   1.134  17.009  -4.140
  240    H    VAL  30           H        VAL  30  -0.368  15.054   1.833
  241    HA   VAL  30           HA       VAL  30  -0.430  12.318   1.203
  242    HB   VAL  30           HB       VAL  30  -2.622  13.990   2.415
  243   1HG1  VAL  30          1HG1      VAL  30  -3.305  11.860   3.396
  244   2HG1  VAL  30          2HG1      VAL  30  -3.378  11.783   1.620
  245   3HG1  VAL  30          3HG1      VAL  30  -2.029  11.013   2.488
  246   1HG2  VAL  30          1HG2      VAL  30  -1.685  13.209   4.533
  247   2HG2  VAL  30          2HG2      VAL  30  -0.359  12.394   3.670
  248   3HG2  VAL  30          3HG2      VAL  30  -0.481  14.169   3.642
  249    H    LYS  31           H        LYS  31  -1.985  15.046  -0.454
  250    HA   LYS  31           HA       LYS  31  -3.910  13.639  -2.057
  251   1HB   LYS  31          2HB       LYS  31  -4.090  15.924  -1.636
  252   2HB   LYS  31          1HB       LYS  31  -2.414  16.231  -2.222
  253   1HG   LYS  31          2HG       LYS  31  -4.593  15.288  -4.080
  254   2HG   LYS  31          1HG       LYS  31  -4.374  16.999  -3.688
  255   1HD   LYS  31          2HD       LYS  31  -1.776  16.348  -4.306
  256   2HD   LYS  31          1HD       LYS  31  -2.594  15.193  -5.314
  257   1HE   LYS  31          2HE       LYS  31  -3.937  17.029  -6.285
  258   2HE   LYS  31          1HE       LYS  31  -2.956  18.173  -5.324
  259   1HZ   LYS  31          1HZ       LYS  31  -1.987  17.887  -7.446
  260   2HZ   LYS  31          2HZ       LYS  31  -1.006  17.151  -6.363
  261   3HZ   LYS  31          3HZ       LYS  31  -1.992  16.260  -7.313
  262    H    GLY  32           H        GLY  32  -0.348  14.158  -2.298
  263   1HA   GLY  32          2HA       GLY  32  -0.039  13.289  -5.056
  264   2HA   GLY  32          1HA       GLY  32   1.217  13.541  -3.866
  265    H    MET  33           H        MET  33   0.855  11.813  -1.875
  266    HA   MET  33           HA       MET  33   1.534   9.230  -2.663
  267   1HB   MET  33          2HB       MET  33   1.451   8.723  -0.520
  268   2HB   MET  33          1HB       MET  33   1.504  10.523  -0.418
  269   1HG   MET  33          2HG       MET  33  -1.005  10.440   0.019
  270   2HG   MET  33          1HG       MET  33  -0.875   8.713   0.157
  271   1HE   MET  33          1HE       MET  33   1.168   8.171   3.369
  272   2HE   MET  33          2HE       MET  33   0.099   7.441   2.147
  273   3HE   MET  33          3HE       MET  33   1.707   8.044   1.678
  274    H    PHE  34           H        PHE  34  -1.715  10.555  -2.233
  275    HA   PHE  34           HA       PHE  34  -3.288   8.186  -2.528
  276   1HB   PHE  34          2HB       PHE  34  -3.590  10.924  -1.961
  277   2HB   PHE  34          1HB       PHE  34  -4.488  10.645  -3.451
  278    HD1  PHE  34           1HD      PHE  34  -6.668  10.227  -3.142
  279    HD2  PHE  34           2HD      PHE  34  -3.873   8.647  -0.284
  280    HE1  PHE  34           1HE      PHE  34  -8.542   9.232  -1.856
  281    HE2  PHE  34           2HE      PHE  34  -5.752   7.664   1.008
  282    HZ   PHE  34           HZ       PHE  34  -8.073   7.907   0.184
  283    H    GLU  35           H        GLU  35  -1.412   9.880  -4.923
  284    HA   GLU  35           HA       GLU  35  -3.097   8.977  -7.187
  285   1HB   GLU  35          2HB       GLU  35  -2.020  11.268  -7.020
  286   2HB   GLU  35          1HB       GLU  35  -0.474  10.454  -7.267
  287   1HG   GLU  35          2HG       GLU  35  -0.886  10.119  -9.473
  288   2HG   GLU  35          1HG       GLU  35  -2.546   9.578  -9.177
  289    H    VAL  36           H        VAL  36   0.115   8.267  -5.689
  290    HA   VAL  36           HA       VAL  36   0.743   6.178  -7.667
  291    HB   VAL  36           HB       VAL  36   2.531   7.558  -6.902
  292   1HG1  VAL  36          1HG1      VAL  36   3.355   7.413  -4.640
  293   2HG1  VAL  36          2HG1      VAL  36   1.716   8.105  -4.654
  294   3HG1  VAL  36          3HG1      VAL  36   1.961   6.412  -4.166
  295   1HG2  VAL  36          1HG2      VAL  36   4.089   5.871  -6.367
  296   2HG2  VAL  36          2HG2      VAL  36   2.772   4.715  -6.060
  297   3HG2  VAL  36          3HG2      VAL  36   3.004   5.388  -7.692
  298    H    LEU  37           H        LEU  37  -0.614   6.411  -4.349
  299    HA   LEU  37           HA       LEU  37  -0.910   3.575  -4.044
  300   1HB   LEU  37          2HB       LEU  37  -1.236   5.929  -2.463
  301   2HB   LEU  37          1HB       LEU  37  -2.582   4.758  -2.251
  302    HG   LEU  37           HG       LEU  37  -0.492   4.560  -0.654
  303   1HD1  LEU  37          1HD1      LEU  37  -0.638   2.168  -0.584
  304   2HD1  LEU  37          2HD1      LEU  37  -2.262   2.865  -0.786
  305   3HD1  LEU  37          3HD1      LEU  37  -1.430   2.129  -2.177
  306   1HD2  LEU  37          1HD2      LEU  37   1.269   3.157  -1.452
  307   2HD2  LEU  37          2HD2      LEU  37   0.591   3.173  -3.096
  308   3HD2  LEU  37          3HD2      LEU  37   1.230   4.674  -2.383
  309    H    GLU  38           H        GLU  38  -2.851   6.014  -5.686
  310    HA   GLU  38           HA       GLU  38  -5.445   4.986  -5.605
  311   1HB   GLU  38          2HB       GLU  38  -3.974   6.925  -7.101
  312   2HB   GLU  38          1HB       GLU  38  -4.735   5.891  -8.263
  313   1HG   GLU  38          2HG       GLU  38  -6.575   6.603  -6.097
  314   2HG   GLU  38          1HG       GLU  38  -5.917   7.991  -6.942
  315    HA   PRO  39           HA       PRO  39  -4.382   1.634  -8.892
  316   1HB   PRO  39          2HB       PRO  39  -1.886   1.075  -9.638
  317   2HB   PRO  39          1HB       PRO  39  -2.826   2.326 -10.448
  318   1HG   PRO  39          2HG       PRO  39  -0.709   2.659  -8.269
  319   2HG   PRO  39          1HG       PRO  39  -0.889   3.580  -9.760
  320   1HD   PRO  39          1HD       PRO  39  -1.935   4.485  -7.334
  321   2HD   PRO  39          2HD       PRO  39  -2.763   4.838  -8.906
  322    H    LEU  40           H        LEU  40  -2.257   2.132  -6.029
  323    HA   LEU  40           HA       LEU  40  -1.656  -0.702  -5.614
  324   1HB   LEU  40          2HB       LEU  40  -1.502   1.610  -3.761
  325   2HB   LEU  40          1HB       LEU  40  -0.808  -0.048  -3.580
  326    HG   LEU  40           HG       LEU  40   0.255   2.343  -4.821
  327   1HD1  LEU  40          1HD1      LEU  40   2.324   1.112  -4.187
  328   2HD1  LEU  40          2HD1      LEU  40   1.134   1.222  -2.868
  329   3HD1  LEU  40          3HD1      LEU  40   1.319  -0.297  -3.776
  330   1HD2  LEU  40          1HD2      LEU  40   1.630   1.283  -6.524
  331   2HD2  LEU  40          2HD2      LEU  40   0.713  -0.231  -6.345
  332   3HD2  LEU  40          3HD2      LEU  40  -0.093   1.231  -6.964
  333    H    HIS  41           H        HIS  41  -4.310   1.493  -4.771
  334    HA   HIS  41           HA       HIS  41  -5.629  -0.236  -2.899
  335   1HB   HIS  41          2HB       HIS  41  -6.706   1.973  -4.636
  336   2HB   HIS  41          1HB       HIS  41  -7.427   1.289  -3.139
  337    HD1  HIS  41           1HD      HIS  41  -6.793   4.355  -3.414
  338    HD2  HIS  41           2HD      HIS  41  -4.292   1.501  -1.724
  339    HE1  HIS  41           1HE      HIS  41  -5.253   5.605  -1.771
  340    H    ALA  42           H        ALA  42  -5.709   0.087  -6.458
  341    HA   ALA  42           HA       ALA  42  -7.932  -1.850  -6.792
  342   1HB   ALA  42          1HB       ALA  42  -7.650  -1.383  -9.130
  343   2HB   ALA  42          2HB       ALA  42  -7.858   0.114  -8.190
  344   3HB   ALA  42          3HB       ALA  42  -6.244  -0.352  -8.778
  345    H    MET  43           H        MET  43  -4.400  -1.661  -7.308
  346    HA   MET  43           HA       MET  43  -3.918  -4.323  -8.315
  347   1HB   MET  43          2HB       MET  43  -2.164  -2.168  -7.109
  348   2HB   MET  43          1HB       MET  43  -1.557  -3.736  -7.533
  349   1HG   MET  43          2HG       MET  43  -2.922  -1.861  -9.512
  350   2HG   MET  43          1HG       MET  43  -1.214  -2.071  -9.339
  351   1HE   MET  43          1HE       MET  43  -4.062  -4.549 -11.759
  352   2HE   MET  43          2HE       MET  43  -4.579  -3.920 -10.175
  353   3HE   MET  43          3HE       MET  43  -4.024  -2.797 -11.440
  354    H    MET  44           H        MET  44  -4.759  -3.223  -5.105
  355    HA   MET  44           HA       MET  44  -3.951  -5.897  -4.035
  356   1HB   MET  44          2HB       MET  44  -3.256  -3.437  -3.131
  357   2HB   MET  44          1HB       MET  44  -4.788  -3.567  -2.328
  358   1HG   MET  44          2HG       MET  44  -2.899  -5.903  -2.105
  359   2HG   MET  44          1HG       MET  44  -2.587  -4.463  -1.189
  360   1HE   MET  44          1HE       MET  44  -4.726  -7.806   0.242
  361   2HE   MET  44          2HE       MET  44  -4.280  -7.672  -1.476
  362   3HE   MET  44          3HE       MET  44  -3.061  -7.375  -0.214
  363    H    GLU  45           H        GLU  45  -6.654  -4.479  -5.423
  364    HA   GLU  45           HA       GLU  45  -8.582  -5.840  -3.569
  365   1HB   GLU  45          2HB       GLU  45  -8.763  -3.261  -3.972
  366   2HB   GLU  45          1HB       GLU  45  -9.324  -3.696  -5.571
  367   1HG   GLU  45          2HG       GLU  45 -11.353  -3.782  -4.602
  368   2HG   GLU  45          1HG       GLU  45 -10.852  -5.366  -3.995
  369    H    ARG  46           H        ARG  46  -7.690  -5.268  -7.046
  370    HA   ARG  46           HA       ARG  46  -9.633  -6.730  -8.367
  371   1HB   ARG  46          2HB       ARG  46  -7.581  -5.332  -9.206
  372   2HB   ARG  46          1HB       ARG  46  -6.737  -6.878  -9.178
  373   1HG   ARG  46          2HG       ARG  46  -9.360  -7.191 -10.447
  374   2HG   ARG  46          1HG       ARG  46  -8.446  -5.925 -11.229
  375   1HD   ARG  46          2HD       ARG  46  -6.787  -8.256 -10.656
  376   2HD   ARG  46          1HD       ARG  46  -8.206  -8.631 -11.660
  377    HE   ARG  46           HE       ARG  46  -7.233  -6.314 -12.737
  378   1HH1  ARG  46          2HH2      ARG  46  -5.839  -9.486 -12.207
  379   2HH1  ARG  46          1HH2      ARG  46  -4.743  -9.381 -13.548
  380   1HH2  ARG  46          1HH1      ARG  46  -5.788  -6.208 -14.520
  381   2HH2  ARG  46          2HH1      ARG  46  -4.736  -7.545 -14.833
  382    H    GLY  47           H        GLY  47  -6.874  -7.946  -6.452
  383   1HA   GLY  47          2HA       GLY  47  -6.968  -9.998  -5.309
  384   2HA   GLY  47          1HA       GLY  47  -8.098 -10.636  -6.500
  385    HA   PRO  48           HA       PRO  48  -3.554 -11.755  -7.473
  386   1HB   PRO  48          2HB       PRO  48  -3.432 -14.304  -6.537
  387   2HB   PRO  48          1HB       PRO  48  -3.016 -12.924  -5.522
  388   1HG   PRO  48          2HG       PRO  48  -5.652 -14.465  -5.639
  389   2HG   PRO  48          1HG       PRO  48  -4.747 -13.956  -4.213
  390   1HD   PRO  48          1HD       PRO  48  -6.878 -12.430  -5.247
  391   2HD   PRO  48          2HD       PRO  48  -5.435 -11.619  -4.475
  392    H    GLN  49           H        GLN  49  -3.082 -12.775  -9.340
  393    HA   GLN  49           HA       GLN  49  -5.317 -13.993 -10.883
  394   1HB   GLN  49          2HB       GLN  49  -3.985 -13.565 -12.800
  395   2HB   GLN  49          1HB       GLN  49  -4.200 -12.080 -11.823
  396   1HG   GLN  49          2HG       GLN  49  -1.932 -12.370 -10.919
  397   2HG   GLN  49          1HG       GLN  49  -1.723 -13.822 -11.952
  398   1HE2  GLN  49          2HE2      GLN  49  -0.477 -13.450 -13.681
  399   2HE2  GLN  49          1HE2      GLN  49  -0.384 -11.899 -14.467
  400    H    THR  50           H        THR  50  -1.947 -14.608  -9.976
  401    HA   THR  50           HA       THR  50  -1.981 -17.348 -11.005
  402    HB   THR  50           HB       THR  50  -0.136 -16.384 -11.787
  403    HG1  THR  50           1HG      THR  50   1.618 -17.423 -10.699
  404   1HG2  THR  50          1HG2      THR  50   1.520 -15.050 -10.568
  405   2HG2  THR  50          2HG2      THR  50  -0.079 -14.267 -10.543
  406   3HG2  THR  50          3HG2      THR  50   0.514 -15.123  -9.101
  407    H    LEU  51           H        LEU  51   0.147 -17.020  -8.475
  408    HA   LEU  51           HA       LEU  51  -1.476 -17.213  -6.045
  409   1HB   LEU  51          2HB       LEU  51  -1.421 -19.526  -7.500
  410   2HB   LEU  51          1HB       LEU  51   0.107 -19.702  -6.681
  411    HG   LEU  51           HG       LEU  51  -1.072 -19.295  -4.514
  412   1HD1  LEU  51          1HD1      LEU  51  -3.508 -19.584  -4.456
  413   2HD1  LEU  51          2HD1      LEU  51  -3.041 -18.109  -5.334
  414   3HD1  LEU  51          3HD1      LEU  51  -3.556 -19.555  -6.234
  415   1HD2  LEU  51          1HD2      LEU  51  -2.039 -21.592  -4.516
