*HEADER    TRANSFERASE                             25-JUN-04   1TUZ              
*TITLE     NMR STRUCTURE OF THE DIACYLGLYCEROL KINASE ALPHA, NESGC               
*TITLE    2 TARGET HR532                                                         
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: DIACYLGLYCEROL KINASE ALPHA;                               
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 EC: 2.7.1.107;                                                       
*COMPND   5 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 GENE: DAGK1;                                                         
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   7 EXPRESSION_SYSTEM_STRAIN: BL21(DE3)+MAGIC;                           
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   9 EXPRESSION_SYSTEM_PLASMID: PET14                                     
*KEYWDS    KINASE, TRANSFERASE, HR532, NESGC, STRUCTURAL GENOMICS, PSI,          
*KEYWDS   2 PROTEIN STRUCTURE INITIATIVE, NORTHEAST STRUCTURAL GENOMICS          
*KEYWDS   3 CONSORTIUM                                                           
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    G.LIU, Y.SHAO, R.XIAO, T.ACTON, G.T.MONTELIONE, T.SZYPERSKI,          
*AUTHOR   2 NORTHEAST STRUCTURAL GENOMICS CONSORTIUM (NESG)                      
*REVDAT   1   28-JUN-05 1TUZ    0                                                
  1 MET  HA      1 MET  HG2     3.75                
  1 MET  HA      1 MET  HG3     3.75                
  1 MET  HA      1 MET  QE      5.44                
  1 MET  HA      2 ALA  HN      2.77                
  1 MET  HA      2 ALA  QB      6.34                
  1 MET  HA      3 LYS+ HN      4.33                
  1 MET  HB2     1 MET  QE      4.41                
  1 MET  HB2     2 ALA  HN      4.86                
  1 MET  HB2     3 LYS+ HN      5.72                
  1 MET  HB3     1 MET  QE      4.41                
  1 MET  HB3     2 ALA  HN      4.86                
  1 MET  HB3     3 LYS+ HN      5.72                
  1 MET  QB      1 MET  QE      3.98                
  1 MET  QB      3 LYS+ HN      5.07                
  1 MET  HG2     2 ALA  HN      6.50                
  1 MET  HG2     3 LYS+ HN      6.50                
  1 MET  HG3     2 ALA  HN      6.50                
  1 MET  HG3     3 LYS+ HN      6.50                
  1 MET  QE      2 ALA  HN      7.53                
  2 ALA  HN      2 ALA  QB      3.47                
  2 ALA  HN      3 LYS+ HN      4.33                
  2 ALA  HA      3 LYS+ HN      2.85                
  2 ALA  QB      3 LYS+ HN      4.41                
  3 LYS+ HN      3 LYS+ HB2     3.75                
  3 LYS+ HN      3 LYS+ HB3     3.75                
  3 LYS+ HN      3 LYS+ QB      3.35                
  3 LYS+ HN      3 LYS+ QG      5.53                
  3 LYS+ HN      3 LYS+ QD      7.05                
  3 LYS+ HN      3 LYS+ QE      7.38                
  3 LYS+ HN      4 GLU- HN      3.79                
  3 LYS+ HA      3 LYS+ QD      4.79                
  3 LYS+ HA      3 LYS+ QE      7.38                
  3 LYS+ HA      4 GLU- HN      3.26                
  3 LYS+ HB2     4 GLU- HN      4.74                
  3 LYS+ HB3     4 GLU- HN      4.74                
  3 LYS+ QB      3 LYS+ QE      5.80                
  3 LYS+ QB      4 GLU- HN      4.24                
  3 LYS+ QB      4 GLU- QG      8.26                
  3 LYS+ QG      4 GLU- HN      6.52                
  3 LYS+ QG      4 GLU- QG      8.25                
  3 LYS+ QG      5 ARG+ HN      5.82                
  3 LYS+ QD      4 GLU- HN      7.38                
  4 GLU- HN      4 GLU- HB2     3.79                
  4 GLU- HN      4 GLU- HB3     3.79                
  4 GLU- HN      4 GLU- QB      3.57                
  4 GLU- HN      4 GLU- QG      4.96                
  4 GLU- HN      5 ARG+ HN      4.20                
  4 GLU- HN      5 ARG+ QG      7.38                
  4 GLU- HA      4 GLU- HB2     2.97                
  4 GLU- HA      4 GLU- HB3     2.97                
  4 GLU- HA      5 ARG+ HN      3.02                
  4 GLU- HA      5 ARG+ QG      7.38                
  4 GLU- HB2     5 ARG+ HN      4.16                
  4 GLU- HB3     5 ARG+ HN      4.16                
  4 GLU- QB      5 ARG+ HN      3.99                
  4 GLU- QB      7 LEU  QD1     6.48                
  4 GLU- QB      7 LEU  QD2     7.30                
  4 GLU- QG      5 ARG+ HN      5.86                
  4 GLU- QG      7 LEU  HG      6.93                
  4 GLU- QG      7 LEU  QD1     8.40                
  5 ARG+ HN      5 ARG+ QB      3.93                
  5 ARG+ HN      5 ARG+ QG      4.96                
  5 ARG+ HN      5 ARG+ QD      7.38                
  5 ARG+ HN      5 ARG+ HE      6.50                
  5 ARG+ HN      6 GLY  HN      4.74                
  5 ARG+ HA      5 ARG+ QD      5.74                
  5 ARG+ HA      6 GLY  HN      2.93                
  5 ARG+ HB2     6 GLY  HN      5.47                
  5 ARG+ HB3     6 GLY  HN      5.47                
  5 ARG+ QG      6 GLY  HN      5.24                
  5 ARG+ QD      6 GLY  HN      7.38                
  6 GLY  HN      7 LEU  HN      3.96                
  6 GLY  HA1     7 LEU  HN      3.42                
  6 GLY  HA2     7 LEU  HN      3.42                
  7 LEU  HN      7 LEU  QB      3.69                
  7 LEU  HN      7 LEU  HG      3.96                
  7 LEU  HN      7 LEU  QD1     5.60                
  7 LEU  HN      7 LEU  QD2     6.67                
  7 LEU  HN      8 ILE  HN      5.02                
  7 LEU  HA      7 LEU  QD1     6.17                
  7 LEU  HA      7 LEU  QD2     4.17                
  7 LEU  HA      8 ILE  HN      3.38                
  7 LEU  QB      8 ILE  HN      6.44                
  7 LEU  HG      8 ILE  HN      6.01                
  7 LEU  QD1     8 ILE  HN      7.53                
  7 LEU  QD2     8 ILE  HN      5.76                
  8 ILE  HN      8 ILE  HG12    5.72                
  8 ILE  HN      8 ILE  HG13    5.72                
  8 ILE  HN      8 ILE  QG1     5.07                
  8 ILE  HN      8 ILE  QD1     6.01                
  8 ILE  HN      9 SER  HN      6.50                
  8 ILE  HA      9 SER  HN      3.02                
  8 ILE  HA     12 ASP- HN      5.11                
  8 ILE  HB      9 SER  HN      4.53                
  8 ILE  HB     73 ALA  QB      6.71                
  8 ILE  QG2     9 SER  HN      5.11                
  8 ILE  QG2    12 ASP- HN      7.24                
  8 ILE  QG2    12 ASP- HB2     6.17                
  8 ILE  QG2    12 ASP- HB3     6.87                
  8 ILE  QG2    13 PHE  HN      6.50                
  8 ILE  QG2    13 PHE  QB      7.54                
  8 ILE  QG2    13 PHE  QD      9.65                
  8 ILE  QG2    73 ALA  QB      7.16                
  8 ILE  QG2    74 LEU  HA      6.26                
  8 ILE  QG2    74 LEU  QD2     7.37                
  8 ILE  QG2    77 SER  HA      7.53                
  8 ILE  HG12    9 SER  HN      5.52                
  8 ILE  HG13    9 SER  HN      5.52                
  8 ILE  QG1     9 SER  HN      5.03                
  8 ILE  QG1    12 ASP- HN      6.15                
  8 ILE  QG1    16 LEU  QQD     9.98                
  8 ILE  QG1    74 LEU  HA      7.38                
  8 ILE  QG1    77 SER  HN      7.26                
  8 ILE  QG1    77 SER  HA      7.05                
  8 ILE  QD1     9 SER  HN      7.32                
  8 ILE  QD1    12 ASP- HN      7.53                
  8 ILE  QD1    12 ASP- HB3     6.54                
  8 ILE  QD1    13 PHE  HA      5.11                
  8 ILE  QD1    13 PHE  QB      7.62                
  8 ILE  QD1    13 PHE  QD      7.48                
  8 ILE  QD1    15 GLN  QB      8.41                
  8 ILE  QD1    16 LEU  QD1     7.49                
  8 ILE  QD1    16 LEU  QD2     7.49                
  8 ILE  QD1    16 LEU  QQD     7.10                
  8 ILE  QD1    70 LEU  QD1     5.73                
  8 ILE  QD1    73 ALA  QB      8.35                
  8 ILE  QD1    74 LEU  HN      7.53                
  8 ILE  QD1    74 LEU  HA      5.31                
  8 ILE  QD1    74 LEU  QD1     8.02                
  8 ILE  QD1    74 LEU  QD2     5.40                
  9 SER  HN     12 ASP- HN      5.07                
  9 SER  HN     12 ASP- HB2     5.52                
  9 SER  QB     10 PRO  QD      8.25                
  9 SER  QB     12 ASP- HN      6.27                
 10 PRO  HA     14 ALA  HN      5.64                
 10 PRO  QB     12 ASP- HN      7.38                
 11 SER  HN     11 SER  HB2     3.92                
 11 SER  HN     11 SER  HB3     3.92                
 11 SER  HN     11 SER  QB      3.64                
 11 SER  HN     12 ASP- HN      3.67                
 11 SER  HA     14 ALA  HN      3.75                
 11 SER  HA     14 ALA  QB      4.53                
 11 SER  HA     15 GLN  HN      5.93                
 11 SER  HB2    12 ASP- HN      4.00                
 11 SER  HB2    14 ALA  QB      7.53                
 11 SER  HB3    12 ASP- HN      4.00                
 11 SER  HB3    14 ALA  QB      7.53                
 11 SER  QB     12 ASP- HN      3.76                
 11 SER  QB     14 ALA  QB      7.21                
 12 ASP- HN     12 ASP- HB2     3.22                
 12 ASP- HN     12 ASP- HB3     3.42                
 12 ASP- HN     13 PHE  HN      3.38                
 12 ASP- HN     13 PHE  QB      6.31                
 12 ASP- HN     14 ALA  HN      4.53                
 12 ASP- HN     70 LEU  QD1     6.09                
 12 ASP- HA     14 ALA  HN      5.68                
 12 ASP- HA     15 GLN  HN      4.00                
 12 ASP- HA     15 GLN  HB2     4.00                
 12 ASP- HA     15 GLN  HB3     4.00                
 12 ASP- HA     15 GLN  QB      3.66                
 12 ASP- HA     16 LEU  HN      4.16                
 12 ASP- HA     70 LEU  QD1     5.03                
 12 ASP- HB2    13 PHE  HN      4.33                
 12 ASP- HB2    70 LEU  QD1     6.46                
 12 ASP- HB3    70 LEU  QD1     4.82                
 13 PHE  HN     14 ALA  HN      3.47                
 13 PHE  HN     14 ALA  QB      6.09                
 13 PHE  HA     16 LEU  HN      3.67                
 13 PHE  HA     16 LEU  HB2     4.16                
 13 PHE  HA     16 LEU  HB3     4.16                
 13 PHE  HA     16 LEU  QB      3.77                
 13 PHE  HA     16 LEU  HG      5.97                
 13 PHE  HA     16 LEU  QQD     9.10                
 13 PHE  HA     70 LEU  QD1     7.53                
 13 PHE  QB     14 ALA  HN      4.47                
 13 PHE  QB     14 ALA  QB      8.40                
 13 PHE  QE    106 LEU  QD1     9.32                
 13 PHE  QE    106 LEU  QD2     9.32                
 13 PHE  QE    106 LEU  QQD     8.41                
 13 PHE  HZ    106 LEU  QD1     5.52                
 13 PHE  HZ    106 LEU  QD2     5.52                
 13 PHE  HZ    106 LEU  QQD     5.00                
 14 ALA  HN     15 GLN  HN      3.26                
 14 ALA  HN     15 GLN  QB      7.38                
 14 ALA  HN     15 GLN  QG      7.38                
 14 ALA  HN     16 LEU  HN      4.29                
 14 ALA  HN     17 GLN  QB      6.97                
 14 ALA  HA     17 GLN  HN      3.88                
 14 ALA  HA     17 GLN  HB2     3.63                
 14 ALA  HA     17 GLN  HB3     3.63                
 14 ALA  HA     17 GLN  QB      3.44                
 14 ALA  HA     18 LYS+ HN      4.29                
 14 ALA  QB     15 GLN  HN      3.88                
 14 ALA  QB     15 GLN  HA      6.42                
 14 ALA  QB     15 GLN  HB2     7.08                
 14 ALA  QB     15 GLN  HB3     7.08                
 14 ALA  QB     15 GLN  QB      6.62                
 14 ALA  QB     15 GLN  QG      7.46                
 14 ALA  QB     16 LEU  HN      7.40                
 14 ALA  QB     17 GLN  HN      6.30                
 14 ALA  QB     17 GLN  HB2     6.38                
 14 ALA  QB     17 GLN  HB3     6.38                
 14 ALA  QB     17 GLN  QB      5.88                
 15 GLN  HN     15 GLN  HB2     3.22                
 15 GLN  HN     15 GLN  HB3     3.22                
 15 GLN  HN     15 GLN  HG2     4.41                
 15 GLN  HN     15 GLN  HG3     4.41                
 15 GLN  HN     15 GLN  QG      4.26                
 15 GLN  HN     15 GLN  QE2     7.37                
 15 GLN  HN     16 LEU  HN      3.30                
 15 GLN  HN     17 GLN  HN      4.74                
 15 GLN  HN     18 LYS+ QB      5.65                
 15 GLN  HN     70 LEU  QD1     7.53                
 15 GLN  HN     70 LEU  QD2     7.53                
 15 GLN  HA     15 GLN  QG      3.97                
 15 GLN  HA     15 GLN  QE2     5.85                
 15 GLN  HA     17 GLN  HN      5.93                
 15 GLN  HA     18 LYS+ HN      3.79                
 15 GLN  HA     18 LYS+ QB      4.59                
 15 GLN  HA     18 LYS+ QD      7.38                
 15 GLN  HA     18 LYS+ QE      7.38                
 15 GLN  HA     19 TYR  HN      5.64                
 15 GLN  HB2    15 GLN  HG2     3.02                
 15 GLN  HB2    15 GLN  HG3     3.02                
 15 GLN  HB2    15 GLN  HE21    6.50                
 15 GLN  HB2    15 GLN  HE22    6.50                
 15 GLN  HB2    16 LEU  HN      3.96                
 15 GLN  HB2    70 LEU  QD2     7.53                
 15 GLN  HB3    15 GLN  HG2     3.02                
 15 GLN  HB3    15 GLN  HG3     3.02                
 15 GLN  HB3    15 GLN  HE21    6.50                
 15 GLN  HB3    15 GLN  HE22    6.50                
 15 GLN  HB3    16 LEU  HN      3.96                
 15 GLN  HB3    70 LEU  QD2     7.53                
 15 GLN  QB     15 GLN  QG      2.38                
 15 GLN  QB     17 GLN  HN      7.26                
 15 GLN  QB     70 LEU  QD1     5.74                
 15 GLN  QB     70 LEU  QD2     7.35                
 15 GLN  HG2    16 LEU  HN      4.82                
 15 GLN  HG2    19 TYR  QD      8.64                
 15 GLN  HG2    19 TYR  QE      8.63                
 15 GLN  HG2    70 LEU  QD1     7.53                
 15 GLN  HG2    70 LEU  QD2     5.40                
 15 GLN  HG3    16 LEU  HN      4.82                
 15 GLN  HG3    19 TYR  QD      8.64                
 15 GLN  HG3    19 TYR  QE      8.63                
 15 GLN  HG3    70 LEU  QD1     7.53                
 15 GLN  HG3    70 LEU  QD2     5.40                
 15 GLN  QG     16 LEU  HN      4.63                
 15 GLN  QG     19 TYR  QE      8.03                
 15 GLN  QG     70 LEU  QD1     7.37                
 15 GLN  QG     70 LEU  QD2     4.91                
 15 GLN  HE21   18 LYS+ QB      7.38                
 15 GLN  HE21   18 LYS+ QD      7.38                
 15 GLN  HE21   67 PRO  HG2     6.50                
 15 GLN  HE21   67 PRO  HG3     6.50                
 15 GLN  HE22   18 LYS+ QB      7.38                
 15 GLN  HE22   18 LYS+ QD      7.38                
 15 GLN  HE22   67 PRO  HG2     6.50                
 15 GLN  HE22   67 PRO  HG3     6.50                
 15 GLN  QE2    18 LYS+ QG      8.24                
 15 GLN  QE2    67 PRO  QG      6.20                
 15 GLN  QE2    70 LEU  QD2     8.40                
 16 LEU  HN     16 LEU  HB2     3.71                
 16 LEU  HN     16 LEU  HB3     3.71                
 16 LEU  HN     16 LEU  QB      3.50                
 16 LEU  HN     16 LEU  HG      4.70                
 16 LEU  HN     16 LEU  QD1     4.94                
 16 LEU  HN     16 LEU  QD2     4.94                
 16 LEU  HN     17 GLN  HN      3.22                
 16 LEU  HN     17 GLN  HB2     6.13                
 16 LEU  HN     17 GLN  HB3     6.13                
 16 LEU  HN     17 GLN  QB      5.77                
 16 LEU  HN     18 LYS+ HN      4.94                
 16 LEU  HN     70 LEU  QD1     4.90                
 16 LEU  HN     70 LEU  QD2     5.23                
 16 LEU  HA     16 LEU  QD1     6.58                
 16 LEU  HA     16 LEU  QD2     6.58                
 16 LEU  HA     19 TYR  HN      4.53                
 16 LEU  HA     19 TYR  QB      6.23                
 16 LEU  HA     19 TYR  QD      6.67                
 16 LEU  HA     20 MET  QE      7.53                
 16 LEU  HA     70 LEU  QD1     7.53                
 16 LEU  HA     70 LEU  QD2     6.30                
 16 LEU  HB2    17 GLN  HN      4.04                
 16 LEU  HB3    17 GLN  HN      4.04                
 16 LEU  QB     17 GLN  HN      3.82                
 16 LEU  QB     18 LYS+ HN      5.70                
 16 LEU  QB     70 LEU  QD1     6.23                
 16 LEU  QB     70 LEU  QD2     5.58                
 16 LEU  HG     17 GLN  HN      5.72                
 16 LEU  QD1    17 GLN  HN      6.71                
 16 LEU  QD1    19 TYR  QD      9.67                
 16 LEU  QD1    70 LEU  QD2     6.26                
 16 LEU  QD1   103 PHE  QE      8.62                
 16 LEU  QD1   103 PHE  HZ      7.08                
 16 LEU  QD1   106 LEU  QD1     9.81                
 16 LEU  QD1   106 LEU  QD2     9.81                
 16 LEU  QD2    17 GLN  HN      6.71                
 16 LEU  QD2    19 TYR  QD      9.67                
 16 LEU  QD2    70 LEU  QD2     6.26                
 16 LEU  QD2   103 PHE  QE      8.62                
 16 LEU  QD2   103 PHE  HZ      7.08                
 16 LEU  QD2   106 LEU  QD1     9.81                
 16 LEU  QD2   106 LEU  QD2     9.81                
 16 LEU  QQD    17 GLN  HN      6.40                
 16 LEU  QQD    18 LYS+ HN      9.10                
 16 LEU  QQD    19 TYR  HN      8.28                
 16 LEU  QQD    19 TYR  QD      9.30                
 16 LEU  QQD    20 MET  HN      7.79                
 16 LEU  QQD    20 MET  QB      9.97                
 16 LEU  QQD    20 MET  QG      9.97                
 16 LEU  QQD    20 MET  QE      8.57                
 16 LEU  QQD    57 LEU  QD2     8.03                
 16 LEU  QQD    61 LEU  QD1     7.83                
 16 LEU  QQD    61 LEU  QD2     7.71                
 16 LEU  QQD    66 VAL  QQG    11.69                
 16 LEU  QQD    70 LEU  QD1     8.40                
 16 LEU  QQD    70 LEU  QD2     5.98                
 16 LEU  QQD    74 LEU  HG      8.97                
 16 LEU  QQD    74 LEU  QD1     7.21                
 16 LEU  QQD    74 LEU  QD2     6.93                
 16 LEU  QQD   102 TYR  QE     10.94                
 16 LEU  QQD   103 PHE  QD     11.18                
 16 LEU  QQD   103 PHE  QE      8.01                
 16 LEU  QQD   106 LEU  QQD     7.15                
 17 GLN  HN     17 GLN  HB2     3.38                
 17 GLN  HN     17 GLN  HB3     3.38                
 17 GLN  HN     17 GLN  QG      5.65                
 17 GLN  HN     18 LYS+ HN      3.51                
 17 GLN  HN     18 LYS+ HA      6.50                
 17 GLN  HN     19 TYR  HN      5.64                
 17 GLN  HA     17 GLN  HE21    6.50                
 17 GLN  HA     20 MET  HN      4.16                
 17 GLN  HA     20 MET  QE      6.05                
 17 GLN  HA     21 GLU- HN      5.52                
 17 GLN  HB2    17 GLN  HE21    5.02                
 17 GLN  HB2    17 GLN  HE22    4.37                
 17 GLN  HB2    18 LYS+ HN      4.00                
 17 GLN  HB3    17 GLN  HE21    5.02                
 17 GLN  HB3    17 GLN  HE22    4.37                
 17 GLN  HB3    18 LYS+ HN      4.00                
 17 GLN  QB     17 GLN  HE21    4.64                
 17 GLN  QB     17 GLN  HE22    3.98                
 17 GLN  QG     18 LYS+ HN      5.08                
 18 LYS+ HN     18 LYS+ QB      3.93                
 18 LYS+ HN     18 LYS+ HG2     4.82                
 18 LYS+ HN     18 LYS+ HG3     4.82                
 18 LYS+ HN     18 LYS+ QG      4.57                
 18 LYS+ HN     18 LYS+ QD      7.38                
 18 LYS+ HN     18 LYS+ QE      7.38                
 18 LYS+ HN     19 TYR  HN      3.42                
 18 LYS+ HA     18 LYS+ QD      5.82                
 18 LYS+ HA     18 LYS+ QE      6.76                
 18 LYS+ HA     21 GLU- HN      3.92                
 18 LYS+ HA     21 GLU- HB2     4.04                
 18 LYS+ HA     21 GLU- HB3     4.04                
 18 LYS+ HA     21 GLU- QB      3.86                
 18 LYS+ QB     18 LYS+ QE      7.10                
 18 LYS+ QB     19 TYR  HN      4.34                
 18 LYS+ HG2    19 TYR  HN      6.30                
 18 LYS+ HG3    19 TYR  HN      6.30                
 18 LYS+ QG     19 TYR  HN      5.67                
 18 LYS+ QD     19 TYR  HN      7.38                
 19 TYR  HN     20 MET  HN      3.51                
 19 TYR  HN     61 LEU  QD2     5.97                
 19 TYR  HA     21 GLU- HN      5.11                
 19 TYR  HA     61 LEU  QD2     7.53                
 19 TYR  QB     23 SER  HN      7.38                
 19 TYR  QB     61 LEU  QD1     6.11                
 19 TYR  QB     61 LEU  QD2     5.94                
 19 TYR  QD     61 LEU  QD2     8.03                
 19 TYR  QD     63 VAL  QG1     7.33                
 19 TYR  QD     63 VAL  QG2     7.37                
 19 TYR  QD     70 LEU  QD1     9.67                
 19 TYR  QD     70 LEU  QD2     7.29                
 19 TYR  QE     61 LEU  QD2     9.66                
 19 TYR  QE     63 VAL  HA      7.73                
 19 TYR  QE     63 VAL  QG1     7.20                
 19 TYR  QE     63 VAL  QG2     7.90                
 19 TYR  QE     64 ASP- HN      8.63                
 19 TYR  QE     66 VAL  HA      8.18                
 19 TYR  QE     70 LEU  QD2     7.49                
 20 MET  HN     20 MET  QG      5.94                
 20 MET  HN     20 MET  QE      6.34                
 20 MET  HN     21 GLU- HN      3.34                
 20 MET  HN     21 GLU- QB      6.11                
 20 MET  HN     22 TYR  HN      5.11                
 20 MET  HN     61 LEU  QD2     4.94                
 20 MET  HA     20 MET  QE      4.90                
 20 MET  HA     23 SER  HN      4.29                
 20 MET  HA     61 LEU  QB      6.81                
 20 MET  HA    106 LEU  QQD     9.10                
 20 MET  QB     20 MET  QE      4.30                
 20 MET  QB     61 LEU  QD2     7.87                
 20 MET  QG     21 GLU- HN      7.38                
 20 MET  QG     61 LEU  QD2     7.54                
 20 MET  QE     21 GLU- HN      6.34                
 20 MET  QE     60 TYR  QE      7.77                
 20 MET  QE     61 LEU  QD2     7.41                
 20 MET  QE    103 PHE  HA      6.79                
 20 MET  QE    103 PHE  QB      6.23                
 20 MET  QE    103 PHE  QD      7.97                
 20 MET  QE    103 PHE  QE      9.28                
 20 MET  QE    106 LEU  HN      5.64                
 20 MET  QE    106 LEU  HB2     4.12                
 20 MET  QE    106 LEU  HB3     4.12                
 20 MET  QE    106 LEU  HG      4.74                
 20 MET  QE    106 LEU  QD1     6.59                
 20 MET  QE    106 LEU  QD2     6.59                
 20 MET  QE    106 LEU  QQD     6.23                
 20 MET  QE    107 GLU- HN      5.60                
 20 MET  QE    107 GLU- HA      4.12                
 20 MET  QE    107 GLU- QB      5.25                
 21 GLU- HN     21 GLU- HB2     3.51                
 21 GLU- HN     21 GLU- HB3     3.51                
 21 GLU- HN     21 GLU- QB      3.23                
 21 GLU- HN     21 GLU- HG2     3.79                
 21 GLU- HN     21 GLU- HG3     3.79                
 21 GLU- HN     21 GLU- QG      3.53                
 21 GLU- HN     22 TYR  HN      3.26                
 21 GLU- HN     23 SER  HN      4.33                
 21 GLU- HA     21 GLU- HG2     4.12                
 21 GLU- HA     21 GLU- HG3     4.12                
 21 GLU- HA     22 TYR  HN      3.63                
 21 GLU- HA     23 SER  HN      5.11                
 21 GLU- HB2    22 TYR  HN      3.84                
 21 GLU- HB3    22 TYR  HN      3.84                
 21 GLU- QB     23 SER  HN      6.68                
 21 GLU- HG2    22 TYR  HN      5.02                
 21 GLU- HG3    22 TYR  HN      5.02                
 21 GLU- QG     22 TYR  HN      4.78                
 22 TYR  HN     22 TYR  HB2     2.93                
 22 TYR  HN     22 TYR  HB3     3.63                
 22 TYR  HN     23 SER  HN      3.14                
 22 TYR  HN     23 SER  HB2     6.25                
 22 TYR  HN     23 SER  HB3     6.25                
 22 TYR  HN     23 SER  QB      5.81                
 22 TYR  HA     22 TYR  HB2     2.85                
 22 TYR  HA     22 TYR  HB3     2.97                
 22 TYR  HB2    23 SER  HN      3.88                
 22 TYR  HB3    23 SER  HN      4.12                
 23 SER  HN     23 SER  HB2     3.26                
 23 SER  HN     23 SER  HB3     3.26                
 23 SER  HN     23 SER  QB      3.08                
 23 SER  HN     24 THR  HN      4.70                
 23 SER  HN     25 LYS+ HN      5.64                
 23 SER  HA     24 THR  HN      2.81                
 23 SER  HA     24 THR  QG2     6.79                
 23 SER  HB2    24 THR  HN      5.02                
 23 SER  HB2    25 LYS+ HN      4.86                
 23 SER  HB3    24 THR  HN      5.02                
 23 SER  HB3    25 LYS+ HN      4.86                
 23 SER  QB     25 LYS+ HN      4.52                
 24 THR  HN     24 THR  HB      3.88                
 24 THR  HN     24 THR  QG2     4.29                
 24 THR  HN     25 LYS+ HN      3.06                
 24 THR  HN     25 LYS+ HB2     6.50                
 24 THR  HN     25 LYS+ HB3     6.50                
 24 THR  HN     25 LYS+ QG      7.38                
 24 THR  HA     24 THR  HB      2.65                
 24 THR  HA     25 LYS+ HN      3.10                
 24 THR  HB     25 LYS+ HN      4.41                
 24 THR  QG2    25 LYS+ HN      5.07                
 25 LYS+ HN     25 LYS+ HB2     3.14                
 25 LYS+ HN     25 LYS+ HB3     3.51                
 25 LYS+ HN     25 LYS+ QG      4.22                
 25 LYS+ HN     25 LYS+ QD      5.94                
 25 LYS+ HN     25 LYS+ QE      7.38                
 25 LYS+ HN     26 LYS+ HN      4.45                
 25 LYS+ HA     25 LYS+ QD      6.60                
 25 LYS+ HA     25 LYS+ QE      7.38                
 25 LYS+ HA     26 LYS+ HN      2.65                
 25 LYS+ HA     26 LYS+ QG      7.30                
 25 LYS+ HB2    25 LYS+ QE      5.70                
 25 LYS+ HB2    26 LYS+ HN      3.92                
 25 LYS+ HB2    30 VAL  QG2     5.52                
 25 LYS+ HB3    25 LYS+ QE      4.75                
 25 LYS+ HB3    26 LYS+ HN      3.55                
 25 LYS+ HB3    30 VAL  QG2     5.64                
 25 LYS+ QG     26 LYS+ HN      5.82                
 25 LYS+ QG     30 VAL  QG2     7.50                
 25 LYS+ QD     26 LYS+ HN      7.38                
 25 LYS+ QD     30 VAL  QG2     6.64                
 25 LYS+ QD     59 ILE  QG2     7.83                
 25 LYS+ QE     26 LYS+ HN      7.38                
 25 LYS+ QE     30 VAL  QG2     7.05                
 25 LYS+ QE     59 ILE  QG2     5.94                
 25 LYS+ QE     62 GLU- QG      7.93                
 26 LYS+ HN     26 LYS+ HB2     3.34                
 26 LYS+ HN     26 LYS+ HB3     3.71                
 26 LYS+ HN     26 LYS+ HG2     4.16                
 26 LYS+ HN     26 LYS+ HG3     4.16                
 26 LYS+ HN     26 LYS+ QG      3.75                
 26 LYS+ HN     26 LYS+ HD2     5.80                
 26 LYS+ HN     26 LYS+ HD3     5.80                
 26 LYS+ HN     26 LYS+ QD      5.63                
 26 LYS+ HN     26 LYS+ QE      7.38                
 26 LYS+ HN     29 ASP- HN      4.33                
 26 LYS+ HN     29 ASP- HB2     6.50                
 26 LYS+ HN     29 ASP- HB3     6.50                
 26 LYS+ HN     29 ASP- QB      6.38                
 26 LYS+ HN     30 VAL  QG2     6.01                
 26 LYS+ HA     26 LYS+ HD2     4.57                
 26 LYS+ HA     26 LYS+ HD3     4.57                
 26 LYS+ HA     26 LYS+ QD      4.36                
 26 LYS+ HA     27 VAL  HB      4.37                
 26 LYS+ HA     27 VAL  QG1     7.53                
 26 LYS+ HA     28 SER  HN      4.78                
 26 LYS+ HB2    26 LYS+ HD2     3.88                
 26 LYS+ HB2    26 LYS+ HD3     3.88                
 26 LYS+ HB2    26 LYS+ QD      3.53                
 26 LYS+ HB2    26 LYS+ QE      6.60                
 26 LYS+ HB2    28 SER  HN      4.00                
 26 LYS+ HB2    29 ASP- HN      4.04                
 26 LYS+ HB3    26 LYS+ HD2     4.00                
 26 LYS+ HB3    26 LYS+ HD3     4.00                
 26 LYS+ HB3    26 LYS+ QD      3.72                
 26 LYS+ HB3    28 SER  HN      3.96                
 26 LYS+ HB3    29 ASP- HN      4.12                
 26 LYS+ HG2    29 ASP- HN      6.50                
 26 LYS+ HG3    29 ASP- HN      6.50                
 26 LYS+ QG     28 SER  HN      7.26                
 26 LYS+ QG     29 ASP- HN      6.14                
 26 LYS+ QD     28 SER  QB      8.25                
 27 VAL  HA     30 VAL  HN      4.33                
 27 VAL  HA     30 VAL  HB      3.67                
 27 VAL  HA     30 VAL  QG2     5.19                
 27 VAL  HA     31 LEU  HN      4.98                
 27 VAL  HA     60 TYR  QE      8.22                
 27 VAL  HB     28 SER  HN      4.08                
 27 VAL  HB     60 TYR  QE      7.77                
 27 VAL  QG1    28 SER  HN      4.12                
 27 VAL  QG1    28 SER  HB2     6.91                
 27 VAL  QG1    28 SER  HB3     6.91                
 27 VAL  QG1    28 SER  QB      6.61                
 27 VAL  QG1    29 ASP- HN      7.40                
 27 VAL  QG1    31 LEU  QD1     6.55                
 27 VAL  QG1   100 SER  HA      5.03                
 27 VAL  QG1   100 SER  QB      8.40                
 27 VAL  QG1   103 PHE  QB      8.41                
 27 VAL  QG1   104 SER  HN      4.90                
 27 VAL  QG1   104 SER  HB2     7.53                
 27 VAL  QG1   104 SER  HB3     6.13                
 27 VAL  QG2    28 SER  HN      5.15                
 27 VAL  QG2    28 SER  QB      8.41                
 27 VAL  QG2    31 LEU  HG      6.87                
 27 VAL  QG2    56 PHE  QE      7.60                
 27 VAL  QG2    56 PHE  HZ      4.49                
 27 VAL  QG2    60 TYR  QD      8.77                
 27 VAL  QG2    60 TYR  QE      8.96                
 27 VAL  QG2    99 VAL  QG1     6.87                
 27 VAL  QG2    99 VAL  QG2     8.56                
 27 VAL  QG2   100 SER  HA      4.25                
 27 VAL  QG2   103 PHE  HN      6.17                
 27 VAL  QG2   103 PHE  QB      6.11                
 27 VAL  QG2   103 PHE  QD      7.85                
 27 VAL  QG2   104 SER  HN      6.30                
 28 SER  HN     28 SER  HB2     3.59                
 28 SER  HN     28 SER  HB3     3.59                
 28 SER  HN     28 SER  QB      3.42                
 28 SER  HN     29 ASP- HN      3.26                
 28 SER  HN     30 VAL  HN      4.49                
 28 SER  HA     31 LEU  HN      4.08                
 28 SER  HA     31 LEU  HB2     4.61                
 28 SER  HA     31 LEU  HB3     4.61                
 28 SER  HA     31 LEU  QB      4.45                
 28 SER  HA     31 LEU  HG      4.86                
 28 SER  HA     31 LEU  QD1     6.05                
 28 SER  HA     31 LEU  QD2     6.63                
 28 SER  HA     32 LYS+ HN      5.15                
 28 SER  HB2    29 ASP- HN      4.94                
 28 SER  HB3    29 ASP- HN      4.94                
 28 SER  QB     29 ASP- HN      4.52                
 28 SER  QB     31 LEU  HN      7.38                
 29 ASP- HN     29 ASP- HB2     3.55                
 29 ASP- HN     29 ASP- HB3     3.55                
 29 ASP- HN     29 ASP- QB      3.22                
 29 ASP- HN     30 VAL  HN      3.18                
 29 ASP- HN     30 VAL  HA      5.11                
 29 ASP- HN     30 VAL  HB      4.61                
 29 ASP- HN     30 VAL  QG1     7.53                
 29 ASP- HN     30 VAL  QG2     5.31                
 29 ASP- HN     31 LEU  HN      4.08                
 29 ASP- HA     32 LYS+ HN      4.41                
 29 ASP- HA     32 LYS+ QB      4.71                
 29 ASP- HA     32 LYS+ QG      6.19                
 29 ASP- HA     32 LYS+ QD      5.94                
 29 ASP- HA     32 LYS+ QE      6.19                
 29 ASP- HB2    30 VAL  HN      4.37                
 29 ASP- HB3    30 VAL  HN      4.37                
 29 ASP- QB     30 VAL  HN      3.98                
 29 ASP- QB     30 VAL  QG2     8.41                
 29 ASP- QB     33 LEU  QD1     8.41                
 30 VAL  HN     30 VAL  HB      3.22                
 30 VAL  HN     30 VAL  QG1     4.49                
 30 VAL  HN     30 VAL  QG2     3.76                
 30 VAL  HN     31 LEU  HN      3.30                
 30 VAL  HN     31 LEU  QB      5.99                
 30 VAL  HN     32 LYS+ HN      4.57                
 30 VAL  HA     30 VAL  QG2     3.76                
 30 VAL  HA     32 LYS+ HN      5.39                
 30 VAL  HA     33 LEU  HN      4.53                
 30 VAL  HA     33 LEU  QD1     4.41                
 30 VAL  HA     33 LEU  QD2     7.04                
 30 VAL  HA     59 ILE  QG2     6.09                
 30 VAL  HB     31 LEU  HN      3.42                
 30 VAL  QG1    31 LEU  HN      4.78                
 30 VAL  QG1    33 LEU  HN      7.53                
 30 VAL  QG1    34 PHE  QD      9.49                
 30 VAL  QG1    34 PHE  QE      9.40                
 30 VAL  QG1    56 PHE  QD      7.76                
 30 VAL  QG1    56 PHE  QE      9.65                
 30 VAL  QG1    59 ILE  HB      5.44                
 30 VAL  QG1    59 ILE  QG1     6.97                
 30 VAL  QG1    60 TYR  QB      8.00                
 30 VAL  QG1    60 TYR  QD      7.49                
 30 VAL  QG2    31 LEU  HN      5.07                
 30 VAL  QG2    56 PHE  QE      9.65                
 30 VAL  QG2    59 ILE  HB      5.48                
 30 VAL  QG2    59 ILE  QG2     6.18                
 30 VAL  QG2    60 TYR  HN      5.93                
 30 VAL  QG2    60 TYR  HA      4.41                
 30 VAL  QG2    60 TYR  QB      6.36                
 30 VAL  QG2    60 TYR  QD      7.04                
 31 LEU  HN     31 LEU  HB2     3.42                
 31 LEU  HN     31 LEU  HB3     3.42                
 31 LEU  HN     31 LEU  HG      4.12                
 31 LEU  HN     31 LEU  QD1     5.56                
 31 LEU  HN     31 LEU  QD2     5.44                
 31 LEU  HN     32 LYS+ HN      3.47                
 31 LEU  HN     34 PHE  QB      7.01                
 31 LEU  HA     31 LEU  QD1     5.72                
 31 LEU  HA     31 LEU  QD2     4.33                
 31 LEU  HA     33 LEU  HN      5.11                
 31 LEU  HA     34 PHE  HN      3.96                
 31 LEU  HA     34 PHE  QB      5.74                
 31 LEU  HA     34 PHE  QD      7.23                
 31 LEU  HB2    32 LYS+ HN      4.49                
 31 LEU  HB3    32 LYS+ HN      4.49                
 31 LEU  QB     32 LYS+ HN      4.34                
 31 LEU  HG     32 LYS+ HN      4.74                
 31 LEU  QD1    32 LYS+ HN      6.79                
 31 LEU  QD1    34 PHE  HN      7.12                
 31 LEU  QD1    56 PHE  QE      9.65                
 31 LEU  QD1    96 LEU  HG      6.38                
 31 LEU  QD1    99 VAL  QG1     6.96                
 31 LEU  QD1   100 SER  HN      5.76                
 31 LEU  QD1   100 SER  HA      4.37                
 31 LEU  QD1   100 SER  QB      5.90                
 31 LEU  QD2    32 LYS+ HN      7.53                
 31 LEU  QD2    34 PHE  QD      9.65                
 31 LEU  QD2    56 PHE  QD      9.65                
 31 LEU  QD2    56 PHE  QE      9.65                
 31 LEU  QD2    99 VAL  QG1     8.56                
 31 LEU  QD2   100 SER  HA      7.53                
 31 LEU  QD2   100 SER  QB      8.40                
 32 LYS+ HN     32 LYS+ HG2     4.08                
 32 LYS+ HN     32 LYS+ HG3     4.08                
 32 LYS+ HN     32 LYS+ QG      3.74                
 32 LYS+ HN     32 LYS+ QD      7.05                
 32 LYS+ HN     32 LYS+ QE      7.38                
 32 LYS+ HN     33 LEU  HN      3.71                
 32 LYS+ HN     33 LEU  QB      7.01                
 32 LYS+ HN     33 LEU  HG      6.50                
 32 LYS+ HA     32 LYS+ HG2     4.12                
 32 LYS+ HA     32 LYS+ HG3     4.12                
 32 LYS+ HA     32 LYS+ QG      3.92                
 32 LYS+ HA     32 LYS+ QD      5.98                
 32 LYS+ HA     32 LYS+ QE      7.38                
 32 LYS+ HA     33 LEU  HN      3.55                
 32 LYS+ HA     34 PHE  HN      5.68                
 32 LYS+ HA     35 GLU- HN      4.12                
 32 LYS+ HA     35 GLU- QB      4.71                
 32 LYS+ QB     32 LYS+ QE      7.76                
 32 LYS+ QB     33 LEU  HN      4.88                
 32 LYS+ QB     36 ASP- HN      7.38                
 32 LYS+ HG2    33 LEU  HN      6.50                
 32 LYS+ HG3    33 LEU  HN      6.50                
 32 LYS+ QG     32 LYS+ QE      3.70                
 32 LYS+ QG     33 LEU  HN      5.91                
 32 LYS+ QG     35 GLU- QG      8.25                
 32 LYS+ QD     33 LEU  HN      7.38                
 32 LYS+ QE     33 LEU  HN      7.38                
 32 LYS+ QE     33 LEU  QD2     8.40                
 33 LEU  HN     33 LEU  HB2     3.79                
 33 LEU  HN     33 LEU  HB3     3.79                
 33 LEU  HN     33 LEU  HG      3.71                
 33 LEU  HN     33 LEU  QD1     4.74                
 33 LEU  HN     33 LEU  QD2     4.70                
 33 LEU  HN     34 PHE  HN      3.42                
 33 LEU  HN     35 GLU- HN      3.79                
 33 LEU  HN     36 ASP- HN      5.19                
 33 LEU  HA     33 LEU  QD1     5.35                
 33 LEU  HA     33 LEU  QD2     3.51                
 33 LEU  HA     35 GLU- HN      5.15                
 33 LEU  HA     36 ASP- HN      4.78                
 33 LEU  HA     37 GLY  HN      4.82                
 33 LEU  HA     38 GLU- HN      5.64                
 33 LEU  HB2    34 PHE  HN      4.37                