  416   2HD2  LEU  51          2HD2      LEU  51  -2.012 -21.594  -6.296
  417   3HD2  LEU  51          3HD2      LEU  51  -0.486 -21.545  -5.383
  418    H    LYS  52           H        LYS  52   0.677 -15.524  -7.065
  419    HA   LYS  52           HA       LYS  52   2.863 -16.209  -5.130
  420   1HB   LYS  52          2HB       LYS  52   3.028 -14.560  -7.613
  421   2HB   LYS  52          1HB       LYS  52   4.345 -14.976  -6.467
  422   1HG   LYS  52          2HG       LYS  52   3.972 -17.403  -7.087
  423   2HG   LYS  52          1HG       LYS  52   2.876 -16.850  -8.358
  424   1HD   LYS  52          2HD       LYS  52   5.026 -15.270  -8.947
  425   2HD   LYS  52          1HD       LYS  52   5.875 -16.603  -8.208
  426   1HE   LYS  52          2HE       LYS  52   3.852 -17.559 -10.139
  427   2HE   LYS  52          1HE       LYS  52   5.016 -16.499 -10.862
  428   1HZ   LYS  52          1HZ       LYS  52   5.711 -18.655 -10.959
  429   2HZ   LYS  52          2HZ       LYS  52   6.724 -17.871  -9.957
  430   3HZ   LYS  52          3HZ       LYS  52   5.606 -18.896  -9.349
  431    H    GLU  53           H        GLU  53   1.017 -13.402  -6.509
  432    HA   GLU  53           HA       GLU  53   1.747 -11.607  -4.435
  433   1HB   GLU  53          2HB       GLU  53   0.295 -10.073  -5.453
  434   2HB   GLU  53          1HB       GLU  53   1.293 -10.937  -6.665
  435   1HG   GLU  53          2HG       GLU  53  -1.076 -12.401  -6.492
  436   2HG   GLU  53          1HG       GLU  53  -1.578 -10.678  -6.459
  437    H    THR  54           H        THR  54   1.099 -13.476  -2.814
  438    HA   THR  54           HA       THR  54  -1.293 -12.647  -1.302
  439    HB   THR  54           HB       THR  54  -1.257 -15.277  -2.689
  440    HG1  THR  54           1HG      THR  54  -2.296 -12.787  -3.168
  441   1HG2  THR  54          1HG2      THR  54  -3.397 -15.781  -1.643
  442   2HG2  THR  54          2HG2      THR  54  -2.094 -15.699  -0.434
  443   3HG2  THR  54          3HG2      THR  54  -3.241 -14.349  -0.599
  444    H    SER  55           H        SER  55   1.624 -12.643  -0.903
  445    HA   SER  55           HA       SER  55   1.900 -14.543   1.393
  446   1HB   SER  55          2HB       SER  55   3.555 -14.327  -0.533
  447   2HB   SER  55          1HB       SER  55   4.050 -12.822   0.305
  448    HG   SER  55           HG       SER  55   5.170 -14.881   1.039
  449    H    PHE  56           H        PHE  56   1.507 -11.171   0.600
  450    HA   PHE  56           HA       PHE  56   1.964 -10.289   3.342
  451   1HB   PHE  56          2HB       PHE  56   1.729  -8.054   2.206
  452   2HB   PHE  56          1HB       PHE  56   3.084  -9.076   1.631
  453    HD1  PHE  56           1HD      PHE  56  -0.091  -7.460   0.758
  454    HD2  PHE  56           2HD      PHE  56   3.052 -10.082  -0.558
  455    HE1  PHE  56           1HE      PHE  56  -0.869  -7.222  -1.593
  456    HE2  PHE  56           2HE      PHE  56   2.232  -9.898  -2.898
  457    HZ   PHE  56           HZ       PHE  56   0.253  -8.486  -3.389
  458    H    ASN  57           H        ASN  57  -0.693 -11.022   1.185
  459    HA   ASN  57           HA       ASN  57  -2.675  -9.372   2.597
  460   1HB   ASN  57          2HB       ASN  57  -2.801  -9.786   0.104
  461   2HB   ASN  57          1HB       ASN  57  -3.052 -11.483   0.430
  462   1HD2  ASN  57          2HD2      ASN  57  -5.052 -11.075  -0.790
  463   2HD2  ASN  57          1HD2      ASN  57  -6.400 -10.500   0.154
  464    H    GLN  58           H        GLN  58  -1.375 -12.693   2.594
  465    HA   GLN  58           HA       GLN  58  -3.541 -13.830   4.238
  466   1HB   GLN  58          2HB       GLN  58  -1.295 -14.840   2.706
  467   2HB   GLN  58          1HB       GLN  58  -1.539 -15.607   4.282
  468   1HG   GLN  58          2HG       GLN  58  -3.701 -15.271   2.115
  469   2HG   GLN  58          1HG       GLN  58  -2.943 -16.763   2.564
  470   1HE2  GLN  58          2HE2      GLN  58  -5.693 -16.330   2.534
  471   2HE2  GLN  58          1HE2      GLN  58  -6.229 -16.393   4.196
  472    H    ALA  59           H        ALA  59  -0.136 -12.770   4.713
  473    HA   ALA  59           HA       ALA  59  -0.157 -13.253   7.569
  474   1HB   ALA  59          1HB       ALA  59   1.974 -12.094   7.471
  475   2HB   ALA  59          2HB       ALA  59   1.867 -13.348   6.212
  476   3HB   ALA  59          3HB       ALA  59   1.665 -11.633   5.780
  477    H    TYR  60           H        TYR  60  -0.782 -10.493   5.435
  478    HA   TYR  60           HA       TYR  60  -1.656  -8.893   7.850
  479   1HB   TYR  60          2HB       TYR  60  -0.294  -7.565   5.554
  480   2HB   TYR  60          1HB       TYR  60  -0.419  -7.079   7.280
  481    HD1  TYR  60           1HD      TYR  60   0.929  -8.500   8.969
  482    HD2  TYR  60           2HD      TYR  60   1.666  -8.482   4.744
  483    HE1  TYR  60           1HE      TYR  60   3.254  -9.249   9.367
  484    HE2  TYR  60           2HE      TYR  60   3.938  -9.351   5.115
  485    HH   TYR  60           HH       TYR  60   5.376 -10.164   6.605
  486    H    GLY  61           H        GLY  61  -3.697 -10.142   6.811
  487   1HA   GLY  61          2HA       GLY  61  -5.087  -9.114   4.592
  488   2HA   GLY  61          1HA       GLY  61  -5.837  -9.753   6.013
  489    H    ARG  62           H        ARG  62  -4.648  -7.642   7.760
  490    HA   ARG  62           HA       ARG  62  -6.624  -5.552   7.180
  491   1HB   ARG  62          2HB       ARG  62  -5.044  -6.383   9.585
  492   2HB   ARG  62          1HB       ARG  62  -5.803  -4.774   9.501
  493   1HG   ARG  62          2HG       ARG  62  -7.986  -5.671   9.524
  494   2HG   ARG  62          1HG       ARG  62  -7.511  -7.145   8.711
  495   1HD   ARG  62          2HD       ARG  62  -7.839  -8.018  10.832
  496   2HD   ARG  62          1HD       ARG  62  -6.192  -7.534  11.074
  497    HE   ARG  62           HE       ARG  62  -8.553  -6.392  12.187
  498   1HH1  ARG  62          2HH2      ARG  62  -5.127  -5.787  11.659
  499   2HH1  ARG  62          1HH2      ARG  62  -4.998  -4.699  13.003
  500   1HH2  ARG  62          1HH1      ARG  62  -8.329  -4.974  13.932
  501   2HH2  ARG  62          2HH1      ARG  62  -6.793  -4.247  14.254
  502    H    ASP  63           H        ASP  63  -3.481  -6.028   6.239
  503    HA   ASP  63           HA       ASP  63  -2.234  -3.476   6.711
  504   1HB   ASP  63          2HB       ASP  63  -1.348  -5.844   6.160
  505   2HB   ASP  63          1HB       ASP  63  -1.679  -5.379   4.468
  506    H    LEU  64           H        LEU  64  -1.470  -3.201   3.727
  507    HA   LEU  64           HA       LEU  64  -2.743  -1.212   2.703
  508   1HB   LEU  64          2HB       LEU  64  -1.213  -3.275   1.668
  509   2HB   LEU  64          1HB       LEU  64  -2.653  -3.214   0.617
  510    HG   LEU  64           HG       LEU  64  -1.865  -0.496   1.196
  511   1HD1  LEU  64          1HD1      LEU  64   0.400  -0.480   0.295
  512   2HD1  LEU  64          2HD1      LEU  64   0.311  -1.412   1.808
  513   3HD1  LEU  64          3HD1      LEU  64   0.404  -2.259   0.246
  514   1HD2  LEU  64          1HD2      LEU  64  -1.577  -0.368  -1.223
  515   2HD2  LEU  64          2HD2      LEU  64  -1.604  -2.142  -1.341
  516   3HD2  LEU  64          3HD2      LEU  64  -3.061  -1.263  -0.820
  517    H    MET  65           H        MET  65  -4.265  -4.471   2.489
  518    HA   MET  65           HA       MET  65  -6.667  -4.064   1.210
  519   1HB   MET  65          2HB       MET  65  -5.359  -5.886   2.812
  520   2HB   MET  65          1HB       MET  65  -6.809  -5.449   3.771
  521   1HG   MET  65          2HG       MET  65  -6.877  -6.375   0.898
  522   2HG   MET  65          1HG       MET  65  -7.077  -7.448   2.320
  523   1HE   MET  65          1HE       MET  65 -10.682  -7.742   1.689
  524   2HE   MET  65          2HE       MET  65  -9.213  -8.124   0.761
  525   3HE   MET  65          3HE       MET  65  -9.243  -8.373   2.524
  526    H    GLU  66           H        GLU  66  -6.252  -3.364   4.782
  527    HA   GLU  66           HA       GLU  66  -8.840  -1.900   4.841
  528   1HB   GLU  66          2HB       GLU  66  -7.413  -3.347   6.760
  529   2HB   GLU  66          1HB       GLU  66  -7.210  -1.654   7.203
  530   1HG   GLU  66          2HG       GLU  66  -9.264  -2.183   8.248
  531   2HG   GLU  66          1HG       GLU  66  -9.838  -1.508   6.747
  532    H    ALA  67           H        ALA  67  -5.339  -1.265   4.850
  533    HA   ALA  67           HA       ALA  67  -5.375   1.486   5.432
  534   1HB   ALA  67          1HB       ALA  67  -3.094   1.337   4.472
  535   2HB   ALA  67          2HB       ALA  67  -3.456   0.024   5.619
  536   3HB   ALA  67          3HB       ALA  67  -3.480  -0.292   3.868
  537    H    GLN  68           H        GLN  68  -6.269  -0.146   2.477
  538    HA   GLN  68           HA       GLN  68  -6.708   2.394   1.005
  539   1HB   GLN  68          2HB       GLN  68  -6.612   1.114  -0.872
  540   2HB   GLN  68          1HB       GLN  68  -5.455   0.260   0.201
  541   1HG   GLN  68          2HG       GLN  68  -7.452  -1.241   0.786
  542   2HG   GLN  68          1HG       GLN  68  -8.199  -0.557  -0.697
  543   1HE2  GLN  68          2HE2      GLN  68  -8.335  -2.571  -1.555
  544   2HE2  GLN  68          1HE2      GLN  68  -6.933  -3.422  -2.144
  545    H    GLU  69           H        GLU  69  -8.484  -0.366   2.462
  546    HA   GLU  69           HA       GLU  69 -11.037   0.158   1.296
  547   1HB   GLU  69          2HB       GLU  69  -9.942  -1.880   2.781
  548   2HB   GLU  69          1HB       GLU  69 -10.972  -1.109   3.960
  549   1HG   GLU  69          2HG       GLU  69 -11.988  -1.906   1.193
  550   2HG   GLU  69          1HG       GLU  69 -12.096  -2.931   2.586
  551    H    TRP  70           H        TRP  70  -9.210   1.746   3.829
  552    HA   TRP  70           HA       TRP  70 -11.236   3.217   5.151
  553   1HB   TRP  70          2HB       TRP  70  -9.547   4.658   5.784
  554   2HB   TRP  70          1HB       TRP  70  -8.825   3.013   5.735
  555    HD1  TRP  70           HD       TRP  70  -8.497   3.590   2.327
  556    HE1  TRP  70           1HE      TRP  70  -6.348   4.696   1.666
  557    HE3  TRP  70           3HE      TRP  70  -7.281   5.452   6.823
  558    HZ2  TRP  70           2HZ      TRP  70  -4.381   6.251   2.950
  559    HZ3  TRP  70           3HZ      TRP  70  -5.468   7.101   6.941
  560    HH2  TRP  70           HH       TRP  70  -4.005   7.423   5.054
  561    H    CYS  71           H        CYS  71 -10.310   3.341   1.697
  562    HA   CYS  71           HA       CYS  71 -10.726   5.896   0.869
  563   1HB   CYS  71          2HB       CYS  71 -10.356   4.059  -0.708
  564   2HB   CYS  71          1HB       CYS  71 -11.961   3.443  -0.410
  565    HG   CYS  71           HG       CYS  71 -12.019   4.548  -2.670
  566    H    ARG  72           H        ARG  72 -13.521   3.642   1.480
  567    HA   ARG  72           HA       ARG  72 -15.682   5.412   1.215
  568   1HB   ARG  72          2HB       ARG  72 -16.835   3.894   2.749
  569   2HB   ARG  72          1HB       ARG  72 -15.910   2.991   1.563
  570   1HG   ARG  72          2HG       ARG  72 -14.439   2.170   3.135
  571   2HG   ARG  72          1HG       ARG  72 -14.506   3.618   4.134
  572   1HD   ARG  72          2HD       ARG  72 -16.931   2.938   4.632
  573   2HD   ARG  72          1HD       ARG  72 -16.452   1.344   3.969
  574    HE   ARG  72           HE       ARG  72 -14.521   2.352   5.847
  575   1HH1  ARG  72          2HH2      ARG  72 -17.601   0.722   5.717
  576   2HH1  ARG  72          1HH2      ARG  72 -17.451  -0.016   7.279
  577   1HH2  ARG  72          1HH1      ARG  72 -14.320   1.380   7.920
  578   2HH2  ARG  72          2HH1      ARG  72 -15.595   0.359   8.499
  579    H    LYS  73           H        LYS  73 -13.307   5.328   3.775
  580    HA   LYS  73           HA       LYS  73 -14.770   7.135   5.597
  581   1HB   LYS  73          2HB       LYS  73 -12.610   5.231   5.919
  582   2HB   LYS  73          1HB       LYS  73 -12.384   6.810   6.716
  583   1HG   LYS  73          2HG       LYS  73 -14.953   6.448   7.341
  584   2HG   LYS  73          1HG       LYS  73 -14.504   4.728   7.134
  585   1HD   LYS  73          2HD       LYS  73 -12.530   6.341   8.718
  586   2HD   LYS  73          1HD       LYS  73 -14.075   6.159   9.505
  587   1HE   LYS  73          2HE       LYS  73 -12.992   3.681   8.328
  588   2HE   LYS  73          1HE       LYS  73 -12.063   4.400   9.670
  589   1HZ   LYS  73          1HZ       LYS  73 -13.782   2.942  10.464
  590   2HZ   LYS  73          2HZ       LYS  73 -14.074   4.480  10.923
  591   3HZ   LYS  73          3HZ       LYS  73 -14.939   3.820   9.709
  592    H    TYR  74           H        TYR  74 -11.440   6.990   4.200
  593    HA   TYR  74           HA       TYR  74 -10.662   9.640   4.335
  594   1HB   TYR  74          2HB       TYR  74  -9.400   7.527   3.451
  595   2HB   TYR  74          1HB       TYR  74 -10.075   7.899   1.892
  596    HD1  TYR  74           1HD      TYR  74  -7.539   8.652   4.295
  597    HD2  TYR  74           2HD      TYR  74  -9.599  10.185   0.847
  598    HE1  TYR  74           1HE      TYR  74  -5.612  10.124   3.788
  599    HE2  TYR  74           2HE      TYR  74  -7.676  11.618   0.328
  600    HH   TYR  74           HH       TYR  74  -5.840  12.482   1.064
  601    H    MET  75           H        MET  75 -12.950   8.338   1.902
  602    HA   MET  75           HA       MET  75 -13.203  10.537   0.227
  603   1HB   MET  75          2HB       MET  75 -14.820   8.207   1.043
  604   2HB   MET  75          1HB       MET  75 -15.745   9.569   0.369
  605   1HG   MET  75          2HG       MET  75 -13.429   9.302  -1.280
  606   2HG   MET  75          1HG       MET  75 -14.029   7.668  -1.031
  607   1HE   MET  75          1HE       MET  75 -17.481   7.598  -2.614
  608   2HE   MET  75          2HE       MET  75 -16.036   6.677  -2.128
  609   3HE   MET  75          3HE       MET  75 -16.978   7.567  -0.908
  610    H    LYS  76           H        LYS  76 -14.660  10.073   3.430
  611    HA   LYS  76           HA       LYS  76 -15.806  12.814   3.330
  612   1HB   LYS  76          2HB       LYS  76 -17.015  10.272   3.887
  613   2HB   LYS  76          1HB       LYS  76 -17.123  11.324   5.316
  614   1HG   LYS  76          2HG       LYS  76 -17.689  12.711   2.728
  615   2HG   LYS  76          1HG       LYS  76 -18.858  11.474   3.148
  616   1HD   LYS  76          2HD       LYS  76 -18.109  13.276   5.386
  617   2HD   LYS  76          1HD       LYS  76 -18.964  14.033   4.036
  618   1HE   LYS  76          2HE       LYS  76 -20.259  11.537   4.561
  619   2HE   LYS  76          1HE       LYS  76 -20.025  12.364   6.115
  620   1HZ   LYS  76          1HZ       LYS  76 -22.050  13.004   4.983
  621   2HZ   LYS  76          2HZ       LYS  76 -21.046  14.273   5.213
  622   3HZ   LYS  76          3HZ       LYS  76 -21.181  13.601   3.732
  623    H    SER  77           H        SER  77 -13.842  10.554   5.117
  624    HA   SER  77           HA       SER  77 -13.186  12.536   7.238
  625   1HB   SER  77          2HB       SER  77 -14.573  10.376   7.783
  626   2HB   SER  77          1HB       SER  77 -13.030   9.533   7.538
  627    HG   SER  77           HG       SER  77 -13.397  10.189   9.756
  628    H    GLY  78           H        GLY  78 -11.982  12.291   4.532
  629   1HA   GLY  78          2HA       GLY  78  -9.377  11.053   4.620
  630   2HA   GLY  78          1HA       GLY  78  -9.920  12.267   3.516
  631    H    ASN  79           H        ASN  79  -9.640  12.217   6.988
  632    HA   ASN  79           HA       ASN  79  -8.107  14.722   6.887
  633   1HB   ASN  79          2HB       ASN  79 -10.220  13.734   8.529
  634   2HB   ASN  79          1HB       ASN  79  -8.779  13.757   9.562
  635   1HD2  ASN  79          2HD2      ASN  79  -9.532  15.549  10.807
  636   2HD2  ASN  79          1HD2      ASN  79  -9.510  17.139  10.090
  637    H    VAL  80           H        VAL  80  -6.000  14.725   7.625
  638    HA   VAL  80           HA       VAL  80  -4.227  12.663   7.862
  639    HB   VAL  80           HB       VAL  80  -4.225  15.230   9.364
  640   1HG1  VAL  80          1HG1      VAL  80  -1.803  14.887   9.616
  641   2HG1  VAL  80          2HG1      VAL  80  -2.719  13.646  10.501
  642   3HG1  VAL  80          3HG1      VAL  80  -1.956  13.247   8.944
  643   1HG2  VAL  80          1HG2      VAL  80  -2.608  15.814   7.558
  644   2HG2  VAL  80          2HG2      VAL  80  -2.856  14.212   6.826
  645   3HG2  VAL  80          3HG2      VAL  80  -4.198  15.381   6.887
  646    H    LYS  81           H        LYS  81  -6.629  13.517  10.381
  647    HA   LYS  81           HA       LYS  81  -5.815  11.931  12.480
  648   1HB   LYS  81          2HB       LYS  81  -8.196  13.281  11.721
  649   2HB   LYS  81          1HB       LYS  81  -8.643  11.663  12.230
  650   1HG   LYS  81          2HG       LYS  81  -7.098  13.735  13.842
  651   2HG   LYS  81          1HG       LYS  81  -8.624  12.991  14.229
  652   1HD   LYS  81          2HD       LYS  81  -7.150  10.772  14.130
  653   2HD   LYS  81          1HD       LYS  81  -5.871  11.962  14.530
  654   1HE   LYS  81          2HE       LYS  81  -8.414  11.453  16.143
  655   2HE   LYS  81          1HE       LYS  81  -6.790  10.978  16.598
  656   1HZ   LYS  81          1HZ       LYS  81  -7.468  12.931  17.639
  657   2HZ   LYS  81          2HZ       LYS  81  -6.203  13.263  16.656
  658   3HZ   LYS  81          3HZ       LYS  81  -7.718  13.694  16.217
  659    H    ASP  82           H        ASP  82  -6.964  10.762   9.374
  660    HA   ASP  82           HA       ASP  82  -7.043   7.935  10.319
  661   1HB   ASP  82          2HB       ASP  82  -7.973   9.389   7.900
  662   2HB   ASP  82          1HB       ASP  82  -7.510   7.660   7.794
  663    H    LEU  83           H        LEU  83  -5.112  10.219   8.302
  664    HA   LEU  83           HA       LEU  83  -3.444   8.267   7.012
  665   1HB   LEU  83          2HB       LEU  83  -3.858  10.682   6.369
  666   2HB   LEU  83          1HB       LEU  83  -2.622  11.063   7.622
  667    HG   LEU  83           HG       LEU  83  -1.518  11.063   5.443
  668   1HD1  LEU  83          1HD1      LEU  83   0.145   9.417   5.586
  669   2HD1  LEU  83          2HD1      LEU  83  -0.160  10.154   7.177
  670   3HD1  LEU  83          3HD1      LEU  83  -0.782   8.525   6.816
  671   1HD2  LEU  83          1HD2      LEU  83  -1.479   9.156   3.989
  672   2HD2  LEU  83          2HD2      LEU  83  -2.604   8.278   5.053
  673   3HD2  LEU  83          3HD2      LEU  83  -3.150   9.735   4.192
  674    H    THR  84           H        THR  84  -3.072  10.239  10.051
  675    HA   THR  84           HA       THR  84  -0.620   9.448  11.092
  676    HB   THR  84           HB       THR  84  -1.858  11.013  12.205
  677    HG1  THR  84           1HG      THR  84  -1.923   9.889  14.377
  678   1HG2  THR  84          1HG2      THR  84  -3.834  10.523  13.563
  679   2HG2  THR  84          2HG2      THR  84  -4.167  10.276  11.832
  680   3HG2  THR  84          3HG2      THR  84  -3.897   8.875  12.895
  681    H    GLN  85           H        GLN  85  -3.402   7.343  10.634
  682    HA   GLN  85           HA       GLN  85  -2.156   5.066  12.124
  683   1HB   GLN  85          2HB       GLN  85  -4.791   6.080  11.699
  684   2HB   GLN  85          1HB       GLN  85  -4.622   4.443  10.992
  685   1HG   GLN  85          2HG       GLN  85  -3.836   3.527  13.099
  686   2HG   GLN  85          1HG       GLN  85  -3.600   5.129  13.792
  687   1HE2  GLN  85          2HE2      GLN  85  -4.884   4.759  15.537
  688   2HE2  GLN  85          1HE2      GLN  85  -6.621   4.633  15.379
  689    H    ALA  86           H        ALA  86  -3.453   5.890   8.808
  690    HA   ALA  86           HA       ALA  86  -2.630   3.399   7.624
  691   1HB   ALA  86          1HB       ALA  86  -2.705   4.475   5.529
  692   2HB   ALA  86          2HB       ALA  86  -4.156   4.840   6.493
  693   3HB   ALA  86          3HB       ALA  86  -2.877   6.065   6.312
  694    H    TRP  87           H        TRP  87  -0.779   6.356   8.431
  695    HA   TRP  87           HA       TRP  87   1.614   5.718   7.006
  696   1HB   TRP  87          2HB       TRP  87   1.634   7.852   7.673
  697   2HB   TRP  87          1HB       TRP  87   0.676   7.516   9.153
  698    HD1  TRP  87           HD       TRP  87   1.898   7.497  11.327
  699    HE1  TRP  87           1HE      TRP  87   4.319   7.534  12.095
  700    HE3  TRP  87           3HE      TRP  87   4.114   7.134   6.804
  701    HZ2  TRP  87           2HZ      TRP  87   6.870   7.417  10.892
  702    HZ3  TRP  87           3HZ      TRP  87   6.562   6.737   6.668
  703    HH2  TRP  87           HH       TRP  87   7.949   6.950   8.712
  704    H    ASP  88           H        ASP  88   0.200   4.684  10.112
  705    HA   ASP  88           HA       ASP  88   2.570   3.454  11.196
  706   1HB   ASP  88          2HB       ASP  88   0.721   4.199  12.667
  707   2HB   ASP  88          1HB       ASP  88  -0.332   2.989  11.948
  708    H    LEU  89           H        LEU  89  -0.438   2.282   9.433
  709    HA   LEU  89           HA       LEU  89   0.383  -0.508   9.263
  710   1HB   LEU  89          2HB       LEU  89  -1.747   1.141   7.936
  711   2HB   LEU  89          1HB       LEU  89  -1.419  -0.522   7.493
  712    HG   LEU  89           HG       LEU  89  -1.849   0.214  10.392
  713   1HD1  LEU  89          1HD1      LEU  89  -4.234  -0.268  10.045
  714   2HD1  LEU  89          2HD1      LEU  89  -3.731   1.154   9.103
  715   3HD1  LEU  89          3HD1      LEU  89  -3.959  -0.414   8.293
  716   1HD2  LEU  89          1HD2      LEU  89  -2.637  -2.108  10.489
  717   2HD2  LEU  89          2HD2      LEU  89  -2.350  -2.294   8.742
  718   3HD2  LEU  89          3HD2      LEU  89  -0.979  -2.036   9.847
  719    H    TYR  90           H        TYR  90   0.658   2.260   7.087
  720    HA   TYR  90           HA       TYR  90   1.812   0.949   4.795
  721   1HB   TYR  90          2HB       TYR  90   1.849   3.753   5.844
  722   2HB   TYR  90          1HB       TYR  90   2.826   3.262   4.417
  723    HD1  TYR  90           1HD      TYR  90   1.898   4.519   2.802
  724    HD2  TYR  90           2HD      TYR  90  -0.708   2.065   5.171
  725    HE1  TYR  90           1HE      TYR  90   0.153   4.706   1.086
  726    HE2  TYR  90           2HE      TYR  90  -2.506   2.449   3.547
  727    HH   TYR  90           HH       TYR  90  -3.172   3.377   1.822
  728    H    TYR  91           H        TYR  91   3.361   2.687   7.508
  729    HA   TYR  91           HA       TYR  91   6.076   2.000   6.726
  730   1HB   TYR  91          2HB       TYR  91   5.332   4.061   8.019
  731   2HB   TYR  91          1HB       TYR  91   5.068   3.038   9.413
  732    HD1  TYR  91           1HD      TYR  91   6.763   2.756  10.926
  733    HD2  TYR  91           2HD      TYR  91   7.694   3.704   6.842
  734    HE1  TYR  91           1HE      TYR  91   9.167   2.910  11.509
  735    HE2  TYR  91           2HE      TYR  91  10.089   3.833   7.403
  736    HH   TYR  91           HH       TYR  91  11.580   3.923   9.059
  737    H    HIS  92           H        HIS  92   3.914   0.766   9.348
  738    HA   HIS  92           HA       HIS  92   5.540  -1.130  10.566
  739   1HB   HIS  92          2HB       HIS  92   3.290  -0.474  11.324
  740   2HB   HIS  92          1HB       HIS  92   2.582  -1.305   9.903
  741    HD1  HIS  92           1HD      HIS  92   4.335  -2.107  13.167
  742    HD2  HIS  92           2HD      HIS  92   2.234  -3.904  10.087
  743    HE1  HIS  92           1HE      HIS  92   3.924  -4.527  13.910
  744    H    VAL  93           H        VAL  93   3.621  -1.344   7.520
  745    HA   VAL  93           HA       VAL  93   4.512  -4.119   7.030
  746    HB   VAL  93           HB       VAL  93   2.227  -3.189   6.625
  747   1HG1  VAL  93          1HG1      VAL  93   1.794  -2.557   4.301
  748   2HG1  VAL  93          2HG1      VAL  93   2.738  -1.304   5.141
  749   3HG1  VAL  93          3HG1      VAL  93   3.542  -2.411   4.001
  750   1HG2  VAL  93          1HG2      VAL  93   2.032  -4.975   4.997
  751   2HG2  VAL  93          2HG2      VAL  93   3.809  -5.041   4.897
  752   3HG2  VAL  93          3HG2      VAL  93   2.991  -5.387   6.439
  753    H    PHE  94           H        PHE  94   5.235  -0.808   5.799
  754    HA   PHE  94           HA       PHE  94   6.758  -1.189   3.600
  755   1HB   PHE  94          2HB       PHE  94   6.266   0.942   4.621
  756   2HB   PHE  94          1HB       PHE  94   7.316   0.538   6.018
  757    HD1  PHE  94           1HD      PHE  94   7.182   1.695   2.552
  758    HD2  PHE  94           2HD      PHE  94   9.744   0.377   5.737
  759    HE1  PHE  94           1HE      PHE  94   9.144   2.671   1.380
  760    HE2  PHE  94           2HE      PHE  94  11.712   1.290   4.542
  761    HZ   PHE  94           HZ       PHE  94  11.406   2.470   2.378
  762    H    ARG  95           H        ARG  95   7.794  -1.948   6.933
  763    HA   ARG  95           HA       ARG  95  10.335  -3.058   6.042
  764   1HB   ARG  95          2HB       ARG  95   9.044  -2.328   8.557
  765   2HB   ARG  95          1HB       ARG  95  10.070  -3.794   8.628
  766   1HG   ARG  95          2HG       ARG  95  11.963  -2.598   7.698
  767   2HG   ARG  95          1HG       ARG  95  10.956  -1.180   7.324