 33 LEU  HB3    34 PHE  HN      4.37                
 33 LEU  QB     34 PHE  HN      3.87                
 33 LEU  HG     34 PHE  HN      5.56                
 33 LEU  QD1    34 PHE  HN      6.34                
 33 LEU  QD1    37 GLY  HN      7.40                
 33 LEU  QD1    38 GLU- HN      7.53                
 33 LEU  QD1    38 GLU- QG      8.40                
 33 LEU  QD1    59 ILE  HB      7.53                
 33 LEU  QD1    59 ILE  QG2     6.18                
 33 LEU  QD1    59 ILE  QG1     7.67                
 33 LEU  QD2    34 PHE  HN      6.26                
 33 LEU  QD2    36 ASP- HN      7.53                
 33 LEU  QD2    37 GLY  HN      7.08                
 33 LEU  QD2    38 GLU- HN      6.17                
 33 LEU  QD2    38 GLU- QG      6.85                
 33 LEU  QD2    59 ILE  HB      7.53                
 33 LEU  QD2    59 ILE  QG2     6.83                
 33 LEU  QD2    59 ILE  QG1     7.30                
 34 PHE  HN     35 GLU- HN      3.18                
 34 PHE  HN     35 GLU- QG      7.38                
 34 PHE  HN     36 ASP- HN      4.53                
 34 PHE  HN     43 VAL  QG2     6.71                
 34 PHE  HA     35 GLU- HA      5.19                
 34 PHE  HA     39 MET  HN      4.33                
 34 PHE  HA     39 MET  HA      4.53                
 34 PHE  HA     39 MET  QB      5.25                
 34 PHE  HA     39 MET  QE      6.42                
 34 PHE  HA     40 ALA  HN      4.41                
 34 PHE  HA     40 ALA  HA      4.41                
 34 PHE  HA     40 ALA  QB      5.48                
 34 PHE  HA     43 VAL  QG2     5.93                
 34 PHE  HA     96 LEU  QD1     7.08                
 34 PHE  QB     43 VAL  QG2     5.29                
 34 PHE  QB     48 ILE  QD1     8.40                
 34 PHE  QB     96 LEU  QD1     6.93                
 34 PHE  QD     39 MET  QG      9.50                
 34 PHE  QD     43 VAL  QG1     9.65                
 34 PHE  QD     43 VAL  QG2     6.78                
 34 PHE  QD     48 ILE  QG2     9.65                
 34 PHE  QD     48 ILE  QD1     9.40                
 34 PHE  QD     96 LEU  QD2     8.99                
 34 PHE  QE     48 ILE  QG2     8.71                
 34 PHE  QE     48 ILE  QD1     9.20                
 34 PHE  QE     56 PHE  HA      8.01                
 34 PHE  QE     59 ILE  QD1     8.26                
 34 PHE  HZ     56 PHE  HA      4.74                
 34 PHE  HZ     59 ILE  QD1     6.58                
 35 GLU- HN     35 GLU- HG2     4.04                
 35 GLU- HN     35 GLU- HG3     4.04                
 35 GLU- HN     35 GLU- QG      3.74                
 35 GLU- HN     36 ASP- HN      3.26                
 35 GLU- HN     40 ALA  QB      5.52                
 35 GLU- HA     35 GLU- HG2     4.08                
 35 GLU- HA     35 GLU- HG3     4.08                
 35 GLU- HA     35 GLU- QG      3.70                
 35 GLU- HA     36 ASP- HN      3.63                
 35 GLU- HA     37 GLY  HN      5.68                
 35 GLU- HA     40 ALA  QB      5.93                
 35 GLU- QB     36 ASP- HN      4.06                
 35 GLU- QB     36 ASP- QB      8.25                
 35 GLU- QB     37 GLY  HN      6.15                
 35 GLU- HG2    36 ASP- HN      4.74                
 35 GLU- HG3    36 ASP- HN      4.74                
 35 GLU- QG     36 ASP- HN      4.26                
 36 ASP- HN     37 GLY  HN      3.06                
 36 ASP- HN     37 GLY  HA1     5.88                
 36 ASP- HN     37 GLY  HA2     5.88                
 36 ASP- HN     37 GLY  QA      5.57                
 36 ASP- HN     40 ALA  QB      4.66                
 36 ASP- QB     40 ALA  QB      8.40                
 37 GLY  HN     38 GLU- HN      4.53                
 37 GLY  HN     39 MET  HN      6.50                
 37 GLY  HN     40 ALA  QB      4.74                
 37 GLY  HA1    38 GLU- HN      3.18                
 37 GLY  HA2    38 GLU- HN      3.18                
 37 GLY  QA     39 MET  HN      5.74                
 37 GLY  QA     40 ALA  QB      7.05                
 38 GLU- HN     38 GLU- HB2     3.30                
 38 GLU- HN     38 GLU- HB3     3.30                
 38 GLU- HN     38 GLU- QG      5.16                
 38 GLU- HN     39 MET  HN      3.34                
 38 GLU- HN     39 MET  HA      5.56                
 38 GLU- HN     40 ALA  HN      5.11                
 38 GLU- HA     38 GLU- HB2     2.93                
 38 GLU- HA     38 GLU- HB3     2.93                
 38 GLU- HA     39 MET  HN      3.63                
 38 GLU- HA     40 ALA  HN      4.33                
 38 GLU- HB2    39 MET  HN      4.49                
 38 GLU- HB3    39 MET  HN      4.49                
 38 GLU- QB     39 MET  HN      4.26                
 38 GLU- QB     40 ALA  QB      7.46                
 38 GLU- QG     39 MET  HN      5.61                
 39 MET  HN     39 MET  HB2     3.67                
 39 MET  HN     39 MET  HB3     3.67                
 39 MET  HN     39 MET  QB      3.42                
 39 MET  HN     39 MET  QG      4.26                
 39 MET  HN     39 MET  QE      6.01                
 39 MET  HN     40 ALA  HN      2.85                
 39 MET  HN     40 ALA  QB      5.31                
 39 MET  HN     41 LYS+ HN      5.64                
 39 MET  HA     39 MET  QE      4.90                
 39 MET  HA     42 TYR  HN      5.39                
 39 MET  HB2    39 MET  QE      6.26                
 39 MET  HB2    40 ALA  HN      5.19                
 39 MET  HB3    39 MET  QE      6.26                
 39 MET  HB3    40 ALA  HN      5.19                
 39 MET  QG     40 ALA  HN      6.80                
 39 MET  QG     59 ILE  QG1     7.93                
 39 MET  QG     59 ILE  QD1     5.41                
 39 MET  QE     40 ALA  HN      6.38                
 39 MET  QE     40 ALA  QB      8.56                
 39 MET  QE     42 TYR  QD      8.68                
 39 MET  QE     42 TYR  QE      7.32                
 39 MET  QE     55 GLN  HE21    4.62                
 39 MET  QE     55 GLN  HE22    4.62                
 39 MET  QE     59 ILE  QG1     5.70                
 39 MET  QE     59 ILE  QD1     5.23                
 40 ALA  HN     40 ALA  QB      3.43                
 40 ALA  HN     41 LYS+ HN      3.26                
 40 ALA  HN     41 LYS+ QB      5.94                
 40 ALA  HA     41 LYS+ HN      3.26                
 40 ALA  HA     42 TYR  HN      4.20                
 40 ALA  HA     43 VAL  HN      4.16                
 40 ALA  HA     43 VAL  QG1     7.28                
 40 ALA  HA     43 VAL  QG2     4.25                
 40 ALA  QB     41 LYS+ HN      4.25                
 40 ALA  QB     43 VAL  HB      6.71                
 40 ALA  QB     43 VAL  QG1     6.42                
 40 ALA  QB     43 VAL  QG2     5.52                
 41 LYS+ HN     41 LYS+ HG2     3.30                
 41 LYS+ HN     41 LYS+ HG3     3.30                
 41 LYS+ HN     41 LYS+ QG      3.01                
 41 LYS+ HN     41 LYS+ HD2     5.88                
 41 LYS+ HN     41 LYS+ HD3     5.88                
 41 LYS+ HN     41 LYS+ QD      5.67                
 41 LYS+ HN     41 LYS+ QE      7.38                
 41 LYS+ HN     42 TYR  HN      3.14                
 41 LYS+ HN     42 TYR  HA      6.13                
 41 LYS+ HN     43 VAL  HN      5.02                
 41 LYS+ HN     43 VAL  HB      6.38                
 41 LYS+ HA     41 LYS+ HD2     6.50                
 41 LYS+ HA     41 LYS+ HD3     6.50                
 41 LYS+ HA     41 LYS+ QD      5.80                
 41 LYS+ HA     43 VAL  HN      4.24                
 41 LYS+ QB     41 LYS+ QE      7.47                
 41 LYS+ QB     42 TYR  HN      5.33                
 41 LYS+ HG2    42 TYR  HN      4.00                
 41 LYS+ HG3    42 TYR  HN      4.00                
 41 LYS+ QG     42 TYR  HN      3.76                
 41 LYS+ HD2    42 TYR  HN      6.50                
 41 LYS+ HD3    42 TYR  HN      6.50                
 41 LYS+ QE     42 TYR  QE      9.30                
 42 TYR  HN     42 TYR  HB2     3.38                
 42 TYR  HN     42 TYR  HB3     3.55                
 42 TYR  HN     43 VAL  HN      3.06                
 42 TYR  HN     43 VAL  HB      4.61                
 42 TYR  HN     43 VAL  QG1     6.42                
 42 TYR  HN     43 VAL  QG2     4.86                
 42 TYR  HB2    43 VAL  HN      4.45                
 42 TYR  HB2    52 GLY  HN      5.84                
 42 TYR  HB3    43 VAL  HN      5.93                
 42 TYR  QD     51 GLU- QG      9.52                
 42 TYR  QE     51 GLU- QG      8.16                
 43 VAL  HN     43 VAL  HB      2.89                
 43 VAL  HN     43 VAL  QG1     4.70                
 43 VAL  HN     43 VAL  QG2     3.84                
 43 VAL  HN     44 GLN  HN      4.45                
 43 VAL  HA     44 GLN  HN      2.77                
 43 VAL  HA     44 GLN  QB      5.54                
 43 VAL  HA     44 GLN  QG      7.17                
 43 VAL  HA     47 ALA  HN      5.56                
 43 VAL  HA     48 ILE  QG2     5.52                
 43 VAL  HB     44 GLN  HN      4.29                
 43 VAL  QG1    44 GLN  HN      3.84                
 43 VAL  QG1    44 GLN  QB      8.41                
 43 VAL  QG1    44 GLN  QG      6.31                
 43 VAL  QG1    45 GLY  HN      6.30                
 43 VAL  QG1    46 ASP- HN      5.27                
 43 VAL  QG1    46 ASP- HA      4.17                
 43 VAL  QG1    47 ALA  HN      4.37                
 43 VAL  QG1    47 ALA  QB      8.56                
 43 VAL  QG1    96 LEU  QD1     5.73                
 43 VAL  QG1    96 LEU  QD2     6.71                
 43 VAL  QG2    44 GLN  HN      4.86                
 43 VAL  QG2    44 GLN  QG      7.67                
 43 VAL  QG2    48 ILE  HB      5.07                
 43 VAL  QG2    48 ILE  QG2     5.89                
 43 VAL  QG2    48 ILE  QD1     8.35                
 43 VAL  QG2    96 LEU  QD1     6.01                
 43 VAL  QG2    96 LEU  QD2     5.93                
 44 GLN  HN     44 GLN  HB2     3.59                
 44 GLN  HN     44 GLN  HB3     3.59                
 44 GLN  HN     44 GLN  QB      3.39                
 44 GLN  HN     44 GLN  QG      5.61                
 44 GLN  HN     45 GLY  HN      5.76                
 44 GLN  HN     47 ALA  HN      3.63                
 44 GLN  HN     47 ALA  QB      5.35                
 44 GLN  HN     48 ILE  HA      4.16                
 44 GLN  HN     48 ILE  QG2     6.34                
 44 GLN  HN     49 GLY  HN      4.94                
 44 GLN  HA     44 GLN  HE21    5.56                
 44 GLN  HA     44 GLN  HE22    6.50                
 44 GLN  HA     45 GLY  HN      3.18                
 44 GLN  HA     45 GLY  HA1     5.19                
 44 GLN  HA     45 GLY  HA2     5.23                
 44 GLN  HA     46 ASP- HN      6.46                
 44 GLN  HA     47 ALA  HN      6.46                
 44 GLN  HB2    44 GLN  HE21    6.50                
 44 GLN  HB2    45 GLY  HN      5.15                
 44 GLN  HB3    44 GLN  HE21    6.50                
 44 GLN  HB3    45 GLY  HN      5.15                
 44 GLN  QB     44 GLN  HE21    6.04                
 44 GLN  QB     47 ALA  HN      6.93                
 44 GLN  QB     47 ALA  QB      7.63                
 44 GLN  QB     93 VAL  QG1     7.79                
 44 GLN  QG     45 GLY  HN      6.76                
 44 GLN  QG     47 ALA  QB      6.85                
 44 GLN  QG     93 VAL  QG1     6.89                
 44 GLN  HE21   93 VAL  QG1     5.89                
 44 GLN  HE22   93 VAL  QG1     5.15                
 45 GLY  HN     46 ASP- HN      4.74                
 45 GLY  HA1    46 ASP- HN      3.47                
 45 GLY  HA1    47 ALA  HN      5.60                
 45 GLY  HA2    46 ASP- HN      3.51                
 45 GLY  HA2    47 ALA  HN      4.37                
 46 ASP- HN     46 ASP- HB2     4.08                
 46 ASP- HN     46 ASP- HB3     4.08                
 46 ASP- HN     46 ASP- QB      3.92                
 46 ASP- HN     47 ALA  HN      3.06                
 46 ASP- HN     47 ALA  QB      6.09                
 46 ASP- HA     47 ALA  HN      3.59                
 46 ASP- HA     47 ALA  QB      6.26                
 46 ASP- HA     96 LEU  QD1     5.07                
 46 ASP- HB2    47 ALA  HN      5.64                
 46 ASP- HB3    47 ALA  HN      5.64                
 47 ALA  HN     47 ALA  QB      3.67                
 47 ALA  HN     48 ILE  HN      5.84                
 47 ALA  HN     48 ILE  QG2     7.53                
 47 ALA  HN     93 VAL  QG1     6.01                
 47 ALA  HN     96 LEU  QD1     7.53                
 47 ALA  HA     48 ILE  HN      3.14                
 47 ALA  HA     48 ILE  QG2     7.32                
 47 ALA  HA     95 CYS  HA      3.26                
 47 ALA  HA     96 LEU  HN      3.84                
 47 ALA  QB     48 ILE  HN      4.33                
 47 ALA  QB     48 ILE  QG2     8.56                
 47 ALA  QB     93 VAL  HB      3.92                
 47 ALA  QB     93 VAL  QG1     5.97                
 47 ALA  QB     93 VAL  QG2     5.48                
 47 ALA  QB     94 VAL  HN      4.94                
 47 ALA  QB     94 VAL  HA      7.53                
 47 ALA  QB     95 CYS  HN      7.53                
 47 ALA  QB     95 CYS  HA      4.62                
 47 ALA  QB     95 CYS  QB      8.40                
 47 ALA  QB     96 LEU  HN      6.50                
 48 ILE  HN     48 ILE  QG2     4.41                
 48 ILE  HN     48 ILE  HG12    5.11                
 48 ILE  HN     48 ILE  HG13    5.11                
 48 ILE  HN     48 ILE  QG1     4.93                
 48 ILE  HN     48 ILE  QD1     7.53                
 48 ILE  HN     93 VAL  HB      4.74                
 48 ILE  HN     93 VAL  QG2     5.60                
 48 ILE  HN     94 VAL  HN      3.75                
 48 ILE  HN     94 VAL  QG1     6.09                
 48 ILE  HN     94 VAL  QG2     7.53                
 48 ILE  HN     95 CYS  HN      5.84                
 48 ILE  HN     95 CYS  HA      4.20                
 48 ILE  HN     96 LEU  HN      4.74                
 48 ILE  HA     49 GLY  HN      2.89                
 48 ILE  HB     49 GLY  HN      3.96                
 48 ILE  QG2    49 GLY  HN      4.62                
 48 ILE  QG2    53 PHE  HN      6.79                
 48 ILE  QG2    53 PHE  QB      7.10                
 48 ILE  QG2    94 VAL  QG1     6.71                
 48 ILE  QG2    94 VAL  QG2     8.56                
 48 ILE  QG2    96 LEU  HA      6.17                
 48 ILE  QG2    96 LEU  QD1     6.51                
 48 ILE  QG2    96 LEU  QD2     6.96                
 48 ILE  HG12   49 GLY  HN      4.90                
 48 ILE  HG13   49 GLY  HN      4.90                
 48 ILE  QG1    96 LEU  QD1     6.23                
 48 ILE  QG1    96 LEU  QD2     7.30                
 48 ILE  QD1    52 GLY  HA2     5.97                
 48 ILE  QD1    53 PHE  HN      5.60                
 48 ILE  QD1    53 PHE  HA      4.78                
 48 ILE  QD1    53 PHE  QD      8.67                
 48 ILE  QD1    56 PHE  HB3     5.93                
 48 ILE  QD1    94 VAL  QG1     8.47                
 48 ILE  QD1    96 LEU  QD1     7.61                
 49 GLY  HN     50 TYR  HN      4.94                
 49 GLY  HN     52 GLY  HN      6.50                
 49 GLY  HN     93 VAL  QG1     6.01                
 49 GLY  HA1    50 TYR  HN      3.51                
 49 GLY  HA1    93 VAL  QG1     5.60                
 49 GLY  HA2    50 TYR  HN      3.63                
 49 GLY  HA2    93 VAL  HA      4.37                
 49 GLY  HA2    93 VAL  QG1     4.94                
 50 TYR  HN     50 TYR  HB2     3.63                
 50 TYR  HN     50 TYR  HB3     3.63                
 50 TYR  HN     50 TYR  QB      3.44                
 50 TYR  HN     50 TYR  QE      8.63                
 50 TYR  HN     51 GLU- HN      3.75                
 50 TYR  HN     93 VAL  QG1     6.79                
 50 TYR  HA     53 PHE  HN      4.20                
 50 TYR  HB2    51 GLU- HN      4.41                
 50 TYR  HB3    51 GLU- HN      4.41                
 50 TYR  QB     54 GLN  HE22    7.38                
 50 TYR  QD     51 GLU- QG      9.52                
 50 TYR  QD     72 LEU  QD1     8.68                
 50 TYR  QD     72 LEU  QD2     9.67                
 50 TYR  QE     54 GLN  HE21    8.63                
 50 TYR  QE     54 GLN  HE22    8.63                
 50 TYR  QE     71 SER  HN      7.94                
 50 TYR  QE     72 LEU  HN      8.63                
 50 TYR  QE     72 LEU  HA      7.24                
 50 TYR  QE     72 LEU  QB      9.51                
 50 TYR  QE     72 LEU  QD1     8.51                
 50 TYR  QE     72 LEU  QD2     9.66                
 51 GLU- HN     51 GLU- HB2     3.22                
 51 GLU- HN     51 GLU- HB3     3.22                
 51 GLU- HN     51 GLU- QB      3.04                
 51 GLU- HN     51 GLU- QG      4.83                
 51 GLU- HN     52 GLY  HN      3.63                
 51 GLU- HN     54 GLN  HE21    6.21                
 51 GLU- HA     54 GLN  HN      4.29                
 51 GLU- HA     54 GLN  HG2     6.50                
 51 GLU- HA     54 GLN  HG3     6.50                
 51 GLU- HA     54 GLN  HE21    3.67                
 51 GLU- HA     54 GLN  HE22    4.08                
 51 GLU- HB2    52 GLY  HN      3.59                
 51 GLU- HB2    54 GLN  HG2     5.72                
 51 GLU- HB2    54 GLN  HG3     5.72                
 51 GLU- HB3    52 GLY  HN      3.59                
 51 GLU- HB3    54 GLN  HG2     5.72                
 51 GLU- HB3    54 GLN  HG3     5.72                
 51 GLU- QB     54 GLN  QG      4.86                
 51 GLU- QB     54 GLN  HE21    7.38                
 51 GLU- QG     52 GLY  HN      6.11                
 51 GLU- QG     52 GLY  HA2     7.38                
 51 GLU- QG     54 GLN  HE21    6.97                
 51 GLU- QG     54 GLN  HE22    7.38                
 52 GLY  HN     53 PHE  HN      3.84                
 52 GLY  HN     54 GLN  HN      6.46                
 52 GLY  HA1    55 GLN  HN      5.47                
 52 GLY  HA1    55 GLN  QB      6.35                
 52 GLY  HA2    55 GLN  HN      5.64                
 53 PHE  HN     53 PHE  HB2     3.88                
 53 PHE  HN     53 PHE  HB3     3.88                
 53 PHE  HN     53 PHE  QB      3.53                
 53 PHE  HN     54 GLN  HN      3.71                
 53 PHE  HN     54 GLN  HB2     6.50                
 53 PHE  HN     54 GLN  HB3     6.50                
 53 PHE  HA     56 PHE  HN      4.16                
 53 PHE  HA     56 PHE  HB2     5.93                
 53 PHE  HA     56 PHE  HB3     5.52                
 53 PHE  HA     57 LEU  HN      5.07                
 53 PHE  HB2    54 GLN  HN      4.74                
 53 PHE  HB3    54 GLN  HN      4.74                
 53 PHE  QD     75 PHE  HA      8.13                
 53 PHE  QD     94 VAL  QG1     8.26                
 53 PHE  QD     94 VAL  QG2     9.12                
 53 PHE  QE     75 PHE  HN      8.62                
 53 PHE  QE     99 VAL  QG2     8.13                
 54 GLN  HN     54 GLN  HB2     4.04                
 54 GLN  HN     54 GLN  HB3     4.04                
 54 GLN  HN     54 GLN  QB      3.72                
 54 GLN  HN     54 GLN  HG2     4.37                
 54 GLN  HN     54 GLN  HG3     4.37                
 54 GLN  HN     54 GLN  HE21    5.60                
 54 GLN  HN     54 GLN  HE22    6.50                
 54 GLN  HN     55 GLN  HN      3.88                
 54 GLN  HA     54 GLN  HE21    6.50                
 54 GLN  HA     54 GLN  HE22    6.50                
 54 GLN  HA     56 PHE  HN      6.21                
 54 GLN  HA     57 LEU  HN      4.33                
 54 GLN  HA     57 LEU  HB2     4.94                
 54 GLN  HA     57 LEU  HG      4.70                
 54 GLN  HA     57 LEU  QD1     5.89                
 54 GLN  HB2    54 GLN  HE21    5.35                
 54 GLN  HB2    55 GLN  HN      4.45                
 54 GLN  HB3    54 GLN  HE21    5.35                
 54 GLN  HB3    55 GLN  HN      4.45                
 54 GLN  QB     54 GLN  HE21    4.90                
 54 GLN  QB     55 GLN  HN      4.12                
 54 GLN  HG2    55 GLN  HN      6.50                
 54 GLN  HG3    55 GLN  HN      6.50                
 54 GLN  QG     54 GLN  HE22    3.88                
 54 GLN  QG     55 GLN  HN      5.69                
 54 GLN  QG     56 PHE  HN      6.52                
 55 GLN  HN     55 GLN  HB2     3.96                
 55 GLN  HN     55 GLN  HB3     3.96                
 55 GLN  HN     55 GLN  HG2     4.90                
 55 GLN  HN     55 GLN  HG3     4.90                
 55 GLN  HN     55 GLN  QG      4.33                
 55 GLN  HN     55 GLN  HE21    6.50                
 55 GLN  HN     55 GLN  HE22    6.50                
 55 GLN  HN     56 PHE  HN      3.67                
 55 GLN  HN     57 LEU  HN      6.50                
 55 GLN  HA     55 GLN  QG      3.82                
 55 GLN  HA     55 GLN  QE2     7.37                
 55 GLN  HA     58 LYS+ HN      3.88                
 55 GLN  HA     58 LYS+ HB2     3.71                
 55 GLN  HA     58 LYS+ HB3     3.71                
 55 GLN  HA     58 LYS+ QD      5.98                
 55 GLN  HA     58 LYS+ QE      7.38                
 55 GLN  HA     59 ILE  HN      5.84                
 55 GLN  HB2    55 GLN  HE21    6.50                
 55 GLN  HB2    55 GLN  HE22    6.50                
 55 GLN  HB2    56 PHE  HN      5.02                
 55 GLN  HB3    55 GLN  HE21    6.50                
 55 GLN  HB3    55 GLN  HE22    6.50                
 55 GLN  HB3    56 PHE  HN      5.02                
 55 GLN  HG2    56 PHE  HN      6.01                
 55 GLN  HG3    56 PHE  HN      6.01                
 55 GLN  QG     56 PHE  HN      5.66                
 55 GLN  QG     59 ILE  QD1     8.41                
 55 GLN  HE21   56 PHE  HN      6.50                
 55 GLN  HE21   59 ILE  QD1     6.87                
 55 GLN  HE22   56 PHE  HN      6.50                
 55 GLN  HE22   59 ILE  QD1     6.87                
 55 GLN  QE2    59 ILE  QD1     6.24                
 56 PHE  HN     56 PHE  HB2     3.55                
 56 PHE  HN     56 PHE  HB3     3.59                
 56 PHE  HN     56 PHE  QE      8.62                
 56 PHE  HN     57 LEU  HN      3.63                
 56 PHE  HN     58 LYS+ HN      5.76                
 56 PHE  HN     59 ILE  QD1     7.53                
 56 PHE  HA     59 ILE  HN      4.98                
 56 PHE  HA     59 ILE  HB      5.19                
 56 PHE  HA     59 ILE  QD1     4.82                
 56 PHE  HB2    57 LEU  HN      4.41                
 56 PHE  HB3    57 LEU  HN      3.75                
 56 PHE  QD     57 LEU  HN      8.62                
 56 PHE  QD     57 LEU  QD1     8.75                
 56 PHE  QD     57 LEU  QD2     7.76                
 56 PHE  QE     57 LEU  HN      8.62                
 56 PHE  QE     57 LEU  QD2     8.54                
 56 PHE  QE     99 VAL  QG1     9.65                
 57 LEU  HN     57 LEU  HB2     3.42                
 57 LEU  HN     57 LEU  HB3     3.71                
 57 LEU  HN     57 LEU  HG      3.42                
 57 LEU  HN     57 LEU  QD1     6.34                
 57 LEU  HN     57 LEU  QD2     4.78                
 57 LEU  HN     58 LYS+ HN      3.42                
 57 LEU  HN     58 LYS+ QB      6.72                
 57 LEU  HN     59 ILE  HN      5.64                
 57 LEU  HN     66 VAL  QQG     7.94                
 57 LEU  HA     57 LEU  QD1     6.83                
 57 LEU  HA     57 LEU  QD2     4.21                
 57 LEU  HA     60 TYR  HN      4.70                
 57 LEU  HA     61 LEU  HN      5.68                
 57 LEU  HA     61 LEU  QD1     5.81                
 57 LEU  HA     61 LEU  QD2     7.53                
 57 LEU  HB2    58 LYS+ HN      4.04                
 57 LEU  HB2    63 VAL  QG1     7.53                
 57 LEU  HB2    63 VAL  QG2     6.50                
 57 LEU  HB2    66 VAL  HB      6.50                
 57 LEU  HB2    66 VAL  QQG     8.60                
 57 LEU  HB3    58 LYS+ HN      5.02                
 57 LEU  HB3    66 VAL  QG1     5.52                
 57 LEU  HB3    66 VAL  QG2     5.52                
 57 LEU  HB3    66 VAL  QQG     5.00                
 57 LEU  HG     58 LYS+ HN      5.80                
 57 LEU  HG     74 LEU  QD1     5.35                
 57 LEU  HG     74 LEU  QD2     5.44                
 57 LEU  QD1    58 LYS+ HN      7.49                
 57 LEU  QD1    66 VAL  QQG     8.80                
 57 LEU  QD1    70 LEU  QD1     7.28                
 57 LEU  QD1    71 SER  HA      5.03                
 57 LEU  QD1    71 SER  HB2     5.48                
 57 LEU  QD1    71 SER  HB3     5.48                
 57 LEU  QD1    71 SER  QB      5.19                
 57 LEU  QD1    74 LEU  QD2     6.46                
 57 LEU  QD2    58 LYS+ HN      6.63                
 57 LEU  QD2    60 TYR  QD      8.31                
 57 LEU  QD2    61 LEU  HG      5.81                
 57 LEU  QD2    66 VAL  HN      7.53                
 57 LEU  QD2    66 VAL  HB      6.54                
 57 LEU  QD2    66 VAL  QQG     8.11                
 57 LEU  QD2    70 LEU  QD2     8.27                
 57 LEU  QD2    71 SER  HN      7.53                
 57 LEU  QD2    74 LEU  HB3     7.12                
 57 LEU  QD2    74 LEU  HG      7.53                
 57 LEU  QD2    74 LEU  QD1     6.79                
 57 LEU  QD2    74 LEU  QD2     6.38                
 57 LEU  QD2   103 PHE  QE      9.24                
 57 LEU  QD2   103 PHE  HZ      4.74                
 58 LYS+ HN     58 LYS+ HB2     3.75                
 58 LYS+ HN     58 LYS+ HB3     3.75                
 58 LYS+ HN     58 LYS+ QB      3.40                
 58 LYS+ HN     58 LYS+ HG2     5.64                
 58 LYS+ HN     58 LYS+ HG3     5.64                
 58 LYS+ HN     58 LYS+ QG      5.02                
 58 LYS+ HN     58 LYS+ QD      6.39                
 58 LYS+ HN     58 LYS+ QE      7.38                
 58 LYS+ HN     59 ILE  HN      3.92                
 58 LYS+ HN     60 TYR  HN      4.41                
 58 LYS+ HN     66 VAL  QQG     7.57                
 58 LYS+ HA     58 LYS+ QD      7.38                
 58 LYS+ HA     63 VAL  HN      3.63                
 58 LYS+ HA     63 VAL  QG1     6.05                
 58 LYS+ HA     63 VAL  QG2     4.21                
 58 LYS+ HA     66 VAL  QG1     6.22                
 58 LYS+ HA     66 VAL  QG2     6.22                
 58 LYS+ HA     66 VAL  QQG     5.51                
 58 LYS+ HB2    58 LYS+ QE      5.98                
 58 LYS+ HB2    59 ILE  HN      4.29                
 58 LYS+ HB3    58 LYS+ QE      5.98                
 58 LYS+ HB3    59 ILE  HN      4.29                
 58 LYS+ QB     58 LYS+ QE      5.67                
 58 LYS+ QB     64 ASP- HA      6.97                
 58 LYS+ HG2    59 ILE  HN      6.50                
 58 LYS+ HG2    64 ASP- HA      6.50                
 58 LYS+ HG3    59 ILE  HN      6.50                
 58 LYS+ HG3    64 ASP- HA      6.50                
 58 LYS+ QG     59 ILE  QD1     8.41                
 58 LYS+ QG     64 ASP- HA      5.72                
 58 LYS+ QG     66 VAL  HN      7.38                
 58 LYS+ QD     59 ILE  HN      5.98                
 58 LYS+ QD     64 ASP- HA      5.82                
 58 LYS+ QD     66 VAL  HN      7.38                
 58 LYS+ QE     64 ASP- HA      5.86                
 58 LYS+ QE     65 ASN  HA      7.38                
 58 LYS+ QE     66 VAL  HN      7.38                
 59 ILE  HN     59 ILE  HB      3.34                
 59 ILE  HN     59 ILE  QG2     4.90                
 59 ILE  HN     59 ILE  HG12    3.63                
 59 ILE  HN     59 ILE  HG13    3.63                
 59 ILE  HN     59 ILE  QD1     4.45                
 59 ILE  HN     60 TYR  HN      3.59                
 59 ILE  HA     59 ILE  HG12    3.84                
 59 ILE  HA     59 ILE  HG13    3.84                
 59 ILE  HA     59 ILE  QD1     4.62                
 59 ILE  HA     62 GLU- HN      5.23                
 59 ILE  HA     63 VAL  HN      5.02                
 59 ILE  HB     60 TYR  HN      3.96                
 59 ILE  QG2    60 TYR  HN      4.66                
 59 ILE  QG2    60 TYR  HA      6.83                
 59 ILE  HG12   60 TYR  HN      6.34                
 59 ILE  HG13   60 TYR  HN      6.34                
 59 ILE  QG1    60 TYR  HN      5.82                
 59 ILE  QD1    60 TYR  HN      5.52                
 60 TYR  HN     60 TYR  HB2     3.59                
 60 TYR  HN     60 TYR  HB3     3.59                
 60 TYR  HN     60 TYR  QB      3.39                
 60 TYR  HN     61 LEU  HN      3.63                
 60 TYR  HB2    61 LEU  HN      5.02                
 60 TYR  HB3    61 LEU  HN      5.02                
 60 TYR  QB     61 LEU  HN      4.53                
 60 TYR  QB     61 LEU  QD2     7.83                
 60 TYR  QD     61 LEU  QD2     7.78                
 60 TYR  QD    103 PHE  QD     10.76                
 60 TYR  QE     61 LEU  QD2     9.66                
 60 TYR  QE    103 PHE  QD     10.55                
 61 LEU  HN     61 LEU  HG      3.96                
 61 LEU  HN     61 LEU  QD1     5.35                
 61 LEU  HN     61 LEU  QD2     5.56                
 61 LEU  HN     62 GLU- HN      3.42                
 61 LEU  HA     61 LEU  QD1     5.27                
 61 LEU  HA     61 LEU  QD2     3.88                
 61 LEU  HB2    62 GLU- HN      5.97                
 61 LEU  HB3    62 GLU- HN      5.97                
 61 LEU  QB     62 GLU- HN      5.64                
 61 LEU  QB     63 VAL  HN      5.41                
 61 LEU  QB     63 VAL  QG2     6.64                
 61 LEU  HG     62 GLU- HN      6.25                
 61 LEU  QD1    62 GLU- HN      6.67                
 61 LEU  QD1    63 VAL  QG1     6.46                
 61 LEU  QD1    63 VAL  QG2     7.20                
 61 LEU  QD1    66 VAL  HB      6.13                
 61 LEU  QD1    70 LEU  QD2     8.56                
 61 LEU  QD1    74 LEU  QD1     6.46                
 61 LEU  QD2    62 GLU- HN      7.49                
 61 LEU  QD2    63 VAL  HN      7.53                
 61 LEU  QD2    63 VAL  QG1     5.48                
 61 LEU  QD2    63 VAL  QG2     6.05                
 62 GLU- HN     62 GLU- QB      3.85                
 62 GLU- HN     62 GLU- HG2     5.19                
 62 GLU- HN     62 GLU- HG3     5.19                
 62 GLU- HN     62 GLU- QG      4.62                
 62 GLU- HN     63 VAL  HN      3.06                
 62 GLU- HN     63 VAL  QG2     7.53                
 62 GLU- HA     63 VAL  HN      3.30                
 62 GLU- HB2    63 VAL  HN      4.66                
 62 GLU- HB3    63 VAL  HN      4.66                
 62 GLU- QB     63 VAL  HN      4.49                
 62 GLU- QB     63 VAL  QG1     8.41                
 62 GLU- HG2    63 VAL  HN      6.50                
 62 GLU- HG3    63 VAL  HN      6.50                
 62 GLU- QG     63 VAL  HN      6.30                
 62 GLU- QG     63 VAL  QG1     8.41                
 63 VAL  HN     63 VAL  HB      3.92                
 63 VAL  HN     63 VAL  QG1     4.37                
 63 VAL  HN     63 VAL  QG2     3.92                
 63 VAL  HN     64 ASP- HN      4.82                
 63 VAL  HN     65 ASN  HN      5.47                
 63 VAL  HN     66 VAL  QQG     6.87                
 63 VAL  HA     63 VAL  QG1     3.76                
 63 VAL  HA     64 ASP- HN      2.77                
 63 VAL  HA     64 ASP- QB      4.96                
 63 VAL  HA     65 ASN  HN      3.92                
 63 VAL  HB     64 ASP- HN      3.30                
 63 VAL  HB     64 ASP- QB      7.38                
 63 VAL  HB     65 ASN  HN      3.30                
 63 VAL  HB     65 ASN  QB      7.38                
 63 VAL  QG1    64 ASP- HN      4.70                
 63 VAL  QG1    64 ASP- HA      7.53                
 63 VAL  QG1    64 ASP- QB      8.12                
 63 VAL  QG1    65 ASN  HN      4.49                
 63 VAL  QG1    66 VAL  HN      7.53                
 63 VAL  QG1    66 VAL  HA      6.17                
 63 VAL  QG1    66 VAL  QQG     7.78                
 63 VAL  QG2    64 ASP- HN      4.94                
 63 VAL  QG2    64 ASP- QB      8.40                
 63 VAL  QG2    65 ASN  HN      4.49                
 63 VAL  QG2    65 ASN  HA      7.53                
 63 VAL  QG2    66 VAL  HN      6.67                
 63 VAL  QG2    66 VAL  HA      5.27                
 63 VAL  QG2    66 VAL  HB      7.53                
 63 VAL  QG2    66 VAL  QG1     8.27                
 63 VAL  QG2    66 VAL  QG2     8.27                
 63 VAL  QG2    66 VAL  QQG     7.10                
 64 ASP- HN     64 ASP- QB      3.65                
 64 ASP- HN     65 ASN  HN      3.02                
 64 ASP- HN     65 ASN  HA      6.01                
 64 ASP- QB     65 ASN  HN      4.14                
 65 ASN  HN     65 ASN  HB2     3.84                
 65 ASN  HN     65 ASN  HB3     3.84                
 65 ASN  HN     65 ASN  QB      3.63                
 65 ASN  HN     65 ASN  HD22    6.50                
 65 ASN  HN     66 VAL  HN      3.79                
 65 ASN  HN     66 VAL  QQG     7.45                
 65 ASN  HA     65 ASN  HB2     3.02                
 65 ASN  HA     65 ASN  HB3     3.02                
 65 ASN  HA     65 ASN  HD21    6.50                
 65 ASN  HA     66 VAL  HN      2.69                
 65 ASN  HA     66 VAL  HB      4.70                
 65 ASN  HB2    66 VAL  HN      4.04                
 65 ASN  HB3    66 VAL  HN      4.04                
 65 ASN  HD21   66 VAL  HN      6.50                
 65 ASN  HD22   66 VAL  HN      6.50                
 66 VAL  HN     66 VAL  HB      2.81                
 66 VAL  HN     66 VAL  QG1     4.29                
 66 VAL  HN     66 VAL  QG2     4.29                
 66 VAL  HN     66 VAL  QQG     3.63                
 66 VAL  HN     67 PRO  QD      7.38                
 66 VAL  HA     70 LEU  QD2     6.13                
 66 VAL  QG1    67 PRO  HG2     9.91                
 66 VAL  QG1    67 PRO  HG3     9.91                
 66 VAL  QG1    67 PRO  HD2     8.02                
 66 VAL  QG1    67 PRO  HD3     8.02                
 66 VAL  QG1    70 LEU  HG      5.35                
 66 VAL  QG1    70 LEU  QD1     7.82                
 66 VAL  QG1    70 LEU  QD2     7.12                
 66 VAL  QG2    67 PRO  HG2     9.91                
 66 VAL  QG2    67 PRO  HG3     9.91                
 66 VAL  QG2    67 PRO  HD2     8.02                
 66 VAL  QG2    67 PRO  HD3     8.02                
 66 VAL  QG2    70 LEU  HG      5.35                
 66 VAL  QG2    70 LEU  QD1     7.82                
 66 VAL  QG2    70 LEU  QD2     7.12                
 66 VAL  QQG    67 PRO  QG      8.00                
 66 VAL  QQG    67 PRO  QD      6.20                
 66 VAL  QQG    70 LEU  HN      7.12                
 66 VAL  QQG    70 LEU  HB2     8.47                
 66 VAL  QQG    70 LEU  QD1     7.46                
 66 VAL  QQG    70 LEU  QD2     6.31                
 66 VAL  QQG    71 SER  HN      6.30                
 67 PRO  HA     68 ARG+ HN      2.81                
 67 PRO  HB2    68 ARG+ HN      3.96                
 67 PRO  HB3    68 ARG+ HN      4.33                
 67 PRO  HB3    69 HIS  HN      5.31                
 67 PRO  HB3    70 LEU  HN      4.33                
 67 PRO  QD     70 LEU  QD2     6.15                
 68 ARG+ HN     68 ARG+ HG2     5.02                
 68 ARG+ HN     68 ARG+ HG3     5.02                
 68 ARG+ HN     68 ARG+ QG      4.78                
 68 ARG+ HN     68 ARG+ QD      6.60                
 68 ARG+ HN     69 HIS  HN      4.29                
 68 ARG+ HA     68 ARG+ QG      3.90                
 68 ARG+ HA     68 ARG+ QD      7.38                
 68 ARG+ HA     70 LEU  HN      5.43                
 68 ARG+ HA     71 SER  HN      4.45                
 68 ARG+ HA     71 SER  QB      4.84                
 68 ARG+ HG2    69 HIS  HN      6.50                
 68 ARG+ HG3    69 HIS  HN      6.50                
 68 ARG+ QD     72 LEU  QD1     8.03                
 69 HIS  HN     70 LEU  HN      4.16                
 69 HIS  HN     71 SER  HN      5.43                
 69 HIS  HA     72 LEU  HN      5.07                
 69 HIS  HA     72 LEU  QB      4.71                
 69 HIS  HA     72 LEU  QD2     7.16                
 69 HIS  HB2    70 LEU  HN      4.94                
 69 HIS  HB3    70 LEU  HN      4.94                
 69 HIS  QB     70 LEU  HN      4.68                
 70 LEU  HN     70 LEU  HB2     3.75                
 70 LEU  HN     70 LEU  HB3     3.30                
 70 LEU  HN     70 LEU  HG      5.07                
 70 LEU  HN     70 LEU  QD1     6.87                
 70 LEU  HN     70 LEU  QD2     4.78                
 70 LEU  HN     71 SER  HN      2.97                
 70 LEU  HN     72 LEU  HN      4.82                
 70 LEU  HA     70 LEU  QD1     4.12                
 70 LEU  HA     70 LEU  QD2     4.86                
 70 LEU  HA     73 ALA  HN      4.12                
 70 LEU  HA     73 ALA  QB      4.70                
 70 LEU  HB2    71 SER  HN      4.08                
 70 LEU  HB2    74 LEU  QD1     7.16                
 70 LEU  HB2    74 LEU  QD2     7.20                
 70 LEU  HB3    71 SER  HN      3.63                
 70 LEU  HG     71 SER  HN      4.57                
 70 LEU  HG     74 LEU  HB3     4.61                
 70 LEU  HG     74 LEU  QD1     5.68                
 70 LEU  HG     74 LEU  QD2     5.81                
 70 LEU  QD1    71 SER  HN      7.45                
 70 LEU  QD1    73 ALA  QB      6.67                
 70 LEU  QD1    74 LEU  HG      5.76                
 70 LEU  QD2    71 SER  HN      6.30                
 71 SER  HN     71 SER  HB2     3.84                
 71 SER  HN     71 SER  HB3     3.84                
 71 SER  HN     72 LEU  HN      3.22                
 71 SER  HN     72 LEU  QB      5.94                
 71 SER  HN     73 ALA  HN      5.35                
 71 SER  HA     74 LEU  HN      4.94                
 71 SER  HA     74 LEU  QD1     5.48                
 71 SER  HA     74 LEU  QD2     7.53                