  768   1HD   ARG  95          2HD       ARG  95  10.534  -0.866   9.742
  769   2HD   ARG  95          1HD       ARG  95  11.611  -2.253  10.089
  770    HE   ARG  95           HE       ARG  95  13.123  -0.644   8.483
  771   1HH1  ARG  95          2HH2      ARG  95  11.449  -0.036  11.497
  772   2HH1  ARG  95          1HH2      ARG  95  12.562   1.181  12.031
  773   1HH2  ARG  95          1HH1      ARG  95  14.587   0.966   9.213
  774   2HH2  ARG  95          2HH1      ARG  95  14.308   1.732  10.741
  775    H    ARG  96           H        ARG  96   7.246  -4.407   7.294
  776    HA   ARG  96           HA       ARG  96   7.918  -7.182   7.424
  777   1HB   ARG  96          2HB       ARG  96   5.321  -5.768   6.853
  778   2HB   ARG  96          1HB       ARG  96   5.526  -7.506   7.255
  779   1HG   ARG  96          2HG       ARG  96   6.235  -5.213   9.137
  780   2HG   ARG  96          1HG       ARG  96   4.738  -6.114   9.199
  781   1HD   ARG  96          2HD       ARG  96   6.312  -8.180   9.273
  782   2HD   ARG  96          1HD       ARG  96   7.499  -6.945   9.844
  783    HE   ARG  96           HE       ARG  96   5.267  -6.333  11.265
  784   1HH1  ARG  96          2HH2      ARG  96   6.742  -9.471  10.823
  785   2HH1  ARG  96          1HH2      ARG  96   6.189 -10.104  12.346
  786   1HH2  ARG  96          1HH1      ARG  96   4.542  -7.169  13.245
  787   2HH2  ARG  96          2HH1      ARG  96   4.977  -8.777  13.720
  788    H    ILE  97           H        ILE  97   6.042  -5.513   4.854
  789    HA   ILE  97           HA       ILE  97   6.160  -7.701   2.919
  790    HB   ILE  97           HB       ILE  97   5.394  -6.021   1.314
  791   1HG1  ILE  97          2HG1      ILE  97   4.991  -4.192   3.615
  792   2HG1  ILE  97          1HG1      ILE  97   6.359  -4.095   2.454
  793   1HG2  ILE  97          1HG2      ILE  97   3.110  -6.019   2.288
  794   2HG2  ILE  97          2HG2      ILE  97   3.911  -7.589   2.526
  795   3HG2  ILE  97          3HG2      ILE  97   3.793  -6.437   3.877
  796   1HD1  ILE  97          1HD1      ILE  97   4.612  -2.493   1.920
  797   2HD1  ILE  97          2HD1      ILE  97   4.779  -3.716   0.639
  798   3HD1  ILE  97          3HD1      ILE  97   3.425  -3.811   1.789
  799    H    SER  98           H        SER  98   8.408  -5.239   3.917
  800    HA   SER  98           HA       SER  98   9.781  -4.695   1.480
  801   1HB   SER  98          2HB       SER  98  10.720  -3.289   2.751
  802   2HB   SER  98          1HB       SER  98  10.061  -4.089   4.222
  803    HG   SER  98           HG       SER  98  12.265  -3.961   4.458
  804    H    LYS  99           H        LYS  99  10.936  -6.723   4.160
  805    HA   LYS  99           HA       LYS  99  11.371  -9.201   2.764
  806   1HB   LYS  99          2HB       LYS  99  13.857  -9.066   2.813
  807   2HB   LYS  99          1HB       LYS  99  13.023  -8.179   1.499
  808   1HG   LYS  99          2HG       LYS  99  13.751  -6.111   2.279
  809   2HG   LYS  99          1HG       LYS  99  13.716  -6.598   3.960
  810   1HD   LYS  99          2HD       LYS  99  15.816  -7.748   3.768
  811   2HD   LYS  99          1HD       LYS  99  15.801  -7.629   2.011
  812   1HE   LYS  99          2HE       LYS  99  15.726  -5.133   3.728
  813   2HE   LYS  99          1HE       LYS  99  17.250  -5.942   3.338
  814   1HZ   LYS  99          1HZ       LYS  99  16.708  -4.254   1.772
  815   2HZ   LYS  99          2HZ       LYS  99  16.715  -5.722   1.054
  816   3HZ   LYS  99          3HZ       LYS  99  15.297  -4.988   1.386
  817    H    GLN 100           H        GLN 100  10.080  -8.996   5.078
  818    HA   GLN 100           HA       GLN 100  11.389  -8.961   7.547
  819   1HB   GLN 100          2HB       GLN 100   9.007  -9.164   7.154
  820   2HB   GLN 100          1HB       GLN 100   9.261 -10.851   6.605
  821   1HG   GLN 100          2HG       GLN 100   8.474 -10.877   8.860
  822   2HG   GLN 100          1HG       GLN 100  10.201 -11.372   8.839
  823   1HE2  GLN 100          2HE2      GLN 100   8.974 -10.691  11.179
  824   2HE2  GLN 100          1HE2      GLN 100   9.540  -9.126  11.701
  Start of MODEL   19
    1   1H    GLU   1          1H        GLU   1   5.938 -18.043 -10.867
    2   2H    GLU   1          2H        GLU   1   7.349 -17.175 -11.158
    3    HA   GLU   1           HA       GLU   1   5.456 -17.308 -12.911
    4   1HB   GLU   1          2HB       GLU   1   3.860 -16.321 -11.082
    5   2HB   GLU   1          1HB       GLU   1   4.566 -14.781 -11.530
    6   1HG   GLU   1          2HG       GLU   1   3.796 -16.452 -13.821
    7   2HG   GLU   1          1HG       GLU   1   2.449 -15.952 -12.743
    8    H    LEU   2           H        LEU   2   6.991 -14.522 -11.239
    9    HA   LEU   2           HA       LEU   2   7.727 -12.784 -13.131
   10   1HB   LEU   2          2HB       LEU   2   9.831 -12.569 -11.714
   11   2HB   LEU   2          1HB       LEU   2   8.185 -12.256 -11.009
   12    HG   LEU   2           HG       LEU   2  10.242 -13.408  -9.765
   13   1HD1  LEU   2          1HD1      LEU   2   8.549 -14.023  -8.098
   14   2HD1  LEU   2          2HD1      LEU   2   8.306 -12.401  -8.790
   15   3HD1  LEU   2          3HD1      LEU   2   7.282 -13.756  -9.320
   16   1HD2  LEU   2          1HD2      LEU   2   9.722 -15.735  -9.270
   17   2HD2  LEU   2          2HD2      LEU   2   8.506 -15.755 -10.568
   18   3HD2  LEU   2          3HD2      LEU   2  10.227 -15.536 -10.964
   19    H    ILE   3           H        ILE   3   7.934 -14.067 -15.100
   20    HA   ILE   3           HA       ILE   3  10.725 -14.773 -15.814
   21    HB   ILE   3           HB       ILE   3   8.287 -16.492 -15.819
   22   1HG1  ILE   3          2HG1      ILE   3   9.612 -16.679 -13.905
   23   2HG1  ILE   3          1HG1      ILE   3   9.742 -18.167 -14.905
   24   1HG2  ILE   3          1HG2      ILE   3   9.388 -18.223 -17.134
   25   2HG2  ILE   3          2HG2      ILE   3   9.064 -16.777 -18.119
   26   3HG2  ILE   3          3HG2      ILE   3  10.712 -17.102 -17.531
   27   1HD1  ILE   3          1HD1      ILE   3  11.889 -17.583 -13.878
   28   2HD1  ILE   3          2HD1      ILE   3  11.972 -17.460 -15.651
   29   3HD1  ILE   3          3HD1      ILE   3  11.844 -15.987 -14.663
   30    H    ARG   4           H        ARG   4   9.739 -12.318 -16.449
   31    HA   ARG   4           HA       ARG   4   9.777 -12.013 -19.278
   32   1HB   ARG   4          2HB       ARG   4   7.441 -11.357 -19.794
   33   2HB   ARG   4          1HB       ARG   4   7.641 -13.058 -19.561
   34   1HG   ARG   4          2HG       ARG   4   6.866 -12.488 -17.051
   35   2HG   ARG   4          1HG       ARG   4   6.182 -11.098 -17.825
   36   1HD   ARG   4          2HD       ARG   4   4.473 -12.574 -17.958
   37   2HD   ARG   4          1HD       ARG   4   5.226 -12.848 -19.533
   38    HE   ARG   4           HE       ARG   4   6.525 -14.661 -18.069
   39   1HH1  ARG   4          2HH2      ARG   4   3.123 -13.941 -18.410
   40   2HH1  ARG   4          1HH2      ARG   4   2.588 -15.555 -18.074
   41   1HH2  ARG   4          1HH1      ARG   4   5.795 -16.804 -17.560
   42   2HH2  ARG   4          2HH1      ARG   4   4.099 -17.145 -17.601
   43    H    VAL   5           H        VAL   5   7.889 -10.660 -16.654
   44    HA   VAL   5           HA       VAL   5   9.083  -7.961 -17.045
   45    HB   VAL   5           HB       VAL   5   6.901  -8.014 -17.968
   46   1HG1  VAL   5          1HG1      VAL   5   4.874  -8.319 -16.624
   47   2HG1  VAL   5          2HG1      VAL   5   5.815  -9.827 -16.716
   48   3HG1  VAL   5          3HG1      VAL   5   5.860  -8.840 -15.236
   49   1HG2  VAL   5          1HG2      VAL   5   5.911  -6.170 -16.768
   50   2HG2  VAL   5          2HG2      VAL   5   7.056  -6.437 -15.431
   51   3HG2  VAL   5          3HG2      VAL   5   7.660  -5.983 -17.044
   52    H    ALA   6           H        ALA   6   7.682 -10.354 -14.733
   53    HA   ALA   6           HA       ALA   6   7.966 -10.703 -12.506
   54   1HB   ALA   6          1HB       ALA   6  10.025  -9.991 -11.419
   55   2HB   ALA   6          2HB       ALA   6  10.344 -10.783 -12.981
   56   3HB   ALA   6          3HB       ALA   6  10.450  -9.012 -12.844
   57    H    ILE   7           H        ILE   7   6.462  -8.375 -13.710
   58    HA   ILE   7           HA       ILE   7   6.694  -5.971 -12.480
   59    HB   ILE   7           HB       ILE   7   5.203  -6.617 -14.347
   60   1HG1  ILE   7          2HG1      ILE   7   5.538  -4.469 -13.753
   61   2HG1  ILE   7          1HG1      ILE   7   3.782  -4.755 -14.048
   62   1HG2  ILE   7          1HG2      ILE   7   2.817  -6.879 -13.879
   63   2HG2  ILE   7          2HG2      ILE   7   3.738  -8.297 -13.325
   64   3HG2  ILE   7          3HG2      ILE   7   3.166  -7.091 -12.147
   65   1HD1  ILE   7          1HD1      ILE   7   4.144  -3.134 -12.274
   66   2HD1  ILE   7          2HD1      ILE   7   3.367  -4.608 -11.651
   67   3HD1  ILE   7          3HD1      ILE   7   5.099  -4.324 -11.359
   68    H    LEU   8           H        LEU   8   4.919  -8.821 -11.281
   69    HA   LEU   8           HA       LEU   8   3.852  -9.310  -9.259
   70   1HB   LEU   8          2HB       LEU   8   6.654  -8.534  -8.918
   71   2HB   LEU   8          1HB       LEU   8   5.653  -8.662  -7.430
   72    HG   LEU   8           HG       LEU   8   7.024 -10.693  -8.238
   73   1HD1  LEU   8          1HD1      LEU   8   5.273 -12.150  -7.276
   74   2HD1  LEU   8          2HD1      LEU   8   5.477 -10.633  -6.370
   75   3HD1  LEU   8          3HD1      LEU   8   4.094 -10.832  -7.471
   76   1HD2  LEU   8          1HD2      LEU   8   5.819 -12.274  -9.679
   77   2HD2  LEU   8          2HD2      LEU   8   4.591 -11.034 -10.030
   78   3HD2  LEU   8          3HD2      LEU   8   6.270 -10.805 -10.577
   79    H    TRP   9           H        TRP   9   3.621  -8.376  -6.846
   80    HA   TRP   9           HA       TRP   9   2.451  -5.606  -7.122
   81   1HB   TRP   9          2HB       TRP   9   1.472  -7.898  -5.493
   82   2HB   TRP   9          1HB       TRP   9   1.087  -6.248  -5.120
   83    HD1  TRP   9           HD       TRP   9   1.088  -5.918  -8.682
   84    HE1  TRP   9           1HE      TRP   9  -1.321  -6.002  -9.468
   85    HE3  TRP   9           3HE      TRP   9  -0.824  -8.487  -4.815
   86    HZ2  TRP   9           2HZ      TRP   9  -3.719  -7.189  -8.603
   87    HZ3  TRP   9           3HZ      TRP   9  -3.250  -8.982  -4.745
   88    HH2  TRP   9           HH       TRP   9  -4.675  -8.330  -6.662
   89    H    HIS  10           H        HIS  10   4.100  -7.706  -4.705
   90    HA   HIS  10           HA       HIS  10   5.100  -5.967  -2.864
   91   1HB   HIS  10          2HB       HIS  10   5.753  -7.990  -2.391
   92   2HB   HIS  10          1HB       HIS  10   5.782  -8.491  -4.121
   93    HD1  HIS  10           1HD      HIS  10   8.030  -7.997  -1.280
   94    HD2  HIS  10           2HD      HIS  10   8.178  -7.724  -5.426
   95    HE1  HIS  10           1HE      HIS  10  10.506  -7.726  -1.913
   96    H    GLU  11           H        GLU  11   6.219  -6.160  -6.241
   97    HA   GLU  11           HA       GLU  11   8.598  -4.581  -6.038
   98   1HB   GLU  11          2HB       GLU  11   6.752  -4.979  -8.374
   99   2HB   GLU  11          1HB       GLU  11   8.433  -4.359  -8.400
  100   1HG   GLU  11          2HG       GLU  11   7.649  -7.110  -7.431
  101   2HG   GLU  11          1HG       GLU  11   8.165  -6.733  -9.111
  102    H    MET  12           H        MET  12   5.246  -3.671  -7.126
  103    HA   MET  12           HA       MET  12   5.843  -0.827  -7.187
  104   1HB   MET  12          2HB       MET  12   3.565  -0.510  -7.766
  105   2HB   MET  12          1HB       MET  12   4.105  -1.898  -8.666
  106   1HG   MET  12          2HG       MET  12   3.112  -3.377  -6.990
  107   2HG   MET  12          1HG       MET  12   2.504  -1.919  -6.127
  108   1HE   MET  12          1HE       MET  12   1.069  -3.569 -10.146
  109   2HE   MET  12          2HE       MET  12   2.707  -2.922  -9.886
  110   3HE   MET  12          3HE       MET  12   2.175  -4.375  -9.008
  111    H    TRP  13           H        TRP  13   4.908  -3.187  -4.671
  112    HA   TRP  13           HA       TRP  13   3.846  -1.435  -2.725
  113   1HB   TRP  13          2HB       TRP  13   4.997  -4.093  -2.769
  114   2HB   TRP  13          1HB       TRP  13   4.928  -3.198  -1.218
  115    HD1  TRP  13           HD       TRP  13   3.147  -4.952  -0.362
  116    HE1  TRP  13           1HE      TRP  13   0.642  -5.186  -0.730
  117    HE3  TRP  13           3HE      TRP  13   2.531  -1.635  -4.158
  118    HZ2  TRP  13           2HZ      TRP  13  -1.254  -4.104  -2.415
  119    HZ3  TRP  13           3HZ      TRP  13   0.460  -1.616  -5.424