 71 SER  HB2    72 LEU  HN      6.50                
 71 SER  HB3    72 LEU  HN      6.50                
 72 LEU  HN     72 LEU  HG      4.16                
 72 LEU  HN     72 LEU  QD1     5.85                
 72 LEU  HN     72 LEU  QD2     5.56                
 72 LEU  HN     73 ALA  HN      3.42                
 72 LEU  HN     73 ALA  QB      7.53                
 72 LEU  HN     74 LEU  HN      5.64                
 72 LEU  HA     72 LEU  QD1     4.00                
 72 LEU  HA     72 LEU  QD2     4.99                
 72 LEU  HA     75 PHE  HN      4.24                
 72 LEU  QB     73 ALA  HN      4.51                
 72 LEU  HG     73 ALA  HN      6.21                
 72 LEU  HG     76 GLN  HE21    6.50                
 72 LEU  HG     76 GLN  HE22    6.50                
 72 LEU  QD1    73 ALA  HN      6.79                
 72 LEU  QD1    76 GLN  HG2     6.05                
 72 LEU  QD1    76 GLN  HG3     6.05                
 72 LEU  QD1    76 GLN  QG      5.80                
 72 LEU  QD1    76 GLN  QE2     5.98                
 72 LEU  QD2    73 ALA  HN      6.30                
 72 LEU  QD2    76 GLN  HG2     7.53                
 72 LEU  QD2    76 GLN  HG3     7.53                
 72 LEU  QD2    76 GLN  QG      7.13                
 72 LEU  QD2    76 GLN  HE21    5.64                
 72 LEU  QD2    76 GLN  HE22    5.64                
 72 LEU  QD2    76 GLN  QE2     5.41                
 73 ALA  HN     74 LEU  HN      3.63                
 73 ALA  HN     75 PHE  HN      4.45                
 73 ALA  HA     75 PHE  HN      5.27                
 73 ALA  HA     76 GLN  HN      4.45                
 73 ALA  HA     76 GLN  HB2     5.93                
 73 ALA  HA     76 GLN  HB3     5.93                
 73 ALA  HA     76 GLN  QB      5.76                
 73 ALA  QB     74 LEU  HN      3.96                
 73 ALA  QB     74 LEU  HB2     7.53                
 73 ALA  QB     74 LEU  HG      6.71                
 73 ALA  QB     76 GLN  HN      6.22                
 74 LEU  HN     74 LEU  HB2     3.59                
 74 LEU  HN     74 LEU  HB3     4.08                
 74 LEU  HN     74 LEU  HG      3.26                
 74 LEU  HN     74 LEU  QD1     4.78                
 74 LEU  HN     74 LEU  QD2     4.86                
 74 LEU  HN     75 PHE  HN      3.88                
 74 LEU  HN     76 GLN  HN      5.11                
 74 LEU  HA     74 LEU  QD1     5.89                
 74 LEU  HA     74 LEU  QD2     4.04                
 74 LEU  HA     77 SER  HN      5.80                
 74 LEU  HA     77 SER  HB2     5.02                
 74 LEU  HB2    75 PHE  HN      4.00                
 74 LEU  HB3    75 PHE  HN      3.96                
 74 LEU  HG     75 PHE  HN      5.23                
 74 LEU  QD1    75 PHE  HN      7.53                
 74 LEU  QD1   103 PHE  QE      8.83                
 74 LEU  QD1   103 PHE  HZ      5.27                
 74 LEU  QD2    75 PHE  HN      6.71                
 74 LEU  QD2   102 TYR  QE      7.98                
 74 LEU  QD2   103 PHE  QE      7.68                
 74 LEU  QD2   103 PHE  HZ      4.58                
 74 LEU  QD2   106 LEU  QD1     7.49                
 74 LEU  QD2   106 LEU  QD2     7.49                
 74 LEU  QD2   106 LEU  QQD     7.06                
 75 PHE  HN     75 PHE  HB2     3.92                
 75 PHE  HN     75 PHE  HB3     3.92                
 75 PHE  HN     75 PHE  QB      3.57                
 75 PHE  HN     76 GLN  HN      4.16                
 75 PHE  HN     77 SER  HN      5.60                
 75 PHE  HB2    76 GLN  HN      4.57                
 75 PHE  HB3    76 GLN  HN      4.57                
 75 PHE  QB     76 GLN  HN      4.40                
 75 PHE  QD     94 VAL  QG1     8.95                
 75 PHE  QE     94 VAL  QG1     8.46                
 75 PHE  QE     94 VAL  QG2     8.91                
 76 GLN  HN     76 GLN  HB2     4.16                
 76 GLN  HN     76 GLN  HB3     4.16                
 76 GLN  HN     76 GLN  QB      3.86                
 76 GLN  HN     76 GLN  HG2     4.24                
 76 GLN  HN     76 GLN  HG3     4.24                
 76 GLN  HN     76 GLN  QG      3.89                
 76 GLN  HN     77 SER  HN      3.96                
 76 GLN  HA     76 GLN  QE2     7.37                
 76 GLN  HB2    76 GLN  HE21    8.23                
 76 GLN  HB2    76 GLN  HE22    8.23                
 76 GLN  HB2    77 SER  HN      5.35                
 76 GLN  HB3    76 GLN  HE21    8.23                
 76 GLN  HB3    76 GLN  HE22    8.23                
 76 GLN  HB3    77 SER  HN      5.35                
 76 GLN  HG2    77 SER  HN      6.34                
 76 GLN  HG3    77 SER  HN      6.34                
 76 GLN  QG     77 SER  HN      5.92                
 77 SER  HN     77 SER  HB2     3.59                
 77 SER  HN     77 SER  HB3     3.92                
 77 SER  HN     78 PHE  HN      3.88                
 77 SER  HB2    78 PHE  HN      6.09                
 78 PHE  HN     78 PHE  QE      7.88                
 78 PHE  HN     79 GLU- HN      4.78                
 78 PHE  HN     94 VAL  QG2     6.99                
 78 PHE  HB2    79 GLU- HN      6.50                
 78 PHE  HB2    94 VAL  QG1     7.53                
 78 PHE  HB2    94 VAL  QG2     7.28                
 78 PHE  HB3    79 GLU- HN      6.50                
 78 PHE  HB3    94 VAL  QG1     7.53                
 78 PHE  HB3    94 VAL  QG2     7.28                
 78 PHE  QB     94 VAL  QG1     6.83                
 78 PHE  QB     94 VAL  QG2     6.44                
 78 PHE  QD     79 GLU- HN      8.62                
 78 PHE  QD     94 VAL  QG2     9.03                
 78 PHE  QD     99 VAL  HN      8.29                
 78 PHE  QD     99 VAL  QG1     9.32                
 78 PHE  QE     99 VAL  HA      8.62                
 78 PHE  QE     99 VAL  QG2     9.65                
 79 GLU- HN     79 GLU- HG2     4.94                
 79 GLU- HN     79 GLU- HG3     4.94                
 79 GLU- HN     79 GLU- QG      4.66                
 79 GLU- HN     80 THR  HN      4.29                
 79 GLU- HN     94 VAL  QG2     6.71                
 79 GLU- HA     79 GLU- QG      3.84                
 79 GLU- HA     80 THR  HN      3.10                
 79 GLU- HA     94 VAL  QG2     7.12                
 79 GLU- HG2    80 THR  HN      4.53                
 79 GLU- HG2    94 VAL  QG2     6.50                
 79 GLU- HG3    80 THR  HN      4.53                
 79 GLU- HG3    94 VAL  QG2     6.50                
 79 GLU- QG     80 THR  QG2     8.41                
 79 GLU- QG     89 VAL  QQG     8.33                
 79 GLU- QG     93 VAL  QG2     8.41                
 79 GLU- QG     94 VAL  QG2     6.28                
 80 THR  HN     80 THR  HB      4.00                
 80 THR  HN     80 THR  QG2     4.41                
 80 THR  HN     81 GLY  HN      3.92                
 80 THR  HN     81 GLY  QA      6.89                
 80 THR  HN     94 VAL  QG2     7.53                
 80 THR  HA     80 THR  HB      2.85                
 80 THR  HA     81 GLY  HN      3.42                
 80 THR  HA     95 CYS  QB      7.38                
 80 THR  HB     81 GLY  HN      3.88                
 80 THR  HB     93 VAL  QG2     7.53                
 80 THR  QG2    81 GLY  HN      5.23                
 80 THR  QG2    92 ASP- QB      8.40                
 80 THR  QG2    93 VAL  HB      7.49                
 80 THR  QG2    93 VAL  QG1     8.56                
 80 THR  QG2    94 VAL  QG1     8.56                
 80 THR  QG2    94 VAL  QG2     8.56                
 80 THR  QG2    95 CYS  QB      8.40                
 81 GLY  HN     82 HIS  HN      4.37                
 81 GLY  HA1    82 HIS  HN      3.63                
 81 GLY  HA2    82 HIS  HN      3.63                
 82 HIS  HN     82 HIS  HB2     3.75                
 82 HIS  HN     82 HIS  HB3     3.75                
 82 HIS  HN     83 CYS  HN      4.57                
 82 HIS  HB2    83 CYS  HN      5.27                
 82 HIS  HB3    83 CYS  HN      5.27                
 82 HIS  QB     83 CYS  HN      5.03                
 83 CYS  HN     84 LEU  HN      4.24                
 83 CYS  HA     84 LEU  HN      3.26                
 83 CYS  HA     84 LEU  QQD     8.28                
 83 CYS  HA     85 ASN  HN      6.46                
 83 CYS  HB2    84 LEU  HN      4.49                
 83 CYS  HB2    84 LEU  HB2     8.09                
 83 CYS  HB2    84 LEU  HB3     8.09                
 83 CYS  HB2    89 VAL  QG1     9.28                
 83 CYS  HB2    89 VAL  QG2     9.28                
 83 CYS  HB3    84 LEU  HN      4.49                
 83 CYS  HB3    84 LEU  HB2     8.09                
 83 CYS  HB3    84 LEU  HB3     8.09                
 83 CYS  HB3    89 VAL  QG1     9.28                
 83 CYS  HB3    89 VAL  QG2     9.28                
 83 CYS  QB     84 LEU  HN      4.26                
 83 CYS  QB     84 LEU  QB      6.84                
 83 CYS  QB     84 LEU  QQD     9.98                
 83 CYS  QB     89 VAL  QQG     8.26                
 84 LEU  HN     84 LEU  HB2     4.16                
 84 LEU  HN     84 LEU  HB3     4.16                
 84 LEU  HN     84 LEU  HG      4.98                
 84 LEU  HN     84 LEU  QD1     7.53                
 84 LEU  HN     84 LEU  QD2     7.53                
 84 LEU  HN     84 LEU  QQD     6.76                
 84 LEU  HN     85 ASN  HN      3.47                
 84 LEU  HA     84 LEU  QD1     4.90                
 84 LEU  HA     84 LEU  QD2     4.90                
 84 LEU  HA     84 LEU  QQD     4.15                
 84 LEU  HA     85 ASN  HN      3.06                
 84 LEU  HB2    84 LEU  HG      2.61                
 84 LEU  HB2    85 ASN  HN      4.49                
 84 LEU  HB3    84 LEU  HG      2.61                
 84 LEU  HB3    85 ASN  HN      4.49                
 84 LEU  QB     84 LEU  HG      2.35                
 84 LEU  QB     85 ASN  HN      4.34                
 84 LEU  HG     85 ASN  HN      6.50                
 84 LEU  QD1    85 ASN  HN      7.53                
 84 LEU  QD2    85 ASN  HN      7.53                
 84 LEU  QQD    85 ASN  HN      7.16                
 85 ASN  HN     85 ASN  HD21    5.07                
 85 ASN  HN     85 ASN  HD22    6.50                
 85 ASN  HN     86 GLU- HN      4.37                
 85 ASN  HA     85 ASN  HD21    5.07                
 85 ASN  HA     86 GLU- HN      3.18                
 85 ASN  HA     86 GLU- HA      4.70                
 85 ASN  QB     86 GLU- HN      4.42                
 86 GLU- HN     86 GLU- HB2     3.79                
 86 GLU- HN     86 GLU- HB3     3.79                
 86 GLU- HN     86 GLU- QB      3.44                
 86 GLU- HN     86 GLU- QG      5.00                
 86 GLU- HN     87 THR  HN      4.04                
 86 GLU- HN     89 VAL  QQG     9.09                
 86 GLU- HA     87 THR  HN      3.02                
 86 GLU- HB2    87 THR  HN      4.45                
 86 GLU- HB2    88 ASN  HN      4.78                
 86 GLU- HB3    87 THR  HN      4.45                
 86 GLU- HB3    88 ASN  HN      4.78                
 86 GLU- QB     87 THR  HN      4.20                
 86 GLU- QB     88 ASN  HN      4.61                
 86 GLU- QG     87 THR  HN      7.21                
 86 GLU- QG     88 ASN  HN      7.38                
 87 THR  HN     87 THR  HB      3.92                
 87 THR  HN     87 THR  QG2     4.53                
 87 THR  HN     88 ASN  HN      3.96                
 87 THR  HN     88 ASN  HA      6.09                
 87 THR  HA     88 ASN  HN      3.22                
 87 THR  HA     89 VAL  QG1     7.53                
 87 THR  HA     89 VAL  QG2     7.53                
 87 THR  HA     89 VAL  QQG     7.02                
 87 THR  HB     88 ASN  HN      4.45                
 87 THR  QG2    88 ASN  HN      5.23                
 87 THR  QG2    89 VAL  QQG     9.17                
 88 ASN  HN     88 ASN  HB2     3.79                
 88 ASN  HN     88 ASN  HB3     3.79                
 88 ASN  HN     88 ASN  QB      3.55                
 88 ASN  HN     88 ASN  HD21    6.13                
 88 ASN  HN     88 ASN  HD22    6.50                
 88 ASN  HN     89 VAL  HN      3.75                
 88 ASN  HN     89 VAL  QQG     9.09                
 88 ASN  HA     88 ASN  HD21    5.43                
 88 ASN  HA     89 VAL  HN      2.85                
 88 ASN  HA     89 VAL  QQG     6.96                
 88 ASN  HA     90 THR  HN      4.94                
 88 ASN  HA     90 THR  QG2     7.53                
 88 ASN  HB2    88 ASN  HD21    2.97                
 88 ASN  HB2    88 ASN  HD22    3.79                
 88 ASN  HB2    89 VAL  HN      4.74                
 88 ASN  HB2    90 THR  QG2     7.53                
 88 ASN  HB3    88 ASN  HD21    2.97                
 88 ASN  HB3    88 ASN  HD22    3.79                
 88 ASN  HB3    89 VAL  HN      4.74                
 88 ASN  HB3    90 THR  QG2     7.53                
 88 ASN  QB     88 ASN  HD21    2.78                
 88 ASN  QB     89 VAL  HN      4.51                
 88 ASN  QB     90 THR  HN      7.22                
 88 ASN  HD21   89 VAL  QQG     9.09                
 88 ASN  HD21   90 THR  QG2     7.53                
 88 ASN  HD21   91 LYS+ QD      7.38                
 88 ASN  HD22   89 VAL  HA      6.50                
 88 ASN  HD22   89 VAL  QQG     8.72                
 88 ASN  HD22   90 THR  QG2     7.53                
 88 ASN  HD22   91 LYS+ QE      7.38                
 89 VAL  HN     89 VAL  HB      3.06                
 89 VAL  HN     89 VAL  QQG     4.23                
 89 VAL  HN     90 THR  HN      4.61                
 89 VAL  HN     90 THR  HA      6.50                
 89 VAL  HN     90 THR  QG2     6.42                
 89 VAL  HA     90 THR  HN      2.81                
 89 VAL  HB     90 THR  HN      4.24                
 89 VAL  QG1    90 THR  HN      6.67                
 89 VAL  QG2    90 THR  HN      6.67                
 89 VAL  QQG    90 THR  HN      5.64                
 89 VAL  QQG    90 THR  HA      8.39                
 89 VAL  QQG    90 THR  HB      9.09                
 89 VAL  QQG    90 THR  QG2    10.12                
 89 VAL  QQG    91 LYS+ QE      9.96                
 90 THR  HN     90 THR  HB      3.55                
 90 THR  HN     90 THR  QG2     4.41                
 90 THR  HN     91 LYS+ HN      5.19                
 90 THR  HA     90 THR  HB      2.89                
 90 THR  HA     91 LYS+ HN      3.38                
 90 THR  HA     92 ASP- HN      5.27                
 90 THR  HB     91 LYS+ HN      4.33                
 90 THR  QG2    91 LYS+ HN      4.70                
 91 LYS+ HN     91 LYS+ HB2     4.04                
 91 LYS+ HN     91 LYS+ HB3     4.04                
 91 LYS+ HN     91 LYS+ QB      3.80                
 91 LYS+ HN     91 LYS+ HG2     5.76                
 91 LYS+ HN     91 LYS+ HG3     5.76                
 91 LYS+ HN     91 LYS+ QG      5.55                
 91 LYS+ HN     91 LYS+ QD      7.38                
 91 LYS+ HN     92 ASP- HN      4.04                
 91 LYS+ HA     91 LYS+ HB2     3.02                
 91 LYS+ HA     91 LYS+ HB3     3.02                
 91 LYS+ HA     91 LYS+ HG2     4.24                
 91 LYS+ HA     91 LYS+ HG3     4.24                
 91 LYS+ HA     91 LYS+ QD      5.78                
 91 LYS+ HA     91 LYS+ QE      7.38                
 91 LYS+ HA     92 ASP- HN      2.77                
 91 LYS+ HB2    91 LYS+ QE      7.38                
 91 LYS+ HB2    92 ASP- HN      4.74                
 91 LYS+ HB3    91 LYS+ QE      7.38                
 91 LYS+ HB3    92 ASP- HN      4.74                
 91 LYS+ QB     92 ASP- HN      4.37                
 91 LYS+ HG2    92 ASP- HN      6.50                
 91 LYS+ HG3    92 ASP- HN      6.50                
 91 LYS+ QG     93 VAL  QG1     6.60                
 91 LYS+ QD     93 VAL  QG1     8.24                
 91 LYS+ QE     93 VAL  QG1     6.19                
 92 ASP- HN     93 VAL  HN      4.49                
 93 VAL  HN     93 VAL  QG1     4.90                
 93 VAL  HN     93 VAL  QG2     4.04                
 93 VAL  HA     94 VAL  HN      3.26                
 93 VAL  HB     94 VAL  HN      3.71                
 93 VAL  QG1    94 VAL  HN      4.58                
 93 VAL  QG1    94 VAL  HA      7.53                
 93 VAL  QG2    94 VAL  HN      6.30                
 94 VAL  HN     94 VAL  QG1     4.70                
 94 VAL  HN     95 CYS  HN      5.60                
 94 VAL  HA     95 CYS  HN      2.77                
 94 VAL  HA     95 CYS  QB      6.19                
 94 VAL  HB     95 CYS  HN      3.88                
 94 VAL  QG1    95 CYS  HN      5.72                
 94 VAL  QG2    95 CYS  HN      4.66                
 95 CYS  HN     96 LEU  HN      5.56                
 95 CYS  HN     98 ASP- HN      5.43                
 95 CYS  HA     96 LEU  HN      3.06                
 95 CYS  HA     98 ASP- HN      4.41                
 95 CYS  QB     96 LEU  HN      5.45                
 95 CYS  QB     97 ASN  HN      5.45                
 95 CYS  QB     97 ASN  HD21    7.38                
 95 CYS  QB     98 ASP- HN      4.55                
 95 CYS  QB     99 VAL  HN      6.19                
 96 LEU  HN     96 LEU  HB2     4.08                
 96 LEU  HN     96 LEU  HB3     4.08                
 96 LEU  HN     96 LEU  HG      3.96                
 96 LEU  HN     96 LEU  QD1     5.85                
 96 LEU  HN     96 LEU  QD2     6.95                
 96 LEU  HN     97 ASN  HN      3.92                
 96 LEU  HA     96 LEU  QD1     5.03                
 96 LEU  HA     96 LEU  QD2     4.00                
 96 LEU  HA     98 ASP- HN      4.49                
 96 LEU  HA     99 VAL  HN      4.53                
 96 LEU  HA     99 VAL  HB      3.84                
 96 LEU  HA     99 VAL  QG1     6.05                
 96 LEU  HA     99 VAL  QG2     5.19                
 96 LEU  HA    100 SER  HN      4.78                
 96 LEU  HB2    97 ASN  HN      4.57                
 96 LEU  HB3    97 ASN  HN      4.57                
 96 LEU  QB     97 ASN  HN      4.32                
 96 LEU  HG     97 ASN  HN      5.76                
 96 LEU  QD1    97 ASN  HN      6.75                
 96 LEU  QD2    97 ASN  HN      7.53                
 96 LEU  QD2    98 ASP- HN      7.53                
 96 LEU  QD2    99 VAL  HB      6.42                
 96 LEU  QD2    99 VAL  QG1     8.56                
 96 LEU  QD2    99 VAL  QG2     7.74                
 97 ASN  HN     97 ASN  HD21    5.68                
 97 ASN  HN     97 ASN  HD22    6.50                
 97 ASN  HN     98 ASP- HN      3.47                
 97 ASN  HA     97 ASN  HD21    5.80                
 97 ASN  HA    100 SER  HN      4.29                
 97 ASN  HA    100 SER  HA      5.07                
 97 ASN  HA    100 SER  QB      5.12                
 97 ASN  QB    100 SER  HN      6.56                
 98 ASP- HN     98 ASP- HB2     3.55                
 98 ASP- HN     98 ASP- HB3     3.55                
 98 ASP- HN     98 ASP- QB      3.27                
 98 ASP- HN     99 VAL  HN      3.14                
 98 ASP- HN     99 VAL  HB      5.31                
 98 ASP- HN     99 VAL  QG1     7.53                
 98 ASP- HN     99 VAL  QG2     5.81                
 98 ASP- HN    100 SER  HN      4.53                
 98 ASP- HA    101 CYS  HN      4.37                
 98 ASP- HA    101 CYS  HB2     3.75                
 98 ASP- HA    101 CYS  HB3     3.79                
 98 ASP- HA    102 TYR  HN      5.07                
 98 ASP- HB2    99 VAL  HN      4.98                
 98 ASP- HB3    99 VAL  HN      4.98                
 99 VAL  HN     99 VAL  HB      3.75                
 99 VAL  HN     99 VAL  QG2     3.92                
 99 VAL  HN    100 SER  HN      3.59                
 99 VAL  HN    101 CYS  HN      4.94                
 99 VAL  HA    102 TYR  HN      4.33                
 99 VAL  HB    100 SER  HN      3.47                
 99 VAL  QG1   100 SER  HN      5.44                
 99 VAL  QG1   100 SER  HA      7.53                
 99 VAL  QG1   103 PHE  QD      7.64                
 99 VAL  QG1   103 PHE  QE      7.93                
 99 VAL  QG2   100 SER  HN      4.99                
100 SER  HN    101 CYS  HN      3.51                
100 SER  HA    101 CYS  HN      3.47                
100 SER  HA    102 TYR  HN      6.50                
100 SER  HA    103 PHE  HN      5.52                
101 CYS  HN    101 CYS  HB2     2.97                
101 CYS  HN    101 CYS  HB3     3.10                
101 CYS  HN    102 TYR  HN      3.47                
101 CYS  HA    104 SER  HN      3.75                
101 CYS  HA    104 SER  HB2     3.34                
101 CYS  HA    104 SER  HB3     2.85                
101 CYS  HB2   102 TYR  HN      3.63                
101 CYS  HB3   102 TYR  HN      3.38                
102 TYR  HN    102 TYR  HB2     3.55                
102 TYR  HN    102 TYR  HB3     3.55                
102 TYR  HN    102 TYR  QB      3.35                
102 TYR  HN    102 TYR  QE      8.63                
102 TYR  HN    103 PHE  HN      3.55                
102 TYR  HN    103 PHE  QB      7.38                
102 TYR  HA    105 LEU  HN      4.24                
102 TYR  HA    105 LEU  HB2     5.64                
102 TYR  HA    105 LEU  HB3     5.64                
102 TYR  HB2   103 PHE  HN      4.74                
102 TYR  HB3   103 PHE  HN      4.74                
102 TYR  QB    103 PHE  HN      4.30                
102 TYR  QD    103 PHE  HN      8.64                
102 TYR  QE    103 PHE  HN      8.63                
102 TYR  QE    106 LEU  QD1     8.47                
102 TYR  QE    106 LEU  QD2     8.47                
102 TYR  QE    106 LEU  QQD     8.24                
103 PHE  HN    103 PHE  HB2     4.12                
103 PHE  HN    103 PHE  HB3     4.12                
103 PHE  HN    104 SER  HN      3.34                
103 PHE  HA    106 LEU  HN      3.84                
103 PHE  HA    106 LEU  HB2     5.97                
103 PHE  HA    106 LEU  HB3     5.97                
103 PHE  HA    106 LEU  QB      5.26                
103 PHE  HA    106 LEU  HG      6.13                
103 PHE  HA    106 LEU  QQD     7.25                
103 PHE  HB2   104 SER  HN      4.94                
103 PHE  HB3   104 SER  HN      4.94                
103 PHE  QB    104 SER  HA      6.23                
103 PHE  QD    106 LEU  QQD     9.87                
103 PHE  QE    106 LEU  QD1     9.65                
103 PHE  QE    106 LEU  QD2     9.65                
103 PHE  QE    106 LEU  QQD     9.21                
104 SER  HN    104 SER  HB2     3.51                
104 SER  HN    104 SER  HB3     3.88                
104 SER  HN    105 LEU  HN      3.55                
104 SER  HN    107 GLU- HN      5.80                
104 SER  HA    104 SER  HB3     3.02                
104 SER  HA    107 GLU- HN      4.29                
104 SER  HB2   105 LEU  HN      4.33                
104 SER  HB3   105 LEU  HN      3.84                
105 LEU  HN    105 LEU  HB2     3.67                
105 LEU  HN    105 LEU  HB3     3.67                
105 LEU  HN    105 LEU  QB      3.44                
105 LEU  HN    105 LEU  HG      4.90                
105 LEU  HN    105 LEU  QD1     5.85                
105 LEU  HN    105 LEU  QD2     5.85                
105 LEU  HN    105 LEU  QQD     5.32                
105 LEU  HN    106 LEU  HN      3.67                
105 LEU  HN    107 GLU- HN      5.93                
105 LEU  HA    105 LEU  QD1     4.29                
105 LEU  HA    105 LEU  QD2     4.29                
105 LEU  HA    105 LEU  QQD     3.84                
105 LEU  HB2   106 LEU  HN      4.53                
105 LEU  HB3   106 LEU  HN      4.53                
105 LEU  QB    106 LEU  HN      4.36                
105 LEU  HG    106 LEU  HN      6.42                
105 LEU  QD1   106 LEU  HN      7.24                
105 LEU  QD2   106 LEU  HN      7.24                
105 LEU  QQD   106 LEU  HN      6.60                
105 LEU  QQD   108 GLY  HN      8.48                
105 LEU  QQD   109 GLY  HN      8.44                
106 LEU  HN    106 LEU  QB      3.90                
106 LEU  HN    106 LEU  HG      3.92                
106 LEU  HN    106 LEU  QD1     5.60                
106 LEU  HN    106 LEU  QD2     5.60                
106 LEU  HN    106 LEU  QQD     5.25                
106 LEU  HN    107 GLU- HN      3.55                
106 LEU  HN    108 GLY  HN      4.94                
106 LEU  HA    106 LEU  QD1     5.15                
106 LEU  HA    106 LEU  QD2     5.15                
106 LEU  HA    106 LEU  QQD     4.20                
106 LEU  HB2   107 GLU- HN      4.41                
106 LEU  HB3   107 GLU- HN      4.41                
106 LEU  QB    107 GLU- HN      4.20                
106 LEU  QB    108 GLY  HN      6.27                
106 LEU  HG    107 GLU- HN      5.76                
106 LEU  QD1   107 GLU- HN      7.53                
106 LEU  QD2   107 GLU- HN      7.53                
106 LEU  QQD   107 GLU- HN      6.76                
107 GLU- HN    107 GLU- HB2     3.63                
107 GLU- HN    107 GLU- HB3     3.63                
107 GLU- HN    107 GLU- QB      3.38                
107 GLU- HN    107 GLU- HG2     3.96                
107 GLU- HN    107 GLU- HG3     3.96                
107 GLU- HN    107 GLU- QG      3.72                
107 GLU- HN    108 GLY  HN      3.30                
107 GLU- HN    109 GLY  HN      5.52                
107 GLU- HB2   108 GLY  HN      4.16                
107 GLU- HB3   108 GLY  HN      4.16                
107 GLU- QB    108 GLY  HN      3.99                
107 GLU- QB    109 GLY  HN      5.99                
107 GLU- HG2   108 GLY  HN      6.25                
107 GLU- HG3   108 GLY  HN      6.25                
107 GLU- QG    108 GLY  HN      5.62                
108 GLY  HN    109 GLY  HN      3.30                
108 GLY  HN    110 ARG+ HN      5.39                
109 GLY  HN    109 GLY  HA2     2.89                
109 GLY  HN    110 ARG+ HN      3.42                
109 GLY  HN    110 ARG+ QB      7.38                
109 GLY  HA1   110 ARG+ HN      3.30                
109 GLY  HA2   110 ARG+ HA      5.56                
109 GLY  HA2   110 ARG+ QG      7.38                
110 ARG+ HN    110 ARG+ HB2     3.67                
110 ARG+ HN    110 ARG+ HB3     3.67                
110 ARG+ HN    110 ARG+ QB      3.34                
110 ARG+ HN    110 ARG+ QG      5.29                
110 ARG+ HN    110 ARG+ QD      7.29                
110 ARG+ HA    110 ARG+ QD      7.05                
110 ARG+ HA    111 PRO  HD2     2.69                
110 ARG+ HA    111 PRO  HD3     2.69                
110 ARG+ HB2   111 PRO  HD2     6.09                
110 ARG+ HB2   111 PRO  HD3     6.09                
110 ARG+ HB3   111 PRO  HD2     6.09                
110 ARG+ HB3   111 PRO  HD3     6.09                
110 ARG+ QB    111 PRO  QG      8.17                
110 ARG+ QB    111 PRO  QD      5.12                
110 ARG+ QG    111 PRO  HD2     6.19                
110 ARG+ QG    111 PRO  HD3     6.19                
110 ARG+ QG    111 PRO  QD      5.65                
111 PRO  HA    112 GLU- HN      2.61                
111 PRO  HA    112 GLU- HA      4.98                
111 PRO  HA    113 ASP- HN      4.08                
111 PRO  HA    114 LYS+ HN      6.50                
111 PRO  HB2   112 GLU- HN      3.59                
111 PRO  HB3   112 GLU- HN      3.59                
111 PRO  QB    114 LYS+ HN      7.38                
112 GLU- HN    112 GLU- HB2     3.59                
112 GLU- HN    112 GLU- HB3     3.59                
112 GLU- HN    112 GLU- QB      3.42                
112 GLU- HN    112 GLU- QG      5.57                
112 GLU- HN    113 ASP- HN      3.75                
112 GLU- HA    113 ASP- HN      3.47                
112 GLU- HA    113 ASP- HA      5.88                
112 GLU- HB2   113 ASP- HN      3.96                
112 GLU- HB3   113 ASP- HN      3.96                
112 GLU- QB    113 ASP- HN      3.78                
112 GLU- QG    113 ASP- HN      5.94                
113 ASP- HN    113 ASP- HB2     3.47                
113 ASP- HN    113 ASP- HB3     3.47                
113 ASP- HN    113 ASP- QB      3.25                
113 ASP- HN    114 LYS+ HN      4.24                
113 ASP- HN    114 LYS+ QB      7.38                
113 ASP- HA    114 LYS+ HN      3.10                
113 ASP- HB2   114 LYS+ HN      4.66                
113 ASP- HB3   114 LYS+ HN      4.66                
113 ASP- QB    114 LYS+ HN      4.43                
114 LYS+ HN    114 LYS+ HB2     3.59                
114 LYS+ HN    114 LYS+ HB3     3.59                
114 LYS+ HN    114 LYS+ QB      3.18                
114 LYS+ HN    114 LYS+ HG2     3.96                
114 LYS+ HN    114 LYS+ HG3     3.96                
114 LYS+ HN    114 LYS+ QD      7.38                
114 LYS+ HN    114 LYS+ QE      7.38                
114 LYS+ HN    115 LEU  HN      4.61                
114 LYS+ HA    114 LYS+ QG      3.96                
114 LYS+ HA    114 LYS+ QD      6.23                
114 LYS+ HA    114 LYS+ QE      7.38                
114 LYS+ HA    115 LEU  HN      3.14                
114 LYS+ HB2   114 LYS+ QE      7.38                
114 LYS+ HB2   115 LEU  HN      4.00                
114 LYS+ HB3   114 LYS+ QE      7.38                
114 LYS+ HB3   115 LEU  HN      4.00                
114 LYS+ HG2   115 LEU  HN      6.09                
114 LYS+ HG3   115 LEU  HN      6.09                
114 LYS+ QD    115 LEU  HN      7.25                
115 LEU  HN    115 LEU  HB2     3.42                
115 LEU  HN    115 LEU  HB3     3.42                
115 LEU  HN    115 LEU  QB      3.08                
115 LEU  HN    115 LEU  HG      4.41                
115 LEU  HN    115 LEU  QD1     6.42                
115 LEU  HN    115 LEU  QD2     6.42                
115 LEU  HN    115 LEU  QQD     5.89                
115 LEU  HN    116 GLU- HN      4.86                
115 LEU  HA    115 LEU  HB2     2.89                
115 LEU  HA    115 LEU  HB3     2.89                
115 LEU  HA    115 LEU  HG      4.00                
115 LEU  HA    115 LEU  QD1     5.27                
115 LEU  HA    115 LEU  QD2     5.27                
115 LEU  HA    116 GLU- HN      2.61                
115 LEU  HB2   116 GLU- HN      3.79                
115 LEU  HB2   117 TRP  HN      6.38                
115 LEU  HB2   117 TRP  HE1     6.50                
115 LEU  HB3   116 GLU- HN      3.79                
115 LEU  HB3   117 TRP  HN      6.38                
115 LEU  HB3   117 TRP  HE1     6.50                
115 LEU  QB    117 TRP  HN      6.17                
115 LEU  QB    117 TRP  HE1     6.28                
115 LEU  HG    116 GLU- HN      6.50                
115 LEU  QD1   116 GLU- HN      5.93                
115 LEU  QD1   117 TRP  HE1     7.53                
115 LEU  QD2   116 GLU- HN      5.93                
115 LEU  QD2   117 TRP  HE1     7.53                
115 LEU  QQD   117 TRP  HE1     7.00                
116 GLU- HN    116 GLU- HB2     3.26                
116 GLU- HN    116 GLU- HB3     3.92                
116 GLU- HN    116 GLU- HG2     4.24                
116 GLU- HN    116 GLU- HG3     4.24                
116 GLU- HN    116 GLU- QG      4.01                
116 GLU- HN    117 TRP  HN      4.12                
116 GLU- HA    117 TRP  HN      3.10                
116 GLU- HB2   117 TRP  HN      3.75                
116 GLU- HB3   117 TRP  HN      3.63                
116 GLU- HG2   117 TRP  HN      5.64                
116 GLU- HG3   117 TRP  HN      5.64                
117 TRP  HN    117 TRP  HB2     3.38                
117 TRP  HN    117 TRP  HB3     3.71                
117 TRP  HN    117 TRP  HD1     4.20                
117 TRP  HN    117 TRP  HE3     6.42                
117 TRP  HN    118 SER  HN      3.63                
117 TRP  HA    117 TRP  HB3     2.97                
117 TRP  HA    117 TRP  HD1     5.52                
117 TRP  HA    118 SER  HN      3.38                
117 TRP  HB2   118 SER  HN      4.45                
117 TRP  HB2   118 SER  HA      5.31                
117 TRP  HB3   117 TRP  HE3     4.12                
117 TRP  HB3   118 SER  HN      4.37                
117 TRP  HD1   118 SER  QB      7.38                



  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    MET   1           H        MET   1 -17.416   0.984  14.612
    2    HA   MET   1           HA       MET   1 -16.940   2.022  12.368
    3   1HB   MET   1          1HB       MET   1 -16.259  -0.806  13.253
    4   2HB   MET   1          2HB       MET   1 -15.674  -0.255  11.696
    5   1HG   MET   1          1HG       MET   1 -13.978   0.848  12.722
    6   2HG   MET   1          2HG       MET   1 -15.138   1.859  13.560
    7   1HE   MET   1          1HE       MET   1 -13.105  -1.951  14.965
    8   2HE   MET   1          2HE       MET   1 -14.700  -2.253  14.236
    9   3HE   MET   1          3HE       MET   1 -13.437  -1.418  13.300
   10    H    ALA   2           H        ALA   2 -19.218   2.210  11.421
   11    HA   ALA   2           HA       ALA   2 -19.746  -0.053   9.621
   12   1HB   ALA   2          1HB       ALA   2 -21.830   2.020  10.054
   13   2HB   ALA   2          2HB       ALA   2 -21.975   0.247   9.985
   14   3HB   ALA   2          3HB       ALA   2 -21.422   1.037  11.481
   15    H    LYS   3           H        LYS   3 -17.918   0.893   8.303
   16    HA   LYS   3           HA       LYS   3 -18.776   3.315   6.893
   17   1HB   LYS   3          1HB       LYS   3 -16.509   3.192   8.066
   18   2HB   LYS   3          2HB       LYS   3 -16.032   2.044   6.832
   19   1HG   LYS   3          1HG       LYS   3 -15.355   3.992   5.776
   20   2HG   LYS   3          2HG       LYS   3 -17.001   3.928   5.180
   21   1HD   LYS   3          1HD       LYS   3 -17.499   5.271   7.466
   22   2HD   LYS   3          2HD       LYS   3 -15.814   5.719   7.294
   23   1HE   LYS   3          1HE       LYS   3 -16.428   6.342   4.827
   24   2HE   LYS   3          2HE       LYS   3 -18.097   6.254   5.355
   25   1HZ   LYS   3          1HZ       LYS   3 -16.012   7.996   6.468
   26   2HZ   LYS   3          2HZ       LYS   3 -17.320   8.459   5.607
   27   3HZ   LYS   3          3HZ       LYS   3 -17.506   7.846   7.109
   28    H    GLU   4           H        GLU   4 -16.528   1.987   4.934
   29    HA   GLU   4           HA       GLU   4 -16.513   0.661   3.189
   30   1HB   GLU   4          1HB       GLU   4 -17.887  -0.962   4.671
   31   2HB   GLU   4          2HB       GLU   4 -19.303  -0.370   3.824
   32   1HG   GLU   4          1HG       GLU   4 -18.641  -1.296   1.766
   33   2HG   GLU   4          2HG       GLU   4 -16.937  -1.269   2.177
   34    H    ARG   5           H        ARG   5 -17.227   0.817   0.952
   35    HA   ARG   5           HA       ARG   5 -19.624   1.999   0.255
   36   1HB   ARG   5          1HB       ARG   5 -18.775   4.230  -0.555
   37   2HB   ARG   5          2HB       ARG   5 -18.729   4.082   1.191
   38   1HG   ARG   5          1HG       ARG   5 -16.237   3.073   0.064
   39   2HG   ARG   5          2HG       ARG   5 -16.555   4.678  -0.563
   40   1HD   ARG   5          1HD       ARG   5 -16.832   5.560   1.741
   41   2HD   ARG   5          2HD       ARG   5 -16.624   3.953   2.407
   42    HE   ARG   5           HE       ARG   5 -14.307   4.117   2.058
   43   1HH1  ARG   5          2HH2      ARG   5 -15.949   6.668   0.277
   44   2HH1  ARG   5          1HH2      ARG   5 -14.485   7.495  -0.141
   45   1HH2  ARG   5          2HH1      ARG   5 -12.375   5.206   1.508
   46   2HH2  ARG   5          1HH1      ARG   5 -12.439   6.657   0.564
   47    H    GLY   6           H        GLY   6 -17.913  -0.225  -0.492
   48   1HA   GLY   6          1HA       GLY   6 -17.545  -1.265  -2.493
   49   2HA   GLY   6          2HA       GLY   6 -17.758   0.253  -3.342
   50    H    LEU   7           H        LEU   7 -15.478  -2.008  -2.001
   51    HA   LEU   7           HA       LEU   7 -13.314  -0.326  -2.997
   52   1HB   LEU   7          1HB       LEU   7 -11.955  -1.053  -0.989
   53   2HB   LEU   7          2HB       LEU   7 -13.135   0.222  -0.757
   54    HG   LEU   7           HG       LEU   7 -12.942  -1.567   1.054
   55   1HD1  LEU   7          1HD1      LEU   7 -14.998   0.044   0.309
   56   2HD1  LEU   7          2HD1      LEU   7 -15.786  -1.551   0.261
   57   3HD1  LEU   7          3HD1      LEU   7 -14.998  -0.992   1.756
   58   1HD2  LEU   7          1HD2      LEU   7 -13.832  -3.690   0.776
   59   2HD2  LEU   7          2HD2      LEU   7 -14.734  -3.236  -0.690
   60   3HD2  LEU   7          3HD2      LEU   7 -12.966  -3.424  -0.756
   61    H    ILE   8           H        ILE   8 -11.174  -1.994  -2.508
   62    HA   ILE   8           HA       ILE   8 -11.203  -3.756  -4.524
   63    HB   ILE   8           HB       ILE   8  -9.444  -5.012  -3.158
   64   1HG1  ILE   8          1HG1      ILE   8  -9.860  -2.698  -1.246
   65   2HG1  ILE   8          2HG1      ILE   8 -10.407  -4.335  -0.940
   66   1HG2  ILE   8          1HG2      ILE   8  -9.278  -2.895  -4.761
   67   2HG2  ILE   8          2HG2      ILE   8  -8.745  -2.116  -3.252
   68   3HG2  ILE   8          3HG2      ILE   8  -7.870  -3.534  -3.878
   69   1HD1  ILE   8          1HD1      ILE   8  -8.116  -3.699   0.041
   70   2HD1  ILE   8          2HD1      ILE   8  -8.168  -5.202  -0.911
   71   3HD1  ILE   8          3HD1      ILE   8  -7.508  -3.714  -1.632
   72    H    SER   9           H        SER   9 -12.387  -5.501  -5.067
   73    HA   SER   9           HA       SER   9 -14.354  -6.515  -3.519
   74   1HB   SER   9          1HB       SER   9 -13.228  -7.050  -6.060
   75   2HB   SER   9          2HB       SER   9 -13.212  -8.595  -5.235
   76    HG   SER   9           HG       SER   9 -15.309  -7.377  -6.394
   77    HA   PRO  10           HA       PRO  10 -12.579  -9.555  -0.932
   78   1HB   PRO  10          1HB       PRO  10 -13.934 -11.894  -1.336
   79   2HB   PRO  10          2HB       PRO  10 -14.579 -10.563  -0.397
   80   1HG   PRO  10          1HG       PRO  10 -15.308 -11.430  -3.127
   81   2HG   PRO  10          2HG       PRO  10 -16.204 -10.404  -2.025
   82   1HD   PRO  10          1HD       PRO  10 -14.685  -9.557  -4.306