  120    HH2  TRP  13           HH       TRP  13  -1.468  -2.933  -4.620
  121    H    HIS  14           H        HIS  14   7.306  -2.338  -3.236
  122    HA   HIS  14           HA       HIS  14   8.432  -0.772  -1.162
  123   1HB   HIS  14          2HB       HIS  14   9.333  -2.154  -3.549
  124   2HB   HIS  14          1HB       HIS  14  10.194  -0.635  -3.314
  125    HD1  HIS  14           1HD      HIS  14  10.916  -3.841  -2.594
  126    HD2  HIS  14           2HD      HIS  14  10.502  -0.488  -0.204
  127    HE1  HIS  14           1HE      HIS  14  12.487  -4.200  -0.602
  128    H    GLU  15           H        GLU  15   8.089   0.196  -4.596
  129    HA   GLU  15           HA       GLU  15   8.711   2.954  -4.075
  130   1HB   GLU  15          2HB       GLU  15   8.068   1.321  -6.445
  131   2HB   GLU  15          1HB       GLU  15   7.641   3.040  -6.529
  132   1HG   GLU  15          2HG       GLU  15  10.252   2.879  -5.325
  133   2HG   GLU  15          1HG       GLU  15  10.269   1.838  -6.739
  134    H    GLY  16           H        GLY  16   5.515   1.193  -4.715
  135   1HA   GLY  16          2HA       GLY  16   3.889   3.535  -4.727
  136   2HA   GLY  16          1HA       GLY  16   3.384   1.906  -4.392
  137    H    LEU  17           H        LEU  17   5.319   1.667  -2.014
  138    HA   LEU  17           HA       LEU  17   3.873   3.302  -0.057
  139   1HB   LEU  17          2HB       LEU  17   6.005   1.223   0.276
  140   2HB   LEU  17          1HB       LEU  17   5.141   2.064   1.566
  141    HG   LEU  17           HG       LEU  17   3.768   0.379  -0.596
  142   1HD1  LEU  17          1HD1      LEU  17   3.493  -1.231   1.202
  143   2HD1  LEU  17          2HD1      LEU  17   5.220  -0.934   0.885
  144   3HD1  LEU  17          3HD1      LEU  17   4.434  -0.193   2.300
  145   1HD2  LEU  17          1HD2      LEU  17   1.827   0.525   0.817
  146   2HD2  LEU  17          2HD2      LEU  17   2.692   1.584   1.955
  147   3HD2  LEU  17          3HD2      LEU  17   2.335   2.153   0.307
  148    H    GLU  18           H        GLU  18   7.127   3.293  -1.574
  149    HA   GLU  18           HA       GLU  18   8.196   5.409   0.129
  150   1HB   GLU  18          2HB       GLU  18   9.549   3.658  -0.859
  151   2HB   GLU  18          1HB       GLU  18   9.288   4.419  -2.440
  152   1HG   GLU  18          2HG       GLU  18  10.627   6.218  -1.934
  153   2HG   GLU  18          1HG       GLU  18  10.075   6.291  -0.255
  154    H    GLU  19           H        GLU  19   7.230   5.454  -3.378
  155    HA   GLU  19           HA       GLU  19   7.493   8.275  -3.810
  156   1HB   GLU  19          2HB       GLU  19   7.481   6.578  -5.561
  157   2HB   GLU  19          1HB       GLU  19   5.796   6.140  -5.121
  158   1HG   GLU  19          2HG       GLU  19   5.860   7.556  -7.182
  159   2HG   GLU  19          1HG       GLU  19   5.034   8.391  -5.898
  160    H    ALA  20           H        ALA  20   4.985   6.242  -2.352
  161    HA   ALA  20           HA       ALA  20   2.914   8.317  -2.316
  162   1HB   ALA  20          1HB       ALA  20   1.701   6.738  -0.949
  163   2HB   ALA  20          2HB       ALA  20   2.272   5.977  -2.452
  164   3HB   ALA  20          3HB       ALA  20   3.110   5.653  -0.917
  165    H    SER  21           H        SER  21   4.580   6.458   0.351
  166    HA   SER  21           HA       SER  21   4.046   8.208   2.447
  167   1HB   SER  21          2HB       SER  21   5.687   7.257   3.724
  168   2HB   SER  21          1HB       SER  21   5.126   5.956   2.682
  169    HG   SER  21           HG       SER  21   7.018   6.850   1.233
  170    H    ARG  22           H        ARG  22   6.523   8.646  -0.113
  171    HA   ARG  22           HA       ARG  22   8.063  10.738   1.088
  172   1HB   ARG  22          2HB       ARG  22   8.848   9.355  -0.779
  173   2HB   ARG  22          1HB       ARG  22   7.633  10.068  -1.823
  174   1HG   ARG  22          2HG       ARG  22   8.625  12.303  -1.515
  175   2HG   ARG  22          1HG       ARG  22   9.784  11.663  -0.364
  176   1HD   ARG  22          2HD       ARG  22   9.635  10.407  -3.083
  177   2HD   ARG  22          1HD       ARG  22  10.420  11.989  -2.889
  178    HE   ARG  22           HE       ARG  22  11.486  10.513  -0.864
  179   1HH1  ARG  22          2HH2      ARG  22  11.285   9.980  -4.320
  180   2HH1  ARG  22          1HH2      ARG  22  12.800   9.141  -4.419
  181   1HH2  ARG  22          1HH1      ARG  22  13.501   9.419  -1.023
  182   2HH2  ARG  22          2HH1      ARG  22  14.021   8.827  -2.561
  183    H    LEU  23           H        LEU  23   5.000  10.789  -0.815
  184    HA   LEU  23           HA       LEU  23   4.851  13.686  -1.152
  185   1HB   LEU  23          2HB       LEU  23   3.191  11.383  -1.691
  186   2HB   LEU  23          1HB       LEU  23   2.371  12.927  -1.265
  187    HG   LEU  23           HG       LEU  23   2.520  12.827  -3.694
  188   1HD1  LEU  23          1HD1      LEU  23   3.715  14.753  -4.252
  189   2HD1  LEU  23          2HD1      LEU  23   2.746  14.966  -2.776
  190   3HD1  LEU  23          3HD1      LEU  23   4.510  14.761  -2.661
  191   1HD2  LEU  23          1HD2      LEU  23   4.576  12.588  -4.893
  192   2HD2  LEU  23          2HD2      LEU  23   5.479  12.348  -3.378
  193   3HD2  LEU  23          3HD2      LEU  23   4.282  11.140  -3.902
  194    H    TYR  24           H        TYR  24   4.644  11.663   1.556
  195    HA   TYR  24           HA       TYR  24   3.267  13.825   3.220
  196   1HB   TYR  24          2HB       TYR  24   1.874  12.053   3.309
  197   2HB   TYR  24          1HB       TYR  24   3.205  10.853   3.156
  198    HD1  TYR  24           1HD      TYR  24   1.482  13.178   5.453
  199    HD2  TYR  24           2HD      TYR  24   4.304   9.971   5.046
  200    HE1  TYR  24           1HE      TYR  24   1.381  12.788   7.896
  201    HE2  TYR  24           2HE      TYR  24   4.215   9.569   7.480
  202    HH   TYR  24           HH       TYR  24   3.545  10.376   9.431
  203    H    PHE  25           H        PHE  25   5.906  11.407   3.234
  204    HA   PHE  25           HA       PHE  25   7.225  11.728   5.543
  205   1HB   PHE  25          2HB       PHE  25   7.828  10.190   3.619
  206   2HB   PHE  25          1HB       PHE  25   8.478  11.545   2.744
  207    HD1  PHE  25           1HD      PHE  25   8.749   9.828   6.022
  208    HD2  PHE  25           2HD      PHE  25  10.711  12.150   2.988
  209    HE1  PHE  25           1HE      PHE  25  10.910   9.515   7.190
  210    HE2  PHE  25           2HE      PHE  25  12.883  11.820   4.143
  211    HZ   PHE  25           HZ       PHE  25  12.979  10.514   6.250
  212    H    GLY  26           H        GLY  26   7.702  13.858   2.690
  213   1HA   GLY  26          2HA       GLY  26   8.367  16.154   4.422
  214   2HA   GLY  26          1HA       GLY  26   9.660  15.597   3.386
  215    H    GLU  27           H        GLU  27   6.253  15.326   2.419
  216    HA   GLU  27           HA       GLU  27   6.725  17.566   0.528
  217   1HB   GLU  27          2HB       GLU  27   6.351  14.878  -0.161
  218   2HB   GLU  27          1HB       GLU  27   4.824  15.641  -0.506
  219   1HG   GLU  27          2HG       GLU  27   6.339  15.725  -2.424
  220   2HG   GLU  27          1HG       GLU  27   5.953  17.350  -1.877
  221    H    ARG  28           H        ARG  28   4.875  16.615   3.203
  222    HA   ARG  28           HA       ARG  28   2.740  16.904   3.946
  223   1HB   ARG  28          2HB       ARG  28   4.119  19.425   3.338
  224   2HB   ARG  28          1HB       ARG  28   2.386  19.577   3.652
  225   1HG   ARG  28          2HG       ARG  28   2.571  18.876   5.825
  226   2HG   ARG  28          1HG       ARG  28   3.932  17.786   5.475
  227   1HD   ARG  28          2HD       ARG  28   5.411  19.405   6.134
  228   2HD   ARG  28          1HD       ARG  28   4.769  20.516   4.940
  229    HE   ARG  28           HE       ARG  28   2.941  20.565   6.989
  230   1HH1  ARG  28          2HH2      ARG  28   6.380  21.192   6.702
  231   2HH1  ARG  28          1HH2      ARG  28   6.404  22.399   7.947
  232   1HH2  ARG  28          1HH1      ARG  28   3.009  22.167   8.645
  233   2HH2  ARG  28          2HH1      ARG  28   4.517  22.925   9.024
  234    H    ASN  29           H        ASN  29   2.578  15.916   1.255
  235    HA   ASN  29           HA       ASN  29   0.102  17.203   0.289
  236   1HB   ASN  29          2HB       ASN  29   2.364  17.731  -0.954
  237   2HB   ASN  29          1HB       ASN  29   2.224  16.087  -1.566
  238   1HD2  ASN  29          2HD2      ASN  29   2.096  18.616  -2.970
  239   2HD2  ASN  29          1HD2      ASN  29   0.523  18.682  -3.725
  240    H    VAL  30           H        VAL  30  -0.474  15.417   1.862
  241    HA   VAL  30           HA       VAL  30  -0.441  12.677   1.301
  242    HB   VAL  30           HB       VAL  30  -2.617  14.270   2.679
  243   1HG1  VAL  30          1HG1      VAL  30  -3.100  12.193   3.801
  244   2HG1  VAL  30          2HG1      VAL  30  -3.344  12.012   2.047
  245   3HG1  VAL  30          3HG1      VAL  30  -1.886  11.342   2.817
  246   1HG2  VAL  30          1HG2      VAL  30  -1.449  13.636   4.702
  247   2HG2  VAL  30          2HG2      VAL  30  -0.160  12.858   3.751
  248   3HG2  VAL  30          3HG2      VAL  30  -0.386  14.621   3.669
  249    H    LYS  31           H        LYS  31  -2.476  15.265  -0.167
  250    HA   LYS  31           HA       LYS  31  -4.213  13.743  -1.799
  251   1HB   LYS  31          2HB       LYS  31  -4.586  15.978  -1.513
  252   2HB   LYS  31          1HB       LYS  31  -2.874  16.411  -1.892
  253   1HG   LYS  31          2HG       LYS  31  -4.812  15.450  -4.003
  254   2HG   LYS  31          1HG       LYS  31  -4.659  17.150  -3.552
  255   1HD   LYS  31          2HD       LYS  31  -2.095  16.725  -3.885
  256   2HD   LYS  31          1HD       LYS  31  -2.672  15.332  -4.860
  257   1HE   LYS  31          2HE       LYS  31  -4.078  17.031  -6.127
  258   2HE   LYS  31          1HE       LYS  31  -3.067  18.276  -5.334
  259   1HZ   LYS  31          1HZ       LYS  31  -2.045  17.687  -7.352
  260   2HZ   LYS  31          2HZ       LYS  31  -1.142  16.968  -6.183
  261   3HZ   LYS  31          3HZ       LYS  31  -2.198  16.091  -7.061
  262    H    GLY  32           H        GLY  32  -0.755  14.729  -2.366
  263   1HA   GLY  32          2HA       GLY  32  -0.478  13.777  -5.021
  264   2HA   GLY  32          1HA       GLY  32   0.816  14.021  -3.872
  265    H    MET  33           H        MET  33   0.544  12.181  -1.935
  266    HA   MET  33           HA       MET  33   1.329   9.685  -3.052
  267   1HB   MET  33          2HB       MET  33   1.158   8.782  -0.938
  268   2HB   MET  33          1HB       MET  33   1.740  10.473  -0.745
  269   1HG   MET  33          2HG       MET  33  -0.105  11.083   0.483
  270   2HG   MET  33          1HG       MET  33  -1.190  10.014  -0.379
  271   1HE   MET  33          1HE       MET  33   1.834   8.597   2.754
  272   2HE   MET  33          2HE       MET  33   2.245   9.030   1.078
  273   3HE   MET  33          3HE       MET  33   1.659  10.279   2.202
  274    H    PHE  34           H        PHE  34  -1.856  10.975  -2.362
  275    HA   PHE  34           HA       PHE  34  -3.368   8.558  -2.339
  276   1HB   PHE  34          2HB       PHE  34  -3.782  11.209  -1.838
  277   2HB   PHE  34          1HB       PHE  34  -4.582  10.992  -3.428
  278    HD1  PHE  34           1HD      PHE  34  -5.810  11.760  -0.805
  279    HD2  PHE  34           2HD      PHE  34  -5.300   7.895  -2.622
  280    HE1  PHE  34           1HE      PHE  34  -7.784  10.909   0.419
  281    HE2  PHE  34           2HE      PHE  34  -7.239   7.052  -1.372
  282    HZ   PHE  34           HZ       PHE  34  -8.501   8.568   0.137
  283    H    GLU  35           H        GLU  35  -1.794  10.336  -4.968
  284    HA   GLU  35           HA       GLU  35  -3.450   9.274  -7.134
  285   1HB   GLU  35          2HB       GLU  35  -2.070  11.470  -7.184
  286   2HB   GLU  35          1HB       GLU  35  -0.644  10.493  -7.257
  287   1HG   GLU  35          2HG       GLU  35  -0.970  10.848  -9.421
  288   2HG   GLU  35          1HG       GLU  35  -1.926   9.341  -9.254
  289    H    VAL  36           H        VAL  36  -0.449   8.268  -5.435
  290    HA   VAL  36           HA       VAL  36  -0.014   6.038  -7.353
  291    HB   VAL  36           HB       VAL  36   1.915   7.396  -6.920
  292   1HG1  VAL  36          1HG1      VAL  36   3.023   7.381  -4.818
  293   2HG1  VAL  36          2HG1      VAL  36   1.435   8.168  -4.655
  294   3HG1  VAL  36          3HG1      VAL  36   1.671   6.506  -4.059
  295   1HG2  VAL  36          1HG2      VAL  36   3.437   5.695  -6.468
  296   2HG2  VAL  36          2HG2      VAL  36   2.127   4.620  -5.925
  297   3HG2  VAL  36          3HG2      VAL  36   2.175   5.178  -7.614
  298    H    LEU  37           H        LEU  37  -0.868   6.644  -3.899
  299    HA   LEU  37           HA       LEU  37  -1.448   3.871  -3.219
  300   1HB   LEU  37          2HB       LEU  37  -1.803   6.460  -1.894
  301   2HB   LEU  37          1HB       LEU  37  -2.671   4.983  -1.367
  302    HG   LEU  37           HG       LEU  37   0.367   5.029  -1.693
  303   1HD1  LEU  37          1HD1      LEU  37   0.439   5.401   0.733
  304   2HD1  LEU  37          2HD1      LEU  37  -0.361   6.779  -0.058
  305   3HD1  LEU  37          3HD1      LEU  37  -1.333   5.551   0.784
  306   1HD2  LEU  37          1HD2      LEU  37   0.288   3.175  -0.160
  307   2HD2  LEU  37          2HD2      LEU  37  -1.486   3.284  -0.066
  308   3HD2  LEU  37          3HD2      LEU  37  -0.703   2.823  -1.597
  309    H    GLU  38           H        GLU  38  -3.303   6.259  -5.137
  310    HA   GLU  38           HA       GLU  38  -5.898   5.106  -4.652
  311   1HB   GLU  38          2HB       GLU  38  -6.179   7.054  -5.481
  312   2HB   GLU  38          1HB       GLU  38  -4.798   6.925  -6.628
  313   1HG   GLU  38          2HG       GLU  38  -6.116   5.545  -8.093
  314   2HG   GLU  38          1HG       GLU  38  -7.483   5.584  -6.936
  315    HA   PRO  39           HA       PRO  39  -5.380   2.349  -8.420
  316   1HB   PRO  39          2HB       PRO  39  -3.211   2.194  -9.970
  317   2HB   PRO  39          1HB       PRO  39  -4.355   3.522 -10.141
  318   1HG   PRO  39          2HG       PRO  39  -1.675   3.505  -8.691
  319   2HG   PRO  39          1HG       PRO  39  -2.338   4.749  -9.747
  320   1HD   PRO  39          1HD       PRO  39  -2.559   4.816  -6.936
  321   2HD   PRO  39          2HD       PRO  39  -3.731   5.638  -8.038
  322    H    LEU  40           H        LEU  40  -2.205   2.542  -6.572
  323    HA   LEU  40           HA       LEU  40  -1.763  -0.294  -6.499
  324   1HB   LEU  40          2HB       LEU  40  -0.037   0.070  -5.375
  325   2HB   LEU  40          1HB       LEU  40  -0.275   1.728  -6.043
  326    HG   LEU  40           HG       LEU  40  -1.421   2.179  -3.784
  327   1HD1  LEU  40          1HD1      LEU  40  -0.376   0.910  -1.911
  328   2HD1  LEU  40          2HD1      LEU  40  -1.342  -0.173  -2.941
  329   3HD1  LEU  40          3HD1      LEU  40   0.431  -0.156  -3.086
  330   1HD2  LEU  40          1HD2      LEU  40   0.828   2.786  -2.884
  331   2HD2  LEU  40          2HD2      LEU  40   1.581   1.714  -4.089
  332   3HD2  LEU  40          3HD2      LEU  40   0.693   3.162  -4.618
  333    H    HIS  41           H        HIS  41  -4.027   1.791  -4.629
  334    HA   HIS  41           HA       HIS  41  -4.589  -0.238  -2.667
  335   1HB   HIS  41          2HB       HIS  41  -5.846   2.344  -3.414
  336   2HB   HIS  41          1HB       HIS  41  -6.690   1.167  -2.355
  337    HD1  HIS  41           1HD      HIS  41  -6.027   3.793  -1.095
  338    HD2  HIS  41           2HD      HIS  41  -3.341   0.651  -1.202
  339    HE1  HIS  41           1HE      HIS  41  -4.521   4.084   0.949
  340    H    ALA  42           H        ALA  42  -5.979   0.583  -5.864
  341    HA   ALA  42           HA       ALA  42  -8.233  -1.312  -5.590
  342   1HB   ALA  42          1HB       ALA  42  -8.757  -0.614  -7.832
  343   2HB   ALA  42          2HB       ALA  42  -8.555   0.783  -6.747
  344   3HB   ALA  42          3HB       ALA  42  -7.268   0.358  -7.900
  345    H    MET  43           H        MET  43  -5.080  -1.091  -7.245
  346    HA   MET  43           HA       MET  43  -5.079  -3.579  -8.670
  347   1HB   MET  43          2HB       MET  43  -2.950  -1.681  -7.715
  348   2HB   MET  43          1HB       MET  43  -2.588  -3.204  -8.539
  349   1HG   MET  43          2HG       MET  43  -3.679  -2.485 -10.567
  350   2HG   MET  43          1HG       MET  43  -4.557  -1.218  -9.765
  351   1HE   MET  43          1HE       MET  43  -2.481   0.859 -12.119
  352   2HE   MET  43          2HE       MET  43  -3.291  -0.702 -12.394
  353   3HE   MET  43          3HE       MET  43  -4.074   0.543 -11.391
  354    H    MET  44           H        MET  44  -4.942  -3.008  -5.218
  355    HA   MET  44           HA       MET  44  -3.676  -5.696  -4.785
  356   1HB   MET  44          2HB       MET  44  -3.351  -5.114  -2.632
  357   2HB   MET  44          1HB       MET  44  -2.810  -3.730  -3.644
  358   1HG   MET  44          2HG       MET  44  -3.914  -2.460  -2.166
  359   2HG   MET  44          1HG       MET  44  -5.389  -3.030  -2.953
  360   1HE   MET  44          1HE       MET  44  -5.671  -2.821   0.957
  361   2HE   MET  44          2HE       MET  44  -4.412  -2.034  -0.023
  362   3HE   MET  44          3HE       MET  44  -6.093  -2.079  -0.602
  363    H    GLU  45           H        GLU  45  -6.787  -4.089  -4.804
  364    HA   GLU  45           HA       GLU  45  -8.132  -6.191  -3.219
  365   1HB   GLU  45          2HB       GLU  45  -8.595  -3.655  -3.072
  366   2HB   GLU  45          1HB       GLU  45  -9.441  -3.857  -4.589
  367   1HG   GLU  45          2HG       GLU  45 -10.148  -5.827  -2.419
  368   2HG   GLU  45          1HG       GLU  45 -10.674  -4.193  -2.204
  369    H    ARG  46           H        ARG  46  -7.788  -5.169  -6.662
  370    HA   ARG  46           HA       ARG  46  -9.739  -6.547  -8.009
  371   1HB   ARG  46          2HB       ARG  46  -7.289  -5.287  -8.635
  372   2HB   ARG  46          1HB       ARG  46  -7.065  -6.911  -9.205
  373   1HG   ARG  46          2HG       ARG  46  -9.708  -5.878  -9.972
  374   2HG   ARG  46          1HG       ARG  46  -8.398  -4.881 -10.546
  375   1HD   ARG  46          2HD       ARG  46  -7.303  -7.026 -11.382
  376   2HD   ARG  46          1HD       ARG  46  -8.874  -7.804 -11.059
  377    HE   ARG  46           HE       ARG  46  -9.255  -5.370 -12.484
  378   1HH1  ARG  46          2HH2      ARG  46  -8.232  -8.674 -13.093
  379   2HH1  ARG  46          1HH2      ARG  46  -8.617  -8.614 -14.783
  380   1HH2  ARG  46          1HH1      ARG  46  -9.762  -5.338 -14.717
  381   2HH2  ARG  46          2HH1      ARG  46  -9.477  -6.753 -15.669
  382    H    GLY  47           H        GLY  47  -6.945  -8.009  -6.343
  383   1HA   GLY  47          2HA       GLY  47  -7.211 -10.221  -5.464
  384   2HA   GLY  47          1HA       GLY  47  -8.073 -10.697  -6.927
  385    HA   PRO  48           HA       PRO  48  -3.307 -11.236  -7.334
  386   1HB   PRO  48          2HB       PRO  48  -2.907 -13.661  -6.382
  387   2HB   PRO  48          1HB       PRO  48  -2.760 -12.142  -5.373
  388   1HG   PRO  48          2HG       PRO  48  -5.106 -14.153  -5.495
  389   2HG   PRO  48          1HG       PRO  48  -4.369 -13.482  -4.043
  390   1HD   PRO  48          1HD       PRO  48  -6.622 -12.291  -5.239
  391   2HD   PRO  48          2HD       PRO  48  -5.336 -11.257  -4.449
  392    H    GLN  49           H        GLN  49  -2.322 -13.253  -8.467
  393    HA   GLN  49           HA       GLN  49  -4.349 -14.310 -10.384
  394   1HB   GLN  49          2HB       GLN  49  -3.239 -12.519 -11.536
  395   2HB   GLN  49          1HB       GLN  49  -1.663 -13.055 -11.032
  396   1HG   GLN  49          2HG       GLN  49  -1.523 -14.162 -12.898
  397   2HG   GLN  49          1HG       GLN  49  -2.786 -15.279 -12.284
  398   1HE2  GLN  49          2HE2      GLN  49  -2.136 -14.582 -14.985
  399   2HE2  GLN  49          1HE2      GLN  49  -3.563 -13.819 -15.641
  400    H    THR  50           H        THR  50  -0.947 -14.891 -10.545
  401    HA   THR  50           HA       THR  50  -0.872 -17.660 -10.616
  402    HB   THR  50           HB       THR  50   0.872 -16.642 -11.580
  403    HG1  THR  50           1HG      THR  50   2.720 -17.457 -10.455
  404   1HG2  THR  50          1HG2      THR  50   2.414 -15.029 -10.544
  405   2HG2  THR  50          2HG2      THR  50   0.747 -14.404 -10.554
  406   3HG2  THR  50          3HG2      THR  50   1.447 -15.051  -9.051
  407    H    LEU  51           H        LEU  51   1.123 -16.413  -8.143
  408    HA   LEU  51           HA       LEU  51  -0.279 -16.841  -5.681
  409   1HB   LEU  51          2HB       LEU  51   0.226 -19.268  -6.942
  410   2HB   LEU  51          1HB       LEU  51   1.637 -19.090  -5.939
  411    HG   LEU  51           HG       LEU  51   0.254 -18.750  -3.979
  412   1HD1  LEU  51          1HD1      LEU  51  -2.174 -19.161  -4.048
  413   2HD1  LEU  51          2HD1      LEU  51  -1.731 -17.705  -4.971
  414   3HD1  LEU  51          3HD1      LEU  51  -2.115 -19.219  -5.825
  415   1HD2  LEU  51          1HD2      LEU  51  -0.642 -21.094  -3.952
  416   2HD2  LEU  51          2HD2      LEU  51  -0.490 -21.155  -5.724
  417   3HD2  LEU  51          3HD2      LEU  51   0.967 -21.018  -4.709
  418    H    LYS  52           H        LYS  52   1.356 -14.867  -6.779
  419    HA   LYS  52           HA       LYS  52   3.915 -15.028  -5.221
  420   1HB   LYS  52          2HB       LYS  52   3.433 -13.896  -8.021
  421   2HB   LYS  52          1HB       LYS  52   4.902 -13.684  -7.117
  422   1HG   LYS  52          2HG       LYS  52   4.058 -16.498  -7.308
  423   2HG   LYS  52          1HG       LYS  52   4.404 -15.707  -8.855
  424   1HD   LYS  52          2HD       LYS  52   6.663 -15.244  -8.246
  425   2HD   LYS  52          1HD       LYS  52   6.342 -15.375  -6.534
  426   1HE   LYS  52          2HE       LYS  52   6.007 -17.796  -6.770
  427   2HE   LYS  52          1HE       LYS  52   6.346 -17.659  -8.512
  428   1HZ   LYS  52          1HZ       LYS  52   8.252 -18.209  -7.026
  429   2HZ   LYS  52          2HZ       LYS  52   8.500 -16.973  -8.054
  430   3HZ   LYS  52          3HZ       LYS  52   8.199 -16.676  -6.477
  431    H    GLU  53           H        GLU  53   1.367 -12.916  -6.595
  432    HA   GLU  53           HA       GLU  53   2.058 -10.567  -4.996
  433   1HB   GLU  53          2HB       GLU  53  -0.152 -11.318  -6.937
  434   2HB   GLU  53          1HB       GLU  53   0.120  -9.688  -6.243
  435   1HG   GLU  53          2HG       GLU  53   1.886  -9.253  -7.638
  436   2HG   GLU  53          1HG       GLU  53   2.402 -10.945  -7.708
  437    H    THR  54           H        THR  54   1.680 -12.515  -3.171
  438    HA   THR  54           HA       THR  54  -0.768 -11.821  -1.713
  439    HB   THR  54           HB       THR  54  -0.383 -14.697  -2.509
  440    HG1  THR  54           1HG      THR  54  -2.555 -14.055  -3.619
  441   1HG2  THR  54          1HG2      THR  54  -2.649 -15.003  -1.619
  442   2HG2  THR  54          2HG2      THR  54  -1.541 -14.411  -0.359
  443   3HG2  THR  54          3HG2      THR  54  -2.697 -13.296  -1.125
  444    H    SER  55           H        SER  55   1.832 -11.220  -1.088
  445    HA   SER  55           HA       SER  55   2.695 -13.162   0.994
  446   1HB   SER  55          2HB       SER  55   4.094 -10.645  -0.009
  447   2HB   SER  55          1HB       SER  55   4.699 -11.710   1.232
  448    HG   SER  55           HG       SER  55   5.632 -12.680  -0.340
  449    H    PHE  56           H        PHE  56   1.444  -9.875   0.513
  450    HA   PHE  56           HA       PHE  56   1.457  -9.132   3.347
  451   1HB   PHE  56          2HB       PHE  56   0.512  -7.036   2.572
  452   2HB   PHE  56          1HB       PHE  56   1.933  -7.416   1.639
  453    HD1  PHE  56           1HD      PHE  56   1.794  -8.092  -0.685
  454    HD2  PHE  56           2HD      PHE  56  -1.728  -7.230   1.623
  455    HE1  PHE  56           1HE      PHE  56   0.439  -8.000  -2.769
  456    HE2  PHE  56           2HE      PHE  56  -3.073  -7.130  -0.450
  457    HZ   PHE  56           HZ       PHE  56  -1.989  -7.510  -2.647
  458    H    ASN  57           H        ASN  57  -1.014 -10.039   0.810
  459    HA   ASN  57           HA       ASN  57  -3.271  -9.821   2.577
  460   1HB   ASN  57          2HB       ASN  57  -2.949  -9.893  -0.052
  461   2HB   ASN  57          1HB       ASN  57  -3.295 -11.609   0.230
  462   1HD2  ASN  57          2HD2      ASN  57  -5.391 -12.211   0.560
  463   2HD2  ASN  57          1HD2      ASN  57  -6.679 -11.061   0.786
  464    H    GLN  58           H        GLN  58  -0.716 -12.037   2.650
  465    HA   GLN  58           HA       GLN  58  -2.195 -14.457   3.440
  466   1HB   GLN  58          2HB       GLN  58   0.295 -13.933   2.229
  467   2HB   GLN  58          1HB       GLN  58   0.679 -14.458   3.854
  468   1HG   GLN  58          2HG       GLN  58  -1.063 -15.967   1.860
  469   2HG   GLN  58          1HG       GLN  58   0.547 -16.400   2.389
  470   1HE2  GLN  58          2HE2      GLN  58  -2.780 -16.760   2.951
  471   2HE2  GLN  58          1HE2      GLN  58  -2.624 -17.543   4.501
  472    H    ALA  59           H        ALA  59   0.295 -12.317   4.976