   83   2HD   PRO  10          2HD       PRO  10 -15.485  -8.525  -3.137
   84    H    SER  11           H        SER  11 -12.029  -9.775  -4.139
   85    HA   SER  11           HA       SER  11 -10.605 -12.233  -4.062
   86   1HB   SER  11          1HB       SER  11 -10.997 -10.029  -6.100
   87   2HB   SER  11          2HB       SER  11  -9.760 -11.242  -6.367
   88    HG   SER  11           HG       SER  11 -11.988 -12.572  -5.623
   89    H    ASP  12           H        ASP  12  -9.799  -8.700  -4.172
   90    HA   ASP  12           HA       ASP  12  -7.028  -9.180  -4.122
   91   1HB   ASP  12          1HB       ASP  12  -8.849  -6.915  -4.255
   92   2HB   ASP  12          2HB       ASP  12  -7.617  -6.584  -3.054
   93    H    PHE  13           H        PHE  13  -9.602  -8.350  -1.722
   94    HA   PHE  13           HA       PHE  13  -7.880  -7.939   0.453
   95   1HB   PHE  13          1HB       PHE  13 -10.509  -7.536  -0.098
   96   2HB   PHE  13          2HB       PHE  13 -10.687  -9.108   0.656
   97    HD1  PHE  13           1HD      PHE  13  -9.460  -9.336   3.002
   98    HD2  PHE  13           2HD      PHE  13 -10.650  -5.662   1.243
   99    HE1  PHE  13           1HE      PHE  13  -9.458  -8.251   5.266
  100    HE2  PHE  13           2HE      PHE  13 -10.647  -4.578   3.506
  101    HZ   PHE  13           HZ       PHE  13 -10.051  -5.885   5.491
  102    H    ALA  14           H        ALA  14  -9.357 -10.848  -1.002
  103    HA   ALA  14           HA       ALA  14  -8.909 -12.547   1.202
  104   1HB   ALA  14          1HB       ALA  14 -10.500 -13.275  -0.369
  105   2HB   ALA  14          2HB       ALA  14  -9.444 -12.904  -1.753
  106   3HB   ALA  14          3HB       ALA  14  -9.091 -14.306  -0.715
  107    H    GLN  15           H        GLN  15  -7.063 -11.914  -1.860
  108    HA   GLN  15           HA       GLN  15  -5.045 -13.687  -1.390
  109   1HB   GLN  15          1HB       GLN  15  -5.642 -11.751  -3.303
  110   2HB   GLN  15          2HB       GLN  15  -4.146 -11.151  -2.616
  111   1HG   GLN  15          1HG       GLN  15  -3.496 -12.607  -4.411
  112   2HG   GLN  15          2HG       GLN  15  -3.165 -13.496  -2.938
  113   1HE2  GLN  15          1HE2      GLN  15  -3.356 -14.904  -5.170
  114   2HE2  GLN  15          2HE2      GLN  15  -4.823 -15.822  -5.260
  115    H    LEU  16           H        LEU  16  -5.124 -10.141  -0.574
  116    HA   LEU  16           HA       LEU  16  -2.671 -10.162   0.768
  117   1HB   LEU  16          1HB       LEU  16  -4.727  -8.317   0.100
  118   2HB   LEU  16          2HB       LEU  16  -4.422  -8.163   1.819
  119    HG   LEU  16           HG       LEU  16  -2.001  -7.837   1.336
  120   1HD1  LEU  16          1HD1      LEU  16  -2.606  -7.344  -1.547
  121   2HD1  LEU  16          2HD1      LEU  16  -1.080  -7.801  -0.753
  122   3HD1  LEU  16          3HD1      LEU  16  -2.351  -9.021  -1.006
  123   1HD2  LEU  16          1HD2      LEU  16  -3.609  -5.952   1.643
  124   2HD2  LEU  16          2HD2      LEU  16  -2.189  -5.549   0.648
  125   3HD2  LEU  16          3HD2      LEU  16  -3.762  -5.855  -0.128
  126    H    GLN  17           H        GLN  17  -6.051 -10.765   1.833
  127    HA   GLN  17           HA       GLN  17  -5.506 -10.767   4.544
  128   1HB   GLN  17          1HB       GLN  17  -7.787 -10.650   3.785
  129   2HB   GLN  17          2HB       GLN  17  -7.642 -12.137   2.868
  130   1HG   GLN  17          1HG       GLN  17  -7.880 -13.485   4.736
  131   2HG   GLN  17          2HG       GLN  17  -7.033 -12.369   5.788
  132   1HE2  GLN  17          1HE2      GLN  17  -9.943 -12.351   3.725
  133   2HE2  GLN  17          2HE2      GLN  17 -11.028 -11.659   4.883
  134    H    LYS  18           H        LYS  18  -5.917 -13.610   2.300
  135    HA   LYS  18           HA       LYS  18  -5.113 -15.519   4.141
  136   1HB   LYS  18          1HB       LYS  18  -6.316 -15.919   1.990
  137   2HB   LYS  18          2HB       LYS  18  -4.826 -15.604   1.123
  138   1HG   LYS  18          1HG       LYS  18  -3.739 -17.528   2.046
  139   2HG   LYS  18          2HG       LYS  18  -4.911 -17.683   3.338
  140   1HD   LYS  18          1HD       LYS  18  -6.487 -17.851   1.018
  141   2HD   LYS  18          2HD       LYS  18  -5.026 -18.711   0.574
  142   1HE   LYS  18          1HE       LYS  18  -5.873 -19.426   3.292
  143   2HE   LYS  18          2HE       LYS  18  -7.167 -19.700   2.142
  144   1HZ   LYS  18          1HZ       LYS  18  -5.846 -21.615   2.181
  145   2HZ   LYS  18          2HZ       LYS  18  -5.481 -20.877   0.771
  146   3HZ   LYS  18          3HZ       LYS  18  -4.446 -20.788   2.032
  147    H    TYR  19           H        TYR  19  -3.268 -13.218   2.181
  148    HA   TYR  19           HA       TYR  19  -0.789 -14.559   2.357
  149   1HB   TYR  19          1HB       TYR  19  -1.980 -11.864   1.692
  150   2HB   TYR  19          2HB       TYR  19  -0.286 -11.823   2.140
  151    HD1  TYR  19           1HD      TYR  19   0.675 -14.395   0.952
  152    HD2  TYR  19           2HD      TYR  19  -1.966 -11.413  -0.611
  153    HE1  TYR  19           1HE      TYR  19   1.312 -15.062  -1.417
  154    HE2  TYR  19           2HE      TYR  19  -1.319 -12.091  -2.975
  155    HH   TYR  19           HH       TYR  19  -0.156 -13.419  -4.209
  156    H    MET  20           H        MET  20  -2.186 -11.751   4.199
  157    HA   MET  20           HA       MET  20   0.013 -11.707   5.959
  158   1HB   MET  20          1HB       MET  20  -1.328  -9.988   7.135
  159   2HB   MET  20          2HB       MET  20  -1.461  -9.730   5.407
  160   1HG   MET  20          1HG       MET  20  -3.676 -10.616   5.314
  161   2HG   MET  20          2HG       MET  20  -3.507 -11.455   6.843
  162   1HE   MET  20          1HE       MET  20  -1.830  -8.091   6.672
  163   2HE   MET  20          2HE       MET  20  -3.055  -7.742   5.428
  164   3HE   MET  20          3HE       MET  20  -3.107  -6.893   6.992
  165    H    GLU  21           H        GLU  21  -2.997 -13.508   5.796
  166    HA   GLU  21           HA       GLU  21  -3.530 -13.957   8.419
  167   1HB   GLU  21          1HB       GLU  21  -3.937 -15.491   5.876
  168   2HB   GLU  21          2HB       GLU  21  -4.172 -16.377   7.369
  169   1HG   GLU  21          1HG       GLU  21  -5.443 -13.775   7.607
  170   2HG   GLU  21          2HG       GLU  21  -5.974 -14.533   6.119
  171    H    TYR  22           H        TYR  22  -1.219 -15.727   6.260
  172    HA   TYR  22           HA       TYR  22  -0.366 -17.433   8.401
  173   1HB   TYR  22          1HB       TYR  22  -0.348 -17.321   5.571
  174   2HB   TYR  22          2HB       TYR  22   1.330 -17.012   5.969
  175    HD1  TYR  22           1HD      TYR  22   2.310 -18.708   7.838
  176    HD2  TYR  22           2HD      TYR  22  -0.969 -19.525   5.214
  177    HE1  TYR  22           1HE      TYR  22   2.695 -21.205   8.123
  178    HE2  TYR  22           2HE      TYR  22  -0.573 -22.020   5.508
  179    HH   TYR  22           HH       TYR  22   0.658 -23.552   6.394
  180    H    SER  23           H        SER  23   0.571 -14.307   7.023
  181    HA   SER  23           HA       SER  23   3.178 -14.412   8.155
  182   1HB   SER  23          1HB       SER  23   2.421 -13.099   6.061
  183   2HB   SER  23          2HB       SER  23   1.709 -11.939   7.164
  184    HG   SER  23           HG       SER  23   3.867 -11.316   6.550
  185    H    THR  24           H        THR  24   3.929 -12.721   9.784
  186    HA   THR  24           HA       THR  24   1.769 -11.870  11.578
  187    HB   THR  24           HB       THR  24   3.161 -12.726  13.494
  188    HG1  THR  24           1HG      THR  24   4.957 -14.163  12.731
  189   1HG2  THR  24          1HG2      THR  24   1.651 -14.327  11.695
  190   2HG2  THR  24          2HG2      THR  24   3.172 -15.216  11.945
  191   3HG2  THR  24          3HG2      THR  24   2.158 -14.777  13.340
  192    H    LYS  25           H        LYS  25   3.930 -10.803   9.492
  193    HA   LYS  25           HA       LYS  25   5.553  -9.117  11.094
  194   1HB   LYS  25          1HB       LYS  25   4.891  -9.205   8.144
  195   2HB   LYS  25          2HB       LYS  25   5.948  -7.991   8.835
  196   1HG   LYS  25          1HG       LYS  25   6.883 -10.422   9.930
  197   2HG   LYS  25          2HG       LYS  25   6.491 -10.823   8.270
  198   1HD   LYS  25          1HD       LYS  25   7.807  -8.291   8.169
  199   2HD   LYS  25          2HD       LYS  25   8.731  -9.265   9.296
  200   1HE   LYS  25          1HE       LYS  25   9.736 -10.038   7.373
  201   2HE   LYS  25          2HE       LYS  25   8.364 -11.128   7.346
  202   1HZ   LYS  25          1HZ       LYS  25   7.760 -10.198   5.463
  203   2HZ   LYS  25          2HZ       LYS  25   7.575  -8.744   6.183
  204   3HZ   LYS  25          3HZ       LYS  25   9.009  -9.148   5.515
  205    H    LYS  26           H        LYS  26   5.388  -6.570  10.225
  206    HA   LYS  26           HA       LYS  26   2.594  -5.781  10.569
  207   1HB   LYS  26          1HB       LYS  26   4.922  -4.992  12.318
  208   2HB   LYS  26          2HB       LYS  26   3.534  -3.940  12.130
  209   1HG   LYS  26          1HG       LYS  26   2.695  -6.712  12.617
  210   2HG   LYS  26          2HG       LYS  26   3.763  -6.147  13.886
  211   1HD   LYS  26          1HD       LYS  26   2.325  -4.338  14.472
  212   2HD   LYS  26          2HD       LYS  26   1.476  -4.391  12.941
  213   1HE   LYS  26          1HE       LYS  26  -0.067  -5.416  14.401
  214   2HE   LYS  26          2HE       LYS  26   0.727  -6.799  13.673
  215   1HZ   LYS  26          1HZ       LYS  26   2.294  -6.618  15.641
  216   2HZ   LYS  26          2HZ       LYS  26   1.159  -5.669  16.331
  217   3HZ   LYS  26          3HZ       LYS  26   0.798  -7.208  15.922
  218    H    VAL  27           H        VAL  27   2.022  -3.872   9.480
  219    HA   VAL  27           HA       VAL  27   3.588  -3.265   7.237
  220    HB   VAL  27           HB       VAL  27   1.118  -3.094   7.443
  221   1HG1  VAL  27          1HG1      VAL  27   0.264  -0.865   8.366
  222   2HG1  VAL  27          2HG1      VAL  27   0.756  -2.095   9.555
  223   3HG1  VAL  27          3HG1      VAL  27   1.837  -0.729   9.188
  224   1HG2  VAL  27          1HG2      VAL  27   1.812  -2.075   5.507
  225   2HG2  VAL  27          2HG2      VAL  27   1.081  -0.679   6.335
  226   3HG2  VAL  27          3HG2      VAL  27   2.847  -0.904   6.359
  227    H    SER  28           H        SER  28   3.341  -1.882  10.517
  228    HA   SER  28           HA       SER  28   4.665   0.497   9.904
  229   1HB   SER  28          1HB       SER  28   5.175   0.317  12.512
  230   2HB   SER  28          2HB       SER  28   3.554   0.641  11.931
  231    HG   SER  28           HG       SER  28   4.427  -2.070  12.331
  232    H    ASP  29           H        ASP  29   5.716  -2.814  10.351
  233    HA   ASP  29           HA       ASP  29   8.328  -2.211  11.200
  234   1HB   ASP  29          1HB       ASP  29   6.759  -4.504  10.922
  235   2HB   ASP  29          2HB       ASP  29   7.945  -4.713   9.649
  236    H    VAL  30           H        VAL  30   6.730  -3.068   8.052
  237    HA   VAL  30           HA       VAL  30   9.142  -2.924   6.559
  238    HB   VAL  30           HB       VAL  30   6.224  -2.908   5.768
  239   1HG1  VAL  30          1HG1      VAL  30   7.470  -1.928   3.960
  240   2HG1  VAL  30          2HG1      VAL  30   8.723  -3.188   4.069
  241   3HG1  VAL  30          3HG1      VAL  30   7.084  -3.608   3.515
  242   1HG2  VAL  30          1HG2      VAL  30   6.762  -4.959   6.872
  243   2HG2  VAL  30          2HG2      VAL  30   6.742  -5.294   5.124
  244   3HG2  VAL  30          3HG2      VAL  30   8.293  -5.114   5.978
  245    H    LEU  31           H        LEU  31   6.653  -0.636   7.630
  246    HA   LEU  31           HA       LEU  31   7.035   1.369   5.769
  247   1HB   LEU  31          1HB       LEU  31   5.658   0.976   8.197
  248   2HB   LEU  31          2HB       LEU  31   6.606   2.435   8.407
  249    HG   LEU  31           HG       LEU  31   5.576   3.044   6.033
  250   1HD1  LEU  31          1HD1      LEU  31   3.471   2.158   5.547
  251   2HD1  LEU  31          2HD1      LEU  31   4.444   0.736   5.994
  252   3HD1  LEU  31          3HD1      LEU  31   3.295   1.431   7.162
  253   1HD2  LEU  31          1HD2      LEU  31   5.353   4.270   8.206
  254   2HD2  LEU  31          2HD2      LEU  31   3.930   4.373   7.141
  255   3HD2  LEU  31          3HD2      LEU  31   3.911   3.284   8.549
  256    H    LYS  32           H        LYS  32   8.692   0.879   8.965
  257    HA   LYS  32           HA       LYS  32  10.423   3.035   8.688
  258   1HB   LYS  32          1HB       LYS  32  11.320   2.320  10.653
  259   2HB   LYS  32          2HB       LYS  32   9.822   1.413  10.698
  260   1HG   LYS  32          1HG       LYS  32  11.084  -0.510   9.540
  261   2HG   LYS  32          2HG       LYS  32  12.559   0.394   9.818
  262   1HD   LYS  32          1HD       LYS  32  11.521   0.490  12.336
  263   2HD   LYS  32          2HD       LYS  32  10.783  -1.004  11.794
  264   1HE   LYS  32          1HE       LYS  32  12.739  -2.058  12.261
  265   2HE   LYS  32          2HE       LYS  32  13.462  -1.202  10.914
  266   1HZ   LYS  32          1HZ       LYS  32  14.109  -0.915  13.529
  267   2HZ   LYS  32          2HZ       LYS  32  14.583   0.062  12.310
  268   3HZ   LYS  32          3HZ       LYS  32  13.267   0.445  13.199
  269    H    LEU  33           H        LEU  33  10.520  -0.293   7.406
  270    HA   LEU  33           HA       LEU  33  13.197  -0.387   6.708
  271   1HB   LEU  33          1HB       LEU  33  10.743  -1.823   6.116
  272   2HB   LEU  33          2HB       LEU  33  11.803  -1.760   4.722
  273    HG   LEU  33           HG       LEU  33  12.430  -2.892   7.457
  274   1HD1  LEU  33          1HD1      LEU  33  11.492  -4.007   4.943
  275   2HD1  LEU  33          2HD1      LEU  33  13.014  -4.761   5.476
  276   3HD1  LEU  33          3HD1      LEU  33  11.600  -4.749   6.558
  277   1HD2  LEU  33          1HD2      LEU  33  14.247  -1.948   5.323
  278   2HD2  LEU  33          2HD2      LEU  33  14.525  -2.164   7.068
  279   3HD2  LEU  33          3HD2      LEU  33  14.592  -3.568   5.976
  280    H    PHE  34           H        PHE  34  10.353   1.011   4.987
  281    HA   PHE  34           HA       PHE  34  11.984   1.781   2.758
  282   1HB   PHE  34          1HB       PHE  34   9.119   2.057   3.749
  283   2HB   PHE  34          2HB       PHE  34   9.637   3.133   2.467
  284    HD1  PHE  34           1HD      PHE  34  10.055   2.303   0.240
  285    HD2  PHE  34           2HD      PHE  34   8.972  -0.362   3.359
  286    HE1  PHE  34           1HE      PHE  34   9.590   0.510  -1.454
  287    HE2  PHE  34           2HE      PHE  34   8.506  -2.155   1.666
  288    HZ   PHE  34           HZ       PHE  34   8.821  -1.697  -0.721
  289    H    GLU  35           H        GLU  35  11.381   3.017   5.912
  290    HA   GLU  35           HA       GLU  35  11.607   5.759   5.109
  291   1HB   GLU  35          1HB       GLU  35  11.587   4.510   7.893
  292   2HB   GLU  35          2HB       GLU  35  11.456   6.223   7.547
  293   1HG   GLU  35          1HG       GLU  35   9.497   4.657   6.005
  294   2HG   GLU  35          2HG       GLU  35   9.328   4.382   7.727
  295    H    ASP  36           H        ASP  36  13.510   3.447   7.181
  296    HA   ASP  36           HA       ASP  36  15.832   5.094   6.553
  297   1HB   ASP  36          1HB       ASP  36  14.824   3.918   9.042
  298   2HB   ASP  36          2HB       ASP  36  16.456   3.365   8.719
  299    H    GLY  37           H        GLY  37  14.344   1.851   6.763
  300   1HA   GLY  37          1HA       GLY  37  16.488   0.158   6.491
  301   2HA   GLY  37          2HA       GLY  37  14.894  -0.115   5.817
  302    H    GLU  38           H        GLU  38  16.525  -1.257   4.212
  303    HA   GLU  38           HA       GLU  38  17.948   0.444   2.485
  304   1HB   GLU  38          1HB       GLU  38  17.273  -2.470   2.619
  305   2HB   GLU  38          2HB       GLU  38  17.700  -1.847   1.037
  306   1HG   GLU  38          1HG       GLU  38  19.577  -0.732   2.904
  307   2HG   GLU  38          2HG       GLU  38  19.442  -2.439   3.280
  308    H    MET  39           H        MET  39  14.621  -0.733   2.664
  309    HA   MET  39           HA       MET  39  13.954  -0.429  -0.011
  310   1HB   MET  39          1HB       MET  39  12.487  -0.467   2.643
  311   2HB   MET  39          2HB       MET  39  11.584   0.029   1.225
  312   1HG   MET  39          1HG       MET  39  11.424  -2.447   1.692
  313   2HG   MET  39          2HG       MET  39  12.043  -2.086   0.093
  314   1HE   MET  39          1HE       MET  39  15.550  -2.638  -0.012
  315   2HE   MET  39          2HE       MET  39  14.475  -3.973  -0.492
  316   3HE   MET  39          3HE       MET  39  13.972  -2.286  -0.756
  317    H    ALA  40           H        ALA  40  14.907   1.916   2.280
  318    HA   ALA  40           HA       ALA  40  13.193   4.026   1.378
  319   1HB   ALA  40          1HB       ALA  40  14.495   5.389   2.892
  320   2HB   ALA  40          2HB       ALA  40  14.203   3.822   3.683
  321   3HB   ALA  40          3HB       ALA  40  15.790   4.169   2.957
  322    H    LYS  41           H        LYS  41  15.634   2.305  -0.112
  323    HA   LYS  41           HA       LYS  41  17.098   4.484  -1.234
  324   1HB   LYS  41          1HB       LYS  41  18.325   2.841  -2.381
  325   2HB   LYS  41          2HB       LYS  41  17.941   2.121  -0.830
  326   1HG   LYS  41          1HG       LYS  41  16.174   0.770  -1.778
  327   2HG   LYS  41          2HG       LYS  41  16.177   1.682  -3.275
  328   1HD   LYS  41          1HD       LYS  41  17.407  -0.208  -3.904
  329   2HD   LYS  41          2HD       LYS  41  18.695   0.894  -3.461
  330   1HE   LYS  41          1HE       LYS  41  18.803  -0.120  -1.185
  331   2HE   LYS  41          2HE       LYS  41  17.484  -1.200  -1.592
  332   1HZ   LYS  41          1HZ       LYS  41  18.849  -2.497  -2.737
  333   2HZ   LYS  41          2HZ       LYS  41  19.621  -1.263  -3.476
  334   3HZ   LYS  41          3HZ       LYS  41  20.074  -1.729  -1.978
  335    H    TYR  42           H        TYR  42  13.996   3.049  -1.763
  336    HA   TYR  42           HA       TYR  42  13.888   4.351  -4.402
  337   1HB   TYR  42          1HB       TYR  42  12.649   1.821  -3.176
  338   2HB   TYR  42          2HB       TYR  42  11.951   2.545  -4.611
  339    HD1  TYR  42           1HD      TYR  42  14.425   3.361  -6.085
  340    HD2  TYR  42           2HD      TYR  42  13.507  -0.226  -3.942
  341    HE1  TYR  42           1HE      TYR  42  16.069   2.068  -7.531
  342    HE2  TYR  42           2HE      TYR  42  15.154  -1.507  -5.394
  343    HH   TYR  42           HH       TYR  42  16.319  -0.340  -8.256
  344    H    VAL  43           H        VAL  43  13.455   5.724  -1.890
  345    HA   VAL  43           HA       VAL  43  10.556   6.158  -2.107
  346    HB   VAL  43           HB       VAL  43  12.363   6.022   0.293
  347   1HG1  VAL  43          1HG1      VAL  43   9.618   7.320   0.210
  348   2HG1  VAL  43          2HG1      VAL  43  10.608   7.033   1.661
  349   3HG1  VAL  43          3HG1      VAL  43  11.165   8.176   0.415
  350   1HG2  VAL  43          1HG2      VAL  43   9.795   4.918   0.758
  351   2HG2  VAL  43          2HG2      VAL  43  10.304   4.371  -0.858
  352   3HG2  VAL  43          3HG2      VAL  43  11.340   4.058   0.555
  353    H    GLN  44           H        GLN  44   9.890   8.266  -2.419
  354    HA   GLN  44           HA       GLN  44  12.077  10.163  -2.697
  355   1HB   GLN  44          1HB       GLN  44   9.317  10.007  -3.965
  356   2HB   GLN  44          2HB       GLN  44  10.298  11.457  -4.061
  357   1HG   GLN  44          1HG       GLN  44  12.041   9.312  -4.756
  358   2HG   GLN  44          2HG       GLN  44  10.533   8.976  -5.584
  359   1HE2  GLN  44          1HE2      GLN  44   9.564  10.682  -6.864
  360   2HE2  GLN  44          2HE2      GLN  44  10.567  11.829  -7.689
  361    H    GLY  45           H        GLY  45  12.165  10.633  -0.384
  362   1HA   GLY  45          1HA       GLY  45  11.736  12.100   1.287
  363   2HA   GLY  45          2HA       GLY  45  10.407  12.769   0.362
  364    H    ASP  46           H        ASP  46   8.291  12.181   0.839
  365    HA   ASP  46           HA       ASP  46   8.055  10.104   2.873
  366   1HB   ASP  46          1HB       ASP  46   6.756  12.791   2.514
  367   2HB   ASP  46          2HB       ASP  46   5.740  11.513   3.151
  368    H    ALA  47           H        ALA  47   7.923  10.210  -0.264
  369    HA   ALA  47           HA       ALA  47   5.390   8.765  -0.453
  370   1HB   ALA  47          1HB       ALA  47   5.286  11.258  -1.233
  371   2HB   ALA  47          2HB       ALA  47   6.235  10.687  -2.627
  372   3HB   ALA  47          3HB       ALA  47   4.628   9.994  -2.300
  373    H    ILE  48           H        ILE  48   5.440   7.031  -1.943
  374    HA   ILE  48           HA       ILE  48   8.094   6.559  -3.113
  375    HB   ILE  48           HB       ILE  48   7.780   5.109  -1.235
  376   1HG1  ILE  48          1HG1      ILE  48   7.331   3.556  -3.801
  377   2HG1  ILE  48          2HG1      ILE  48   8.869   4.224  -3.291
  378   1HG2  ILE  48          1HG2      ILE  48   5.624   4.804  -0.648
  379   2HG2  ILE  48          2HG2      ILE  48   5.044   4.826  -2.330
  380   3HG2  ILE  48          3HG2      ILE  48   5.777   3.349  -1.662
  381   1HD1  ILE  48          1HD1      ILE  48   9.247   2.405  -2.003
  382   2HD1  ILE  48          2HD1      ILE  48   7.774   2.753  -1.066
  383   3HD1  ILE  48          3HD1      ILE  48   7.683   1.728  -2.518
  384    H    GLY  49           H        GLY  49   8.125   5.430  -5.170
  385   1HA   GLY  49          1HA       GLY  49   5.947   6.245  -6.861
  386   2HA   GLY  49          2HA       GLY  49   7.427   5.432  -7.331
  387    H    TYR  50           H        TYR  50   5.510   4.380  -8.704
  388    HA   TYR  50           HA       TYR  50   3.921   2.459  -7.332
  389   1HB   TYR  50          1HB       TYR  50   3.191   3.413  -9.464
  390   2HB   TYR  50          2HB       TYR  50   4.761   3.149 -10.198
  391    HD1  TYR  50           1HD      TYR  50   5.287   1.095 -11.303
  392    HD2  TYR  50           2HD      TYR  50   1.669   1.446  -9.046
  393    HE1  TYR  50           1HE      TYR  50   4.450  -1.094 -12.289
  394    HE2  TYR  50           2HE      TYR  50   0.845  -0.744 -10.039
  395    HH   TYR  50           HH       TYR  50   1.188  -2.119 -11.892
  396    H    GLU  51           H        GLU  51   6.808   2.242  -9.531
  397    HA   GLU  51           HA       GLU  51   7.039  -0.483  -9.423
  398   1HB   GLU  51          1HB       GLU  51   8.287   1.303 -10.869
  399   2HB   GLU  51          2HB       GLU  51   9.446   1.362  -9.556
  400   1HG   GLU  51          1HG       GLU  51   8.628  -1.198 -11.010
  401   2HG   GLU  51          2HG       GLU  51  10.066  -0.270 -11.384
  402    H    GLY  52           H        GLY  52   8.682   2.029  -7.373
  403   1HA   GLY  52          1HA       GLY  52  10.170   0.343  -5.765
  404   2HA   GLY  52          2HA       GLY  52   9.548   1.915  -5.303
  405    H    PHE  53           H        PHE  53   6.674   1.100  -5.724
  406    HA   PHE  53           HA       PHE  53   6.174   0.222  -3.113
  407   1HB   PHE  53          1HB       PHE  53   4.814   1.448  -5.176
  408   2HB   PHE  53          2HB       PHE  53   4.193  -0.180  -5.368
  409    HD1  PHE  53           1HD      PHE  53   4.289   2.754  -3.180
  410    HD2  PHE  53           2HD      PHE  53   2.731  -1.159  -3.702
  411    HE1  PHE  53           1HE      PHE  53   2.611   3.180  -1.362
  412    HE2  PHE  53           2HE      PHE  53   1.053  -0.733  -1.884
  413    HZ   PHE  53           HZ       PHE  53   1.013   1.431  -0.736
  414    H    GLN  54           H        GLN  54   6.685  -1.479  -6.180
  415    HA   GLN  54           HA       GLN  54   5.346  -3.804  -5.643
  416   1HB   GLN  54          1HB       GLN  54   8.023  -3.621  -7.086
  417   2HB   GLN  54          2HB       GLN  54   6.768  -4.820  -7.335
  418   1HG   GLN  54          1HG       GLN  54   5.645  -2.145  -7.644
  419   2HG   GLN  54          2HG       GLN  54   7.060  -2.311  -8.664
  420   1HE2  GLN  54          1HE2      GLN  54   5.725  -2.215 -10.488
  421   2HE2  GLN  54          2HE2      GLN  54   4.803  -3.575 -11.037
  422    H    GLN  55           H        GLN  55   8.674  -2.765  -4.703
  423    HA   GLN  55           HA       GLN  55   9.496  -5.168  -3.659
  424   1HB   GLN  55          1HB       GLN  55  10.306  -2.331  -3.481
  425   2HB   GLN  55          2HB       GLN  55  10.729  -3.252  -2.051
  426   1HG   GLN  55          1HG       GLN  55  11.341  -4.875  -4.361
  427   2HG   GLN  55          2HG       GLN  55  12.009  -3.278  -4.636
  428   1HE2  GLN  55          1HE2      GLN  55  11.512  -5.311  -1.750
  429   2HE2  GLN  55          2HE2      GLN  55  13.145  -5.276  -1.174
  430    H    PHE  56           H        PHE  56   7.347  -2.655  -2.348
  431    HA   PHE  56           HA       PHE  56   7.468  -3.300   0.335
  432   1HB   PHE  56          1HB       PHE  56   6.239  -1.423  -1.089
  433   2HB   PHE  56          2HB       PHE  56   4.938  -2.587  -1.243
  434    HD1  PHE  56           1HD      PHE  56   6.302  -0.002   0.750
  435    HD2  PHE  56           2HD      PHE  56   3.989  -3.553   0.978
  436    HE1  PHE  56           1HE      PHE  56   5.373   0.745   2.958
  437    HE2  PHE  56           2HE      PHE  56   3.061  -2.806   3.187
  438    HZ   PHE  56           HZ       PHE  56   3.763  -0.666   4.151
  439    H    LEU  57           H        LEU  57   5.212  -4.545  -2.230
  440    HA   LEU  57           HA       LEU  57   3.868  -6.297  -0.508
  441   1HB   LEU  57          1HB       LEU  57   4.200  -6.188  -3.501
  442   2HB   LEU  57          2HB       LEU  57   3.214  -7.397  -2.703
  443    HG   LEU  57           HG       LEU  57   2.620  -4.615  -1.907
  444   1HD1  LEU  57          1HD1      LEU  57   1.257  -5.019  -4.393
  445   2HD1  LEU  57          2HD1      LEU  57   2.321  -3.682  -3.894
  446   3HD1  LEU  57          3HD1      LEU  57   3.013  -5.129  -4.666
  447   1HD2  LEU  57          1HD2      LEU  57   0.620  -6.545  -3.007
  448   2HD2  LEU  57          2HD2      LEU  57   1.390  -6.903  -1.443
  449   3HD2  LEU  57          3HD2      LEU  57   0.481  -5.388  -1.661
  450    H    LYS  58           H        LYS  58   7.018  -6.406  -2.040
  451    HA   LYS  58           HA       LYS  58   7.283  -9.220  -2.068
  452   1HB   LYS  58          1HB       LYS  58   8.689  -7.074  -3.079
  453   2HB   LYS  58          2HB       LYS  58   9.748  -7.637  -1.802
  454   1HG   LYS  58          1HG       LYS  58   9.973  -9.800  -2.756
  455   2HG   LYS  58          2HG       LYS  58   8.507  -9.645  -3.704
  456   1HD   LYS  58          1HD       LYS  58  10.771  -7.717  -4.240
  457   2HD   LYS  58          2HD       LYS  58  10.921  -9.361  -4.829
  458   1HE   LYS  58          1HE       LYS  58   9.703  -8.690  -6.632
  459   2HE   LYS  58          2HE       LYS  58   8.309  -8.694  -5.569
  460   1HZ   LYS  58          1HZ       LYS  58  10.087  -6.386  -5.958
  461   2HZ   LYS  58          2HZ       LYS  58   8.641  -6.582  -6.691
  462   3HZ   LYS  58          3HZ       LYS  58   8.717  -6.407  -5.069
  463    H    ILE  59           H        ILE  59   8.639  -6.682   0.159
  464    HA   ILE  59           HA       ILE  59   9.470  -8.641   2.033
  465    HB   ILE  59           HB       ILE  59   9.182  -5.641   2.198
  466   1HG1  ILE  59          1HG1      ILE  59  11.742  -7.222   1.981
  467   2HG1  ILE  59          2HG1      ILE  59  10.834  -6.769   0.552
  468   1HG2  ILE  59          1HG2      ILE  59  10.447  -5.690   4.227
  469   2HG2  ILE  59          2HG2      ILE  59   9.047  -6.771   4.426
  470   3HG2  ILE  59          3HG2      ILE  59  10.662  -7.453   4.119
  471   1HD1  ILE  59          1HD1      ILE  59  12.534  -5.112   2.268
  472   2HD1  ILE  59          2HD1      ILE  59  11.901  -4.770   0.640
  473   3HD1  ILE  59          3HD1      ILE  59  10.914  -4.400   2.074
  474    H    TYR  60           H        TYR  60   6.677  -6.356   1.797
  475    HA   TYR  60           HA       TYR  60   5.501  -6.712   4.196
  476   1HB   TYR  60          1HB       TYR  60   4.650  -5.297   2.329
  477   2HB   TYR  60          2HB       TYR  60   4.399  -6.708   1.322
  478    HD1  TYR  60           1HD      TYR  60   3.459  -7.071   4.810
  479    HD2  TYR  60           2HD      TYR  60   2.074  -5.822   0.959
  480    HE1  TYR  60           1HE      TYR  60   1.053  -7.223   5.618
  481    HE2  TYR  60           2HE      TYR  60  -0.327  -5.979   1.780
  482    HH   TYR  60           HH       TYR  60  -1.596  -7.037   3.433
  483    H    LEU  61           H        LEU  61   4.466  -8.677   1.318
  484    HA   LEU  61           HA       LEU  61   3.450 -10.682   3.124
  485   1HB   LEU  61          1HB       LEU  61   3.483 -10.968   0.151
  486   2HB   LEU  61          2HB       LEU  61   2.303 -11.530   1.317
  487    HG   LEU  61           HG       LEU  61   2.397  -8.648   1.370
  488   1HD1  LEU  61          1HD1      LEU  61   1.236  -8.867  -1.141
  489   2HD1  LEU  61          2HD1      LEU  61   2.811  -8.132  -0.756
  490   3HD1  LEU  61          3HD1      LEU  61   2.725  -9.834  -1.270
  491   1HD2  LEU  61          1HD2      LEU  61   0.518  -9.894   2.191
  492   2HD2  LEU  61          2HD2      LEU  61  -0.014  -8.919   0.800
  493   3HD2  LEU  61          3HD2      LEU  61   0.272 -10.666   0.606
  494    H    GLU  62           H        GLU  62   6.488  -9.917   2.360
  495    HA   GLU  62           HA       GLU  62   8.373 -10.967   2.032
  496   1HB   GLU  62          1HB       GLU  62   8.785 -12.891   3.472
  497   2HB   GLU  62          2HB       GLU  62   7.728 -11.773   4.310
  498   1HG   GLU  62          1HG       GLU  62   5.800 -13.136   3.969
  499   2HG   GLU  62          2HG       GLU  62   6.549 -14.034   2.663
  500    H    VAL  63           H        VAL  63   6.204 -11.405  -0.026
  501    HA   VAL  63           HA       VAL  63   6.541 -14.099  -0.925
  502    HB   VAL  63           HB       VAL  63   5.315 -13.180  -2.933
  503   1HG1  VAL  63          1HG1      VAL  63   4.131 -12.897  -0.154
  504   2HG1  VAL  63          2HG1      VAL  63   3.171 -12.862  -1.653
  505   3HG1  VAL  63          3HG1      VAL  63   4.088 -14.324  -1.218
  506   1HG2  VAL  63          1HG2      VAL  63   4.876 -10.710  -1.245
  507   2HG2  VAL  63          2HG2      VAL  63   6.155 -10.795  -2.480
  508   3HG2  VAL  63          3HG2      VAL  63   4.450 -10.989  -2.951
  509    H    ASP  64           H        ASP  64   7.395 -14.575  -3.176
  510    HA   ASP  64           HA       ASP  64   9.903 -13.163  -3.425
  511   1HB   ASP  64          1HB       ASP  64   9.719 -15.720  -3.318
  512   2HB   ASP  64          2HB       ASP  64   8.949 -15.665  -4.891
  513    H    ASN  65           H        ASN  65   6.750 -13.061  -4.648
  514    HA   ASN  65           HA       ASN  65   7.438 -11.340  -6.715
  515   1HB   ASN  65          1HB       ASN  65   6.123 -13.092  -8.408
  516   2HB   ASN  65          2HB       ASN  65   7.864 -12.890  -8.365
  517   1HD2  ASN  65          1HD2      ASN  65   5.150 -14.854  -7.466
  518   2HD2  ASN  65          2HD2      ASN  65   6.010 -16.268  -6.955
  519    H    VAL  66           H        VAL  66   5.674  -9.950  -6.547
  520    HA   VAL  66           HA       VAL  66   3.136 -11.090  -5.670
  521    HB   VAL  66           HB       VAL  66   4.593  -8.837  -4.953
  522   1HG1  VAL  66          1HG1      VAL  66   2.085  -7.872  -6.350
  523   2HG1  VAL  66          2HG1      VAL  66   3.373  -6.903  -5.597
  524   3HG1  VAL  66          3HG1      VAL  66   3.698  -7.802  -7.098
  525   1HG2  VAL  66          1HG2      VAL  66   2.080 -10.146  -4.274
  526   2HG2  VAL  66          2HG2      VAL  66   3.263  -9.330  -3.223
  527   3HG2  VAL  66          3HG2      VAL  66   1.993  -8.384  -4.036
  528    HA   PRO  67           HA       PRO  67   1.423 -10.608  -9.609
  529   1HB   PRO  67          1HB       PRO  67  -1.243 -10.533  -9.011
  530   2HB   PRO  67          2HB       PRO  67  -0.322 -12.021  -9.099
  531   1HG   PRO  67          1HG       PRO  67  -1.288 -10.579  -6.707
  532   2HG   PRO  67          2HG       PRO  67  -0.755 -12.243  -6.845
  533   1HD   PRO  67          1HD       PRO  67   0.727 -10.052  -5.734
  534   2HD   PRO  67          2HD       PRO  67   1.302 -11.690  -5.978
  535    H    ARG  68           H        ARG  68   1.145  -9.070 -11.130
  536    HA   ARG  68           HA       ARG  68   1.199  -6.456 -10.182
  537   1HB   ARG  68          1HB       ARG  68   1.226  -7.847 -12.789
  538   2HB   ARG  68          2HB       ARG  68   0.378  -6.316 -12.876
  539   1HG   ARG  68          1HG       ARG  68   2.445  -5.339 -11.582
  540   2HG   ARG  68          2HG       ARG  68   3.258  -6.821 -12.045
  541   1HD   ARG  68          1HD       ARG  68   1.837  -5.593 -14.321
  542   2HD   ARG  68          2HD       ARG  68   3.014  -4.501 -13.619
  543    HE   ARG  68           HE       ARG  68   3.583  -6.958 -15.082
  544   1HH1  ARG  68          2HH2      ARG  68   4.815  -4.764 -12.623
  545   2HH1  ARG  68          1HH2      ARG  68   6.471  -5.203 -12.878
  546   1HH2  ARG  68          2HH1      ARG  68   5.767  -7.538 -15.420
  547   2HH2  ARG  68          1HH1      ARG  68   7.016  -6.792 -14.480
  548    H    HIS  69           H        HIS  69  -1.392  -8.702 -10.980
  549    HA   HIS  69           HA       HIS  69  -3.393  -6.906 -11.657
  550   1HB   HIS  69          1HB       HIS  69  -3.122  -9.696 -11.121
  551   2HB   HIS  69          2HB       HIS  69  -4.478  -9.109 -10.179
  552    HD1  HIS  69           1HD      HIS  69  -6.106 -10.459 -11.754
  553    HD2  HIS  69           2HD      HIS  69  -3.942  -7.408 -13.653
  554    HE1  HIS  69           1HE      HIS  69  -7.225 -10.091 -14.017
  555    H    LEU  70           H        LEU  70  -2.423  -8.267  -8.439
  556    HA   LEU  70           HA       LEU  70  -4.371  -6.766  -7.039
  557   1HB   LEU  70          1HB       LEU  70  -3.753  -8.634  -5.901
  558   2HB   LEU  70          2HB       LEU  70  -2.071  -8.526  -6.381
  559    HG   LEU  70           HG       LEU  70  -1.980  -6.458  -4.805
  560   1HD1  LEU  70          1HD1      LEU  70  -4.302  -7.857  -3.477
  561   2HD1  LEU  70          2HD1      LEU  70  -3.558  -6.292  -3.070
  562   3HD1  LEU  70          3HD1      LEU  70  -4.519  -6.460  -4.559
  563   1HD2  LEU  70          1HD2      LEU  70  -2.301  -8.835  -3.101
  564   2HD2  LEU  70          2HD2      LEU  70  -1.271  -9.082  -4.532
  565   3HD2  LEU  70          3HD2      LEU  70  -0.887  -7.788  -3.371
  566    H    SER  71           H        SER  71  -0.905  -6.288  -7.882
  567    HA   SER  71           HA       SER  71  -0.445  -4.112  -6.291
  568   1HB   SER  71          1HB       SER  71   0.837  -5.461  -8.487
  569   2HB   SER  71          2HB       SER  71   0.905  -3.741  -8.812
  570    HG   SER  71           HG       SER  71   2.625  -4.920  -7.360
  571    H    LEU  72           H        LEU  72  -2.188  -4.423  -9.385
  572    HA   LEU  72           HA       LEU  72  -2.224  -1.644  -9.956
  573   1HB   LEU  72          1HB       LEU  72  -3.047  -4.094 -11.171
  574   2HB   LEU  72          2HB       LEU  72  -4.413  -2.997 -11.165
  575    HG   LEU  72           HG       LEU  72  -2.951  -2.952 -13.222
  576   1HD1  LEU  72          1HD1      LEU  72  -4.528  -1.167 -12.742
  577   2HD1  LEU  72          2HD1      LEU  72  -3.328  -0.353 -11.709
  578   3HD1  LEU  72          3HD1      LEU  72  -3.038  -0.506 -13.459
  579   1HD2  LEU  72          1HD2      LEU  72  -0.816  -2.029 -13.230
  580   2HD2  LEU  72          2HD2      LEU  72  -1.014  -1.295 -11.621
  581   3HD2  LEU  72          3HD2      LEU  72  -0.812  -3.057 -11.777
  582    H    ALA  73           H        ALA  73  -4.530  -3.964  -8.410
  583    HA   ALA  73           HA       ALA  73  -6.471  -1.944  -7.934
  584   1HB   ALA  73          1HB       ALA  73  -6.025  -4.818  -7.147
  585   2HB   ALA  73          2HB       ALA  73  -7.260  -3.861  -6.293
  586   3HB   ALA  73          3HB       ALA  73  -7.370  -4.086  -8.055
  587    H    LEU  74           H        LEU  74  -3.469  -2.901  -6.440
  588    HA   LEU  74           HA       LEU  74  -4.120  -2.084  -3.804
  589   1HB   LEU  74          1HB       LEU  74  -1.730  -2.961  -5.305
  590   2HB   LEU  74          2HB       LEU  74  -1.421  -1.919  -3.931
  591    HG   LEU  74           HG       LEU  74  -3.062  -4.458  -3.765
  592   1HD1  LEU  74          1HD1      LEU  74  -1.115  -5.578  -2.877
  593   2HD1  LEU  74          2HD1      LEU  74  -0.743  -4.932  -4.494
  594   3HD1  LEU  74          3HD1      LEU  74  -0.141  -4.096  -3.042
  595   1HD2  LEU  74          1HD2      LEU  74  -1.892  -3.837  -1.292
  596   2HD2  LEU  74          2HD2      LEU  74  -2.524  -2.298  -1.923
  597   3HD2  LEU  74          3HD2      LEU  74  -3.606  -3.701  -1.751
  598    H    PHE  75           H        PHE  75  -2.369  -0.534  -6.575
  599    HA   PHE  75           HA       PHE  75  -1.915   1.873  -5.209
  600   1HB   PHE  75          1HB       PHE  75  -1.090   0.683  -7.528
  601   2HB   PHE  75          2HB       PHE  75  -2.354   1.687  -8.211
  602    HD1  PHE  75           1HD      PHE  75  -1.365   3.449  -9.321
  603    HD2  PHE  75           2HD      PHE  75   0.149   2.340  -5.515
  604    HE1  PHE  75           1HE      PHE  75   0.215   5.398  -9.382
  605    HE2  PHE  75           2HE      PHE  75   1.729   4.289  -5.576
  606    HZ   PHE  75           HZ       PHE  75   1.744   5.795  -7.508
  607    H    GLN  76           H        GLN  76  -4.556   0.721  -7.381
  608    HA   GLN  76           HA       GLN  76  -5.801   3.122  -7.758
  609   1HB   GLN  76          1HB       GLN  76  -6.883   0.286  -7.575