  473    HA   ALA  59           HA       ALA  59  -0.897 -12.901   7.683
  474   1HB   ALA  59          1HB       ALA  59   1.301 -12.449   8.530
  475   2HB   ALA  59          2HB       ALA  59   1.342 -13.771   7.339
  476   3HB   ALA  59          3HB       ALA  59   1.905 -12.145   6.883
  477    H    TYR  60           H        TYR  60   0.616 -10.379   5.748
  478    HA   TYR  60           HA       TYR  60  -0.042  -8.070   7.474
  479   1HB   TYR  60          2HB       TYR  60   0.695  -8.060   4.583
  480   2HB   TYR  60          1HB       TYR  60   0.998  -6.832   5.865
  481    HD1  TYR  60           1HD      TYR  60   2.979  -7.785   3.869
  482    HD2  TYR  60           2HD      TYR  60   2.072  -9.248   7.798
  483    HE1  TYR  60           1HE      TYR  60   5.285  -8.641   4.084
  484    HE2  TYR  60           2HE      TYR  60   4.319 -10.203   7.967
  485    HH   TYR  60           HH       TYR  60   6.713  -9.882   5.311
  486    H    GLY  61           H        GLY  61  -2.407  -9.574   7.108
  487   1HA   GLY  61          2HA       GLY  61  -4.227  -8.382   5.166
  488   2HA   GLY  61          1HA       GLY  61  -4.643  -9.374   6.533
  489    H    ARG  62           H        ARG  62  -2.901  -7.318   8.170
  490    HA   ARG  62           HA       ARG  62  -5.067  -5.426   8.671
  491   1HB   ARG  62          2HB       ARG  62  -2.546  -6.223  10.163
  492   2HB   ARG  62          1HB       ARG  62  -3.499  -4.837  10.645
  493   1HG   ARG  62          2HG       ARG  62  -4.633  -7.647  10.356
  494   2HG   ARG  62          1HG       ARG  62  -4.100  -6.927  11.867
  495   1HD   ARG  62          2HD       ARG  62  -5.765  -5.022  11.377
  496   2HD   ARG  62          1HD       ARG  62  -6.422  -6.079  10.116
  497    HE   ARG  62           HE       ARG  62  -7.405  -7.331  11.722
  498   1HH1  ARG  62          2HH2      ARG  62  -4.873  -5.514  13.363
  499   2HH1  ARG  62          1HH2      ARG  62  -5.306  -6.099  14.935
  500   1HH2  ARG  62          1HH1      ARG  62  -7.933  -8.068  13.815
  501   2HH2  ARG  62          2HH1      ARG  62  -7.010  -7.518  15.171
  502    H    ASP  63           H        ASP  63  -2.157  -5.468   6.894
  503    HA   ASP  63           HA       ASP  63  -1.276  -2.743   7.252
  504   1HB   ASP  63          2HB       ASP  63  -0.454  -4.902   5.240
  505   2HB   ASP  63          1HB       ASP  63   0.396  -3.410   5.514
  506    H    LEU  64           H        LEU  64  -0.851  -2.543   4.147
  507    HA   LEU  64           HA       LEU  64  -2.452  -1.079   2.908
  508   1HB   LEU  64          2HB       LEU  64  -1.204  -3.567   2.103
  509   2HB   LEU  64          1HB       LEU  64  -2.582  -3.106   1.075
  510    HG   LEU  64           HG       LEU  64  -1.179  -0.728   1.663
  511   1HD1  LEU  64          1HD1      LEU  64   1.078  -1.178   0.789
  512   2HD1  LEU  64          2HD1      LEU  64   0.764  -2.022   2.324
  513   3HD1  LEU  64          3HD1      LEU  64   0.719  -2.922   0.789
  514   1HD2  LEU  64          1HD2      LEU  64  -0.830  -0.796  -0.829
  515   2HD2  LEU  64          2HD2      LEU  64  -1.263  -2.523  -0.817
  516   3HD2  LEU  64          3HD2      LEU  64  -2.477  -1.299  -0.378
  517    H    MET  65           H        MET  65  -3.749  -4.434   3.373
  518    HA   MET  65           HA       MET  65  -6.286  -4.286   2.308
  519   1HB   MET  65          2HB       MET  65  -5.132  -6.249   3.391
  520   2HB   MET  65          1HB       MET  65  -5.500  -5.562   4.954
  521   1HG   MET  65          2HG       MET  65  -7.913  -5.753   4.533
  522   2HG   MET  65          1HG       MET  65  -7.643  -6.233   2.885
  523   1HE   MET  65          1HE       MET  65  -8.846  -9.575   3.890
  524   2HE   MET  65          2HE       MET  65  -9.507  -7.937   4.107
  525   3HE   MET  65          3HE       MET  65  -8.660  -8.363   2.600
  526    H    GLU  66           H        GLU  66  -5.433  -3.201   5.647
  527    HA   GLU  66           HA       GLU  66  -8.047  -1.817   6.017
  528   1HB   GLU  66          2HB       GLU  66  -5.774  -2.368   7.899
  529   2HB   GLU  66          1HB       GLU  66  -7.169  -1.376   8.264
  530   1HG   GLU  66          2HG       GLU  66  -8.416  -3.657   7.321
  531   2HG   GLU  66          1HG       GLU  66  -6.985  -4.334   8.048
  532    H    ALA  67           H        ALA  67  -4.591  -1.043   5.434
  533    HA   ALA  67           HA       ALA  67  -4.704   1.730   5.849
  534   1HB   ALA  67          1HB       ALA  67  -2.755   1.797   4.356
  535   2HB   ALA  67          2HB       ALA  67  -2.647   0.499   5.568
  536   3HB   ALA  67          3HB       ALA  67  -3.072   0.110   3.885
  537    H    GLN  68           H        GLN  68  -6.016  -0.154   3.200
  538    HA   GLN  68           HA       GLN  68  -6.942   2.258   1.701
  539   1HB   GLN  68          2HB       GLN  68  -5.947   0.914   0.229
  540   2HB   GLN  68          1HB       GLN  68  -6.381  -0.589   1.130
  541   1HG   GLN  68          2HG       GLN  68  -8.474   0.955  -0.406
  542   2HG   GLN  68          1HG       GLN  68  -7.413  -0.191  -1.220
  543   1HE2  GLN  68          2HE2      GLN  68 -10.423  -0.034  -0.131
  544   2HE2  GLN  68          1HE2      GLN  68 -10.573  -1.675   0.448
  545    H    GLU  69           H        GLU  69  -8.273  -0.776   3.227
  546    HA   GLU  69           HA       GLU  69 -10.886  -0.656   2.547
  547   1HB   GLU  69          2HB       GLU  69  -9.732  -2.297   4.081
  548   2HB   GLU  69          1HB       GLU  69 -10.096  -1.182   5.391
  549   1HG   GLU  69          2HG       GLU  69 -12.490  -1.317   4.912
  550   2HG   GLU  69          1HG       GLU  69 -12.184  -2.301   3.479
  551    H    TRP  70           H        TRP  70  -9.373   1.544   4.868
  552    HA   TRP  70           HA       TRP  70 -11.817   3.063   5.397
  553   1HB   TRP  70          2HB       TRP  70  -8.923   3.110   6.172
  554   2HB   TRP  70          1HB       TRP  70  -9.901   4.579   6.351
  555    HD1  TRP  70           HD       TRP  70 -11.407   4.695   8.414
  556    HE1  TRP  70           1HE      TRP  70 -11.858   3.178  10.387
  557    HE3  TRP  70           3HE      TRP  70  -9.356   0.496   6.582
  558    HZ2  TRP  70           2HZ      TRP  70 -11.457   0.441  11.032
  559    HZ3  TRP  70           3HZ      TRP  70  -9.780  -1.661   7.692
  560    HH2  TRP  70           HH       TRP  70 -10.706  -1.681   9.998
  561    H    CYS  71           H        CYS  71 -11.631   2.787   2.671
  562    HA   CYS  71           HA       CYS  71 -10.211   5.015   1.468
  563   1HB   CYS  71          2HB       CYS  71 -10.649   2.779   0.345
  564   2HB   CYS  71          1HB       CYS  71 -12.261   3.418   0.005
  565    HG   CYS  71           HG       CYS  71 -10.807   3.739  -2.099
  566    H    ARG  72           H        ARG  72 -13.797   4.194   1.503
  567    HA   ARG  72           HA       ARG  72 -14.878   6.737   1.012
  568   1HB   ARG  72          2HB       ARG  72 -15.849   4.347   2.490
  569   2HB   ARG  72          1HB       ARG  72 -16.671   5.869   2.741
  570   1HG   ARG  72          2HG       ARG  72 -16.580   6.023   0.137
  571   2HG   ARG  72          1HG       ARG  72 -16.375   4.241   0.284
  572   1HD   ARG  72          2HD       ARG  72 -18.379   4.912   2.178
  573   2HD   ARG  72          1HD       ARG  72 -18.802   5.871   0.756
  574    HE   ARG  72           HE       ARG  72 -18.296   3.438  -0.307
  575   1HH1  ARG  72          2HH2      ARG  72 -20.411   4.463   2.316
  576   2HH1  ARG  72          1HH2      ARG  72 -21.554   3.188   2.051
  577   1HH2  ARG  72          1HH1      ARG  72 -19.829   1.768  -0.602
  578   2HH2  ARG  72          2HH1      ARG  72 -21.219   1.697   0.426
  579    H    LYS  73           H        LYS  73 -13.468   5.580   4.032
  580    HA   LYS  73           HA       LYS  73 -14.096   7.893   5.674
  581   1HB   LYS  73          2HB       LYS  73 -12.718   5.322   6.011
  582   2HB   LYS  73          1HB       LYS  73 -11.953   6.641   6.840
  583   1HG   LYS  73          2HG       LYS  73 -14.937   6.220   7.083
  584   2HG   LYS  73          1HG       LYS  73 -13.787   5.338   8.067
  585   1HD   LYS  73          2HD       LYS  73 -12.803   7.615   8.737
  586   2HD   LYS  73          1HD       LYS  73 -14.220   8.336   7.973
  587   1HE   LYS  73          2HE       LYS  73 -15.675   6.855   9.485
  588   2HE   LYS  73          1HE       LYS  73 -14.222   6.378  10.323
  589   1HZ   LYS  73          1HZ       LYS  73 -15.200   8.084  11.424
  590   2HZ   LYS  73          2HZ       LYS  73 -13.854   8.727  10.770
  591   3HZ   LYS  73          3HZ       LYS  73 -15.339   9.038  10.127
  592    H    TYR  74           H        TYR  74 -10.909   6.750   4.336
  593    HA   TYR  74           HA       TYR  74  -9.589   9.256   4.662
  594   1HB   TYR  74          2HB       TYR  74  -8.479   7.164   4.442
  595   2HB   TYR  74          1HB       TYR  74  -9.108   6.967   2.767
  596    HD1  TYR  74           1HD      TYR  74  -7.719  10.182   3.993
  597    HD2  TYR  74           2HD      TYR  74  -7.033   6.580   1.771
  598    HE1  TYR  74           1HE      TYR  74  -5.710  11.188   3.021
  599    HE2  TYR  74           2HE      TYR  74  -4.939   7.525   0.880
  600    HH   TYR  74           HH       TYR  74  -3.822   9.398   0.542
  601    H    MET  75           H        MET  75 -11.889   8.422   2.192
  602    HA   MET  75           HA       MET  75 -11.092  10.489   0.287
  603   1HB   MET  75          2HB       MET  75 -12.500   8.021   0.253
  604   2HB   MET  75          1HB       MET  75 -13.677   9.252  -0.158
  605   1HG   MET  75          2HG       MET  75 -10.965   8.964  -1.534
  606   2HG   MET  75          1HG       MET  75 -12.476   8.366  -2.162
  607   1HE   MET  75          1HE       MET  75 -12.128  11.139  -4.639
  608   2HE   MET  75          2HE       MET  75 -10.967   9.920  -4.064
  609   3HE   MET  75          3HE       MET  75 -12.675   9.479  -4.302
  610    H    LYS  76           H        LYS  76 -14.160   9.854   2.161
  611    HA   LYS  76           HA       LYS  76 -15.037  12.626   1.665
  612   1HB   LYS  76          2HB       LYS  76 -16.362  10.259   1.793
  613   2HB   LYS  76          1HB       LYS  76 -16.571  10.858   3.452
  614   1HG   LYS  76          2HG       LYS  76 -17.211  13.125   2.348
  615   2HG   LYS  76          1HG       LYS  76 -17.379  12.201   0.848
  616   1HD   LYS  76          2HD       LYS  76 -18.847  10.597   2.436
  617   2HD   LYS  76          1HD       LYS  76 -19.046  12.092   3.347
  618   1HE   LYS  76          2HE       LYS  76 -20.681  12.601   1.918
  619   2HE   LYS  76          1HE       LYS  76 -19.414  12.883   0.697
  620   1HZ   LYS  76          1HZ       LYS  76 -21.000  11.296  -0.077
  621   2HZ   LYS  76          2HZ       LYS  76 -19.566  10.543   0.151
  622   3HZ   LYS  76          3HZ       LYS  76 -20.773  10.351   1.233
  623    H    SER  77           H        SER  77 -14.053  10.563   4.444
  624    HA   SER  77           HA       SER  77 -14.560  12.652   6.414
  625   1HB   SER  77          2HB       SER  77 -14.630  10.044   6.633
  626   2HB   SER  77          1HB       SER  77 -12.865  10.232   6.878
  627    HG   SER  77           HG       SER  77 -14.320  10.181   8.792
  628    H    GLY  78           H        GLY  78 -11.743  11.196   4.586
  629   1HA   GLY  78          2HA       GLY  78  -9.557  11.843   4.309
  630   2HA   GLY  78          1HA       GLY  78 -10.146  13.479   4.343
  631    H    ASN  79           H        ASN  79 -10.638  11.485   7.130
  632    HA   ASN  79           HA       ASN  79  -9.280  13.324   8.800
  633   1HB   ASN  79          2HB       ASN  79 -11.168  11.166   9.070
  634   2HB   ASN  79          1HB       ASN  79  -9.863  10.957  10.251
  635   1HD2  ASN  79          2HD2      ASN  79 -12.626  12.912   9.302
  636   2HD2  ASN  79          1HD2      ASN  79 -12.530  13.972  10.674
  637    H    VAL  80           H        VAL  80  -7.159  13.412   8.967
  638    HA   VAL  80           HA       VAL  80  -5.195  11.545   8.313
  639    HB   VAL  80           HB       VAL  80  -4.956  13.721  10.399
  640   1HG1  VAL  80          1HG1      VAL  80  -2.601  13.590   9.940
  641   2HG1  VAL  80          2HG1      VAL  80  -3.177  12.039  10.595
  642   3HG1  VAL  80          3HG1      VAL  80  -2.850  12.203   8.854
  643   1HG2  VAL  80          1HG2      VAL  80  -3.990  14.975   8.572
  644   2HG2  VAL  80          2HG2      VAL  80  -4.332  13.646   7.438
  645   3HG2  VAL  80          3HG2      VAL  80  -5.673  14.539   8.192
  646    H    LYS  81           H        LYS  81  -7.343  11.541  11.139
  647    HA   LYS  81           HA       LYS  81  -6.190   9.712  12.915
  648   1HB   LYS  81          2HB       LYS  81  -9.045   9.781  12.133
  649   2HB   LYS  81          1HB       LYS  81  -8.276   9.261  13.668
  650   1HG   LYS  81          2HG       LYS  81  -8.706  12.040  12.588
  651   2HG   LYS  81          1HG       LYS  81  -9.176  11.346  14.172
  652   1HD   LYS  81          2HD       LYS  81  -6.806  11.386  14.895
  653   2HD   LYS  81          1HD       LYS  81  -6.308  12.000  13.331
  654   1HE   LYS  81          2HE       LYS  81  -8.171  13.880  13.975
  655   2HE   LYS  81          1HE       LYS  81  -7.622  13.415  15.585
  656   1HZ   LYS  81          1HZ       LYS  81  -6.239  15.056  14.882
  657   2HZ   LYS  81          2HZ       LYS  81  -5.338  13.709  14.644
  658   3HZ   LYS  81          3HZ       LYS  81  -6.060  14.459  13.383
  659    H    ASP  82           H        ASP  82  -7.477   8.989   9.663
  660    HA   ASP  82           HA       ASP  82  -6.969   6.140   9.977
  661   1HB   ASP  82          2HB       ASP  82  -8.052   7.951   7.947
  662   2HB   ASP  82          1HB       ASP  82  -7.163   6.498   7.345
  663    H    LEU  83           H        LEU  83  -5.299   8.938   8.543
  664    HA   LEU  83           HA       LEU  83  -3.324   7.434   7.106
  665   1HB   LEU  83          2HB       LEU  83  -3.706  10.303   7.739
  666   2HB   LEU  83          1HB       LEU  83  -2.151   9.687   7.092
  667    HG   LEU  83           HG       LEU  83  -3.313  10.408   5.214
  668   1HD1  LEU  83          1HD1      LEU  83  -3.858   8.504   3.865
  669   2HD1  LEU  83          2HD1      LEU  83  -2.333   8.320   4.764
  670   3HD1  LEU  83          3HD1      LEU  83  -3.794   7.462   5.308
  671   1HD2  LEU  83          1HD2      LEU  83  -5.720   9.852   4.827
  672   2HD2  LEU  83          2HD2      LEU  83  -5.753   8.978   6.378
  673   3HD2  LEU  83          3HD2      LEU  83  -5.494  10.738   6.353
  674    H    THR  84           H        THR  84  -3.332   9.126  10.274
  675    HA   THR  84           HA       THR  84  -0.705   8.792  11.175
  676    HB   THR  84           HB       THR  84  -2.251  10.077  12.349
  677    HG1  THR  84           1HG      THR  84  -1.867   9.002  14.499
  678   1HG2  THR  84          1HG2      THR  84  -3.954   9.137  13.829
  679   2HG2  THR  84          2HG2      THR  84  -4.335   8.809  12.122
  680   3HG2  THR  84          3HG2      THR  84  -3.667   7.518  13.150
  681    H    GLN  85           H        GLN  85  -3.274   6.333  10.957
  682    HA   GLN  85           HA       GLN  85  -1.524   4.210  11.932
  683   1HB   GLN  85          2HB       GLN  85  -4.419   4.503  11.427
  684   2HB   GLN  85          1HB       GLN  85  -3.739   2.918  11.072
  685   1HG   GLN  85          2HG       GLN  85  -4.426   2.954  13.439
  686   2HG   GLN  85          1HG       GLN  85  -2.694   2.922  13.415
  687   1HE2  GLN  85          2HE2      GLN  85  -1.882   4.092  14.982
  688   2HE2  GLN  85          1HE2      GLN  85  -2.567   5.605  15.508
  689    H    ALA  86           H        ALA  86  -2.979   5.189   8.744
  690    HA   ALA  86           HA       ALA  86  -2.059   3.103   7.110
  691   1HB   ALA  86          1HB       ALA  86  -2.103   4.724   5.331
  692   2HB   ALA  86          2HB       ALA  86  -3.539   4.868   6.373
  693   3HB   ALA  86          3HB       ALA  86  -2.215   6.049   6.512
  694    H    TRP  87           H        TRP  87  -0.188   5.886   8.436
  695    HA   TRP  87           HA       TRP  87   2.261   5.351   7.083
  696   1HB   TRP  87          2HB       TRP  87   2.015   6.627   9.847
  697   2HB   TRP  87          1HB       TRP  87   3.245   6.897   8.662
  698    HD1  TRP  87           HD       TRP  87   1.020   8.810  10.129
  699    HE1  TRP  87           1HE      TRP  87  -0.353  10.384   8.700
  700    HE3  TRP  87           3HE      TRP  87   1.613   6.492   5.709
  701    HZ2  TRP  87           2HZ      TRP  87  -0.965  10.702   5.969
  702    HZ3  TRP  87           3HZ      TRP  87   0.594   7.424   3.686
  703    HH2  TRP  87           HH       TRP  87  -0.746   9.538   3.836
  704    H    ASP  88           H        ASP  88   0.863   4.233  10.187
  705    HA   ASP  88           HA       ASP  88   3.144   2.753  11.135
  706   1HB   ASP  88          2HB       ASP  88   1.106   3.540  12.505
  707   2HB   ASP  88          1HB       ASP  88   0.243   2.184  11.804
  708    H    LEU  89           H        LEU  89   0.419   2.039   8.881
  709    HA   LEU  89           HA       LEU  89   0.949  -0.837   8.741
  710   1HB   LEU  89          2HB       LEU  89  -0.874   0.920   7.096
  711   2HB   LEU  89          1HB       LEU  89  -0.770  -0.821   7.011
  712    HG   LEU  89           HG       LEU  89  -1.571   0.753   9.500
  713   1HD1  LEU  89          1HD1      LEU  89  -3.764  -0.128   9.048
  714   2HD1  LEU  89          2HD1      LEU  89  -3.198   0.898   7.708
  715   3HD1  LEU  89          3HD1      LEU  89  -3.181  -0.874   7.541
  716   1HD2  LEU  89          1HD2      LEU  89  -2.181  -1.393  10.426
  717   2HD2  LEU  89          2HD2      LEU  89  -1.538  -2.230   8.992
  718   3HD2  LEU  89          3HD2      LEU  89  -0.436  -1.350  10.078
  719    H    TYR  90           H        TYR  90   1.272   1.908   6.483
  720    HA   TYR  90           HA       TYR  90   2.753   0.590   4.379
  721   1HB   TYR  90          2HB       TYR  90   2.835   3.522   5.178
  722   2HB   TYR  90          1HB       TYR  90   3.379   2.852   3.675
  723    HD1  TYR  90           1HD      TYR  90   0.964   0.816   3.342
  724    HD2  TYR  90           2HD      TYR  90   1.329   4.958   4.381
  725    HE1  TYR  90           1HE      TYR  90  -1.276   1.229   2.422
  726    HE2  TYR  90           2HE      TYR  90  -0.990   5.354   3.620
  727    HH   TYR  90           HH       TYR  90  -2.793   2.862   1.812
  728    H    TYR  91           H        TYR  91   3.840   1.987   7.413
  729    HA   TYR  91           HA       TYR  91   6.765   1.734   6.856
  730   1HB   TYR  91          2HB       TYR  91   5.815   3.589   8.097
  731   2HB   TYR  91          1HB       TYR  91   5.163   2.441   9.308
  732    HD1  TYR  91           1HD      TYR  91   6.443   1.850  11.165
  733    HD2  TYR  91           2HD      TYR  91   8.322   3.566   7.704
  734    HE1  TYR  91           1HE      TYR  91   8.545   2.121  12.444
  735    HE2  TYR  91           2HE      TYR  91  10.417   3.856   8.970
  736    HH   TYR  91           HH       TYR  91  11.512   3.327  10.810
  737    H    HIS  92           H        HIS  92   4.525   0.183   9.287
  738    HA   HIS  92           HA       HIS  92   6.302  -1.809  10.172
  739   1HB   HIS  92          2HB       HIS  92   4.225  -1.237  11.272
  740   2HB   HIS  92          1HB       HIS  92   3.297  -1.853   9.866
  741    HD1  HIS  92           1HD      HIS  92   3.324  -4.493   9.573
  742    HD2  HIS  92           2HD      HIS  92   5.023  -3.010  13.045
  743    HE1  HIS  92           1HE      HIS  92   3.515  -6.486  11.178
  744    H    VAL  93           H        VAL  93   4.195  -1.701   7.252
  745    HA   VAL  93           HA       VAL  93   4.965  -4.377   6.361
  746    HB   VAL  93           HB       VAL  93   2.788  -3.206   6.012
  747   1HG1  VAL  93          1HG1      VAL  93   2.484  -2.297   3.772
  748   2HG1  VAL  93          2HG1      VAL  93   3.494  -1.223   4.770
  749   3HG1  VAL  93          3HG1      VAL  93   4.248  -2.258   3.534
  750   1HG2  VAL  93          1HG2      VAL  93   2.447  -4.670   4.117
  751   2HG2  VAL  93          2HG2      VAL  93   4.205  -4.929   4.023
  752   3HG2  VAL  93          3HG2      VAL  93   3.308  -5.430   5.476
  753    H    PHE  94           H        PHE  94   6.006  -0.967   5.538
  754    HA   PHE  94           HA       PHE  94   7.713  -1.339   3.411
  755   1HB   PHE  94          2HB       PHE  94   7.234   0.789   4.168
  756   2HB   PHE  94          1HB       PHE  94   7.794   0.415   5.837
  757    HD1  PHE  94           1HD      PHE  94   8.783   1.533   2.481
  758    HD2  PHE  94           2HD      PHE  94  10.171   0.122   6.286
  759    HE1  PHE  94           1HE      PHE  94  11.061   2.398   1.978
  760    HE2  PHE  94           2HE      PHE  94  12.455   0.892   5.755
  761    HZ   PHE  94           HZ       PHE  94  12.900   2.050   3.603
  762    H    ARG  95           H        ARG  95   8.372  -2.244   6.784
  763    HA   ARG  95           HA       ARG  95  11.051  -3.199   6.158
  764   1HB   ARG  95          2HB       ARG  95  11.181  -3.688   8.543
  765   2HB   ARG  95          1HB       ARG  95  10.544  -2.070   8.302
  766   1HG   ARG  95          2HG       ARG  95   8.216  -3.206   8.426
  767   2HG   ARG  95          1HG       ARG  95   9.123  -4.559   9.173
  768   1HD   ARG  95          2HD       ARG  95   9.568  -1.814  10.304
  769   2HD   ARG  95          1HD       ARG  95   8.036  -2.583  10.651
  770    HE   ARG  95           HE       ARG  95  10.092  -4.443  11.123
  771   1HH1  ARG  95          2HH2      ARG  95   8.707  -1.507  12.375
  772   2HH1  ARG  95          1HH2      ARG  95   9.152  -1.795  14.027
  773   1HH2  ARG  95          1HH1      ARG  95  10.721  -4.831  13.338
  774   2HH2  ARG  95          2HH1      ARG  95  10.285  -3.669  14.543
  775    H    ARG  96           H        ARG  96   7.859  -4.665   6.786
  776    HA   ARG  96           HA       ARG  96   8.672  -7.403   6.929
  777   1HB   ARG  96          2HB       ARG  96   6.085  -5.881   6.746
  778   2HB   ARG  96          1HB       ARG  96   6.120  -7.667   6.616
  779   1HG   ARG  96          2HG       ARG  96   7.350  -6.208   8.992
  780   2HG   ARG  96          1HG       ARG  96   5.662  -6.672   8.968
  781   1HD   ARG  96          2HD       ARG  96   6.253  -9.015   8.697
  782   2HD   ARG  96          1HD       ARG  96   7.974  -8.590   8.571
  783    HE   ARG  96           HE       ARG  96   6.347  -8.702  10.964
  784   1HH1  ARG  96          2HH2      ARG  96   9.277  -7.280   9.643
  785   2HH1  ARG  96          1HH2      ARG  96   9.986  -7.000  11.201
  786   1HH2  ARG  96          1HH1      ARG  96   7.297  -8.282  12.983
  787   2HH2  ARG  96          2HH1      ARG  96   8.869  -7.568  13.060
  788    H    ILE  97           H        ILE  97   6.827  -5.580   4.396
  789    HA   ILE  97           HA       ILE  97   7.033  -7.694   2.339
  790    HB   ILE  97           HB       ILE  97   6.342  -5.897   0.777
  791   1HG1  ILE  97          2HG1      ILE  97   5.492  -4.212   3.028
  792   2HG1  ILE  97          1HG1      ILE  97   7.114  -4.059   2.386
  793   1HG2  ILE  97          1HG2      ILE  97   4.018  -6.082   1.468
  794   2HG2  ILE  97          2HG2      ILE  97   4.843  -7.648   1.652
  795   3HG2  ILE  97          3HG2      ILE  97   4.514  -6.640   3.082
  796   1HD1  ILE  97          1HD1      ILE  97   5.587  -2.563   1.275
  797   2HD1  ILE  97          2HD1      ILE  97   6.210  -3.774   0.129
  798   3HD1  ILE  97          3HD1      ILE  97   4.561  -3.931   0.781
  799    H    SER  98           H        SER  98   9.357  -5.502   3.652
  800    HA   SER  98           HA       SER  98  10.921  -5.372   1.104
  801   1HB   SER  98          2HB       SER  98  12.232  -3.694   2.147
  802   2HB   SER  98          1HB       SER  98  10.595  -3.277   2.560
  803    HG   SER  98           HG       SER  98  11.545  -4.923   4.530
  804    H    LYS  99           H        LYS  99  10.425  -7.845   2.822
  805    HA   LYS  99           HA       LYS  99  13.213  -8.829   2.807
  806   1HB   LYS  99          2HB       LYS  99  13.151  -9.538   5.155
  807   2HB   LYS  99          1HB       LYS  99  13.133  -7.806   5.012
  808   1HG   LYS  99          2HG       LYS  99  10.841  -7.669   5.531
  809   2HG   LYS  99          1HG       LYS  99  10.632  -9.440   5.354
  810   1HD   LYS  99          2HD       LYS  99  12.374  -8.141   7.482
  811   2HD   LYS  99          1HD       LYS  99  10.696  -8.630   7.742
  812   1HE   LYS  99          2HE       LYS  99  11.987 -10.872   6.547
  813   2HE   LYS  99          1HE       LYS  99  13.088 -10.265   7.788
  814   1HZ   LYS  99          1HZ       LYS  99  11.546 -11.796   8.657
  815   2HZ   LYS  99          2HZ       LYS  99  11.279 -10.322   9.318
  816   3HZ   LYS  99          3HZ       LYS  99  10.270 -10.900   8.170
  817    H    GLN 100           H        GLN 100  11.136  -9.507   1.051
  818    HA   GLN 100           HA       GLN 100   9.514 -11.699   1.565
  819   1HB   GLN 100          2HB       GLN 100   9.802 -10.563  -0.682
  820   2HB   GLN 100          1HB       GLN 100  11.339 -11.350  -0.872
  821   1HG   GLN 100          2HG       GLN 100   9.974 -12.838  -2.019
  822   2HG   GLN 100          1HG       GLN 100   9.875 -13.581  -0.463
  823   1HE2  GLN 100          2HE2      GLN 100   8.274 -11.942  -2.934
  824   2HE2  GLN 100          1HE2      GLN 100   6.666 -12.095  -2.264