  610   2HB   GLN  76          2HB       GLN  76  -7.916   1.641  -7.987
  611   1HG   GLN  76          1HG       GLN  76  -6.702   2.113  -9.997
  612   2HG   GLN  76          2HG       GLN  76  -5.315   1.171  -9.488
  613   1HE2  GLN  76          1HE2      GLN  76  -5.087  -0.659 -10.499
  614   2HE2  GLN  76          2HE2      GLN  76  -6.335  -1.694 -11.108
  615    H    SER  77           H        SER  77  -5.884   0.882  -4.967
  616    HA   SER  77           HA       SER  77  -8.086   1.817  -3.684
  617   1HB   SER  77          1HB       SER  77  -5.430   0.926  -2.475
  618   2HB   SER  77          2HB       SER  77  -6.929   1.064  -1.578
  619    HG   SER  77           HG       SER  77  -6.190  -1.113  -2.654
  620    H    PHE  78           H        PHE  78  -4.655   2.987  -3.380
  621    HA   PHE  78           HA       PHE  78  -5.745   5.586  -2.610
  622   1HB   PHE  78          1HB       PHE  78  -4.114   3.638  -1.070
  623   2HB   PHE  78          2HB       PHE  78  -3.296   5.182  -1.202
  624    HD1  PHE  78           1HD      PHE  78  -4.845   7.279  -0.664
  625    HD2  PHE  78           2HD      PHE  78  -5.560   3.324   0.700
  626    HE1  PHE  78           1HE      PHE  78  -6.242   8.180   1.217
  627    HE2  PHE  78           2HE      PHE  78  -6.957   4.225   2.580
  628    HZ   PHE  78           HZ       PHE  78  -7.281   6.642   2.816
  629    H    GLU  79           H        GLU  79  -4.729   7.303  -3.599
  630    HA   GLU  79           HA       GLU  79  -2.092   6.840  -4.675
  631   1HB   GLU  79          1HB       GLU  79  -4.130   6.388  -6.374
  632   2HB   GLU  79          2HB       GLU  79  -4.070   8.132  -6.538
  633   1HG   GLU  79          1HG       GLU  79  -2.125   8.066  -7.730
  634   2HG   GLU  79          2HG       GLU  79  -1.377   6.940  -6.614
  635    H    THR  80           H        THR  80  -1.906   9.258  -6.187
  636    HA   THR  80           HA       THR  80  -2.938  11.543  -5.183
  637    HB   THR  80           HB       THR  80  -2.338  11.303  -2.937
  638    HG1  THR  80           1HG      THR  80  -0.357  12.555  -2.754
  639   1HG2  THR  80          1HG2      THR  80  -0.305   9.424  -4.052
  640   2HG2  THR  80          2HG2      THR  80   0.257  10.378  -2.658
  641   3HG2  THR  80          3HG2      THR  80  -1.186   9.347  -2.507
  642    H    GLY  81           H        GLY  81  -2.216  13.226  -6.386
  643   1HA   GLY  81          1HA       GLY  81  -0.168  14.324  -7.232
  644   2HA   GLY  81          2HA       GLY  81   0.308  12.759  -7.860
  645    H    HIS  82           H        HIS  82  -2.179  15.351  -8.087
  646    HA   HIS  82           HA       HIS  82  -2.387  14.783 -10.908
  647   1HB   HIS  82          1HB       HIS  82  -4.528  14.173  -8.955
  648   2HB   HIS  82          2HB       HIS  82  -5.041  15.080 -10.364
  649    HD1  HIS  82           1HD      HIS  82  -3.371  13.781 -12.593
  650    HD2  HIS  82           2HD      HIS  82  -5.272  11.610  -9.548
  651    HE1  HIS  82           1HE      HIS  82  -3.688  11.415 -13.493
  652    H    CYS  83           H        CYS  83  -3.976  16.546 -11.909
  653    HA   CYS  83           HA       CYS  83  -4.317  18.914 -10.433
  654   1HB   CYS  83          1HB       CYS  83  -1.756  18.830 -10.845
  655   2HB   CYS  83          2HB       CYS  83  -2.147  19.200 -12.513
  656    HG   CYS  83           HG       CYS  83  -2.576  20.883  -9.735
  657    H    LEU  84           H        LEU  84  -5.788  20.237 -11.578
  658    HA   LEU  84           HA       LEU  84  -6.720  19.095 -14.079
  659   1HB   LEU  84          1HB       LEU  84  -7.839  21.010 -12.056
  660   2HB   LEU  84          2HB       LEU  84  -8.530  20.911 -13.664
  661    HG   LEU  84           HG       LEU  84  -9.795  19.550 -12.111
  662   1HD1  LEU  84          1HD1      LEU  84  -8.655  17.273 -13.484
  663   2HD1  LEU  84          2HD1      LEU  84 -10.220  18.086 -13.725
  664   3HD1  LEU  84          3HD1      LEU  84  -8.769  18.682 -14.566
  665   1HD2  LEU  84          1HD2      LEU  84  -8.071  19.097 -10.457
  666   2HD2  LEU  84          2HD2      LEU  84  -8.823  17.580 -11.007
  667   3HD2  LEU  84          3HD2      LEU  84  -7.213  18.045 -11.608
  668    H    ASN  85           H        ASN  85  -4.158  20.195 -14.319
  669    HA   ASN  85           HA       ASN  85  -4.584  21.943 -16.418
  670   1HB   ASN  85          1HB       ASN  85  -4.805  23.366 -14.087
  671   2HB   ASN  85          2HB       ASN  85  -3.066  23.438 -14.291
  672   1HD2  ASN  85          1HD2      ASN  85  -2.258  24.096 -16.439
  673   2HD2  ASN  85          2HD2      ASN  85  -3.099  25.336 -17.308
  674    H    GLU  86           H        GLU  86  -3.182  19.537 -16.065
  675    HA   GLU  86           HA       GLU  86  -0.608  20.290 -16.882
  676   1HB   GLU  86          1HB       GLU  86  -0.157  20.587 -14.506
  677   2HB   GLU  86          2HB       GLU  86  -0.880  19.038 -14.118
  678   1HG   GLU  86          1HG       GLU  86   1.141  18.053 -14.390
  679   2HG   GLU  86          2HG       GLU  86   1.100  18.480 -16.089
  680    H    THR  87           H        THR  87   0.077  18.736 -18.316
  681    HA   THR  87           HA       THR  87  -1.301  16.139 -18.162
  682    HB   THR  87           HB       THR  87   0.074  17.296 -20.616
  683    HG1  THR  87           1HG      THR  87  -1.469  18.874 -20.487
  684   1HG2  THR  87          1HG2      THR  87  -0.921  14.954 -20.657
  685   2HG2  THR  87          2HG2      THR  87  -2.497  15.673 -20.244
  686   3HG2  THR  87          3HG2      THR  87  -1.712  16.077 -21.790
  687    H    ASN  88           H        ASN  88   0.735  16.391 -16.355
  688    HA   ASN  88           HA       ASN  88   2.726  14.708 -17.640
  689   1HB   ASN  88          1HB       ASN  88   3.544  17.130 -17.203
  690   2HB   ASN  88          2HB       ASN  88   3.397  16.780 -15.492
  691   1HD2  ASN  88          1HD2      ASN  88   5.595  17.066 -15.180
  692   2HD2  ASN  88          2HD2      ASN  88   6.780  15.894 -15.652
  693    H    VAL  89           H        VAL  89   1.639  12.859 -16.650
  694    HA   VAL  89           HA       VAL  89   1.495  12.908 -13.728
  695    HB   VAL  89           HB       VAL  89   0.286  11.033 -15.771
  696   1HG1  VAL  89          1HG1      VAL  89   0.367   9.660 -13.939
  697   2HG1  VAL  89          2HG1      VAL  89   0.376  11.013 -12.783
  698   3HG1  VAL  89          3HG1      VAL  89  -1.143  10.531 -13.576
  699   1HG2  VAL  89          1HG2      VAL  89  -1.799  12.118 -15.392
  700   2HG2  VAL  89          2HG2      VAL  89  -1.144  13.061 -14.032
  701   3HG2  VAL  89          3HG2      VAL  89  -0.609  13.407 -15.693
  702    H    THR  90           H        THR  90   4.083  12.845 -14.930
  703    HA   THR  90           HA       THR  90   4.918  10.081 -15.005
  704    HB   THR  90           HB       THR  90   5.871  11.830 -16.522
  705    HG1  THR  90           1HG      THR  90   8.101  11.220 -15.906
  706   1HG2  THR  90          1HG2      THR  90   5.927  13.459 -14.233
  707   2HG2  THR  90          2HG2      THR  90   7.625  12.963 -14.427
  708   3HG2  THR  90          3HG2      THR  90   6.783  13.793 -15.757
  709    H    LYS  91           H        LYS  91   6.729   9.283 -13.635
  710    HA   LYS  91           HA       LYS  91   7.118   8.565 -11.539
  711   1HB   LYS  91          1HB       LYS  91   8.446  10.284 -10.264
  712   2HB   LYS  91          2HB       LYS  91   8.975   9.987 -11.908
  713   1HG   LYS  91          1HG       LYS  91   8.051  12.037 -12.711
  714   2HG   LYS  91          2HG       LYS  91   6.999  12.217 -11.321
  715   1HD   LYS  91          1HD       LYS  91   9.936  12.114 -10.733
  716   2HD   LYS  91          2HD       LYS  91   9.377  13.537 -11.591
  717   1HE   LYS  91          1HE       LYS  91   7.694  13.984  -9.827
  718   2HE   LYS  91          2HE       LYS  91   8.138  12.509  -8.992
  719   1HZ   LYS  91          1HZ       LYS  91   9.546  15.011  -9.130
  720   2HZ   LYS  91          2HZ       LYS  91   9.480  13.916  -7.919
  721   3HZ   LYS  91          3HZ       LYS  91  10.488  13.677  -9.183
  722    H    ASP  92           H        ASP  92   4.871   8.095 -10.978
  723    HA   ASP  92           HA       ASP  92   3.547  10.155  -9.470
  724   1HB   ASP  92          1HB       ASP  92   2.798   7.354 -10.390
  725   2HB   ASP  92          2HB       ASP  92   1.798   8.216  -9.238
  726    H    VAL  93           H        VAL  93   3.770  10.255  -7.227
  727    HA   VAL  93           HA       VAL  93   4.823   7.856  -5.901
  728    HB   VAL  93           HB       VAL  93   5.617   9.437  -4.181
  729   1HG1  VAL  93          1HG1      VAL  93   7.053  10.741  -6.224
  730   2HG1  VAL  93          2HG1      VAL  93   7.501   9.250  -5.361
  731   3HG1  VAL  93          3HG1      VAL  93   6.595   9.156  -6.890
  732   1HG2  VAL  93          1HG2      VAL  93   3.863  11.202  -4.751
  733   2HG2  VAL  93          2HG2      VAL  93   5.510  11.791  -4.424
  734   3HG2  VAL  93          3HG2      VAL  93   4.924  11.673  -6.101
  735    H    VAL  94           H        VAL  94   4.035   7.536  -3.609
  736    HA   VAL  94           HA       VAL  94   1.356   8.626  -3.203
  737    HB   VAL  94           HB       VAL  94   0.814   6.621  -4.261
  738   1HG1  VAL  94          1HG1      VAL  94   2.929   5.539  -4.454
  739   2HG1  VAL  94          2HG1      VAL  94   3.076   5.357  -2.689
  740   3HG1  VAL  94          3HG1      VAL  94   1.859   4.414  -3.582
  741   1HG2  VAL  94          1HG2      VAL  94  -0.428   6.892  -2.195
  742   2HG2  VAL  94          2HG2      VAL  94  -0.097   5.164  -2.463
  743   3HG2  VAL  94          3HG2      VAL  94   0.860   6.079  -1.273
  744    H    CYS  95           H        CYS  95   0.713   8.684  -0.972
  745    HA   CYS  95           HA       CYS  95   2.939   8.972   0.765
  746   1HB   CYS  95          1HB       CYS  95   0.895  10.428   0.811
  747   2HB   CYS  95          2HB       CYS  95  -0.015   9.074   1.452
  748    HG   CYS  95           HG       CYS  95   0.896  11.027   3.219
  749    H    LEU  96           H        LEU  96   3.633   7.551   2.400
  750    HA   LEU  96           HA       LEU  96   2.691   4.851   2.167
  751   1HB   LEU  96          1HB       LEU  96   4.846   6.191   3.795
  752   2HB   LEU  96          2HB       LEU  96   4.461   4.488   3.947
  753    HG   LEU  96           HG       LEU  96   4.826   5.023   1.171
  754   1HD1  LEU  96          1HD1      LEU  96   7.428   5.697   2.352
  755   2HD1  LEU  96          2HD1      LEU  96   6.604   6.355   0.918
  756   3HD1  LEU  96          3HD1      LEU  96   6.195   6.966   2.539
  757   1HD2  LEU  96          1HD2      LEU  96   6.991   3.683   2.685
  758   2HD2  LEU  96          2HD2      LEU  96   5.356   3.010   2.890
  759   3HD2  LEU  96          3HD2      LEU  96   6.067   3.141   1.263
  760    H    ASN  97           H        ASN  97   2.482   7.571   4.499
  761    HA   ASN  97           HA       ASN  97   1.459   6.165   6.611
  762   1HB   ASN  97          1HB       ASN  97   2.103   8.749   6.244
  763   2HB   ASN  97          2HB       ASN  97   0.385   8.923   5.946
  764   1HD2  ASN  97          1HD2      ASN  97  -0.184  10.018   7.726
  765   2HD2  ASN  97          2HD2      ASN  97  -0.086   9.419   9.348
  766    H    ASP  98           H        ASP  98  -0.011   7.364   3.582
  767    HA   ASP  98           HA       ASP  98  -2.670   7.150   4.412
  768   1HB   ASP  98          1HB       ASP  98  -1.290   7.160   1.700
  769   2HB   ASP  98          2HB       ASP  98  -3.029   6.981   1.821
  770    H    VAL  99           H        VAL  99  -0.368   5.009   2.598
  771    HA   VAL  99           HA       VAL  99  -2.261   2.939   2.197
  772    HB   VAL  99           HB       VAL  99   0.757   3.038   2.059
  773   1HG1  VAL  99          1HG1      VAL  99   0.830   0.894   1.199
  774   2HG1  VAL  99          2HG1      VAL  99  -0.452   0.729   2.421
  775   3HG1  VAL  99          3HG1      VAL  99  -0.879   0.915   0.703
  776   1HG2  VAL  99          1HG2      VAL  99  -1.161   2.903  -0.268
  777   2HG2  VAL  99          2HG2      VAL  99  -0.716   4.457   0.477
  778   3HG2  VAL  99          3HG2      VAL  99   0.542   3.422  -0.242
  779    H    SER 100           H        SER 100   0.110   3.790   4.732
  780    HA   SER 100           HA       SER 100   0.088   1.317   5.996
  781   1HB   SER 100          1HB       SER 100   1.493   2.329   7.492
  782   2HB   SER 100          2HB       SER 100   1.513   3.612   6.298
  783    HG   SER 100           HG       SER 100   0.951   4.730   8.091
  784    H    CYS 101           H        CYS 101  -2.185   4.013   5.914
  785    HA   CYS 101           HA       CYS 101  -3.503   3.310   8.337
  786   1HB   CYS 101          1HB       CYS 101  -3.416   5.613   7.085
  787   2HB   CYS 101          2HB       CYS 101  -4.765   4.974   6.167
  788    HG   CYS 101           HG       CYS 101  -4.659   4.632   9.433
  789    H    TYR 102           H        TYR 102  -4.238   3.056   4.780
  790    HA   TYR 102           HA       TYR 102  -6.617   1.678   4.997
  791   1HB   TYR 102          1HB       TYR 102  -5.344   2.733   2.977
  792   2HB   TYR 102          2HB       TYR 102  -4.331   1.303   2.967
  793    HD1  TYR 102           1HD      TYR 102  -7.962   2.248   2.852
  794    HD2  TYR 102           2HD      TYR 102  -4.914  -0.470   1.576
  795    HE1  TYR 102           1HE      TYR 102  -9.636   1.064   1.350
  796    HE2  TYR 102           2HE      TYR 102  -6.598  -1.644   0.078
  797    HH   TYR 102           HH       TYR 102  -8.731  -0.999  -1.081
  798    H    PHE 103           H        PHE 103  -3.225   0.424   4.863
  799    HA   PHE 103           HA       PHE 103  -4.004  -2.280   4.821
  800   1HB   PHE 103          1HB       PHE 103  -1.526  -0.626   5.498
  801   2HB   PHE 103          2HB       PHE 103  -1.489  -2.355   5.781
  802    HD1  PHE 103           1HD      PHE 103   0.382  -2.495   4.174
  803    HD2  PHE 103           2HD      PHE 103  -3.465  -1.161   2.981
  804    HE1  PHE 103           1HE      PHE 103   0.996  -2.875   1.770
  805    HE2  PHE 103           2HE      PHE 103  -2.851  -1.541   0.577
  806    HZ   PHE 103           HZ       PHE 103  -0.628  -2.393   0.000
  807    H    SER 104           H        SER 104  -3.462   0.111   7.411
  808    HA   SER 104           HA       SER 104  -3.088  -1.642   9.493
  809   1HB   SER 104          1HB       SER 104  -2.726   0.784   9.683
  810   2HB   SER 104          2HB       SER 104  -4.435   1.093   9.445
  811    HG   SER 104           HG       SER 104  -4.406  -0.595  11.472
  812    H    LEU 105           H        LEU 105  -5.960  -0.814   7.627
  813    HA   LEU 105           HA       LEU 105  -7.861  -1.593   9.578
  814   1HB   LEU 105          1HB       LEU 105  -7.987  -0.162   7.335
  815   2HB   LEU 105          2HB       LEU 105  -8.458  -1.712   6.665
  816    HG   LEU 105           HG       LEU 105  -9.945  -1.225   9.089
  817   1HD1  LEU 105          1HD1      LEU 105 -11.157   0.757   8.553
  818   2HD1  LEU 105          2HD1      LEU 105  -9.424   1.163   8.516
  819   3HD1  LEU 105          3HD1      LEU 105 -10.316   0.927   6.994
  820   1HD2  LEU 105          1HD2      LEU 105 -11.813  -1.216   7.189
  821   2HD2  LEU 105          2HD2      LEU 105 -10.464  -1.864   6.225
  822   3HD2  LEU 105          3HD2      LEU 105 -10.983  -2.703   7.707
  823    H    LEU 106           H        LEU 106  -6.210  -3.233   6.820
  824    HA   LEU 106           HA       LEU 106  -7.607  -5.583   6.822
  825   1HB   LEU 106          1HB       LEU 106  -5.110  -4.574   5.826
  826   2HB   LEU 106          2HB       LEU 106  -4.880  -6.208   6.416
  827    HG   LEU 106           HG       LEU 106  -7.122  -6.607   4.984
  828   1HD1  LEU 106          1HD1      LEU 106  -7.649  -5.030   3.517
  829   2HD1  LEU 106          2HD1      LEU 106  -6.453  -3.966   4.295
  830   3HD1  LEU 106          3HD1      LEU 106  -5.980  -4.969   2.902
  831   1HD2  LEU 106          1HD2      LEU 106  -4.314  -6.537   3.843
  832   2HD2  LEU 106          2HD2      LEU 106  -5.038  -7.865   4.781
  833   3HD2  LEU 106          3HD2      LEU 106  -5.695  -7.445   3.181
  834    H    GLU 107           H        GLU 107  -4.453  -5.077   8.564
  835    HA   GLU 107           HA       GLU 107  -4.604  -7.394   9.999
  836   1HB   GLU 107          1HB       GLU 107  -2.868  -6.449  11.408
  837   2HB   GLU 107          2HB       GLU 107  -2.596  -5.902   9.766
  838   1HG   GLU 107          1HG       GLU 107  -3.956  -3.785  10.408
  839   2HG   GLU 107          2HG       GLU 107  -3.810  -4.321  12.070
  840    H    GLY 108           H        GLY 108  -6.065  -4.187  10.623
  841   1HA   GLY 108          1HA       GLY 108  -8.037  -5.263  12.340
  842   2HA   GLY 108          2HA       GLY 108  -6.780  -4.502  13.295
  843    H    GLY 109           H        GLY 109  -6.251  -2.197  12.903
  844   1HA   GLY 109          1HA       GLY 109  -7.303  -0.432  11.189
  845   2HA   GLY 109          2HA       GLY 109  -8.657  -0.700  12.270
  846    H    ARG 110           H        ARG 110  -5.684   0.983  11.786
  847    HA   ARG 110           HA       ARG 110  -5.674   1.736  14.597
  848   1HB   ARG 110          1HB       ARG 110  -3.553   0.700  13.526
  849   2HB   ARG 110          2HB       ARG 110  -3.411   2.176  12.593
  850   1HG   ARG 110          1HG       ARG 110  -2.876   3.480  14.457
  851   2HG   ARG 110          2HG       ARG 110  -3.781   2.468  15.566
  852   1HD   ARG 110          1HD       ARG 110  -1.979   0.635  15.065
  853   2HD   ARG 110          2HD       ARG 110  -1.032   1.936  14.371
  854    HE   ARG 110           HE       ARG 110  -2.072   2.514  17.061
  855   1HH1  ARG 110          2HH2      ARG 110   0.596   1.180  15.194
  856   2HH1  ARG 110          1HH2      ARG 110   1.756   1.385  16.465
  857   1HH2  ARG 110          2HH1      ARG 110  -0.543   2.784  18.738
  858   2HH2  ARG 110          1HH1      ARG 110   1.103   2.303  18.494
  859    HA   PRO 111           HA       PRO 111  -7.150   5.458  12.605
  860   1HB   PRO 111          1HB       PRO 111  -8.588   6.403  14.728
  861   2HB   PRO 111          2HB       PRO 111  -9.265   5.343  13.508
  862   1HG   PRO 111          1HG       PRO 111  -8.459   4.701  16.278
  863   2HG   PRO 111          2HG       PRO 111  -9.506   3.798  15.203
  864   1HD   PRO 111          1HD       PRO 111  -6.779   3.192  15.852
  865   2HD   PRO 111          2HD       PRO 111  -7.790   2.357  14.689
  866    H    GLU 112           H        GLU 112  -7.112   7.874  13.201
  867    HA   GLU 112           HA       GLU 112  -5.577   8.722  15.279
  868   1HB   GLU 112          1HB       GLU 112  -3.904   7.311  13.588
  869   2HB   GLU 112          2HB       GLU 112  -3.699   8.944  12.987
  870   1HG   GLU 112          1HG       GLU 112  -3.575   9.403  15.697
  871   2HG   GLU 112          2HG       GLU 112  -2.918   7.780  15.626
  872    H    ASP 113           H        ASP 113  -6.485   9.029  11.840
  873    HA   ASP 113           HA       ASP 113  -7.678  11.466  12.212
  874   1HB   ASP 113          1HB       ASP 113  -5.083  12.024  12.346
  875   2HB   ASP 113          2HB       ASP 113  -5.137  11.846  10.603
  876    H    LYS 114           H        LYS 114  -9.246  11.187  10.619
  877    HA   LYS 114           HA       LYS 114  -8.594   9.615   8.288
  878   1HB   LYS 114          1HB       LYS 114 -11.006   9.747   7.839
  879   2HB   LYS 114          2HB       LYS 114 -10.668   9.162   9.456
  880   1HG   LYS 114          1HG       LYS 114 -11.219  11.300  10.451
  881   2HG   LYS 114          2HG       LYS 114 -11.223  12.106   8.895
  882   1HD   LYS 114          1HD       LYS 114 -13.083   9.882   8.790
  883   2HD   LYS 114          2HD       LYS 114 -13.423  10.828  10.226
  884   1HE   LYS 114          1HE       LYS 114 -14.116  12.670   9.021
  885   2HE   LYS 114          2HE       LYS 114 -12.901  12.449   7.778
  886   1HZ   LYS 114          1HZ       LYS 114 -14.775  10.342   7.761
  887   2HZ   LYS 114          2HZ       LYS 114 -15.524  11.784   7.599
  888   3HZ   LYS 114          3HZ       LYS 114 -14.348  11.353   6.552
  889    H    LEU 115           H        LEU 115  -8.885  10.358   6.089
  890    HA   LEU 115           HA       LEU 115  -8.149  13.156   5.852
  891   1HB   LEU 115          1HB       LEU 115  -7.838  10.695   4.238
  892   2HB   LEU 115          2HB       LEU 115  -8.060  12.181   3.336
  893    HG   LEU 115           HG       LEU 115  -6.150  13.033   5.010
  894   1HD1  LEU 115          1HD1      LEU 115  -4.588  10.756   4.794
  895   2HD1  LEU 115          2HD1      LEU 115  -5.333  11.394   6.279
  896   3HD1  LEU 115          3HD1      LEU 115  -6.165  10.135   5.336
  897   1HD2  LEU 115          1HD2      LEU 115  -6.272  12.059   2.302
  898   2HD2  LEU 115          2HD2      LEU 115  -5.279  13.362   2.997
  899   3HD2  LEU 115          3HD2      LEU 115  -4.687  11.683   3.020
  900    H    GLU 116           H        GLU 116  -9.128  14.173   3.657
  901    HA   GLU 116           HA       GLU 116 -11.901  13.462   3.402
  902   1HB   GLU 116          1HB       GLU 116 -11.548  16.382   3.797
  903   2HB   GLU 116          2HB       GLU 116 -12.835  15.327   4.346
  904   1HG   GLU 116          1HG       GLU 116 -11.300  14.424   6.130
  905   2HG   GLU 116          2HG       GLU 116 -10.057  15.541   5.601
  906    H    TRP 117           H        TRP 117 -12.562  13.706   1.287
  907    HA   TRP 117           HA       TRP 117 -10.703  15.154  -0.463
  908   1HB   TRP 117          1HB       TRP 117 -12.739  13.110  -1.326
  909   2HB   TRP 117          2HB       TRP 117 -11.364  13.726  -2.220
  910    HD1  TRP 117           HD       TRP 117  -9.239  13.272   0.310
  911    HE1  TRP 117           1HE      TRP 117  -8.325  10.853   0.838
  912    HE3  TRP 117           3HE      TRP 117 -12.977  10.771  -2.062
  913    HZ2  TRP 117           2HZ      TRP 117  -9.247   8.225   0.218
  914    HZ3  TRP 117           3HZ      TRP 117 -12.895   8.280  -2.054
  915    HH2  TRP 117           HH       TRP 117 -11.113   7.009  -0.966
  916    H    SER 118           H        SER 118 -11.851  17.150   0.454
  917    HA   SER 118           HA       SER 118 -14.567  17.507  -0.047
  918   1HB   SER 118          1HB       SER 118 -13.177  18.840   1.570
  919   2HB   SER 118          2HB       SER 118 -12.379  19.617   0.217
  920    HG   SER 118           HG       SER 118 -14.572  20.340  -0.479
  Start of MODEL    2
    1   1H    MET   1           H        MET   1 -19.131   1.423   6.961
    2    HA   MET   1           HA       MET   1 -18.133   3.135   8.287
    3   1HB   MET   1          1HB       MET   1 -16.792   0.897   7.088
    4   2HB   MET   1          2HB       MET   1 -15.624   2.203   7.087
    5   1HG   MET   1          1HG       MET   1 -15.228   1.765   9.281
    6   2HG   MET   1          2HG       MET   1 -16.840   2.351   9.641
    7   1HE   MET   1          1HE       MET   1 -15.480  -1.977   9.074
    8   2HE   MET   1          2HE       MET   1 -14.809  -0.532   8.279
    9   3HE   MET   1          3HE       MET   1 -14.577  -0.776  10.027
   10    H    ALA   2           H        ALA   2 -16.955   5.090   8.441
   11    HA   ALA   2           HA       ALA   2 -16.773   6.543   5.964
   12   1HB   ALA   2          1HB       ALA   2 -17.713   7.629   7.921
   13   2HB   ALA   2          2HB       ALA   2 -16.254   7.267   8.874
   14   3HB   ALA   2          3HB       ALA   2 -16.169   8.420   7.521
   15    H    LYS   3           H        LYS   3 -15.073   4.521   5.556
   16    HA   LYS   3           HA       LYS   3 -12.498   5.857   5.718
   17   1HB   LYS   3          1HB       LYS   3 -12.782   4.289   7.719
   18   2HB   LYS   3          2HB       LYS   3 -12.753   2.967   6.570
   19   1HG   LYS   3          1HG       LYS   3 -10.485   3.048   6.803
   20   2HG   LYS   3          2HG       LYS   3 -10.560   4.440   5.741
   21   1HD   LYS   3          1HD       LYS   3 -11.001   4.851   8.705
   22   2HD   LYS   3          2HD       LYS   3  -9.366   4.600   8.126
   23   1HE   LYS   3          1HE       LYS   3 -10.016   6.460   6.334
   24   2HE   LYS   3          2HE       LYS   3 -11.271   6.867   7.488
   25   1HZ   LYS   3          1HZ       LYS   3  -8.844   6.514   8.829
   26   2HZ   LYS   3          2HZ       LYS   3  -8.622   7.567   7.601
   27   3HZ   LYS   3          3HZ       LYS   3  -9.768   7.856   8.728
   28    H    GLU   4           H        GLU   4 -11.748   2.786   4.904
   29    HA   GLU   4           HA       GLU   4 -11.472   1.676   3.056
   30   1HB   GLU   4          1HB       GLU   4 -13.988   1.822   2.867
   31   2HB   GLU   4          2HB       GLU   4 -13.799   3.248   1.866
   32   1HG   GLU   4          1HG       GLU   4 -13.493   1.938   0.045
   33   2HG   GLU   4          2HG       GLU   4 -12.058   1.246   0.776
   34    H    ARG   5           H        ARG   5 -10.220   1.836   1.109
   35    HA   ARG   5           HA       ARG   5  -9.905   4.464   0.006
   36   1HB   ARG   5          1HB       ARG   5  -7.808   3.056   1.642
   37   2HB   ARG   5          2HB       ARG   5  -7.251   3.859   0.187
   38   1HG   ARG   5          1HG       ARG   5  -7.181   5.749   1.463
   39   2HG   ARG   5          2HG       ARG   5  -8.921   5.791   1.261
   40   1HD   ARG   5          1HD       ARG   5  -8.480   3.950   3.380
   41   2HD   ARG   5          2HD       ARG   5  -7.357   5.262   3.683
   42    HE   ARG   5           HE       ARG   5 -10.194   5.381   4.034
   43   1HH1  ARG   5          2HH2      ARG   5  -7.556   7.330   2.762
   44   2HH1  ARG   5          1HH2      ARG   5  -8.345   8.838   3.082
   45   1HH2  ARG   5          2HH1      ARG   5 -11.237   7.370   4.457
   46   2HH2  ARG   5          1HH1      ARG   5 -10.453   8.861   4.053
   47    H    GLY   6           H        GLY   6 -10.713   3.589  -1.974
   48   1HA   GLY   6          1HA       GLY   6  -9.969   2.897  -4.099
   49   2HA   GLY   6          2HA       GLY   6  -8.834   1.791  -3.350
   50    H    LEU   7           H        LEU   7 -11.304   1.580  -5.307
   51    HA   LEU   7           HA       LEU   7 -12.934  -0.287  -3.791
   52   1HB   LEU   7          1HB       LEU   7 -13.168   0.931  -6.540
   53   2HB   LEU   7          2HB       LEU   7 -14.235  -0.333  -5.962
   54    HG   LEU   7           HG       LEU   7 -15.212   1.921  -5.765
   55   1HD1  LEU   7          1HD1      LEU   7 -16.270   1.541  -3.748
   56   2HD1  LEU   7          2HD1      LEU   7 -15.627  -0.073  -4.137
   57   3HD1  LEU   7          3HD1      LEU   7 -14.788   0.959  -2.953
   58   1HD2  LEU   7          1HD2      LEU   7 -12.996   3.053  -5.301
   59   2HD2  LEU   7          2HD2      LEU   7 -14.377   3.597  -4.319
   60   3HD2  LEU   7          3HD2      LEU   7 -13.165   2.498  -3.618
   61    H    ILE   8           H        ILE   8 -11.412  -1.980  -3.419
   62    HA   ILE   8           HA       ILE   8 -10.496  -3.312  -5.866
   63    HB   ILE   8           HB       ILE   8  -9.000  -4.522  -4.160
   64   1HG1  ILE   8          1HG1      ILE   8  -9.592  -2.051  -2.511
   65   2HG1  ILE   8          2HG1      ILE   8 -10.296  -3.622  -2.182
   66   1HG2  ILE   8          1HG2      ILE   8  -7.291  -3.107  -4.708
   67   2HG2  ILE   8          2HG2      ILE   8  -8.518  -2.571  -5.880
   68   3HG2  ILE   8          3HG2      ILE   8  -8.246  -1.640  -4.388
   69   1HD1  ILE   8          1HD1      ILE   8  -7.312  -3.509  -2.543
   70   2HD1  ILE   8          2HD1      ILE   8  -7.992  -2.841  -1.040
   71   3HD1  ILE   8          3HD1      ILE   8  -8.287  -4.543  -1.470
   72    H    SER   9           H        SER   9 -11.672  -5.020  -6.525
   73    HA   SER   9           HA       SER   9 -13.830  -5.978  -5.219
   74   1HB   SER   9          1HB       SER   9 -12.396  -6.585  -7.583
   75   2HB   SER   9          2HB       SER   9 -12.517  -8.112  -6.731
   76    HG   SER   9           HG       SER   9 -14.840  -6.443  -6.991
   77    HA   PRO  10           HA       PRO  10 -12.446  -8.980  -2.364
   78   1HB   PRO  10          1HB       PRO  10 -13.785 -11.306  -2.881
   79   2HB   PRO  10          2HB       PRO  10 -14.516  -9.942  -2.058
   80   1HG   PRO  10          1HG       PRO  10 -14.918 -10.861  -4.839
   81   2HG   PRO  10          2HG       PRO  10 -15.924  -9.794  -3.879
   82   1HD   PRO  10          1HD       PRO  10 -14.117  -9.028  -5.971
   83   2HD   PRO  10          2HD       PRO  10 -15.036  -7.955  -4.934
   84    H    SER  11           H        SER  11 -11.475  -9.252  -5.451
   85    HA   SER  11           HA       SER  11 -10.142 -11.747  -5.174
   86   1HB   SER  11          1HB       SER  11 -10.923 -10.187  -7.314
   87   2HB   SER  11          2HB       SER  11  -9.204  -9.850  -7.265
   88    HG   SER  11           HG       SER  11  -9.051 -11.692  -8.359
   89    H    ASP  12           H        ASP  12  -9.222  -8.238  -5.202
   90    HA   ASP  12           HA       ASP  12  -6.504  -8.797  -4.756
   91   1HB   ASP  12          1HB       ASP  12  -6.895  -6.694  -5.733
   92   2HB   ASP  12          2HB       ASP  12  -8.279  -6.360  -4.711
   93    H    PHE  13           H        PHE  13  -9.406  -8.137  -2.765
   94    HA   PHE  13           HA       PHE  13  -7.991  -7.644  -0.358
   95   1HB   PHE  13          1HB       PHE  13 -10.541  -7.282  -1.326
   96   2HB   PHE  13          2HB       PHE  13 -10.797  -8.787  -0.466
   97    HD1  PHE  13           1HD      PHE  13  -9.852  -8.796   2.019
   98    HD2  PHE  13           2HD      PHE  13 -10.854  -5.306  -0.178
   99    HE1  PHE  13           1HE      PHE  13 -10.124  -7.523   4.165
  100    HE2  PHE  13           2HE      PHE  13 -11.126  -4.033   1.969
  101    HZ   PHE  13           HZ       PHE  13 -10.758  -5.157   4.114
  102    H    ALA  14           H        ALA  14  -9.621 -10.517  -1.829
  103    HA   ALA  14           HA       ALA  14  -9.352 -12.200   0.372
  104   1HB   ALA  14          1HB       ALA  14  -9.539 -12.667  -2.623
  105   2HB   ALA  14          2HB       ALA  14  -9.524 -13.998  -1.442
  106   3HB   ALA  14          3HB       ALA  14 -10.832 -12.792  -1.406
  107    H    GLN  15           H        GLN  15  -7.221 -11.747  -2.536
  108    HA   GLN  15           HA       GLN  15  -5.337 -13.581  -1.894
  109   1HB   GLN  15          1HB       GLN  15  -5.648 -11.643  -3.836
  110   2HB   GLN  15          2HB       GLN  15  -4.254 -11.029  -2.969
  111   1HG   GLN  15          1HG       GLN  15  -3.390 -12.481  -4.686
  112   2HG   GLN  15          2HG       GLN  15  -3.203 -13.348  -3.174
  113   1HE2  GLN  15          1HE2      GLN  15  -3.290 -14.485  -5.761
  114   2HE2  GLN  15          2HE2      GLN  15  -4.661 -15.539  -5.871
  115    H    LEU  16           H        LEU  16  -5.391 -10.073  -0.943
  116    HA   LEU  16           HA       LEU  16  -3.056 -10.210   0.593
  117   1HB   LEU  16          1HB       LEU  16  -4.916  -8.277  -0.227
  118   2HB   LEU  16          2HB       LEU  16  -4.945  -8.230   1.525
  119    HG   LEU  16           HG       LEU  16  -2.511  -7.877   1.576
  120   1HD1  LEU  16          1HD1      LEU  16  -2.008  -7.140  -1.135
  121   2HD1  LEU  16          2HD1      LEU  16  -1.207  -8.381  -0.142
  122   3HD1  LEU  16          3HD1      LEU  16  -2.640  -8.804  -1.110
  123   1HD2  LEU  16          1HD2      LEU  16  -2.519  -5.588   0.471
  124   2HD2  LEU  16          2HD2      LEU  16  -4.175  -5.962  -0.064
  125   3HD2  LEU  16          3HD2      LEU  16  -3.794  -5.901   1.673
  126    H    GLN  17           H        GLN  17  -6.560 -10.470   1.481
  127    HA   GLN  17           HA       GLN  17  -6.118 -10.769   4.184
  128   1HB   GLN  17          1HB       GLN  17  -8.322 -10.402   2.810
  129   2HB   GLN  17          2HB       GLN  17  -8.389 -12.151   2.723
  130   1HG   GLN  17          1HG       GLN  17  -8.600 -12.393   5.082
  131   2HG   GLN  17          2HG       GLN  17  -7.968 -10.790   5.402
  132   1HE2  GLN  17          1HE2      GLN  17 -10.667 -12.561   3.962
  133   2HE2  GLN  17          2HE2      GLN  17 -11.899 -11.379   4.249
  134    H    LYS  18           H        LYS  18  -5.434 -12.905   1.538
  135    HA   LYS  18           HA       LYS  18  -5.620 -15.308   3.114
  136   1HB   LYS  18          1HB       LYS  18  -5.479 -14.618   0.330
  137   2HB   LYS  18          2HB       LYS  18  -4.174 -15.728   0.698
  138   1HG   LYS  18          1HG       LYS  18  -5.605 -17.470   1.217
  139   2HG   LYS  18          2HG       LYS  18  -6.811 -16.415   1.929
  140   1HD   LYS  18          1HD       LYS  18  -8.019 -16.548   0.018
  141   2HD   LYS  18          2HD       LYS  18  -6.731 -15.719  -0.832
  142   1HE   LYS  18          1HE       LYS  18  -7.122 -17.823  -1.980
  143   2HE   LYS  18          2HE       LYS  18  -5.576 -17.952  -1.166
  144   1HZ   LYS  18          1HZ       LYS  18  -8.086 -18.908   0.018
  145   2HZ   LYS  18          2HZ       LYS  18  -7.087 -19.860  -0.855
  146   3HZ   LYS  18          3HZ       LYS  18  -6.569 -19.202   0.547
  147    H    TYR  19           H        TYR  19  -2.980 -13.371   1.540
  148    HA   TYR  19           HA       TYR  19  -0.931 -14.866   2.792
  149   1HB   TYR  19          1HB       TYR  19  -1.120 -12.032   1.591
  150   2HB   TYR  19          2HB       TYR  19   0.398 -12.841   1.925
  151    HD1  TYR  19           1HD      TYR  19  -0.178 -15.598   0.952
  152    HD2  TYR  19           2HD      TYR  19  -1.159 -11.793  -0.739
  153    HE1  TYR  19           1HE      TYR  19  -0.226 -16.634  -1.369
  154    HE2  TYR  19           2HE      TYR  19  -1.203 -12.841  -3.055
  155    HH   TYR  19           HH       TYR  19  -1.338 -16.135  -3.538
  156    H    MET  20           H        MET  20  -2.541 -11.707   3.504
  157    HA   MET  20           HA       MET  20  -0.836 -11.117   5.645
  158   1HB   MET  20          1HB       MET  20  -2.279  -9.233   5.945
  159   2HB   MET  20          2HB       MET  20  -2.461  -9.594   4.240
  160   1HG   MET  20          1HG       MET  20  -4.708  -9.498   4.796
  161   2HG   MET  20          2HG       MET  20  -4.436 -11.191   5.160
  162   1HE   MET  20          1HE       MET  20  -3.203  -8.077   7.868
  163   2HE   MET  20          2HE       MET  20  -3.968  -7.743   6.296
  164   3HE   MET  20          3HE       MET  20  -4.919  -7.611   7.794
  165    H    GLU  21           H        GLU  21  -3.504 -13.316   5.274
  166    HA   GLU  21           HA       GLU  21  -4.827 -13.314   7.565
  167   1HB   GLU  21          1HB       GLU  21  -5.330 -15.586   7.173
  168   2HB   GLU  21          2HB       GLU  21  -4.884 -14.992   5.586
  169   1HG   GLU  21          1HG       GLU  21  -2.553 -15.857   5.925
  170   2HG   GLU  21          2HG       GLU  21  -3.015 -16.467   7.502
  171    H    TYR  22           H        TYR  22  -1.518 -14.702   7.083
  172    HA   TYR  22           HA       TYR  22  -1.327 -15.361   9.887
  173   1HB   TYR  22          1HB       TYR  22  -0.216 -16.139   7.376
  174   2HB   TYR  22          2HB       TYR  22   1.108 -15.310   8.171
  175    HD1  TYR  22           1HD      TYR  22  -0.614 -18.399   7.832
  176    HD2  TYR  22           2HD      TYR  22   1.654 -16.078  10.621
  177    HE1  TYR  22           1HE      TYR  22  -0.092 -20.499   9.166
  178    HE2  TYR  22           2HE      TYR  22   2.169 -18.186  11.945
  179    HH   TYR  22           HH       TYR  22   1.498 -21.310  10.693
  180    H    SER  23           H        SER  23   0.202 -13.057   7.543
  181    HA   SER  23           HA       SER  23   1.526 -11.347   7.864
  182   1HB   SER  23          1HB       SER  23  -0.349 -10.058   8.366
  183   2HB   SER  23          2HB       SER  23  -0.729 -10.969   9.813
  184    HG   SER  23           HG       SER  23   1.674  -9.399   9.711
  185    H    THR  24           H        THR  24   3.528 -12.321   8.457
  186    HA   THR  24           HA       THR  24   3.997 -12.615  11.342
  187    HB   THR  24           HB       THR  24   4.354 -14.486   9.485
  188    HG1  THR  24           1HG      THR  24   6.195 -15.124  10.887
  189   1HG2  THR  24          1HG2      THR  24   6.039 -12.625   8.356
  190   2HG2  THR  24          2HG2      THR  24   7.165 -13.453   9.459
  191   3HG2  THR  24          3HG2      THR  24   6.292 -14.382   8.217
  192    H    LYS  25           H        LYS  25   3.950 -10.078   9.504
  193    HA   LYS  25           HA       LYS  25   6.447  -9.061  10.618
  194   1HB   LYS  25          1HB       LYS  25   5.829  -9.372   7.762
  195   2HB   LYS  25          2HB       LYS  25   6.284  -7.737   8.199
  196   1HG   LYS  25          1HG       LYS  25   8.240  -8.904   9.543
  197   2HG   LYS  25          2HG       LYS  25   7.885 -10.292   8.534
  198   1HD   LYS  25          1HD       LYS  25   8.779  -9.324   6.659
  199   2HD   LYS  25          2HD       LYS  25   8.060  -7.763   7.000
  200   1HE   LYS  25          1HE       LYS  25  10.495  -8.864   8.481
  201   2HE   LYS  25          2HE       LYS  25  10.602  -7.794   7.097
  202   1HZ   LYS  25          1HZ       LYS  25   9.811  -6.063   8.290
  203   2HZ   LYS  25          2HZ       LYS  25   8.906  -6.975   9.299
  204   3HZ   LYS  25          3HZ       LYS  25  10.522  -6.879   9.512
  205    H    LYS  26           H        LYS  26   6.426  -6.544  10.458
  206    HA   LYS  26           HA       LYS  26   3.697  -5.718  11.142
  207   1HB   LYS  26          1HB       LYS  26   6.415  -4.777  12.070
  208   2HB   LYS  26          2HB       LYS  26   4.969  -3.818  12.314
  209   1HG   LYS  26          1HG       LYS  26   4.782  -6.708  13.095
  210   2HG   LYS  26          2HG       LYS  26   5.826  -5.708  14.085
  211   1HD   LYS  26          1HD       LYS  26   3.907  -4.056  14.332
  212   2HD   LYS  26          2HD       LYS  26   2.879  -5.187  13.474
  213   1HE   LYS  26          1HE       LYS  26   4.277  -6.601  15.597
  214   2HE   LYS  26          2HE       LYS  26   3.516  -5.171  16.267
  215   1HZ   LYS  26          1HZ       LYS  26   1.445  -5.861  15.432
  216   2HZ   LYS  26          2HZ       LYS  26   2.092  -7.053  14.523
  217   3HZ   LYS  26          3HZ       LYS  26   2.096  -7.175  16.151
  218    H    VAL  27           H        VAL  27   2.744  -3.943  10.138
  219    HA   VAL  27           HA       VAL  27   3.793  -3.314   7.569
  220    HB   VAL  27           HB       VAL  27   1.392  -3.582   8.133
  221   1HG1  VAL  27          1HG1      VAL  27   2.012  -1.272   9.906
  222   2HG1  VAL  27          2HG1      VAL  27   0.454  -1.229   9.046
  223   3HG1  VAL  27          3HG1      VAL  27   0.844  -2.600  10.112
  224   1HG2  VAL  27          1HG2      VAL  27   0.755  -1.255   6.995
  225   2HG2  VAL  27          2HG2      VAL  27   2.515  -1.189   6.738
  226   3HG2  VAL  27          3HG2      VAL  27   1.572  -2.555   6.095
  227    H    SER  28           H        SER  28   3.995  -1.950  10.813
  228    HA   SER  28           HA       SER  28   4.768   0.619   9.850
  229   1HB   SER  28          1HB       SER  28   4.884  -0.607  12.641
  230   2HB   SER  28          2HB       SER  28   5.216   1.075  12.282
  231    HG   SER  28           HG       SER  28   3.112   1.488  12.135
  232    H    ASP  29           H        ASP  29   6.297  -2.406  10.987
  233    HA   ASP  29           HA       ASP  29   8.856  -1.265  11.267
  234   1HB   ASP  29          1HB       ASP  29   7.923  -4.151  10.908
  235   2HB   ASP  29          2HB       ASP  29   9.582  -3.713  11.263
  236    H    VAL  30           H        VAL  30   6.955  -2.882   8.694
  237    HA   VAL  30           HA       VAL  30   9.118  -3.365   6.947
  238    HB   VAL  30           HB       VAL  30   6.126  -3.223   6.676
  239   1HG1  VAL  30          1HG1      VAL  30   8.095  -2.997   4.538
  240   2HG1  VAL  30          2HG1      VAL  30   7.071  -4.442   4.350
  241   3HG1  VAL  30          3HG1      VAL  30   6.324  -2.831   4.482
  242   1HG2  VAL  30          1HG2      VAL  30   7.455  -5.160   7.793
  243   2HG2  VAL  30          2HG2      VAL  30   6.187  -5.553   6.607
  244   3HG2  VAL  30          3HG2      VAL  30   7.900  -5.597   6.126
  245    H    LEU  31           H        LEU  31   6.730  -0.680   7.327
  246    HA   LEU  31           HA       LEU  31   7.670   0.758   5.094
  247   1HB   LEU  31          1HB       LEU  31   5.989   1.423   7.495
  248   2HB   LEU  31          2HB       LEU  31   6.468   2.664   6.354
  249    HG   LEU  31           HG       LEU  31   4.824   0.193   5.743
  250   1HD1  LEU  31          1HD1      LEU  31   3.947   3.068   5.498
  251   2HD1  LEU  31          2HD1      LEU  31   2.955   1.590   5.541
  252   3HD1  LEU  31          3HD1      LEU  31   3.777   2.154   7.016
  253   1HD2  LEU  31          1HD2      LEU  31   5.744   0.396   3.697
  254   2HD2  LEU  31          2HD2      LEU  31   4.578   1.730   3.530
  255   3HD2  LEU  31          3HD2      LEU  31   6.266   2.075   3.974
  256    H    LYS  32           H        LYS  32   8.728   0.420   8.457
  257    HA   LYS  32           HA       LYS  32  10.202   2.770   8.664
  258   1HB   LYS  32          1HB       LYS  32   9.886   0.267  10.117
  259   2HB   LYS  32          2HB       LYS  32  11.549   0.818  10.154
  260   1HG   LYS  32          1HG       LYS  32   9.366   2.848  10.640
  261   2HG   LYS  32          2HG       LYS  32   9.739   1.713  11.922
  262   1HD   LYS  32          1HD       LYS  32  12.040   3.126  10.575
  263   2HD   LYS  32          2HD       LYS  32  11.047   4.051  11.683
  264   1HE   LYS  32          1HE       LYS  32  12.215   1.344  12.455
  265   2HE   LYS  32          2HE       LYS  32  13.111   2.834  12.679
  266   1HZ   LYS  32          1HZ       LYS  32  11.971   3.142  14.517
  267   2HZ   LYS  32          2HZ       LYS  32  10.570   3.237  13.683
  268   3HZ   LYS  32          3HZ       LYS  32  11.078   1.799  14.266
  269    H    LEU  33           H        LEU  33  10.662  -0.079   6.711
  270    HA   LEU  33           HA       LEU  33  13.501   0.289   6.457
  271   1HB   LEU  33          1HB       LEU  33  11.562  -1.466   4.943
  272   2HB   LEU  33          2HB       LEU  33  13.307  -1.514   4.794
  273    HG   LEU  33           HG       LEU  33  12.300  -1.833   7.555
  274   1HD1  LEU  33          1HD1      LEU  33  12.031  -4.314   5.954
  275   2HD1  LEU  33          2HD1      LEU  33  11.120  -3.750   7.375
  276   3HD1  LEU  33          3HD1      LEU  33  10.742  -3.103   5.761
  277   1HD2  LEU  33          1HD2      LEU  33  13.992  -3.946   6.561
  278   2HD2  LEU  33          2HD2      LEU  33  14.652  -2.357   6.103
  279   3HD2  LEU  33          3HD2      LEU  33  14.316  -2.722   7.812
  280    H    PHE  34           H        PHE  34  10.509   1.287   4.814
  281    HA   PHE  34           HA       PHE  34  11.922   2.214   2.497
  282   1HB   PHE  34          1HB       PHE  34   9.099   2.295   3.664
  283   2HB   PHE  34          2HB       PHE  34   9.471   3.307   2.282
  284    HD1  PHE  34           1HD      PHE  34   9.090   2.445   0.177
  285    HD2  PHE  34           2HD      PHE  34   9.833  -0.249   3.371
  286    HE1  PHE  34           1HE      PHE  34   8.659   0.507  -1.358
  287    HE2  PHE  34           2HE      PHE  34   9.402  -2.187   1.836
  288    HZ   PHE  34           HZ       PHE  34   8.820  -1.786  -0.510
  289    H    GLU  35           H        GLU  35  11.362   3.378   5.694
  290    HA   GLU  35           HA       GLU  35  11.297   6.131   4.901
  291   1HB   GLU  35          1HB       GLU  35  11.540   4.887   7.676
  292   2HB   GLU  35          2HB       GLU  35  11.214   6.575   7.341
  293   1HG   GLU  35          1HG       GLU  35   9.299   5.092   5.826
  294   2HG   GLU  35          2HG       GLU  35   9.356   4.332   7.403
  295    H    ASP  36           H        ASP  36  13.506   4.006   6.868
  296    HA   ASP  36           HA       ASP  36  15.629   5.868   6.145
  297   1HB   ASP  36          1HB       ASP  36  15.770   3.873   8.430
  298   2HB   ASP  36          2HB       ASP  36  16.730   5.320   8.201
  299    H    GLY  37           H        GLY  37  14.459   2.500   6.349
  300   1HA   GLY  37          1HA       GLY  37  16.795   1.071   5.894
  301   2HA   GLY  37          2HA       GLY  37  15.178   0.582   5.426
  302    H    GLU  38           H        GLU  38  17.227  -0.202   3.781
  303    HA   GLU  38           HA       GLU  38  18.009   1.586   1.853
  304   1HB   GLU  38          1HB       GLU  38  18.919  -0.255   0.787
  305   2HB   GLU  38          2HB       GLU  38  18.646  -0.954   2.370
  306   1HG   GLU  38          1HG       GLU  38  16.417  -1.823   1.575
  307   2HG   GLU  38          2HG       GLU  38  16.752  -1.172  -0.017
  308    H    MET  39           H        MET  39  14.935  -0.101   2.342
  309    HA   MET  39           HA       MET  39  13.954   0.008  -0.224
  310   1HB   MET  39          1HB       MET  39  12.547   0.283   2.490
  311   2HB   MET  39          2HB       MET  39  11.691  -0.008   0.989
  312   1HG   MET  39          1HG       MET  39  13.900  -1.841   2.036
  313   2HG   MET  39          2HG       MET  39  12.199  -2.102   2.365
  314   1HE   MET  39          1HE       MET  39  14.791  -1.718  -0.818
  315   2HE   MET  39          2HE       MET  39  15.017  -2.904   0.489
  316   3HE   MET  39          3HE       MET  39  14.528  -3.450  -1.133
  317    H    ALA  40           H        ALA  40  14.759   2.590   1.909
  318    HA   ALA  40           HA       ALA  40  12.764   4.421   0.964
  319   1HB   ALA  40          1HB       ALA  40  14.095   4.320   3.240
  320   2HB   ALA  40          2HB       ALA  40  15.327   5.226   2.330
  321   3HB   ALA  40          3HB       ALA  40  13.687   5.894   2.514
  322    H    LYS  41           H        LYS  41  15.369   2.942  -0.506
  323    HA   LYS  41           HA       LYS  41  16.640   5.146  -1.723
  324   1HB   LYS  41          1HB       LYS  41  17.800   3.543  -3.005
  325   2HB   LYS  41          2HB       LYS  41  17.547   2.802  -1.437
  326   1HG   LYS  41          1HG       LYS  41  15.761   1.411  -2.255
  327   2HG   LYS  41          2HG       LYS  41  15.584   2.358  -3.719
  328   1HD   LYS  41          1HD       LYS  41  17.220   1.194  -4.798
  329   2HD   LYS  41          2HD       LYS  41  18.325   1.335  -3.445
  330   1HE   LYS  41          1HE       LYS  41  16.634  -0.473  -2.356
  331   2HE   LYS  41          2HE       LYS  41  16.319  -0.832  -4.042
  332   1HZ   LYS  41          1HZ       LYS  41  18.226  -2.008  -2.876
  333   2HZ   LYS  41          2HZ       LYS  41  18.496  -1.433  -4.380
  334   3HZ   LYS  41          3HZ       LYS  41  19.067  -0.624  -3.082
  335    H    TYR  42           H        TYR  42  13.681   3.294  -2.372
  336    HA   TYR  42           HA       TYR  42  13.357   4.803  -4.872
  337   1HB   TYR  42          1HB       TYR  42  12.022   2.301  -3.661
  338   2HB   TYR  42          2HB       TYR  42  11.605   2.958  -5.231
  339    HD1  TYR  42           1HD      TYR  42  14.488   3.647  -6.092
  340    HD2  TYR  42           2HD      TYR  42  12.743   0.138  -4.375
  341    HE1  TYR  42           1HE      TYR  42  16.293   2.214  -7.166
  342    HE2  TYR  42           2HE      TYR  42  14.553  -1.282  -5.455
  343    HH   TYR  42           HH       TYR  42  17.243  -0.422  -6.314
  344    H    VAL  43           H        VAL  43  12.976   6.029  -2.226
  345    HA   VAL  43           HA       VAL  43  10.060   6.394  -2.333
  346    HB   VAL  43           HB       VAL  43  11.983   6.465  -0.005
  347   1HG1  VAL  43          1HG1      VAL  43  10.676   8.065   0.871
  348   2HG1  VAL  43          2HG1      VAL  43   9.427   7.852  -0.380
  349   3HG1  VAL  43          3HG1      VAL  43   9.445   6.792   1.050
  350   1HG2  VAL  43          1HG2      VAL  43  11.290   4.227  -0.547
  351   2HG2  VAL  43          2HG2      VAL  43  10.403   4.742   0.908
  352   3HG2  VAL  43          3HG2      VAL  43   9.586   4.728  -0.674
  353    H    GLN  44           H        GLN  44   9.325   8.437  -2.746
  354    HA   GLN  44           HA       GLN  44  11.405  10.444  -3.030
  355   1HB   GLN  44          1HB       GLN  44   8.620  10.190  -4.232
  356   2HB   GLN  44          2HB       GLN  44   9.579  11.648  -4.383
  357   1HG   GLN  44          1HG       GLN  44  11.322   9.497  -5.079
  358   2HG   GLN  44          2HG       GLN  44   9.798   9.151  -5.873
  359   1HE2  GLN  44          1HE2      GLN  44   8.958  10.546  -7.401
  360   2HE2  GLN  44          2HE2      GLN  44   9.890  11.785  -8.174
  361    H    GLY  45           H        GLY  45  11.504  10.907  -0.711
  362   1HA   GLY  45          1HA       GLY  45  11.038  12.404   0.935
  363   2HA   GLY  45          2HA       GLY  45   9.617  12.941   0.061
  364    H    ASP  46           H        ASP  46   7.571  11.945   0.417
  365    HA   ASP  46           HA       ASP  46   7.603   9.926   2.516
  366   1HB   ASP  46          1HB       ASP  46   5.428  11.013   3.324
  367   2HB   ASP  46          2HB       ASP  46   6.894  11.920   3.635
  368    H    ALA  47           H        ALA  47   7.286  10.092  -0.591
  369    HA   ALA  47           HA       ALA  47   4.825   8.519  -0.684
  370   1HB   ALA  47          1HB       ALA  47   4.745  11.106  -1.461
  371   2HB   ALA  47          2HB       ALA  47   5.343  10.371  -2.968
  372   3HB   ALA  47          3HB       ALA  47   3.802   9.827  -2.263
  373    H    ILE  48           H        ILE  48   4.960   6.744  -2.063
  374    HA   ILE  48           HA       ILE  48   7.526   6.490  -3.472
  375    HB   ILE  48           HB       ILE  48   7.473   5.028  -1.580
  376   1HG1  ILE  48          1HG1      ILE  48   6.939   3.447  -4.112
  377   2HG1  ILE  48          2HG1      ILE  48   8.463   4.209  -3.704
  378   1HG2  ILE  48          1HG2      ILE  48   4.676   4.711  -2.304
  379   2HG2  ILE  48          2HG2      ILE  48   5.478   3.143  -2.045
  380   3HG2  ILE  48          3HG2      ILE  48   5.507   4.380  -0.766
  381   1HD1  ILE  48          1HD1      ILE  48   7.414   1.657  -2.809
  382   2HD1  ILE  48          2HD1      ILE  48   9.031   2.352  -2.544
  383   3HD1  ILE  48          3HD1      ILE  48   7.713   2.705  -1.402
  384    H    GLY  49           H        GLY  49   7.457   5.175  -5.475
  385   1HA   GLY  49          1HA       GLY  49   5.155   5.907  -7.047
  386   2HA   GLY  49          2HA       GLY  49   6.618   5.108  -7.588
  387    H    TYR  50           H        TYR  50   4.544   4.019  -8.758
  388    HA   TYR  50           HA       TYR  50   3.108   2.118  -7.238
  389   1HB   TYR  50          1HB       TYR  50   2.163   2.789  -9.334
  390   2HB   TYR  50          2HB       TYR  50   3.727   2.846 -10.122
  391    HD1  TYR  50           1HD      TYR  50   4.647   0.909 -11.229
  392    HD2  TYR  50           2HD      TYR  50   0.991   0.611  -9.026
  393    HE1  TYR  50           1HE      TYR  50   4.198  -1.368 -12.267
  394    HE2  TYR  50           2HE      TYR  50   0.555  -1.665 -10.072
  395    HH   TYR  50           HH       TYR  50   2.442  -2.826 -12.713
  396    H    GLU  51           H        GLU  51   5.811   1.752  -9.649
  397    HA   GLU  51           HA       GLU  51   6.110  -0.929  -9.399
  398   1HB   GLU  51          1HB       GLU  51   7.325   0.919 -10.885
  399   2HB   GLU  51          2HB       GLU  51   8.562   0.816  -9.649
  400   1HG   GLU  51          1HG       GLU  51   9.374  -0.992 -10.759
  401   2HG   GLU  51          2HG       GLU  51   7.977  -1.875 -10.176
  402    H    GLY  52           H        GLY  52   7.548   1.694  -7.372
  403   1HA   GLY  52          1HA       GLY  52   9.260   0.187  -5.809
  404   2HA   GLY  52          2HA       GLY  52   8.441   1.653  -5.310
  405    H    PHE  53           H        PHE  53   5.698   0.721  -5.515
  406    HA   PHE  53           HA       PHE  53   5.343  -0.331  -3.001
  407   1HB   PHE  53          1HB       PHE  53   3.827   0.651  -5.134
  408   2HB   PHE  53          2HB       PHE  53   3.367  -1.040  -5.158
  409    HD1  PHE  53           1HD      PHE  53   1.313  -1.347  -4.176
  410    HD2  PHE  53           2HD      PHE  53   4.005   1.416  -2.409
  411    HE1  PHE  53           1HE      PHE  53  -0.332  -0.926  -2.328
  412    HE2  PHE  53           2HE      PHE  53   2.360   1.837  -0.561
  413    HZ   PHE  53           HZ       PHE  53   0.211   0.661  -0.542
  414    H    GLN  54           H        GLN  54   6.054  -1.951  -6.069
  415    HA   GLN  54           HA       GLN  54   5.059  -4.453  -5.392
  416   1HB   GLN  54          1HB       GLN  54   7.477  -3.962  -7.169
  417   2HB   GLN  54          2HB       GLN  54   6.310  -5.264  -7.282
  418   1HG   GLN  54          1HG       GLN  54   4.920  -2.707  -7.404
  419   2HG   GLN  54          2HG       GLN  54   6.216  -2.721  -8.583
  420   1HE2  GLN  54          1HE2      GLN  54   4.858  -2.817 -10.325
  421   2HE2  GLN  54          2HE2      GLN  54   3.948  -4.223 -10.769
  422    H    GLN  55           H        GLN  55   8.061  -2.731  -4.574
  423    HA   GLN  55           HA       GLN  55   9.399  -5.063  -3.693
  424   1HB   GLN  55          1HB       GLN  55   9.947  -2.181  -3.914
  425   2HB   GLN  55          2HB       GLN  55  10.611  -2.859  -2.441
  426   1HG   GLN  55          1HG       GLN  55  11.102  -3.881  -5.278
  427   2HG   GLN  55          2HG       GLN  55  12.258  -3.036  -4.268
  428   1HE2  GLN  55          1HE2      GLN  55  12.248  -4.084  -1.905
  429   2HE2  GLN  55          2HE2      GLN  55  12.564  -5.787  -1.884
  430    H    PHE  56           H        PHE  56   7.159  -2.699  -2.295
  431    HA   PHE  56           HA       PHE  56   7.768  -3.219   0.406
  432   1HB   PHE  56          1HB       PHE  56   6.552  -1.208  -0.274
  433   2HB   PHE  56          2HB       PHE  56   5.399  -2.139  -1.209
  434    HD1  PHE  56           1HD      PHE  56   6.458  -1.321   2.238
  435    HD2  PHE  56           2HD      PHE  56   3.421  -2.978  -0.219
  436    HE1  PHE  56           1HE      PHE  56   4.886  -1.341   4.195
  437    HE2  PHE  56           2HE      PHE  56   1.849  -2.998   1.738
  438    HZ   PHE  56           HZ       PHE  56   2.601  -2.180   3.922
  439    H    LEU  57           H        LEU  57   5.236  -4.483  -1.863
  440    HA   LEU  57           HA       LEU  57   3.952  -6.089   0.014
  441   1HB   LEU  57          1HB       LEU  57   4.179  -6.206  -2.988
  442   2HB   LEU  57          2HB       LEU  57   3.207  -7.342  -2.074
  443    HG   LEU  57           HG       LEU  57   2.615  -4.572  -1.355
  444   1HD1  LEU  57          1HD1      LEU  57   3.206  -4.903  -4.059
  445   2HD1  LEU  57          2HD1      LEU  57   1.430  -4.989  -3.972
  446   3HD1  LEU  57          3HD1      LEU  57   2.286  -3.574  -3.313
  447   1HD2  LEU  57          1HD2      LEU  57   0.530  -5.379  -1.088
  448   2HD2  LEU  57          2HD2      LEU  57   0.567  -6.293  -2.615
  449   3HD2  LEU  57          3HD2      LEU  57   1.350  -6.957  -1.161
  450    H    LYS  58           H        LYS  58   7.061  -6.370  -1.549
  451    HA   LYS  58           HA       LYS  58   7.264  -9.190  -1.399
  452   1HB   LYS  58          1HB       LYS  58   8.591  -7.762  -2.930
  453   2HB   LYS  58          2HB       LYS  58   9.435  -7.078  -1.555
  454   1HG   LYS  58          1HG       LYS  58  10.860  -8.839  -1.505
  455   2HG   LYS  58          2HG       LYS  58   9.523  -9.953  -1.301
  456   1HD   LYS  58          1HD       LYS  58   9.290 -10.317  -3.637
  457   2HD   LYS  58          2HD       LYS  58  10.119  -8.829  -4.053
  458   1HE   LYS  58          1HE       LYS  58  12.257  -9.736  -3.642
  459   2HE   LYS  58          2HE       LYS  58  11.649 -10.945  -2.529
  460   1HZ   LYS  58          1HZ       LYS  58  10.781 -11.064  -5.297
  461   2HZ   LYS  58          2HZ       LYS  58  12.291 -11.571  -4.936
  462   3HZ   LYS  58          3HZ       LYS  58  11.001 -12.279  -4.228
  463    H    ILE  59           H        ILE  59   8.721  -6.531   0.613
  464    HA   ILE  59           HA       ILE  59   9.506  -8.400   2.615
  465    HB   ILE  59           HB       ILE  59   9.384  -5.385   2.724
  466   1HG1  ILE  59          1HG1      ILE  59  11.862  -6.948   2.058
  467   2HG1  ILE  59          2HG1      ILE  59  10.708  -6.576   0.793
  468   1HG2  ILE  59          1HG2      ILE  59  11.529  -6.611   4.206
  469   2HG2  ILE  59          2HG2      ILE  59  10.233  -5.527   4.767
  470   3HG2  ILE  59          3HG2      ILE  59   9.963  -7.285   4.717
  471   1HD1  ILE  59          1HD1      ILE  59  11.050  -4.263   0.954
  472   2HD1  ILE  59          2HD1      ILE  59  11.583  -4.358   2.650
  473   3HD1  ILE  59          3HD1      ILE  59  12.673  -4.882   1.344
  474    H    TYR  60           H        TYR  60   6.905  -5.906   2.274
  475    HA   TYR  60           HA       TYR  60   5.763  -5.934   4.691
  476   1HB   TYR  60          1HB       TYR  60   4.919  -4.714   2.694
  477   2HB   TYR  60          2HB       TYR  60   4.583  -6.220   1.863
  478    HD1  TYR  60           1HD      TYR  60   2.269  -5.669   1.405
  479    HD2  TYR  60           2HD      TYR  60   3.733  -5.736   5.424
  480    HE1  TYR  60           1HE      TYR  60  -0.117  -5.617   2.283
  481    HE2  TYR  60           2HE      TYR  60   1.343  -5.684   6.288
  482    HH   TYR  60           HH       TYR  60  -0.852  -6.264   5.542
  483    H    LEU  61           H        LEU  61   4.430  -8.136   2.132
  484    HA   LEU  61           HA       LEU  61   3.330  -9.824   4.155
  485   1HB   LEU  61          1HB       LEU  61   3.472 -10.093   1.149
  486   2HB   LEU  61          2HB       LEU  61   2.579 -11.164   2.210
  487    HG   LEU  61           HG       LEU  61   1.693  -8.571   2.862
  488   1HD1  LEU  61          1HD1      LEU  61   2.774  -7.833   0.735
  489   2HD1  LEU  61          2HD1      LEU  61   1.677  -8.924  -0.145
  490   3HD1  LEU  61          3HD1      LEU  61   1.015  -7.566   0.797
  491   1HD2  LEU  61          1HD2      LEU  61  -0.406  -9.425   1.617
  492   2HD2  LEU  61          2HD2      LEU  61   0.528 -10.923   1.391
  493   3HD2  LEU  61          3HD2      LEU  61   0.182 -10.329   3.033
  494    H    GLU  62           H        GLU  62   6.363  -9.565   2.451
  495    HA   GLU  62           HA       GLU  62   8.229 -10.661   2.839
  496   1HB   GLU  62          1HB       GLU  62   7.082 -11.392   5.074
  497   2HB   GLU  62          2HB       GLU  62   6.792 -12.920   4.268
  498   1HG   GLU  62          1HG       GLU  62   9.486 -12.413   3.688
  499   2HG   GLU  62          2HG       GLU  62   9.319 -11.805   5.323
  500    H    VAL  63           H        VAL  63   5.805 -11.302   0.871
  501    HA   VAL  63           HA       VAL  63   6.192 -13.962   0.048
  502    HB   VAL  63           HB       VAL  63   5.101 -13.057  -2.074
  503   1HG1  VAL  63          1HG1      VAL  63   2.982 -12.370  -0.506
  504   2HG1  VAL  63          2HG1      VAL  63   3.491 -14.044  -0.832
  505   3HG1  VAL  63          3HG1      VAL  63   4.002 -13.235   0.668
  506   1HG2  VAL  63          1HG2      VAL  63   4.302 -10.860  -2.172
  507   2HG2  VAL  63          2HG2      VAL  63   4.559 -10.583  -0.433
  508   3HG2  VAL  63          3HG2      VAL  63   5.953 -10.671  -1.535
  509    H    ASP  64           H        ASP  64   7.183 -14.683  -2.021
  510    HA   ASP  64           HA       ASP  64   9.729 -13.377  -2.293
  511   1HB   ASP  64          1HB       ASP  64   8.575 -16.056  -2.837
  512   2HB   ASP  64          2HB       ASP  64   9.680 -15.518  -4.087
  513    H    ASN  65           H        ASN  65   6.625 -13.223  -3.672
  514    HA   ASN  65           HA       ASN  65   7.470 -11.602  -5.763
  515   1HB   ASN  65          1HB       ASN  65   6.204 -13.368  -7.467
  516   2HB   ASN  65          2HB       ASN  65   7.945 -13.240  -7.316
  517   1HD2  ASN  65          1HD2      ASN  65   5.099 -15.062  -6.570
  518   2HD2  ASN  65          2HD2      ASN  65   5.857 -16.487  -5.941
  519    H    VAL  66           H        VAL  66   5.740 -10.160  -5.759
  520    HA   VAL  66           HA       VAL  66   3.133 -11.181  -4.947
  521    HB   VAL  66           HB       VAL  66   4.616  -8.929  -4.296
  522   1HG1  VAL  66          1HG1      VAL  66   3.878  -7.995  -6.537
  523   2HG1  VAL  66          2HG1      VAL  66   2.218  -7.991  -5.894
  524   3HG1  VAL  66          3HG1      VAL  66   3.477  -7.004  -5.113
  525   1HG2  VAL  66          1HG2      VAL  66   2.040 -10.127  -3.665
  526   2HG2  VAL  66          2HG2      VAL  66   3.185  -9.263  -2.611
  527   3HG2  VAL  66          3HG2      VAL  66   1.982  -8.351  -3.554
  528    HA   PRO  67           HA       PRO  67   1.622 -10.911  -8.988
  529   1HB   PRO  67          1HB       PRO  67  -1.067 -10.764  -8.522
  530   2HB   PRO  67          2HB       PRO  67  -0.168 -12.268  -8.483
  531   1HG   PRO  67          1HG       PRO  67  -1.221 -10.678  -6.224
  532   2HG   PRO  67          2HG       PRO  67  -0.709 -12.354  -6.242
  533   1HD   PRO  67          1HD       PRO  67   0.755 -10.125  -5.188
  534   2HD   PRO  67          2HD       PRO  67   1.314 -11.781  -5.312
  535    H    ARG  68           H        ARG  68   1.339  -9.481 -10.629
  536    HA   ARG  68           HA       ARG  68   1.473  -6.814  -9.857
  537   1HB   ARG  68          1HB       ARG  68   1.040  -6.428 -12.388
  538   2HB   ARG  68          2HB       ARG  68   2.450  -7.378 -11.965
  539   1HG   ARG  68          1HG       ARG  68   1.650  -9.171 -13.100
  540   2HG   ARG  68          2HG       ARG  68   0.171  -9.158 -12.160
  541   1HD   ARG  68          1HD       ARG  68  -1.003  -8.292 -13.903
  542   2HD   ARG  68          2HD       ARG  68   0.110  -6.947 -14.051
  543    HE   ARG  68           HE       ARG  68   1.180  -9.448 -15.140
  544   1HH1  ARG  68          2HH2      ARG  68  -0.769  -6.603 -15.839
  545   2HH1  ARG  68          1HH2      ARG  68  -0.519  -6.695 -17.551
  546   1HH2  ARG  68          2HH1      ARG  68   1.510  -9.570 -17.398
  547   2HH2  ARG  68          1HH1      ARG  68   0.786  -8.394 -18.443
  548    H    HIS  69           H        HIS  69  -1.192  -9.001 -10.778
  549    HA   HIS  69           HA       HIS  69  -3.124  -7.169 -11.439
  550   1HB   HIS  69          1HB       HIS  69  -3.089  -9.777 -11.452
  551   2HB   HIS  69          2HB       HIS  69  -3.745  -9.638  -9.833
  552    HD1  HIS  69           1HD      HIS  69  -6.234  -9.266  -9.628
  553    HD2  HIS  69           2HD      HIS  69  -4.802  -8.504 -13.496
  554    HE1  HIS  69           1HE      HIS  69  -8.290  -8.870 -11.086
  555    H    LEU  70           H        LEU  70  -2.149  -8.414  -8.186
  556    HA   LEU  70           HA       LEU  70  -4.097  -6.847  -6.838
  557   1HB   LEU  70          1HB       LEU  70  -3.522  -8.717  -5.665
  558   2HB   LEU  70          2HB       LEU  70  -1.827  -8.624  -6.102
  559    HG   LEU  70           HG       LEU  70  -1.877  -6.462  -4.572
  560   1HD1  LEU  70          1HD1      LEU  70  -3.652  -6.120  -3.281
  561   2HD1  LEU  70          2HD1      LEU  70  -4.511  -7.337  -4.256
  562   3HD1  LEU  70          3HD1      LEU  70  -3.683  -7.821  -2.756
  563   1HD2  LEU  70          1HD2      LEU  70  -1.935  -9.071  -3.092
  564   2HD2  LEU  70          2HD2      LEU  70  -0.694  -8.782  -4.335
  565   3HD2  LEU  70          3HD2      LEU  70  -0.821  -7.692  -2.934
  566    H    SER  71           H        SER  71  -0.556  -6.534  -7.500
  567    HA   SER  71           HA       SER  71  -0.195  -4.231  -6.040
  568   1HB   SER  71          1HB       SER  71   1.346  -5.882  -7.723
  569   2HB   SER  71          2HB       SER  71   1.417  -4.310  -8.495
  570    HG   SER  71           HG       SER  71   2.233  -5.035  -5.828
  571    H    LEU  72           H        LEU  72  -1.811  -4.810  -9.101
  572    HA   LEU  72           HA       LEU  72  -1.537  -2.148 -10.089
  573   1HB   LEU  72          1HB       LEU  72  -1.807  -3.766 -11.723
  574   2HB   LEU  72          2HB       LEU  72  -3.083  -4.595 -10.854
  575    HG   LEU  72           HG       LEU  72  -4.664  -2.821 -11.377
  576   1HD1  LEU  72          1HD1      LEU  72  -2.917  -1.394 -13.276
  577   2HD1  LEU  72          2HD1      LEU  72  -4.156  -0.777 -12.156
  578   3HD1  LEU  72          3HD1      LEU  72  -2.522  -1.152 -11.557
  579   1HD2  LEU  72          1HD2      LEU  72  -3.833  -3.050 -14.100
  580   2HD2  LEU  72          2HD2      LEU  72  -3.453  -4.572 -13.259
  581   3HD2  LEU  72          3HD2      LEU  72  -5.115  -3.934 -13.238
  582    H    ALA  73           H        ALA  73  -4.136  -4.044  -8.424
  583    HA   ALA  73           HA       ALA  73  -5.895  -1.816  -8.328
  584   1HB   ALA  73          1HB       ALA  73  -7.363  -3.308  -7.332
  585   2HB   ALA  73          2HB       ALA  73  -6.281  -4.440  -8.177
  586   3HB   ALA  73          3HB       ALA  73  -6.074  -4.145  -6.434
  587    H    LEU  74           H        LEU  74  -3.273  -3.108  -6.303
  588    HA   LEU  74           HA       LEU  74  -3.935  -1.836  -3.921
  589   1HB   LEU  74          1HB       LEU  74  -1.543  -3.065  -5.143
  590   2HB   LEU  74          2HB       LEU  74  -1.226  -1.904  -3.869
  591    HG   LEU  74           HG       LEU  74  -3.153  -4.203  -3.502
  592   1HD1  LEU  74          1HD1      LEU  74  -0.304  -4.305  -2.545
  593   2HD1  LEU  74          2HD1      LEU  74  -1.480  -5.625  -2.755
  594   3HD1  LEU  74          3HD1      LEU  74  -0.738  -4.859  -4.180
  595   1HD2  LEU  74          1HD2      LEU  74  -1.622  -2.508  -1.510
  596   2HD2  LEU  74          2HD2      LEU  74  -3.348  -2.345  -1.915
  597   3HD2  LEU  74          3HD2      LEU  74  -2.755  -3.826  -1.126
  598    H    PHE  75           H        PHE  75  -1.866  -0.738  -6.689
  599    HA   PHE  75           HA       PHE  75  -1.395   1.792  -5.510
  600   1HB   PHE  75          1HB       PHE  75   0.179   0.971  -7.141
  601   2HB   PHE  75          2HB       PHE  75  -1.091   0.413  -8.212
  602    HD1  PHE  75           1HD      PHE  75  -1.833   1.758  -9.984
  603    HD2  PHE  75           2HD      PHE  75   0.523   3.491  -6.909
  604    HE1  PHE  75           1HE      PHE  75  -1.619   3.863 -11.335
  605    HE2  PHE  75           2HE      PHE  75   0.737   5.596  -8.260
  606    HZ   PHE  75           HZ       PHE  75  -0.336   5.757 -10.456
  607    H    GLN  76           H        GLN  76  -3.683   0.525  -8.002
  608    HA   GLN  76           HA       GLN  76  -4.675   2.907  -8.865
  609   1HB   GLN  76          1HB       GLN  76  -5.573   0.091  -8.808
  610   2HB   GLN  76          2HB       GLN  76  -6.903   1.231  -8.863
  611   1HG   GLN  76          1HG       GLN  76  -5.459   2.402 -10.763
  612   2HG   GLN  76          2HG       GLN  76  -4.659   0.846 -10.861
  613   1HE2  GLN  76          1HE2      GLN  76  -5.974  -1.064 -11.184
  614   2HE2  GLN  76          2HE2      GLN  76  -7.427  -0.973 -12.123
  615    H    SER  77           H        SER  77  -5.237   1.185  -5.811
  616    HA   SER  77           HA       SER  77  -7.601   2.325  -5.058
  617   1HB   SER  77          1HB       SER  77  -5.178   1.467  -3.427
  618   2HB   SER  77          2HB       SER  77  -6.675   1.982  -2.675
  619    HG   SER  77           HG       SER  77  -7.661   0.265  -4.230
  620    H    PHE  78           H        PHE  78  -4.441   3.334  -3.580
  621    HA   PHE  78           HA       PHE  78  -5.400   6.103  -3.775
  622   1HB   PHE  78          1HB       PHE  78  -4.960   4.552  -1.509
  623   2HB   PHE  78          2HB       PHE  78  -3.361   5.235  -1.727
  624    HD1  PHE  78           1HD      PHE  78  -3.087   6.848  -0.094
  625    HD2  PHE  78           2HD      PHE  78  -6.735   6.739  -2.260
  626    HE1  PHE  78           1HE      PHE  78  -3.829   8.955   1.051
  627    HE2  PHE  78           2HE      PHE  78  -7.477   8.846  -1.115
  628    HZ   PHE  78           HZ       PHE  78  -6.016   9.928   0.527
  629    H    GLU  79           H        GLU  79  -3.915   7.705  -4.409
  630    HA   GLU  79           HA       GLU  79  -1.189   7.324  -4.489
  631   1HB   GLU  79          1HB       GLU  79  -0.744   6.958  -6.869
  632   2HB   GLU  79          2HB       GLU  79  -1.695   5.628  -6.240
  633   1HG   GLU  79          1HG       GLU  79  -3.785   6.894  -7.076
  634   2HG   GLU  79          2HG       GLU  79  -2.689   7.973  -7.916
  635    H    THR  80           H        THR  80  -2.966   9.343  -3.663
  636    HA   THR  80           HA       THR  80  -3.455  11.509  -3.872
  637    HB   THR  80           HB       THR  80  -1.540  12.874  -4.402
  638    HG1  THR  80           1HG      THR  80  -0.639  12.347  -6.352
  639   1HG2  THR  80          1HG2      THR  80  -0.032  10.287  -4.040
  640   2HG2  THR  80          2HG2      THR  80   0.194  11.847  -3.213
  641   3HG2  THR  80          3HG2      THR  80  -1.144  10.774  -2.739
  642    H    GLY  81           H        GLY  81  -5.293  11.911  -4.956
  643   1HA   GLY  81          1HA       GLY  81  -5.694  11.308  -7.672
  644   2HA   GLY  81          2HA       GLY  81  -6.683  12.349  -6.667
  645    H    HIS  82           H        HIS  82  -4.278  12.196  -9.184
  646    HA   HIS  82           HA       HIS  82  -4.542  15.037  -9.556
  647   1HB   HIS  82          1HB       HIS  82  -2.298  14.041  -8.171
  648   2HB   HIS  82          2HB       HIS  82  -1.730  14.379  -9.793
  649    HD1  HIS  82           1HD      HIS  82  -0.313  16.345  -8.641
  650    HD2  HIS  82           2HD      HIS  82  -4.479  16.832  -8.600
  651    HE1  HIS  82           1HE      HIS  82  -0.740  18.799  -8.089
  652    H    CYS  83           H        CYS  83  -5.590  14.637 -11.512
  653    HA   CYS  83           HA       CYS  83  -3.886  13.990 -13.677
  654   1HB   CYS  83          1HB       CYS  83  -4.664  11.702 -12.642
  655   2HB   CYS  83          2HB       CYS  83  -6.182  12.058 -13.440
  656    HG   CYS  83           HG       CYS  83  -4.823  12.770 -15.759
  657    H    LEU  84           H        LEU  84  -4.719  15.025 -15.516
  658    HA   LEU  84           HA       LEU  84  -7.494  15.962 -15.293
  659   1HB   LEU  84          1HB       LEU  84  -5.022  17.451 -16.160
  660   2HB   LEU  84          2HB       LEU  84  -6.636  17.975 -16.600
  661    HG   LEU  84           HG       LEU  84  -5.782  19.200 -14.669
  662   1HD1  LEU  84          1HD1      LEU  84  -7.944  17.470 -13.523
  663   2HD1  LEU  84          2HD1      LEU  84  -7.753  19.239 -13.484
  664   3HD1  LEU  84          3HD1      LEU  84  -8.269  18.433 -14.985
  665   1HD2  LEU  84          1HD2      LEU  84  -4.944  18.296 -12.758
  666   2HD2  LEU  84          2HD2      LEU  84  -5.948  16.830 -12.871
  667   3HD2  LEU  84          3HD2      LEU  84  -4.501  16.999 -13.894
  668    H    ASN  85           H        ASN  85  -6.847  13.483 -16.439
  669    HA   ASN  85           HA       ASN  85  -7.252  12.324 -18.227
  670   1HB   ASN  85          1HB       ASN  85  -8.515  14.932 -18.905
  671   2HB   ASN  85          2HB       ASN  85  -8.070  13.997 -20.319
  672   1HD2  ASN  85          1HD2      ASN  85  -8.702  11.688 -20.323
  673   2HD2  ASN  85          2HD2      ASN  85 -10.246  11.245 -19.675
  674    H    GLU  86           H        GLU  86  -5.308  11.583 -19.112
  675    HA   GLU  86           HA       GLU  86  -4.245  12.728 -21.364
  676   1HB   GLU  86          1HB       GLU  86  -3.242  13.930 -18.894
  677   2HB   GLU  86          2HB       GLU  86  -1.939  13.167 -19.783
  678   1HG   GLU  86          1HG       GLU  86  -3.329  14.442 -21.821
  679   2HG   GLU  86          2HG       GLU  86  -3.562  15.556 -20.488
  680    H    THR  87           H        THR  87  -2.984  11.174 -22.390
  681    HA   THR  87           HA       THR  87  -2.639   8.690 -20.966
  682    HB   THR  87           HB       THR  87  -1.703   9.303 -23.793
  683    HG1  THR  87           1HG      THR  87  -4.409   8.748 -22.803
  684   1HG2  THR  87          1HG2      THR  87  -2.266   7.049 -24.219
  685   2HG2  THR  87          2HG2      THR  87  -1.689   6.943 -22.539
  686   3HG2  THR  87          3HG2      THR  87  -3.435   6.989 -22.878
  687    H    ASN  88           H        ASN  88  -1.169  10.285 -19.473
  688    HA   ASN  88           HA       ASN  88   1.492   9.436 -20.202
  689   1HB   ASN  88          1HB       ASN  88   1.374  11.794 -20.975
  690   2HB   ASN  88          2HB       ASN  88   0.751  12.304 -19.419
  691   1HD2  ASN  88          1HD2      ASN  88   2.434  13.722 -19.085
  692   2HD2  ASN  88          2HD2      ASN  88   4.038  13.222 -18.665
  693    H    VAL  89           H        VAL  89   0.082   8.066 -18.364
  694    HA   VAL  89           HA       VAL  89   0.719   9.265 -15.761
  695    HB   VAL  89           HB       VAL  89  -1.063   6.900 -16.011
  696   1HG1  VAL  89          1HG1      VAL  89  -0.578   7.803 -13.814
  697   2HG1  VAL  89          2HG1      VAL  89  -1.092   9.428 -14.328
  698   3HG1  VAL  89          3HG1      VAL  89  -2.285   8.112 -14.212
  699   1HG2  VAL  89          1HG2      VAL  89  -2.044   8.062 -17.795
  700   2HG2  VAL  89          2HG2      VAL  89  -3.005   8.564 -16.383
  701   3HG2  VAL  89          3HG2      VAL  89  -1.759   9.650 -17.044
  702    H    THR  90           H        THR  90   3.012   8.633 -16.215
  703    HA   THR  90           HA       THR  90   3.383   5.797 -15.521
  704    HB   THR  90           HB       THR  90   3.841   6.485 -18.005
  705    HG1  THR  90           1HG      THR  90   4.699   4.608 -16.681
  706   1HG2  THR  90          1HG2      THR  90   5.521   8.395 -16.671
  707   2HG2  THR  90          2HG2      THR  90   6.597   7.167 -17.380
  708   3HG2  THR  90          3HG2      THR  90   5.452   8.051 -18.416
  709    H    LYS  91           H        LYS  91   3.516   8.879 -14.409
  710    HA   LYS  91           HA       LYS  91   5.713   8.165 -12.627
  711   1HB   LYS  91          1HB       LYS  91   6.854   9.551 -14.169
  712   2HB   LYS  91          2HB       LYS  91   5.523  10.685 -14.280
  713   1HG   LYS  91          1HG       LYS  91   6.284  10.475 -11.500
  714   2HG   LYS  91          2HG       LYS  91   7.742  10.715 -12.441
  715   1HD   LYS  91          1HD       LYS  91   7.226  12.924 -12.510
  716   2HD   LYS  91          2HD       LYS  91   5.918  12.514 -13.600
  717   1HE   LYS  91          1HE       LYS  91   4.366  13.048 -12.032
  718   2HE   LYS  91          2HE       LYS  91   5.078  11.933 -10.882
  719   1HZ   LYS  91          1HZ       LYS  91   6.826  13.891 -10.782
  720   2HZ   LYS  91          2HZ       LYS  91   5.500  14.764 -11.167
  721   3HZ   LYS  91          3HZ       LYS  91   5.506  13.839  -9.821
  722    H    ASP  92           H        ASP  92   4.544   7.849 -10.785
  723    HA   ASP  92           HA       ASP  92   3.208  10.160  -9.761
  724   1HB   ASP  92          1HB       ASP  92   1.233   8.489  -9.096
  725   2HB   ASP  92          2HB       ASP  92   1.205   9.361 -10.616
  726    H    VAL  93           H        VAL  93   2.495   9.649  -7.373
  727    HA   VAL  93           HA       VAL  93   3.990   7.390  -6.273
  728    HB   VAL  93           HB       VAL  93   4.808   8.896  -4.466
  729   1HG1  VAL  93          1HG1      VAL  93   5.722   9.395  -7.314
  730   2HG1  VAL  93          2HG1      VAL  93   6.610   9.965  -5.880
  731   3HG1  VAL  93          3HG1      VAL  93   6.370   8.221  -6.144
  732   1HG2  VAL  93          1HG2      VAL  93   3.972  10.958  -4.297
  733   2HG2  VAL  93          2HG2      VAL  93   4.847  11.388  -5.786
  734   3HG2  VAL  93          3HG2      VAL  93   3.165  10.813  -5.876
  735    H    VAL  94           H        VAL  94   3.403   7.298  -3.754
  736    HA   VAL  94           HA       VAL  94   0.666   8.172  -3.320
  737    HB   VAL  94           HB       VAL  94   0.352   6.054  -4.399
  738   1HG1  VAL  94          1HG1      VAL  94   2.813   5.349  -3.436
  739   2HG1  VAL  94          2HG1      VAL  94   1.738   4.401  -2.381
  740   3HG1  VAL  94          3HG1      VAL  94   1.639   4.217  -4.148
  741   1HG2  VAL  94          1HG2      VAL  94  -1.211   6.427  -2.648
  742   2HG2  VAL  94          2HG2      VAL  94  -0.681   4.735  -2.486
  743   3HG2  VAL  94          3HG2      VAL  94  -0.028   5.980  -1.394
  744    H    CYS  95           H        CYS  95   0.063   8.095  -1.035
  745    HA   CYS  95           HA       CYS  95   2.311   8.665   0.602
  746   1HB   CYS  95          1HB       CYS  95  -0.653   8.800   0.878
  747   2HB   CYS  95          2HB       CYS  95   0.264   8.635   2.362
  748    HG   CYS  95           HG       CYS  95   1.535  10.623   0.144
  749    H    LEU  96           H        LEU  96   3.228   7.357   2.229
  750    HA   LEU  96           HA       LEU  96   2.556   4.554   2.049
  751   1HB   LEU  96          1HB       LEU  96   4.740   6.053   3.499
  752   2HB   LEU  96          2HB       LEU  96   4.550   4.311   3.530
  753    HG   LEU  96           HG       LEU  96   4.576   5.212   0.792
  754   1HD1  LEU  96          1HD1      LEU  96   6.479   6.565   2.600
  755   2HD1  LEU  96          2HD1      LEU  96   7.198   5.809   1.158
  756   3HD1  LEU  96          3HD1      LEU  96   5.903   7.017   0.978
  757   1HD2  LEU  96          1HD2      LEU  96   6.308   3.422   2.498
  758   2HD2  LEU  96          2HD2      LEU  96   5.097   2.969   1.275
  759   3HD2  LEU  96          3HD2      LEU  96   6.636   3.711   0.773
  760    H    ASN  97           H        ASN  97   2.907   7.028   4.692
  761    HA   ASN  97           HA       ASN  97   1.999   5.537   6.729
  762   1HB   ASN  97          1HB       ASN  97   1.556   8.488   6.079
  763   2HB   ASN  97          2HB       ASN  97   1.024   7.805   7.603
  764   1HD2  ASN  97          1HD2      ASN  97   3.208   9.727   6.636
  765   2HD2  ASN  97          2HD2      ASN  97   4.644   9.217   7.459
  766    H    ASP  98           H        ASP  98   0.146   7.261   4.163
  767    HA   ASP  98           HA       ASP  98  -2.359   6.985   5.299
  768   1HB   ASP  98          1HB       ASP  98  -1.376   7.231   2.431
  769   2HB   ASP  98          2HB       ASP  98  -3.087   7.108   2.785
  770    H    VAL  99           H        VAL  99  -0.305   4.870   3.243
  771    HA   VAL  99           HA       VAL  99  -2.369   2.965   2.743
  772    HB   VAL  99           HB       VAL  99   0.635   2.905   2.417
  773   1HG1  VAL  99          1HG1      VAL  99  -1.176   1.013   0.963
  774   2HG1  VAL  99          2HG1      VAL  99   0.534   0.834   1.423
  775   3HG1  VAL  99          3HG1      VAL  99  -0.742   0.652   2.651
  776   1HG2  VAL  99          1HG2      VAL  99  -1.060   4.463   1.048
  777   2HG2  VAL  99          2HG2      VAL  99   0.361   3.700   0.295
  778   3HG2  VAL  99          3HG2      VAL  99  -1.250   2.965   0.105
  779    H    SER 100           H        SER 100   0.171   3.492   5.193
  780    HA   SER 100           HA       SER 100   0.132   0.931   6.249
  781   1HB   SER 100          1HB       SER 100   1.523   1.791   7.897
  782   2HB   SER 100          2HB       SER 100   1.710   3.023   6.665
  783    HG   SER 100           HG       SER 100   1.285   3.919   8.798
  784    H    CYS 101           H        CYS 101  -2.186   3.528   6.334
  785    HA   CYS 101           HA       CYS 101  -3.366   2.819   8.822
  786   1HB   CYS 101          1HB       CYS 101  -3.440   5.097   7.561
  787   2HB   CYS 101          2HB       CYS 101  -4.761   4.386   6.654
  788    HG   CYS 101           HG       CYS 101  -6.387   3.992   8.498
  789    H    TYR 102           H        TYR 102  -4.106   2.337   5.300
  790    HA   TYR 102           HA       TYR 102  -6.471   0.964   5.550
  791   1HB   TYR 102          1HB       TYR 102  -5.678   1.588   3.363
  792   2HB   TYR 102          2HB       TYR 102  -4.055   1.017   3.694
  793    HD1  TYR 102           1HD      TYR 102  -3.539  -1.426   3.584
  794    HD2  TYR 102           2HD      TYR 102  -7.353   0.132   2.429
  795    HE1  TYR 102           1HE      TYR 102  -4.054  -3.586   2.347
  796    HE2  TYR 102           2HE      TYR 102  -7.855  -2.034   1.195
  797    HH   TYR 102           HH       TYR 102  -7.189  -4.036   0.736
  798    H    PHE 103           H        PHE 103  -3.083  -0.313   5.643
  799    HA   PHE 103           HA       PHE 103  -3.881  -3.001   5.852
  800   1HB   PHE 103          1HB       PHE 103  -1.394  -1.354   6.577
  801   2HB   PHE 103          2HB       PHE 103  -1.415  -3.094   6.780
  802    HD1  PHE 103           1HD      PHE 103  -0.148  -0.745   4.745
  803    HD2  PHE 103           2HD      PHE 103  -2.610  -4.190   4.460
  804    HE1  PHE 103           1HE      PHE 103   0.535  -1.035   2.347
  805    HE2  PHE 103           2HE      PHE 103  -1.927  -4.480   2.062
  806    HZ   PHE 103           HZ       PHE 103  -0.363  -2.899   1.034
  807    H    SER 104           H        SER 104  -3.375  -0.370   8.211
  808    HA   SER 104           HA       SER 104  -3.095  -1.922  10.463
  809   1HB   SER 104          1HB       SER 104  -2.695   0.520  10.391
  810   2HB   SER 104          2HB       SER 104  -4.404   0.815  10.143
  811    HG   SER 104           HG       SER 104  -3.677   1.062  12.396
  812    H    LEU 105           H        LEU 105  -6.017  -0.760   8.706
  813    HA   LEU 105           HA       LEU 105  -7.827  -1.735  10.671
  814   1HB   LEU 105          1HB       LEU 105  -7.969  -0.475   7.990
  815   2HB   LEU 105          2HB       LEU 105  -9.342  -1.453   8.470
  816    HG   LEU 105           HG       LEU 105  -8.860   0.137  10.708
  817   1HD1  LEU 105          1HD1      LEU 105  -7.321   1.569   9.557
  818   2HD1  LEU 105          2HD1      LEU 105  -8.439   1.758   8.185
  819   3HD1  LEU 105          3HD1      LEU 105  -8.852   2.450   9.772
  820   1HD2  LEU 105          1HD2      LEU 105 -10.957   1.256  10.067
  821   2HD2  LEU 105          2HD2      LEU 105 -10.837   0.531   8.445
  822   3HD2  LEU 105          3HD2      LEU 105 -11.045  -0.511   9.873
  823    H    LEU 106           H        LEU 106  -6.334  -2.991   7.668
  824    HA   LEU 106           HA       LEU 106  -7.954  -5.170   7.247
  825   1HB   LEU 106          1HB       LEU 106  -5.297  -4.268   6.487
  826   2HB   LEU 106          2HB       LEU 106  -5.373  -6.013   6.636
  827    HG   LEU 106           HG       LEU 106  -7.551  -5.744   5.165
  828   1HD1  LEU 106          1HD1      LEU 106  -7.282  -3.910   3.502
  829   2HD1  LEU 106          2HD1      LEU 106  -7.676  -3.345   5.144
  830   3HD1  LEU 106          3HD1      LEU 106  -6.009  -3.215   4.534
  831   1HD2  LEU 106          1HD2      LEU 106  -4.977  -6.575   4.708
  832   2HD2  LEU 106          2HD2      LEU 106  -6.332  -6.720   3.564
  833   3HD2  LEU 106          3HD2      LEU 106  -5.209  -5.345   3.443
  834    H    GLU 107           H        GLU 107  -4.824  -5.145   9.104
  835    HA   GLU 107           HA       GLU 107  -5.295  -7.702  10.126
  836   1HB   GLU 107          1HB       GLU 107  -3.323  -7.294  11.503
  837   2HB   GLU 107          2HB       GLU 107  -3.041  -6.645   9.901
  838   1HG   GLU 107          1HG       GLU 107  -3.842  -4.370  10.810
  839   2HG   GLU 107          2HG       GLU 107  -3.796  -5.084  12.409
  840    H    GLY 108           H        GLY 108  -6.181  -4.422  11.163
  841   1HA   GLY 108          1HA       GLY 108  -6.642  -4.705  13.844
  842   2HA   GLY 108          2HA       GLY 108  -7.604  -3.720  12.760
  843    H    GLY 109           H        GLY 109  -8.941  -5.493  11.133
  844   1HA   GLY 109          1HA       GLY 109 -10.447  -7.156  13.064
  845   2HA   GLY 109          2HA       GLY 109 -11.185  -6.233  11.770
  846    H    ARG 110           H        ARG 110  -8.524  -8.677  12.220
  847    HA   ARG 110           HA       ARG 110  -9.148  -9.692   9.603
  848   1HB   ARG 110          1HB       ARG 110  -7.108 -11.089   9.923
  849   2HB   ARG 110          2HB       ARG 110  -6.767  -9.398  10.230
  850   1HG   ARG 110          1HG       ARG 110  -6.238  -9.793  12.412
  851   2HG   ARG 110          2HG       ARG 110  -7.680 -10.755  12.672
  852   1HD   ARG 110          1HD       ARG 110  -6.302 -12.541  11.174
  853   2HD   ARG 110          2HD       ARG 110  -4.934 -11.642  11.802
  854    HE   ARG 110           HE       ARG 110  -6.811 -12.297  13.918
  855   1HH1  ARG 110          2HH2      ARG 110  -4.230 -13.640  11.939
  856   2HH1  ARG 110          1HH2      ARG 110  -3.790 -14.844  13.104
  857   1HH2  ARG 110          2HH1      ARG 110  -6.231 -13.885  15.455
  858   2HH2  ARG 110          1HH1      ARG 110  -4.936 -14.984  15.117
  859    HA   PRO 111           HA       PRO 111 -11.358 -13.100  11.194
  860   1HB   PRO 111          1HB       PRO 111 -11.109 -14.914   9.165
  861   2HB   PRO 111          2HB       PRO 111 -12.255 -13.588   9.130
  862   1HG   PRO 111          1HG       PRO 111  -9.702 -13.870   7.667
  863   2HG   PRO 111          2HG       PRO 111 -11.042 -12.788   7.339
  864   1HD   PRO 111          1HD       PRO 111  -8.543 -12.102   8.569
  865   2HD   PRO 111          2HD       PRO 111  -9.926 -11.049   8.346
  866    H    GLU 112           H        GLU 112 -11.322 -15.237  12.125
  867    HA   GLU 112           HA       GLU 112  -8.749 -15.689  13.180
  868   1HB   GLU 112          1HB       GLU 112 -11.138 -16.118  14.210
  869   2HB   GLU 112          2HB       GLU 112 -11.038 -17.663  13.389
  870   1HG   GLU 112          1HG       GLU 112  -9.846 -18.433  15.159
  871   2HG   GLU 112          2HG       GLU 112  -8.523 -17.411  14.632
  872    H    ASP 113           H        ASP 113 -10.507 -16.805  10.369
  873    HA   ASP 113           HA       ASP 113  -8.309 -18.060   9.312
  874   1HB   ASP 113          1HB       ASP 113  -9.046 -19.745  11.180
  875   2HB   ASP 113          2HB       ASP 113 -10.405 -20.105  10.135
  876    H    LYS 114           H        LYS 114  -8.816 -17.524   7.183
  877    HA   LYS 114           HA       LYS 114 -11.488 -17.128   6.357
  878   1HB   LYS 114          1HB       LYS 114  -8.804 -16.705   5.321
  879   2HB   LYS 114          2HB       LYS 114  -9.868 -17.326   4.075
  880   1HG   LYS 114          1HG       LYS 114 -11.143 -15.248   5.762
  881   2HG   LYS 114          2HG       LYS 114  -9.727 -14.667   4.909
  882   1HD   LYS 114          1HD       LYS 114 -11.230 -14.334   3.201
  883   2HD   LYS 114          2HD       LYS 114 -10.912 -16.025   2.870
  884   1HE   LYS 114          1HE       LYS 114 -12.864 -16.519   4.546
  885   2HE   LYS 114          2HE       LYS 114 -13.272 -14.824   4.368
  886   1HZ   LYS 114          1HZ       LYS 114 -13.170 -16.850   2.251
  887   2HZ   LYS 114          2HZ       LYS 114 -14.470 -16.002   2.760
  888   3HZ   LYS 114          3HZ       LYS 114 -13.279 -15.252   1.932
  889    H    LEU 115           H        LEU 115 -12.087 -18.240   4.055
  890    HA   LEU 115           HA       LEU 115 -12.882 -20.789   4.647
  891   1HB   LEU 115          1HB       LEU 115 -12.720 -19.084   2.255
  892   2HB   LEU 115          2HB       LEU 115 -12.753 -20.803   1.917
  893    HG   LEU 115           HG       LEU 115 -14.800 -20.757   3.613
  894   1HD1  LEU 115          1HD1      LEU 115 -15.791 -18.796   4.046
  895   2HD1  LEU 115          2HD1      LEU 115 -14.216 -18.082   3.624
  896   3HD1  LEU 115          3HD1      LEU 115 -15.507 -18.174   2.403
  897   1HD2  LEU 115          1HD2      LEU 115 -16.284 -20.269   1.571
  898   2HD2  LEU 115          2HD2      LEU 115 -14.756 -20.079   0.677
  899   3HD2  LEU 115          3HD2      LEU 115 -15.136 -21.626   1.472
  900    H    GLU 116           H        GLU 116 -12.228 -22.744   3.025
  901    HA   GLU 116           HA       GLU 116  -9.376 -22.833   2.702
  902   1HB   GLU 116          1HB       GLU 116 -10.383 -25.223   4.146
  903   2HB   GLU 116          2HB       GLU 116  -8.869 -24.361   4.331
  904   1HG   GLU 116          1HG       GLU 116 -10.091 -22.524   5.550
  905   2HG   GLU 116          2HG       GLU 116 -11.576 -23.444   5.411
  906    H    TRP 117           H        TRP 117  -8.862 -23.994   0.872
  907    HA   TRP 117           HA       TRP 117 -11.050 -25.573  -0.289
  908   1HB   TRP 117          1HB       TRP 117  -8.711 -24.603  -1.877
  909   2HB   TRP 117          2HB       TRP 117 -10.345 -24.968  -2.395
  910    HD1  TRP 117           HD       TRP 117  -8.202 -22.058  -1.420
  911    HE1  TRP 117           1HE      TRP 117  -9.546 -19.790  -1.291
  912    HE3  TRP 117           3HE      TRP 117 -12.821 -24.175  -1.613
  913    HZ2  TRP 117           2HZ      TRP 117 -12.327 -19.151  -1.285
  914    HZ3  TRP 117           3HZ      TRP 117 -14.798 -22.659  -1.541
  915    HH2  TRP 117           HH       TRP 117 -14.606 -20.227  -1.383
  916    H    SER 118           H        SER 118 -10.315 -27.294   1.310
  917    HA   SER 118           HA       SER 118  -8.733 -29.137  -0.019
  918   1HB   SER 118          1HB       SER 118  -6.853 -27.685   0.713
  919   2HB   SER 118          2HB       SER 118  -7.379 -27.821   2.379
  920    HG   SER 118           HG       SER 118  -6.760 -30.162   0.812
  Start of MODEL    3
    1   1H    MET   1           H        MET   1 -21.539  -1.430   7.426
    2    HA   MET   1           HA       MET   1 -22.216   1.011   7.852
    3   1HB   MET   1          1HB       MET   1 -19.768   1.419   6.724
    4   2HB   MET   1          2HB       MET   1 -20.720   1.411   5.253
    5   1HG   MET   1          1HG       MET   1 -22.150   3.230   6.103
    6   2HG   MET   1          2HG       MET   1 -21.364   3.171   7.667
    7   1HE   MET   1          1HE       MET   1 -19.593   2.903   4.022
    8   2HE   MET   1          2HE       MET   1 -21.109   3.834   3.957
    9   3HE   MET   1          3HE       MET   1 -19.548   4.656   3.720
   10    H    ALA   2           H        ALA   2 -23.465  -1.339   7.144
   11    HA   ALA   2           HA       ALA   2 -24.836  -2.349   5.686
   12   1HB   ALA   2          1HB       ALA   2 -26.411  -0.356   4.685
   13   2HB   ALA   2          2HB       ALA   2 -26.540  -0.988   6.344
   14   3HB   ALA   2          3HB       ALA   2 -25.613   0.498   6.027
   15    H    LYS   3           H        LYS   3 -22.237  -1.805   4.534
   16    HA   LYS   3           HA       LYS   3 -22.837  -2.258   1.848
   17   1HB   LYS   3          1HB       LYS   3 -23.420   0.165   1.893
   18   2HB   LYS   3          2HB       LYS   3 -21.777   0.535   2.373
   19   1HG   LYS   3          1HG       LYS   3 -21.243   0.591   0.168
   20   2HG   LYS   3          2HG       LYS   3 -21.435  -1.151   0.151
   21   1HD   LYS   3          1HD       LYS   3 -24.039  -0.504  -0.105
   22   2HD   LYS   3          2HD       LYS   3 -23.369   0.984  -0.742
   23   1HE   LYS   3          1HE       LYS   3 -21.855  -1.084  -1.969
   24   2HE   LYS   3          2HE       LYS   3 -23.510  -1.659  -1.995
   25   1HZ   LYS   3          1HZ       LYS   3 -24.112  -0.039  -3.390
   26   2HZ   LYS   3          2HZ       LYS   3 -23.155   1.100  -2.716
   27   3HZ   LYS   3          3HZ       LYS   3 -22.524   0.020  -3.767
   28    H    GLU   4           H        GLU   4 -20.106  -0.315   1.762
   29    HA   GLU   4           HA       GLU   4 -18.217  -1.579   3.209
   30   1HB   GLU   4          1HB       GLU   4 -18.582  -3.724   2.282
   31   2HB   GLU   4          2HB       GLU   4 -18.869  -3.094   0.673
   32   1HG   GLU   4          1HG       GLU   4 -16.510  -2.540   0.381
   33   2HG   GLU   4          2HG       GLU   4 -16.164  -2.877   2.066
   34    H    ARG   5           H        ARG   5 -16.066  -0.818   2.664
   35    HA   ARG   5           HA       ARG   5 -16.208   1.441   0.919
   36   1HB   ARG   5          1HB       ARG   5 -15.029   1.261   3.270
   37   2HB   ARG   5          2HB       ARG   5 -13.718   0.496   2.394
   38   1HG   ARG   5          1HG       ARG   5 -12.946   2.586   1.948
   39   2HG   ARG   5          2HG       ARG   5 -14.281   2.745   0.823
   40   1HD   ARG   5          1HD       ARG   5 -14.946   3.258   3.700
   41   2HD   ARG   5          2HD       ARG   5 -13.883   4.430   2.947
   42    HE   ARG   5           HE       ARG   5 -16.710   3.972   2.314
   43   1HH1  ARG   5          2HH2      ARG   5 -13.664   5.290   1.145
   44   2HH1  ARG   5          1HH2      ARG   5 -14.416   6.362   0.011
   45   1HH2  ARG   5          2HH1      ARG   5 -17.703   5.386   0.818
   46   2HH2  ARG   5          1HH1      ARG   5 -16.729   6.417  -0.176
   47    H    GLY   6           H        GLY   6 -16.518  -0.845  -0.619
   48   1HA   GLY   6          1HA       GLY   6 -15.725  -1.807  -2.491
   49   2HA   GLY   6          2HA       GLY   6 -14.409  -0.650  -2.482
   50    H    LEU   7           H        LEU   7 -12.543  -1.088  -0.927
   51    HA   LEU   7           HA       LEU   7 -10.926  -2.403  -0.202
   52   1HB   LEU   7          1HB       LEU   7 -13.006  -4.516   0.342
   53   2HB   LEU   7          2HB       LEU   7 -11.444  -4.319   1.112
   54    HG   LEU   7           HG       LEU   7 -13.745  -2.362   1.359
   55   1HD1  LEU   7          1HD1      LEU   7 -14.146  -4.636   2.372
   56   2HD1  LEU   7          2HD1      LEU   7 -12.774  -4.312   3.457
   57   3HD1  LEU   7          3HD1      LEU   7 -14.213  -3.265   3.505
   58   1HD2  LEU   7          1HD2      LEU   7 -12.100  -1.895   3.480
   59   2HD2  LEU   7          2HD2      LEU   7 -10.923  -2.304   2.209
   60   3HD2  LEU   7          3HD2      LEU   7 -12.083  -0.977   1.955
   61    H    ILE   8           H        ILE   8 -11.388  -2.265  -2.985
   62    HA   ILE   8           HA       ILE   8 -11.151  -3.373  -4.914
   63    HB   ILE   8           HB       ILE   8  -9.039  -4.920  -4.747
   64   1HG1  ILE   8          1HG1      ILE   8  -8.972  -3.472  -2.083
   65   2HG1  ILE   8          2HG1      ILE   8  -9.093  -5.204  -2.320
   66   1HG2  ILE   8          1HG2      ILE   8  -8.581  -3.025  -5.885
   67   2HG2  ILE   8          2HG2      ILE   8  -9.372  -1.975  -4.685
   68   3HG2  ILE   8          3HG2      ILE   8  -7.732  -2.595  -4.381
   69   1HD1  ILE   8          1HD1      ILE   8  -6.869  -4.673  -3.835
   70   2HD1  ILE   8          2HD1      ILE   8  -6.726  -3.415  -2.584
   71   3HD1  ILE   8          3HD1      ILE   8  -6.810  -5.131  -2.116
   72    H    SER   9           H        SER   9 -13.321  -4.449  -3.585
   73    HA   SER   9           HA       SER   9 -14.589  -6.205  -3.418
   74   1HB   SER   9          1HB       SER   9 -13.109  -6.521  -5.905
   75   2HB   SER   9          2HB       SER   9 -13.503  -8.098  -5.250
   76    HG   SER   9           HG       SER   9 -15.276  -7.507  -6.486
   77    HA   PRO  10           HA       PRO  10 -12.775  -9.376  -1.041
   78   1HB   PRO  10          1HB       PRO  10 -14.256 -11.621  -1.528
   79   2HB   PRO  10          2HB       PRO  10 -14.795 -10.327  -0.478
   80   1HG   PRO  10          1HG       PRO  10 -15.683 -10.980  -3.220
   81   2HG   PRO  10          2HG       PRO  10 -16.481  -9.989  -2.015
   82   1HD   PRO  10          1HD       PRO  10 -15.024  -9.064  -4.306
   83   2HD   PRO  10          2HD       PRO  10 -15.722  -8.075  -3.039
   84    H    SER  11           H        SER  11 -12.330  -9.370  -4.255
   85    HA   SER  11           HA       SER  11 -11.060 -11.905  -4.437
   86   1HB   SER  11          1HB       SER  11 -11.826  -9.732  -6.232
   87   2HB   SER  11          2HB       SER  11 -10.189 -10.254  -6.576
   88    HG   SER  11           HG       SER  11 -12.637 -11.675  -6.825
   89    H    ASP  12           H        ASP  12 -10.008  -8.429  -4.352
   90    HA   ASP  12           HA       ASP  12  -7.280  -9.134  -4.340
   91   1HB   ASP  12          1HB       ASP  12  -8.814  -6.574  -3.732
   92   2HB   ASP  12          2HB       ASP  12  -7.069  -6.646  -3.587
   93    H    PHE  13           H        PHE  13  -9.691  -7.916  -1.905
   94    HA   PHE  13           HA       PHE  13  -7.998  -7.740   0.264
   95   1HB   PHE  13          1HB       PHE  13 -10.396  -6.939   0.051
   96   2HB   PHE  13          2HB       PHE  13 -10.944  -8.603   0.028
   97    HD1  PHE  13           1HD      PHE  13 -10.932  -9.946   2.070
   98    HD2  PHE  13           2HD      PHE  13  -9.698  -5.886   2.118
   99    HE1  PHE  13           1HE      PHE  13 -11.131  -9.915   4.572
  100    HE2  PHE  13           2HE      PHE  13  -9.897  -5.855   4.620
  101    HZ   PHE  13           HZ       PHE  13 -10.611  -7.870   5.817
  102    H    ALA  14           H        ALA  14  -9.568 -10.571  -1.237
  103    HA   ALA  14           HA       ALA  14  -9.258 -12.329   0.924
  104   1HB   ALA  14          1HB       ALA  14  -9.280 -14.013  -1.122
  105   2HB   ALA  14          2HB       ALA  14 -10.734 -13.074  -0.707
  106   3HB   ALA  14          3HB       ALA  14  -9.688 -12.547  -2.047
  107    H    GLN  15           H        GLN  15  -7.242 -11.855  -2.068
  108    HA   GLN  15           HA       GLN  15  -5.278 -13.616  -1.370
  109   1HB   GLN  15          1HB       GLN  15  -5.755 -11.799  -3.444
  110   2HB   GLN  15          2HB       GLN  15  -4.256 -11.218  -2.748
  111   1HG   GLN  15          1HG       GLN  15  -3.595 -12.820  -4.398
  112   2HG   GLN  15          2HG       GLN  15  -3.393 -13.639  -2.862
  113   1HE2  GLN  15          1HE2      GLN  15  -5.655 -13.128  -5.536
  114   2HE2  GLN  15          2HE2      GLN  15  -6.436 -14.673  -5.476
  115    H    LEU  16           H        LEU  16  -5.332 -10.015  -0.843
  116    HA   LEU  16           HA       LEU  16  -2.948  -9.798   0.483
  117   1HB   LEU  16          1HB       LEU  16  -5.105  -8.170  -0.154
  118   2HB   LEU  16          2HB       LEU  16  -5.033  -8.098   1.596
  119    HG   LEU  16           HG       LEU  16  -3.735  -6.295   0.865
  120   1HD1  LEU  16          1HD1      LEU  16  -2.408  -8.537   2.099
  121   2HD1  LEU  16          2HD1      LEU  16  -1.254  -7.591   1.128
  122   3HD1  LEU  16          3HD1      LEU  16  -2.212  -6.793   2.398
  123   1HD2  LEU  16          1HD2      LEU  16  -2.623  -6.130  -1.075
  124   2HD2  LEU  16          2HD2      LEU  16  -1.822  -7.707  -0.871
  125   3HD2  LEU  16          3HD2      LEU  16  -3.484  -7.628  -1.504
  126    H    GLN  17           H        GLN  17  -6.232 -10.386   1.919
  127    HA   GLN  17           HA       GLN  17  -5.377 -10.562   4.512
  128   1HB   GLN  17          1HB       GLN  17  -7.773 -10.498   3.563
  129   2HB   GLN  17          2HB       GLN  17  -7.634 -12.229   3.333
  130   1HG   GLN  17          1HG       GLN  17  -6.752 -11.942   5.952
  131   2HG   GLN  17          2HG       GLN  17  -7.960 -10.677   5.847
  132   1HE2  GLN  17          1HE2      GLN  17  -9.951 -11.460   4.448
  133   2HE2  GLN  17          2HE2      GLN  17 -10.664 -12.950   4.969
  134    H    LYS  18           H        LYS  18  -6.021 -13.305   2.201
  135    HA   LYS  18           HA       LYS  18  -5.172 -15.344   3.811
  136   1HB   LYS  18          1HB       LYS  18  -6.301 -15.820   1.776
  137   2HB   LYS  18          2HB       LYS  18  -5.106 -14.977   0.812
  138   1HG   LYS  18          1HG       LYS  18  -3.490 -16.684   1.065
  139   2HG   LYS  18          2HG       LYS  18  -4.214 -17.297   2.538
  140   1HD   LYS  18          1HD       LYS  18  -6.156 -17.482   0.383
  141   2HD   LYS  18          2HD       LYS  18  -4.650 -18.208  -0.144
  142   1HE   LYS  18          1HE       LYS  18  -5.624 -18.889   2.627
  143   2HE   LYS  18          2HE       LYS  18  -6.486 -19.592   1.273
  144   1HZ   LYS  18          1HZ       LYS  18  -3.718 -19.790   0.867
  145   2HZ   LYS  18          2HZ       LYS  18  -4.106 -20.431   2.318
  146   3HZ   LYS  18          3HZ       LYS  18  -4.828 -20.984   0.961
  147    H    TYR  19           H        TYR  19  -3.167 -13.519   1.387
  148    HA   TYR  19           HA       TYR  19  -0.767 -14.735   1.970
  149   1HB   TYR  19          1HB       TYR  19  -1.719 -11.965   1.076
  150   2HB   TYR  19          2HB       TYR  19   0.000 -12.259   1.248
  151    HD1  TYR  19           1HD      TYR  19  -2.204 -14.974   0.125
  152    HD2  TYR  19           2HD      TYR  19   0.381 -11.805  -1.132
  153    HE1  TYR  19           1HE      TYR  19  -2.133 -15.952  -2.221
  154    HE2  TYR  19           2HE      TYR  19   0.443 -12.794  -3.473
  155    HH   TYR  19           HH       TYR  19  -1.591 -15.540  -4.324
  156    H    MET  20           H        MET  20  -2.406 -11.968   3.593
  157    HA   MET  20           HA       MET  20  -0.207 -11.313   5.186
  158   1HB   MET  20          1HB       MET  20  -1.956  -9.673   4.902
  159   2HB   MET  20          2HB       MET  20  -3.215 -10.820   5.312
  160   1HG   MET  20          1HG       MET  20  -2.401 -10.894   7.671
  161   2HG   MET  20          2HG       MET  20  -1.108  -9.781   7.270
  162   1HE   MET  20          1HE       MET  20  -1.403  -7.722   6.106
  163   2HE   MET  20          2HE       MET  20  -2.956  -7.419   5.291
  164   3HE   MET  20          3HE       MET  20  -2.514  -6.485   6.740
  165    H    GLU  21           H        GLU  21  -3.116 -13.395   5.718
  166    HA   GLU  21           HA       GLU  21  -2.900 -13.907   8.332
  167   1HB   GLU  21          1HB       GLU  21  -3.882 -15.396   5.963
  168   2HB   GLU  21          2HB       GLU  21  -3.499 -16.424   7.330
  169   1HG   GLU  21          1HG       GLU  21  -4.851 -14.331   8.563
  170   2HG   GLU  21          2HG       GLU  21  -5.677 -14.426   7.020
  171    H    TYR  22           H        TYR  22  -1.128 -15.670   5.694
  172    HA   TYR  22           HA       TYR  22   0.280 -17.397   7.342
  173   1HB   TYR  22          1HB       TYR  22  -0.017 -16.808   4.644
  174   2HB   TYR  22          2HB       TYR  22   1.577 -16.133   4.917
  175    HD1  TYR  22           1HD      TYR  22  -0.317 -19.136   4.345
  176    HD2  TYR  22           2HD      TYR  22   3.398 -17.662   5.872
  177    HE1  TYR  22           1HE      TYR  22   0.713 -21.447   4.090
  178    HE2  TYR  22           2HE      TYR  22   4.416 -19.978   5.611
  179    HH   TYR  22           HH       TYR  22   3.230 -22.265   3.733
  180    H    SER  23           H        SER  23   0.771 -13.954   6.607
  181    HA   SER  23           HA       SER  23   3.438 -14.010   7.629
  182   1HB   SER  23          1HB       SER  23   2.253 -12.412   5.819
  183   2HB   SER  23          2HB       SER  23   1.907 -11.446   7.240
  184    HG   SER  23           HG       SER  23   4.572 -12.417   6.910
  185    H    THR  24           H        THR  24   4.022 -12.337   9.434
  186    HA   THR  24           HA       THR  24   1.879 -11.929  11.355
  187    HB   THR  24           HB       THR  24   3.114 -14.292  11.576
  188    HG1  THR  24           1HG      THR  24   1.615 -13.293  13.111
  189   1HG2  THR  24          1HG2      THR  24   5.427 -13.100  11.660
  190   2HG2  THR  24          2HG2      THR  24   4.916 -12.484  13.250
  191   3HG2  THR  24          3HG2      THR  24   5.071 -14.237  12.982
  192    H    LYS  25           H        LYS  25   3.887 -10.445   9.509
  193    HA   LYS  25           HA       LYS  25   5.301  -8.961  11.589
  194   1HB   LYS  25          1HB       LYS  25   5.662  -9.334   8.636
  195   2HB   LYS  25          2HB       LYS  25   6.256  -7.863   9.379
  196   1HG   LYS  25          1HG       LYS  25   7.876  -8.968  10.627
  197   2HG   LYS  25          2HG       LYS  25   6.907 -10.417  10.810
  198   1HD   LYS  25          1HD       LYS  25   7.675 -11.354   8.846
  199   2HD   LYS  25          2HD       LYS  25   7.728  -9.817   8.005
  200   1HE   LYS  25          1HE       LYS  25   9.919  -9.435   8.572
  201   2HE   LYS  25          2HE       LYS  25   9.695  -9.997  10.217
  202   1HZ   LYS  25          1HZ       LYS  25  10.637 -11.873   9.612
  203   2HZ   LYS  25          2HZ       LYS  25   9.431 -12.185   8.556
  204   3HZ   LYS  25          3HZ       LYS  25  10.765 -11.385   8.059
  205    H    LYS  26           H        LYS  26   5.372  -6.472  11.137
  206    HA   LYS  26           HA       LYS  26   2.588  -5.666  10.697
  207   1HB   LYS  26          1HB       LYS  26   4.795  -4.374  12.326
  208   2HB   LYS  26          2HB       LYS  26   3.208  -3.676  12.070
  209   1HG   LYS  26          1HG       LYS  26   3.190  -6.507  13.015
  210   2HG   LYS  26          2HG       LYS  26   3.850  -5.356  14.160
  211   1HD   LYS  26          1HD       LYS  26   1.816  -4.356  14.534
  212   2HD   LYS  26          2HD       LYS  26   1.355  -4.425  12.845
  213   1HE   LYS  26          1HE       LYS  26   0.651  -6.735  13.027
  214   2HE   LYS  26          2HE       LYS  26   1.417  -6.922  14.592
  215   1HZ   LYS  26          1HZ       LYS  26  -1.150  -6.076  14.075
  216   2HZ   LYS  26          2HZ       LYS  26  -0.417  -6.193  15.530
  217   3HZ   LYS  26          3HZ       LYS  26  -0.370  -4.785  14.703
  218    H    VAL  27           H        VAL  27   2.088  -3.956   9.286
  219    HA   VAL  27           HA       VAL  27   3.820  -3.692   7.090
  220    HB   VAL  27           HB       VAL  27   1.326  -3.561   7.102
  221   1HG1  VAL  27          1HG1      VAL  27   0.940  -2.148   9.021
  222   2HG1  VAL  27          2HG1      VAL  27   1.859  -0.815   8.282
  223   3HG1  VAL  27          3HG1      VAL  27   0.308  -1.326   7.574
  224   1HG2  VAL  27          1HG2      VAL  27   1.738  -1.098   5.731
  225   2HG2  VAL  27          2HG2      VAL  27   3.223  -2.064   5.562
  226   3HG2  VAL  27          3HG2      VAL  27   1.657  -2.742   5.056
  227    H    SER  28           H        SER  28   3.418  -1.926  10.130
  228    HA   SER  28           HA       SER  28   4.602   0.448   9.289
  229   1HB   SER  28          1HB       SER  28   4.976   0.810  11.768
  230   2HB   SER  28          2HB       SER  28   3.324   0.421  11.332
  231    HG   SER  28           HG       SER  28   5.190  -1.627  12.139
  232    H    ASP  29           H        ASP  29   5.863  -2.736  10.020
  233    HA   ASP  29           HA       ASP  29   8.430  -1.916  10.800
  234   1HB   ASP  29          1HB       ASP  29   6.981  -4.349  10.529
  235   2HB   ASP  29          2HB       ASP  29   8.357  -4.520   9.458
  236    H    VAL  30           H        VAL  30   6.832  -2.919   7.714
  237    HA   VAL  30           HA       VAL  30   9.235  -2.829   6.192
  238    HB   VAL  30           HB       VAL  30   6.311  -2.870   5.422
  239   1HG1  VAL  30          1HG1      VAL  30   8.319  -3.861   3.495
  240   2HG1  VAL  30          2HG1      VAL  30   6.849  -2.893   3.230
  241   3HG1  VAL  30          3HG1      VAL  30   8.349  -2.102   3.770
  242   1HG2  VAL  30          1HG2      VAL  30   8.291  -4.948   6.173
  243   2HG2  VAL  30          2HG2      VAL  30   6.517  -4.945   6.311
  244   3HG2  VAL  30          3HG2      VAL  30   7.287  -5.307   4.748
  245    H    LEU  31           H        LEU  31   6.669  -0.543   7.125
  246    HA   LEU  31           HA       LEU  31   7.078   1.391   5.194
  247   1HB   LEU  31          1HB       LEU  31   5.561   1.057   7.507
  248   2HB   LEU  31          2HB       LEU  31   6.530   2.480   7.831
  249    HG   LEU  31           HG       LEU  31   5.654   3.043   5.311
  250   1HD1  LEU  31          1HD1      LEU  31   4.273   0.972   5.294
  251   2HD1  LEU  31          2HD1      LEU  31   3.331   1.635   6.651
  252   3HD1  LEU  31          3HD1      LEU  31   3.332   2.468   5.078
  253   1HD2  LEU  31          1HD2      LEU  31   4.146   4.617   6.339
  254   2HD2  LEU  31          2HD2      LEU  31   4.139   3.684   7.855
  255   3HD2  LEU  31          3HD2      LEU  31   5.627   4.499   7.319
  256    H    LYS  32           H        LYS  32   8.638   1.047   8.456
  257    HA   LYS  32           HA       LYS  32  10.325   3.237   8.166
  258   1HB   LYS  32          1HB       LYS  32  11.195   2.595  10.175
  259   2HB   LYS  32          2HB       LYS  32   9.697   1.687  10.213
  260   1HG   LYS  32          1HG       LYS  32  11.084  -0.226   9.053
  261   2HG   LYS  32          2HG       LYS  32  12.491   0.675   9.583
  262   1HD   LYS  32          1HD       LYS  32  11.609   0.607  11.946
  263   2HD   LYS  32          2HD       LYS  32  10.256  -0.359  11.393
  264   1HE   LYS  32          1HE       LYS  32  11.515  -2.270  11.252
  265   2HE   LYS  32          2HE       LYS  32  12.869  -1.439  10.513
  266   1HZ   LYS  32          1HZ       LYS  32  12.201  -1.460  13.373
  267   2HZ   LYS  32          2HZ       LYS  32  13.479  -2.187  12.663
  268   3HZ   LYS  32          3HZ       LYS  32  13.396  -0.557  12.722
  269    H    LEU  33           H        LEU  33  10.517  -0.108   6.958
  270    HA   LEU  33           HA       LEU  33  13.248  -0.065   6.319
  271   1HB   LEU  33          1HB       LEU  33  10.885  -1.732   5.737
  272   2HB   LEU  33          2HB       LEU  33  12.153  -1.794   4.529
  273    HG   LEU  33           HG       LEU  33  12.495  -2.390   7.481
  274   1HD1  LEU  33          1HD1      LEU  33  13.128  -4.667   6.036
  275   2HD1  LEU  33          2HD1      LEU  33  11.632  -4.375   6.955
  276   3HD1  LEU  33          3HD1      LEU  33  11.686  -4.031   5.209
  277   1HD2  LEU  33          1HD2      LEU  33  14.743  -3.274   6.708
  278   2HD2  LEU  33          2HD2      LEU  33  14.467  -2.383   5.192
  279   3HD2  LEU  33          3HD2      LEU  33  14.554  -1.504   6.738
  280    H    PHE  34           H        PHE  34  10.300   1.091   4.653
  281    HA   PHE  34           HA       PHE  34  11.741   1.644   2.237
  282   1HB   PHE  34          1HB       PHE  34   8.971   1.899   3.420
  283   2HB   PHE  34          2HB       PHE  34   9.342   3.026   2.131
  284    HD1  PHE  34           1HD      PHE  34   9.396  -0.613   2.917
  285    HD2  PHE  34           2HD      PHE  34   9.092   2.369  -0.087
  286    HE1  PHE  34           1HE      PHE  34   8.859  -2.380   1.217
  287    HE2  PHE  34           2HE      PHE  34   8.556   0.603  -1.787
  288    HZ   PHE  34           HZ       PHE  34   8.446  -1.751  -1.115
  289    H    GLU  35           H        GLU  35  11.386   3.168   5.305
  290    HA   GLU  35           HA       GLU  35  11.554   5.823   4.235
  291   1HB   GLU  35          1HB       GLU  35  11.737   4.839   7.117
  292   2HB   GLU  35          2HB       GLU  35  11.581   6.513   6.622
  293   1HG   GLU  35          1HG       GLU  35   9.512   4.849   5.369
  294   2HG   GLU  35          2HG       GLU  35   9.475   4.689   7.114
  295    H    ASP  36           H        ASP  36  13.599   3.700   6.373
  296    HA   ASP  36           HA       ASP  36  15.872   5.262   5.427
  297   1HB   ASP  36          1HB       ASP  36  15.096   4.955   8.016
  298   2HB   ASP  36          2HB       ASP  36  16.079   3.513   7.864
  299    H    GLY  37           H        GLY  37  14.397   2.064   6.034
  300   1HA   GLY  37          1HA       GLY  37  16.517   0.339   5.760
  301   2HA   GLY  37          2HA       GLY  37  14.875   0.015   5.240
  302    H    GLU  38           H        GLU  38  16.381  -1.280   3.627
  303    HA   GLU  38           HA       GLU  38  17.710   0.197   1.664
  304   1HB   GLU  38          1HB       GLU  38  16.937  -2.638   2.125
  305   2HB   GLU  38          2HB       GLU  38  17.120  -2.203   0.438
  306   1HG   GLU  38          1HG       GLU  38  19.269  -1.188   2.250
  307   2HG   GLU  38          2HG       GLU  38  19.206  -2.930   2.072
  308    H    MET  39           H        MET  39  14.351  -0.936   2.076
  309    HA   MET  39           HA       MET  39  13.508  -0.695  -0.525
  310   1HB   MET  39          1HB       MET  39  12.153  -0.317   2.188
  311   2HB   MET  39          2HB       MET  39  11.231  -0.158   0.706
  312   1HG   MET  39          1HG       MET  39  12.848  -2.628   1.506
  313   2HG   MET  39          2HG       MET  39  11.108  -2.476   1.649
  314   1HE   MET  39          1HE       MET  39  13.762  -2.799  -1.957
  315   2HE   MET  39          2HE       MET  39  14.128  -2.794  -0.215
  316   3HE   MET  39          3HE       MET  39  13.507  -4.271  -0.990
  317    H    ALA  40           H        ALA  40  14.631   1.752   1.627
  318    HA   ALA  40           HA       ALA  40  12.999   3.876   0.638
  319   1HB   ALA  40          1HB       ALA  40  14.215   5.210   2.130
  320   2HB   ALA  40          2HB       ALA  40  14.285   3.610   2.905
  321   3HB   ALA  40          3HB       ALA  40  15.682   4.213   1.983
  322    H    LYS  41           H        LYS  41  15.307   1.959  -0.831
  323    HA   LYS  41           HA       LYS  41  16.870   3.943  -2.117
  324   1HB   LYS  41          1HB       LYS  41  17.778   2.135  -3.379
  325   2HB   LYS  41          2HB       LYS  41  17.554   1.570  -1.736
  326   1HG   LYS  41          1HG       LYS  41  15.436   0.449  -2.373
  327   2HG   LYS  41          2HG       LYS  41  15.566   1.080  -4.003
  328   1HD   LYS  41          1HD       LYS  41  16.820  -0.712  -4.591
  329   2HD   LYS  41          2HD       LYS  41  18.057  -0.213  -3.454
  330   1HE   LYS  41          1HE       LYS  41  17.408  -1.746  -1.856
  331   2HE   LYS  41          2HE       LYS  41  15.702  -1.551  -2.206
  332   1HZ   LYS  41          1HZ       LYS  41  17.496  -3.471  -3.207
  333   2HZ   LYS  41          2HZ       LYS  41  15.866  -3.438  -3.303
  334   3HZ   LYS  41          3HZ       LYS  41  16.766  -2.687  -4.440
  335    H    TYR  42           H        TYR  42  13.699   2.458  -2.668
  336    HA   TYR  42           HA       TYR  42  13.539   3.936  -5.208
  337   1HB   TYR  42          1HB       TYR  42  12.200   1.438  -4.014
  338   2HB   TYR  42          2HB       TYR  42  11.557   2.209  -5.451
  339    HD1  TYR  42           1HD      TYR  42  12.967  -0.641  -4.790
  340    HD2  TYR  42           2HD      TYR  42  14.087   2.917  -6.885
  341    HE1  TYR  42           1HE      TYR  42  14.568  -1.987  -6.235
  342    HE2  TYR  42           2HE      TYR  42  15.685   1.559  -8.323
  343    HH   TYR  42           HH       TYR  42  15.654  -1.890  -8.284
  344    H    VAL  43           H        VAL  43  13.224   5.265  -2.661
  345    HA   VAL  43           HA       VAL  43  10.339   5.810  -2.791
  346    HB   VAL  43           HB       VAL  43  12.188   5.546  -0.432
  347   1HG1  VAL  43          1HG1      VAL  43   9.456   6.871  -0.395
  348   2HG1  VAL  43          2HG1      VAL  43  10.521   6.574   1.001
  349   3HG1  VAL  43          3HG1      VAL  43  11.010   7.728  -0.263
  350   1HG2  VAL  43          1HG2      VAL  43  11.060   3.662  -0.033
  351   2HG2  VAL  43          2HG2      VAL  43   9.500   4.515  -0.122
  352   3HG2  VAL  43          3HG2      VAL  43  10.250   3.875  -1.604
  353    H    GLN  44           H        GLN  44   9.732   7.980  -2.882
  354    HA   GLN  44           HA       GLN  44  11.979   9.771  -3.310
  355   1HB   GLN  44          1HB       GLN  44   9.087   9.804  -4.238
  356   2HB   GLN  44          2HB       GLN  44  10.085  11.241  -4.337
  357   1HG   GLN  44          1HG       GLN  44  11.738   9.238  -5.408
  358   2HG   GLN  44          2HG       GLN  44  10.146   8.800  -5.997
  359   1HE2  GLN  44          1HE2      GLN  44   9.000  10.174  -7.334
  360   2HE2  GLN  44          2HE2      GLN  44   9.722  11.503  -8.179
  361    H    GLY  45           H        GLY  45  12.546  10.661  -1.338
  362   1HA   GLY  45          1HA       GLY  45  12.379  11.902   0.526
  363   2HA   GLY  45          2HA       GLY  45  10.950  12.634  -0.175
  364    H    ASP  46           H        ASP  46   8.907  12.101   0.603
  365    HA   ASP  46           HA       ASP  46   8.898   9.973   2.598
  366   1HB   ASP  46          1HB       ASP  46   7.936  12.773   2.658
  367   2HB   ASP  46          2HB       ASP  46   6.710  11.629   3.166
  368    H    ALA  47           H        ALA  47   8.238  10.249  -0.463
  369    HA   ALA  47           HA       ALA  47   5.573   9.045  -0.258
  370   1HB   ALA  47          1HB       ALA  47   6.337  10.842  -2.566
  371   2HB   ALA  47          2HB       ALA  47   4.718  10.350  -2.011
  372   3HB   ALA  47          3HB       ALA  47   5.662  11.528  -1.068
  373    H    ILE  48           H        ILE  48   5.343   7.167  -1.440
  374    HA   ILE  48           HA       ILE  48   7.642   6.470  -3.134
  375    HB   ILE  48           HB       ILE  48   7.656   5.176  -1.112
  376   1HG1  ILE  48          1HG1      ILE  48   7.776   4.158  -3.656
  377   2HG1  ILE  48          2HG1      ILE  48   8.256   3.315  -2.196
  378   1HG2  ILE  48          1HG2      ILE  48   5.487   5.261  -0.250
  379   2HG2  ILE  48          2HG2      ILE  48   4.758   4.661  -1.759
  380   3HG2  ILE  48          3HG2      ILE  48   5.697   3.558  -0.724
  381   1HD1  ILE  48          1HD1      ILE  48   6.267   2.064  -2.088
  382   2HD1  ILE  48          2HD1      ILE  48   5.353   3.251  -3.048
  383   3HD1  ILE  48          3HD1      ILE  48   6.533   2.184  -3.844
  384    H    GLY  49           H        GLY  49   7.199   5.314  -5.095
  385   1HA   GLY  49          1HA       GLY  49   4.597   5.995  -6.203
  386   2HA   GLY  49          2HA       GLY  49   6.010   5.411  -7.060
  387    H    TYR  50           H        TYR  50   3.900   4.156  -7.948
  388    HA   TYR  50           HA       TYR  50   2.969   2.005  -6.362
  389   1HB   TYR  50          1HB       TYR  50   1.593   2.721  -8.195
  390   2HB   TYR  50          2HB       TYR  50   2.972   2.974  -9.246
  391    HD1  TYR  50           1HD      TYR  50   2.479   1.720 -11.165
  392    HD2  TYR  50           2HD      TYR  50   2.040  -0.094  -7.315
  393    HE1  TYR  50           1HE      TYR  50   2.045  -0.530 -12.266
  394    HE2  TYR  50           2HE      TYR  50   1.607  -2.338  -8.429
  395    HH   TYR  50           HH       TYR  50   0.673  -3.054 -10.727
  396    H    GLU  51           H        GLU  51   5.780   2.515  -8.457
  397    HA   GLU  51           HA       GLU  51   6.261  -0.174  -9.008
  398   1HB   GLU  51          1HB       GLU  51   7.271   2.063 -10.012
  399   2HB   GLU  51          2HB       GLU  51   8.488   1.858  -8.768
  400   1HG   GLU  51          1HG       GLU  51   8.331  -0.707  -9.827
  401   2HG   GLU  51          2HG       GLU  51   8.033   0.279 -11.244
  402    H    GLY  52           H        GLY  52   7.447   2.059  -6.418
  403   1HA   GLY  52          1HA       GLY  52   9.222   0.285  -5.183
  404   2HA   GLY  52          2HA       GLY  52   8.429   1.659  -4.438
  405    H    PHE  53           H        PHE  53   5.660   0.693  -4.952
  406    HA   PHE  53           HA       PHE  53   5.295  -0.741  -2.594
  407   1HB   PHE  53          1HB       PHE  53   3.778   0.209  -4.996
  408   2HB   PHE  53          2HB       PHE  53   3.058  -1.202  -4.245
  409    HD1  PHE  53           1HD      PHE  53   2.422   2.001  -4.441
  410    HD2  PHE  53           2HD      PHE  53   3.538  -0.735  -1.395
  411    HE1  PHE  53           1HE      PHE  53   1.334   3.471  -2.721
  412    HE2  PHE  53           2HE      PHE  53   2.450   0.735   0.324
  413    HZ   PHE  53           HZ       PHE  53   1.361   2.821  -0.359
  414    H    GLN  54           H        GLN  54   5.945  -1.771  -5.924
  415    HA   GLN  54           HA       GLN  54   4.881  -4.287  -5.849
  416   1HB   GLN  54          1HB       GLN  54   7.512  -3.539  -7.191
  417   2HB   GLN  54          2HB       GLN  54   6.405  -4.808  -7.676
  418   1HG   GLN  54          1HG       GLN  54   4.974  -2.272  -7.503
  419   2HG   GLN  54          2HG       GLN  54   6.393  -2.081  -8.514
  420   1HE2  GLN  54          1HE2      GLN  54   5.203  -1.860 -10.375
  421   2HE2  GLN  54          2HE2      GLN  54   4.389  -3.173 -11.158
  422    H    GLN  55           H        GLN  55   8.129  -3.123  -4.755
  423    HA   GLN  55           HA       GLN  55   8.926  -5.718  -3.975
  424   1HB   GLN  55          1HB       GLN  55  10.132  -3.141  -4.281
  425   2HB   GLN  55          2HB       GLN  55  10.427  -3.638  -2.627
  426   1HG   GLN  55          1HG       GLN  55  10.818  -5.833  -4.579
  427   2HG   GLN  55          2HG       GLN  55  11.884  -4.471  -4.859
  428   1HE2  GLN  55          1HE2      GLN  55  10.478  -5.832  -1.888
  429   2HE2  GLN  55          2HE2      GLN  55  11.968  -6.151  -1.063
  430    H    PHE  56           H        PHE  56   7.173  -3.030  -2.490
  431    HA   PHE  56           HA       PHE  56   7.633  -3.564   0.182
  432   1HB   PHE  56          1HB       PHE  56   6.352  -1.652  -1.085
  433   2HB   PHE  56          2HB       PHE  56   4.984  -2.746  -1.142
  434    HD1  PHE  56           1HD      PHE  56   4.019  -3.576   1.063
  435    HD2  PHE  56           2HD      PHE  56   6.765  -0.349   0.825
  436    HE1  PHE  56           1HE      PHE  56   3.301  -2.796   3.339
  437    HE2  PHE  56           2HE      PHE  56   6.047   0.430   3.101
  438    HZ   PHE  56           HZ       PHE  56   4.323  -0.803   4.330
  439    H    LEU  57           H        LEU  57   5.073  -4.857  -2.042
  440    HA   LEU  57           HA       LEU  57   3.719  -6.349  -0.148
  441   1HB   LEU  57          1HB       LEU  57   4.086  -6.629  -3.122
  442   2HB   LEU  57          2HB       LEU  57   3.101  -7.753  -2.206
  443    HG   LEU  57           HG       LEU  57   2.517  -4.861  -1.814
  444   1HD1  LEU  57          1HD1      LEU  57   1.445  -6.191  -4.290
  445   2HD1  LEU  57          2HD1      LEU  57   1.474  -4.466  -3.851
  446   3HD1  LEU  57          3HD1      LEU  57   2.979  -5.290  -4.324
  447   1HD2  LEU  57          1HD2      LEU  57   1.329  -7.217  -1.052
  448   2HD2  LEU  57          2HD2      LEU  57   0.547  -5.618  -1.078
  449   3HD2  LEU  57          3HD2      LEU  57   0.348  -6.729  -2.454
  450    H    LYS  58           H        LYS  58   6.896  -6.775  -1.536
  451    HA   LYS  58           HA       LYS  58   7.052  -9.578  -1.179
  452   1HB   LYS  58          1HB       LYS  58   8.479  -7.976  -2.648
  453   2HB   LYS  58          2HB       LYS  58   9.414  -7.706  -1.192
  454   1HG   LYS  58          1HG       LYS  58  10.565  -9.594  -1.721
  455   2HG   LYS  58          2HG       LYS  58   9.140 -10.491  -1.234
  456   1HD   LYS  58          1HD       LYS  58   8.451 -10.877  -3.422
  457   2HD   LYS  58          2HD       LYS  58   9.113  -9.367  -4.017
  458   1HE   LYS  58          1HE       LYS  58  11.424 -10.674  -3.257
  459   2HE   LYS  58          2HE       LYS  58  10.426 -12.033  -3.737
  460   1HZ   LYS  58          1HZ       LYS  58  11.507 -11.276  -5.644
  461   2HZ   LYS  58          2HZ       LYS  58   9.972 -10.742  -5.806
  462   3HZ   LYS  58          3HZ       LYS  58  11.154  -9.706  -5.363
  463    H    ILE  59           H        ILE  59   8.459  -6.807   0.714
  464    HA   ILE  59           HA       ILE  59   9.131  -8.529   2.873
  465    HB   ILE  59           HB       ILE  59   9.040  -5.521   2.626
  466   1HG1  ILE  59          1HG1      ILE  59  11.515  -7.237   2.637
  467   2HG1  ILE  59          2HG1      ILE  59  10.618  -6.986   1.153
  468   1HG2  ILE  59          1HG2      ILE  59   9.101  -6.973   4.979
  469   2HG2  ILE  59          2HG2      ILE  59  10.819  -6.642   4.652
  470   3HG2  ILE  59          3HG2      ILE  59   9.657  -5.297   4.756
  471   1HD1  ILE  59          1HD1      ILE  59  11.925  -4.875   2.913
  472   2HD1  ILE  59          2HD1      ILE  59  12.275  -5.254   1.209
  473   3HD1  ILE  59          3HD1      ILE  59  10.744  -4.460   1.648
  474    H    TYR  60           H        TYR  60   6.471  -6.204   2.152
  475    HA   TYR  60           HA       TYR  60   5.204  -5.978   4.490
  476   1HB   TYR  60          1HB       TYR  60   4.429  -5.115   2.272
  477   2HB   TYR  60          2HB       TYR  60   4.156  -6.748   1.698
  478    HD1  TYR  60           1HD      TYR  60   1.857  -5.944   1.063
  479    HD2  TYR  60           2HD      TYR  60   3.172  -6.107   5.131
  480    HE1  TYR  60           1HE      TYR  60  -0.556  -5.818   1.856
  481    HE2  TYR  60           2HE      TYR  60   0.755  -5.980   5.910
  482    HH   TYR  60           HH       TYR  60  -1.322  -5.411   5.240
  483    H    LEU  61           H        LEU  61   4.154  -8.597   2.204
  484    HA   LEU  61           HA       LEU  61   3.203 -10.094   4.493
  485   1HB   LEU  61          1HB       LEU  61   3.018 -10.857   1.586
  486   2HB   LEU  61          2HB       LEU  61   2.046 -11.436   2.924
  487    HG   LEU  61           HG       LEU  61   1.691  -8.627   2.854
  488   1HD1  LEU  61          1HD1      LEU  61   1.434  -9.862   0.098
  489   2HD1  LEU  61          2HD1      LEU  61   0.845  -8.253   0.581
  490   3HD1  LEU  61          3HD1      LEU  61   2.591  -8.602   0.591
  491   1HD2  LEU  61          1HD2      LEU  61  -0.483  -9.189   3.013
  492   2HD2  LEU  61          2HD2      LEU  61  -0.404 -10.330   1.649
  493   3HD2  LEU  61          3HD2      LEU  61   0.166 -10.828   3.260
  494    H    GLU  62           H        GLU  62   6.158  -9.645   3.057
  495    HA   GLU  62           HA       GLU  62   8.038 -10.730   3.150
  496   1HB   GLU  62          1HB       GLU  62   6.430 -12.136   5.178
  497   2HB   GLU  62          2HB       GLU  62   7.666 -13.168   4.485
  498   1HG   GLU  62          1HG       GLU  62   8.265 -10.354   5.497
  499   2HG   GLU  62          2HG       GLU  62   8.364 -11.765   6.531
  500    H    VAL  63           H        VAL  63   5.492 -11.557   1.362
  501    HA   VAL  63           HA       VAL  63   5.832 -14.168   0.543
  502    HB   VAL  63           HB       VAL  63   4.940 -13.147  -1.685
  503   1HG1  VAL  63          1HG1      VAL  63   3.530 -14.405  -0.199
  504   2HG1  VAL  63          2HG1      VAL  63   3.441 -13.049   0.952
  505   3HG1  VAL  63          3HG1      VAL  63   2.666 -12.914  -0.645
  506   1HG2  VAL  63          1HG2      VAL  63   3.888 -10.856  -0.209
  507   2HG2  VAL  63          2HG2      VAL  63   5.654 -10.778  -0.411
  508   3HG2  VAL  63          3HG2      VAL  63   4.602 -10.939  -1.838
  509    H    ASP  64           H        ASP  64   6.749 -14.923  -1.611
  510    HA   ASP  64           HA       ASP  64   9.406 -13.796  -1.815
  511   1HB   ASP  64          1HB       ASP  64   8.179 -16.454  -2.142
  512   2HB   ASP  64          2HB       ASP  64   9.218 -16.057  -3.497
  513    H    ASN  65           H        ASN  65   6.326 -13.665  -3.290
  514    HA   ASN  65           HA       ASN  65   7.274 -12.176  -5.444
  515   1HB   ASN  65          1HB       ASN  65   5.990 -14.004  -7.069
  516   2HB   ASN  65          2HB       ASN  65   7.731 -13.914  -6.888
  517   1HD2  ASN  65          1HD2      ASN  65   4.801 -15.558  -5.968
  518   2HD2  ASN  65          2HD2      ASN  65   5.513 -16.981  -5.285
  519    H    VAL  66           H        VAL  66   5.593 -10.681  -5.540
  520    HA   VAL  66           HA       VAL  66   2.914 -11.629  -4.842
  521    HB   VAL  66           HB       VAL  66   4.432  -9.464  -4.003
  522   1HG1  VAL  66          1HG1      VAL  66   2.190  -8.408  -5.753
  523   2HG1  VAL  66          2HG1      VAL  66   3.340  -7.465  -4.775
  524   3HG1  VAL  66          3HG1      VAL  66   3.913  -8.367  -6.198
  525   1HG2  VAL  66          1HG2      VAL  66   2.892  -9.812  -2.421
  526   2HG2  VAL  66          2HG2      VAL  66   1.776  -8.824  -3.394
  527   3HG2  VAL  66          3HG2      VAL  66   1.787 -10.594  -3.576
  528    HA   PRO  67           HA       PRO  67   1.653 -11.123  -8.946
  529   1HB   PRO  67          1HB       PRO  67  -1.051 -10.884  -8.629
  530   2HB   PRO  67          2HB       PRO  67  -0.215 -12.424  -8.605
  531   1HG   PRO  67          1HG       PRO  67  -1.337 -10.888  -6.342
  532   2HG   PRO  67          2HG       PRO  67  -0.891 -12.582  -6.405
  533   1HD   PRO  67          1HD       PRO  67   0.594 -10.461  -5.171
  534   2HD   PRO  67          2HD       PRO  67   1.094 -12.133  -5.335
  535    H    ARG  68           H        ARG  68   1.840  -9.555 -10.419
  536    HA   ARG  68           HA       ARG  68   1.873  -6.956  -9.520
  537   1HB   ARG  68          1HB       ARG  68   1.701  -6.457 -12.096
  538   2HB   ARG  68          2HB       ARG  68   3.086  -7.359 -11.513
  539   1HG   ARG  68          1HG       ARG  68   2.485  -9.231 -12.664
  540   2HG   ARG  68          2HG       ARG  68   0.829  -9.147 -12.097
  541   1HD   ARG  68          1HD       ARG  68   0.372  -8.681 -14.304
  542   2HD   ARG  68          2HD       ARG  68   0.799  -7.045 -13.843
  543    HE   ARG  68           HE       ARG  68   3.090  -8.700 -14.661
  544   1HH1  ARG  68          2HH2      ARG  68   0.589  -6.460 -15.715
  545   2HH1  ARG  68          1HH2      ARG  68   1.442  -5.981 -17.144
  546   1HH2  ARG  68          2HH1      ARG  68   4.215  -8.069 -16.547
  547   2HH2  ARG  68          1HH1      ARG  68   3.518  -6.902 -17.621
  548    H    HIS  69           H        HIS  69  -0.726  -8.999 -10.847
  549    HA   HIS  69           HA       HIS  69  -2.508  -7.081 -11.661
  550   1HB   HIS  69          1HB       HIS  69  -2.619  -9.616 -11.882
  551   2HB   HIS  69          2HB       HIS  69  -3.259  -9.650 -10.251
  552    HD1  HIS  69           1HD      HIS  69  -5.417  -7.686 -10.073
  553    HD2  HIS  69           2HD      HIS  69  -4.665  -9.711 -13.669
  554    HE1  HIS  69           1HE      HIS  69  -7.571  -7.550 -11.434
  555    H    LEU  70           H        LEU  70  -1.938  -8.442  -8.361
  556    HA   LEU  70           HA       LEU  70  -3.991  -6.862  -7.192
  557   1HB   LEU  70          1HB       LEU  70  -3.614  -8.762  -6.002
  558   2HB   LEU  70          2HB       LEU  70  -1.883  -8.743  -6.277
  559    HG   LEU  70           HG       LEU  70  -1.930  -6.643  -4.695
  560   1HD1  LEU  70          1HD1      LEU  70  -4.335  -8.074  -3.576
  561   2HD1  LEU  70          2HD1      LEU  70  -3.670  -6.480  -3.144
  562   3HD1  LEU  70          3HD1      LEU  70  -4.497  -6.707  -4.704
  563   1HD2  LEU  70          1HD2      LEU  70  -1.090  -9.153  -4.394
  564   2HD2  LEU  70          2HD2      LEU  70  -1.092  -7.979  -3.056
  565   3HD2  LEU  70          3HD2      LEU  70  -2.405  -9.173  -3.194
  566    H    SER  71           H        SER  71  -0.394  -6.627  -7.461
  567    HA   SER  71           HA       SER  71  -0.096  -4.413  -5.879
  568   1HB   SER  71          1HB       SER  71   1.577  -6.015  -7.331
  569   2HB   SER  71          2HB       SER  71   1.612  -4.574  -8.329
  570    HG   SER  71           HG       SER  71   1.983  -3.447  -6.107
  571    H    LEU  72           H        LEU  72  -1.442  -4.769  -9.117
  572    HA   LEU  72           HA       LEU  72  -1.078  -2.048  -9.880
  573   1HB   LEU  72          1HB       LEU  72  -1.209  -3.534 -11.646
  574   2HB   LEU  72          2HB       LEU  72  -2.549  -4.423 -10.951
  575    HG   LEU  72           HG       LEU  72  -4.030  -2.455 -11.400
  576   1HD1  LEU  72          1HD1      LEU  72  -3.353  -0.535 -12.405
  577   2HD1  LEU  72          2HD1      LEU  72  -1.832  -0.954 -11.582
  578   3HD1  LEU  72          3HD1      LEU  72  -2.042  -1.331 -13.309
  579   1HD2  LEU  72          1HD2      LEU  72  -3.475  -4.504 -12.984
  580   2HD2  LEU  72          2HD2      LEU  72  -4.539  -3.175 -13.505
  581   3HD2  LEU  72          3HD2      LEU  72  -2.839  -3.212 -14.031
  582    H    ALA  73           H        ALA  73  -3.822  -4.028  -8.588
  583    HA   ALA  73           HA       ALA  73  -5.575  -1.796  -8.493
  584   1HB   ALA  73          1HB       ALA  73  -6.966  -3.559  -8.386
  585   2HB   ALA  73          2HB       ALA  73  -5.620  -4.660  -8.003
  586   3HB   ALA  73          3HB       ALA  73  -6.455  -3.788  -6.696
  587    H    LEU  74           H        LEU  74  -3.162  -3.266  -6.327
  588    HA   LEU  74           HA       LEU  74  -4.003  -2.204  -3.923
  589   1HB   LEU  74          1HB       LEU  74  -1.527  -3.285  -5.073
  590   2HB   LEU  74          2HB       LEU  74  -1.268  -2.157  -3.757
  591    HG   LEU  74           HG       LEU  74  -3.150  -4.511  -3.519
  592   1HD1  LEU  74          1HD1      LEU  74  -1.447  -5.881  -2.676
  593   2HD1  LEU  74          2HD1      LEU  74  -0.745  -5.141  -4.135
  594   3HD1  LEU  74          3HD1      LEU  74  -0.303  -4.526  -2.524
  595   1HD2  LEU  74          1HD2      LEU  74  -3.371  -3.990  -1.330
  596   2HD2  LEU  74          2HD2      LEU  74  -1.705  -3.378  -1.188
  597   3HD2  LEU  74          3HD2      LEU  74  -2.968  -2.358  -1.918
  598    H    PHE  75           H        PHE  75  -1.995  -0.748  -6.545
  599    HA   PHE  75           HA       PHE  75  -1.566   1.654  -5.102
  600   1HB   PHE  75          1HB       PHE  75  -0.004   1.096  -6.843
  601   2HB   PHE  75          2HB       PHE  75  -1.271   0.568  -7.932
  602    HD1  PHE  75           1HD      PHE  75  -1.208   1.846  -9.846
  603    HD2  PHE  75           2HD      PHE  75  -0.713   3.778  -6.100
  604    HE1  PHE  75           1HE      PHE  75  -1.143   4.073 -11.002
  605    HE2  PHE  75           2HE      PHE  75  -0.648   6.005  -7.256
  606    HZ   PHE  75           HZ       PHE  75  -0.863   6.126  -9.694
  607    H    GLN  76           H        GLN  76  -3.947   0.523  -7.551
  608    HA   GLN  76           HA       GLN  76  -5.031   3.055  -8.007
  609   1HB   GLN  76          1HB       GLN  76  -5.934   0.214  -8.505
  610   2HB   GLN  76          2HB       GLN  76  -7.067   1.526  -8.760
  611   1HG   GLN  76          1HG       GLN  76  -5.097   2.624 -10.145
  612   2HG   GLN  76          2HG       GLN  76  -4.440   1.000 -10.181
  613   1HE2  GLN  76          1HE2      GLN  76  -6.107  -0.741 -10.723
  614   2HE2  GLN  76          2HE2      GLN  76  -7.152  -0.430 -12.069
  615    H    SER  77           H        SER  77  -5.399   0.678  -5.438
  616    HA   SER  77           HA       SER  77  -7.910   1.194  -4.555
  617   1HB   SER  77          1HB       SER  77  -5.793  -0.294  -3.666
  618   2HB   SER  77          2HB       SER  77  -5.802   0.967  -2.449
  619    HG   SER  77           HG       SER  77  -8.355   0.315  -2.684
  620    H    PHE  78           H        PHE  78  -4.856   2.773  -3.338
  621    HA   PHE  78           HA       PHE  78  -6.526   5.051  -2.543
  622   1HB   PHE  78          1HB       PHE  78  -4.526   3.414  -1.248
  623   2HB   PHE  78          2HB       PHE  78  -3.778   4.978  -1.504
  624    HD1  PHE  78           1HD      PHE  78  -4.402   6.865  -0.201
  625    HD2  PHE  78           2HD      PHE  78  -6.628   3.265   0.097
  626    HE1  PHE  78           1HE      PHE  78  -5.574   7.758   1.830
  627    HE2  PHE  78           2HE      PHE  78  -7.800   4.158   2.129
  628    HZ   PHE  78           HZ       PHE  78  -7.259   6.394   2.972
  629    H    GLU  79           H        GLU  79  -5.248   7.209  -2.543
  630    HA   GLU  79           HA       GLU  79  -3.027   7.479  -4.171
  631   1HB   GLU  79          1HB       GLU  79  -4.824   6.821  -5.904
  632   2HB   GLU  79          2HB       GLU  79  -5.562   8.379  -5.591
  633   1HG   GLU  79          1HG       GLU  79  -3.426   9.521  -6.208
  634   2HG   GLU  79          2HG       GLU  79  -2.675   7.966  -6.506
  635    H    THR  80           H        THR  80  -2.477   9.827  -4.523
  636    HA   THR  80           HA       THR  80  -2.917  11.342  -2.278
  637    HB   THR  80           HB       THR  80  -2.206  13.239  -3.990
  638    HG1  THR  80           1HG      THR  80  -1.433  12.115  -5.977
  639   1HG2  THR  80          1HG2      THR  80  -0.570  10.678  -3.606
  640   2HG2  THR  80          2HG2      THR  80   0.085  12.186  -4.286
  641   3HG2  THR  80          3HG2      THR  80  -0.488  12.145  -2.602
  642    H    GLY  81           H        GLY  81  -5.079  10.779  -4.967
  643   1HA   GLY  81          1HA       GLY  81  -7.363  11.250  -4.771
  644   2HA   GLY  81          2HA       GLY  81  -7.010  12.585  -3.691
  645    H    HIS  82           H        HIS  82  -5.116  14.106  -4.994
  646    HA   HIS  82           HA       HIS  82  -6.489  15.703  -6.627
  647   1HB   HIS  82          1HB       HIS  82  -3.543  15.051  -6.914
  648   2HB   HIS  82          2HB       HIS  82  -4.336  16.500  -7.498
  649    HD1  HIS  82           1HD      HIS  82  -2.740  15.044  -4.507
  650    HD2  HIS  82           2HD      HIS  82  -5.324  18.238  -5.355
  651    HE1  HIS  82           1HE      HIS  82  -2.694  16.564  -2.458
  652    H    CYS  83           H        CYS  83  -7.315  15.704  -8.677
  653    HA   CYS  83           HA       CYS  83  -6.165  14.320 -10.797
  654   1HB   CYS  83          1HB       CYS  83  -7.403  12.491  -9.186
  655   2HB   CYS  83          2HB       CYS  83  -8.716  12.911 -10.267
  656    HG   CYS  83           HG       CYS  83  -5.865  11.441 -10.741
  657    H    LEU  84           H        LEU  84  -7.567  14.583 -12.784
  658    HA   LEU  84           HA       LEU  84  -8.950  15.728 -14.069
  659   1HB   LEU  84          1HB       LEU  84 -10.584  15.999 -11.543
  660   2HB   LEU  84          2HB       LEU  84 -11.127  16.502 -13.131
  661    HG   LEU  84           HG       LEU  84 -12.102  14.378 -12.640
  662   1HD1  LEU  84          1HD1      LEU  84  -9.844  13.767 -14.555
  663   2HD1  LEU  84          2HD1      LEU  84 -11.505  13.127 -14.556
  664   3HD1  LEU  84          3HD1      LEU  84 -11.208  14.833 -14.967
  665   1HD2  LEU  84          1HD2      LEU  84 -10.888  12.401 -12.032
  666   2HD2  LEU  84          2HD2      LEU  84  -9.328  13.236 -12.225
  667   3HD2  LEU  84          3HD2      LEU  84 -10.434  13.708 -10.912
  668    H    ASN  85           H        ASN  85  -7.747  17.437 -14.779
  669    HA   ASN  85           HA       ASN  85  -7.071  19.487 -14.988
  670   1HB   ASN  85          1HB       ASN  85  -9.441  19.816 -13.216
  671   2HB   ASN  85          2HB       ASN  85  -8.287  21.127 -13.075
  672   1HD2  ASN  85          1HD2      ASN  85  -7.428  21.988 -15.181
  673   2HD2  ASN  85          2HD2      ASN  85  -8.554  22.226 -16.475
  674    H    GLU  86           H        GLU  86  -4.907  19.403 -14.261
  675    HA   GLU  86           HA       GLU  86  -4.235  20.688 -11.925
  676   1HB   GLU  86          1HB       GLU  86  -4.752  17.814 -11.590
  677   2HB   GLU  86          2HB       GLU  86  -3.114  18.235 -11.127
  678   1HG   GLU  86          1HG       GLU  86  -5.229  20.117 -10.166
  679   2HG   GLU  86          2HG       GLU  86  -5.297  18.507  -9.478
  680    H    THR  87           H        THR  87  -2.098  21.357 -12.106
  681    HA   THR  87           HA       THR  87  -0.594  20.137 -14.314
  682    HB   THR  87           HB       THR  87  -1.309  22.718 -14.001
  683    HG1  THR  87           1HG      THR  87  -0.007  22.278 -15.764
  684   1HG2  THR  87          1HG2      THR  87   1.502  22.755 -12.863
  685   2HG2  THR  87          2HG2      THR  87   0.279  24.049 -12.863
  686   3HG2  THR  87          3HG2      THR  87   0.118  22.672 -11.746
  687    H    ASN  88           H        ASN  88  -0.925  19.192 -11.372
  688    HA   ASN  88           HA       ASN  88   1.951  19.074 -10.908
  689   1HB   ASN  88          1HB       ASN  88   0.683  20.439  -9.172
  690   2HB   ASN  88          2HB       ASN  88  -0.260  19.013  -8.786
  691   1HD2  ASN  88          1HD2      ASN  88   0.812  19.800  -6.681
  692   2HD2  ASN  88          2HD2      ASN  88   2.281  19.005  -6.222
  693    H    VAL  89           H        VAL  89   0.779  17.202 -12.585
  694    HA   VAL  89           HA       VAL  89   0.387  14.872 -10.836
  695    HB   VAL  89           HB       VAL  89  -0.759  15.414 -13.582
  696   1HG1  VAL  89          1HG1      VAL  89  -2.124  13.281 -12.403
  697   2HG1  VAL  89          2HG1      VAL  89  -0.944  13.190 -13.732
  698   3HG1  VAL  89          3HG1      VAL  89  -0.409  12.962 -12.050
  699   1HG2  VAL  89          1HG2      VAL  89  -2.890  15.679 -12.533
  700   2HG2  VAL  89          2HG2      VAL  89  -2.243  15.192 -10.948
  701   3HG2  VAL  89          3HG2      VAL  89  -1.748  16.740 -11.674
  702    H    THR  90           H        THR  90   2.966  15.897 -11.513
  703    HA   THR  90           HA       THR  90   3.844  14.056 -13.628
  704    HB   THR  90           HB       THR  90   4.388  16.493 -13.872
  705    HG1  THR  90           1HG      THR  90   6.654  15.976 -14.197
  706   1HG2  THR  90          1HG2      THR  90   6.066  16.032 -11.351
  707   2HG2  THR  90          2HG2      THR  90   6.036  17.511 -12.341
  708   3HG2  THR  90          3HG2      THR  90   4.598  17.037 -11.405
  709    H    LYS  91           H        LYS  91   3.502  14.268 -10.258
  710    HA   LYS  91           HA       LYS  91   5.665  12.305  -9.946
  711   1HB   LYS  91          1HB       LYS  91   6.074  13.134  -7.722
  712   2HB   LYS  91          2HB       LYS  91   6.207  14.459  -8.861
  713   1HG   LYS  91          1HG       LYS  91   4.757  15.571  -7.502
  714   2HG   LYS  91          2HG       LYS  91   3.510  14.559  -8.203
  715   1HD   LYS  91          1HD       LYS  91   3.205  13.424  -6.255
  716   2HD   LYS  91          2HD       LYS  91   4.921  13.119  -6.080
  717   1HE   LYS  91          1HE       LYS  91   4.335  14.453  -4.181
  718   2HE   LYS  91          2HE       LYS  91   5.155  15.554  -5.270
  719   1HZ   LYS  91          1HZ       LYS  91   3.156  16.498  -5.899
  720   2HZ   LYS  91          2HZ       LYS  91   2.247  15.258  -5.351
  721   3HZ   LYS  91          3HZ       LYS  91   2.961  16.276  -4.293
  722    H    ASP  92           H        ASP  92   4.583  10.381 -10.067
  723    HA   ASP  92           HA       ASP  92   2.005  10.210  -8.816
  724   1HB   ASP  92          1HB       ASP  92   3.708   8.194 -10.352
  725   2HB   ASP  92          2HB       ASP  92   2.124   7.816  -9.705
  726    H    VAL  93           H        VAL  93   2.519  10.311  -6.531
  727    HA   VAL  93           HA       VAL  93   3.741   7.876  -5.515
  728    HB   VAL  93           HB       VAL  93   5.070   9.226  -3.892
  729   1HG1  VAL  93          1HG1      VAL  93   6.919   9.202  -5.242
  730   2HG1  VAL  93          2HG1      VAL  93   5.806   8.266  -6.269
  731   3HG1  VAL  93          3HG1      VAL  93   6.081   9.993  -6.599
  732   1HG2  VAL  93          1HG2      VAL  93   3.950  11.454  -5.543
  733   2HG2  VAL  93          2HG2      VAL  93   4.289  11.378  -3.797
  734   3HG2  VAL  93          3HG2      VAL  93   5.623  11.604  -4.954
  735    H    VAL  94           H        VAL  94   3.440   7.894  -2.973
  736    HA   VAL  94           HA       VAL  94   1.082   9.392  -2.195
  737    HB   VAL  94           HB       VAL  94   0.049   7.508  -3.198
  738   1HG1  VAL  94          1HG1      VAL  94   1.331   5.414  -1.549
  739   2HG1  VAL  94          2HG1      VAL  94   0.845   5.395  -3.261
  740   3HG1  VAL  94          3HG1      VAL  94   2.380   6.157  -2.781
  741   1HG2  VAL  94          1HG2      VAL  94  -1.164   6.557  -1.361
  742   2HG2  VAL  94          2HG2      VAL  94   0.173   6.883  -0.232
  743   3HG2  VAL  94          3HG2      VAL  94  -0.756   8.234  -0.926
  744    H    CYS  95           H        CYS  95   0.744   9.333   0.159
  745    HA   CYS  95           HA       CYS  95   3.247   9.288   1.495
  746   1HB   CYS  95          1HB       CYS  95   0.629  10.392   1.951
  747   2HB   CYS  95          2HB       CYS  95   1.124   9.505   3.379
  748    HG   CYS  95           HG       CYS  95   2.252  11.446   4.187
  749    H    LEU  96           H        LEU  96   4.010   7.743   2.999
  750    HA   LEU  96           HA       LEU  96   2.893   5.137   2.741
  751   1HB   LEU  96          1HB       LEU  96   5.156   6.262   4.391
  752   2HB   LEU  96          2HB       LEU  96   4.718   4.566   4.373
  753    HG   LEU  96           HG       LEU  96   5.106   5.633   1.678
  754   1HD1  LEU  96          1HD1      LEU  96   7.392   5.819   3.653
  755   2HD1  LEU  96          2HD1      LEU  96   7.601   5.778   1.885
  756   3HD1  LEU  96          3HD1      LEU  96   6.707   7.116   2.645
  757   1HD2  LEU  96          1HD2      LEU  96   6.728   3.447   2.939
  758   2HD2  LEU  96          2HD2      LEU  96   4.996   3.196   2.617
  759   3HD2  LEU  96          3HD2      LEU  96   6.101   3.593   1.279
  760    H    ASN  97           H        ASN  97   2.725   7.807   5.087
  761    HA   ASN  97           HA       ASN  97   1.771   6.303   7.212
  762   1HB   ASN  97          1HB       ASN  97   1.504   9.233   6.410
  763   2HB   ASN  97          2HB       ASN  97   0.728   8.636   7.864
  764   1HD2  ASN  97          1HD2      ASN  97   2.791  10.589   7.684
  765   2HD2  ASN  97          2HD2      ASN  97   4.179  10.013   8.545
  766    H    ASP  98           H        ASP  98   0.284   7.762   4.307
  767    HA   ASP  98           HA       ASP  98  -2.362   7.568   5.238
  768   1HB   ASP  98          1HB       ASP  98  -0.963   8.159   2.657
  769   2HB   ASP  98          2HB       ASP  98  -2.604   7.563   2.503
  770    H    VAL  99           H        VAL  99  -0.106   5.557   3.270
  771    HA   VAL  99           HA       VAL  99  -2.091   3.628   2.581
  772    HB   VAL  99           HB       VAL  99   0.929   3.491   2.486
  773   1HG1  VAL  99          1HG1      VAL  99  -0.923   1.977   0.664
  774   2HG1  VAL  99          2HG1      VAL  99   0.755   1.616   1.134
  775   3HG1  VAL  99          3HG1      VAL  99  -0.571   1.349   2.291
  776   1HG2  VAL  99          1HG2      VAL  99   0.944   4.682   0.567
  777   2HG2  VAL  99          2HG2      VAL  99  -0.591   3.984  -0.002
  778   3HG2  VAL  99          3HG2      VAL  99  -0.603   5.324   1.169
  779    H    SER 100           H        SER 100   0.154   4.200   5.262
  780    HA   SER 100           HA       SER 100   0.192   1.585   6.213
  781   1HB   SER 100          1HB       SER 100   1.230   2.490   8.157
  782   2HB   SER 100          2HB       SER 100   1.729   3.540   6.845
  783    HG   SER 100           HG       SER 100   0.486   4.246   9.112
  784    H    CYS 101           H        CYS 101  -2.229   4.111   6.244
  785    HA   CYS 101           HA       CYS 101  -3.588   3.182   8.567
  786   1HB   CYS 101          1HB       CYS 101  -3.630   5.553   7.533
  787   2HB   CYS 101          2HB       CYS 101  -4.803   4.907   6.403
  788    HG   CYS 101           HG       CYS 101  -5.837   3.640   8.888
  789    H    TYR 102           H        TYR 102  -4.190   3.098   4.975
  790    HA   TYR 102           HA       TYR 102  -6.459   1.543   5.012
  791   1HB   TYR 102          1HB       TYR 102  -5.591   2.648   2.995
  792   2HB   TYR 102          2HB       TYR 102  -4.030   1.869   3.165
  793    HD1  TYR 102           1HD      TYR 102  -7.618   0.777   2.860
  794    HD2  TYR 102           2HD      TYR 102  -3.566   0.235   1.597
  795    HE1  TYR 102           1HE      TYR 102  -8.354  -1.060   1.264
  796    HE2  TYR 102           2HE      TYR 102  -4.316  -1.600   0.005
  797    HH   TYR 102           HH       TYR 102  -6.070  -3.103  -0.308
  798    H    PHE 103           H        PHE 103  -2.986   0.526   4.957
  799    HA   PHE 103           HA       PHE 103  -3.560  -2.214   4.730
  800   1HB   PHE 103          1HB       PHE 103  -1.274  -0.381   5.511
  801   2HB   PHE 103          2HB       PHE 103  -1.101  -2.068   5.950
  802    HD1  PHE 103           1HD      PHE 103  -2.314  -3.439   3.650
  803    HD2  PHE 103           2HD      PHE 103   0.215  -0.034   3.768
  804    HE1  PHE 103           1HE      PHE 103  -1.506  -3.959   1.331
  805    HE2  PHE 103           2HE      PHE 103   1.023  -0.554   1.449
  806    HZ   PHE 103           HZ       PHE 103   0.153  -2.510   0.258
  807    H    SER 104           H        SER 104  -3.405   0.048   7.471
  808    HA   SER 104           HA       SER 104  -3.038  -1.851   9.458
  809   1HB   SER 104          1HB       SER 104  -2.757   0.605   9.768
  810   2HB   SER 104          2HB       SER 104  -4.485   0.832   9.582
  811    HG   SER 104           HG       SER 104  -3.544  -1.000  11.573
  812    H    LEU 105           H        LEU 105  -5.822  -0.919   7.505
  813    HA   LEU 105           HA       LEU 105  -7.810  -1.863   9.288
  814   1HB   LEU 105          1HB       LEU 105  -7.639  -0.601   6.718
  815   2HB   LEU 105          2HB       LEU 105  -8.720  -1.976   6.611
  816    HG   LEU 105           HG       LEU 105  -9.556  -0.758   8.944
  817   1HD1  LEU 105          1HD1      LEU 105  -9.902   1.668   7.809
  818   2HD1  LEU 105          2HD1      LEU 105  -8.597   1.282   8.957
  819   3HD1  LEU 105          3HD1      LEU 105  -8.276   1.267   7.206
  820   1HD2  LEU 105          1HD2      LEU 105 -11.553  -0.353   7.809
  821   2HD2  LEU 105          2HD2      LEU 105 -10.728  -0.039   6.264
  822   3HD2  LEU 105          3HD2      LEU 105 -10.815  -1.697   6.905
  823    H    LEU 106           H        LEU 106  -5.773  -3.311   6.733
  824    HA   LEU 106           HA       LEU 106  -7.220  -5.694   6.480
  825   1HB   LEU 106          1HB       LEU 106  -4.404  -4.841   5.891
  826   2HB   LEU 106          2HB       LEU 106  -4.876  -6.520   5.717
  827    HG   LEU 106           HG       LEU 106  -4.963  -4.805   3.697
  828   1HD1  LEU 106          1HD1      LEU 106  -5.577  -7.300   3.847
  829   2HD1  LEU 106          2HD1      LEU 106  -7.261  -6.734   3.962
  830   3HD1  LEU 106          3HD1      LEU 106  -6.283  -6.333   2.530
  831   1HD2  LEU 106          1HD2      LEU 106  -7.133  -3.839   3.316
  832   2HD2  LEU 106          2HD2      LEU 106  -7.758  -4.533   4.831
  833   3HD2  LEU 106          3HD2      LEU 106  -6.512  -3.263   4.882
  834    H    GLU 107           H        GLU 107  -4.130  -5.070   8.300
  835    HA   GLU 107           HA       GLU 107  -4.050  -7.475   9.558
  836   1HB   GLU 107          1HB       GLU 107  -2.529  -6.423  11.148
  837   2HB   GLU 107          2HB       GLU 107  -2.238  -5.753   9.555
  838   1HG   GLU 107          1HG       GLU 107  -3.588  -3.755  10.104
  839   2HG   GLU 107          2HG       GLU 107  -4.019  -4.437  11.659
  840    H    GLY 108           H        GLY 108  -5.903  -4.523  10.409
  841   1HA   GLY 108          1HA       GLY 108  -8.070  -5.096  11.479
  842   2HA   GLY 108          2HA       GLY 108  -7.141  -6.030  12.635
  843    H    GLY 109           H        GLY 109  -7.225  -2.689  11.198
  844   1HA   GLY 109          1HA       GLY 109  -6.861  -1.628  13.927
  845   2HA   GLY 109          2HA       GLY 109  -5.853  -1.070  12.607
  846    H    ARG 110           H        ARG 110  -9.392  -1.716  13.185
  847    HA   ARG 110           HA       ARG 110 -10.242   0.113  11.317
  848   1HB   ARG 110          1HB       ARG 110 -12.449  -0.068  12.452
  849   2HB   ARG 110          2HB       ARG 110 -11.698  -1.644  12.300
  850   1HG   ARG 110          1HG       ARG 110 -10.731  -1.187  14.697
  851   2HG   ARG 110          2HG       ARG 110 -11.930   0.089  14.786
  852   1HD   ARG 110          1HD       ARG 110 -13.697  -1.669  14.151
  853   2HD   ARG 110          2HD       ARG 110 -12.454  -2.888  14.354
  854    HE   ARG 110           HE       ARG 110 -12.356  -1.384  16.712
  855   1HH1  ARG 110          2HH2      ARG 110 -14.811  -3.248  15.015
  856   2HH1  ARG 110          1HH2      ARG 110 -15.670  -3.671  16.459
  857   1HH2  ARG 110          2HH1      ARG 110 -13.489  -1.942  18.617
  858   2HH2  ARG 110          1HH1      ARG 110 -14.913  -2.923  18.521
  859    HA   PRO 111           HA       PRO 111  -9.793   3.913  13.413
  860   1HB   PRO 111          1HB       PRO 111 -11.642   5.465  12.133
  861   2HB   PRO 111          2HB       PRO 111 -10.060   5.112  11.466
  862   1HG   PRO 111          1HG       PRO 111 -12.687   3.998  10.694
  863   2HG   PRO 111          2HG       PRO 111 -11.185   3.993   9.792
  864   1HD   PRO 111          1HD       PRO 111 -12.338   1.787  11.218
  865   2HD   PRO 111          2HD       PRO 111 -10.781   1.817  10.413
  866    H    GLU 112           H        GLU 112 -10.627   5.435  14.959
  867    HA   GLU 112           HA       GLU 112 -12.657   4.110  16.467
  868   1HB   GLU 112          1HB       GLU 112 -10.638   6.233  16.918
  869   2HB   GLU 112          2HB       GLU 112 -12.144   6.507  17.772
  870   1HG   GLU 112          1HG       GLU 112 -11.472   3.709  18.036
  871   2HG   GLU 112          2HG       GLU 112 -10.040   4.644  18.417
  872    H    ASP 113           H        ASP 113 -12.392   6.764  14.176
  873    HA   ASP 113           HA       ASP 113 -15.094   6.953  13.826
  874   1HB   ASP 113          1HB       ASP 113 -14.613   8.117  16.217
  875   2HB   ASP 113          2HB       ASP 113 -14.204   9.485  15.201
  876    H    LYS 114           H        LYS 114 -14.873   7.453  11.637
  877    HA   LYS 114           HA       LYS 114 -12.683   9.123  10.786
  878   1HB   LYS 114          1HB       LYS 114 -14.682   7.326   9.480
  879   2HB   LYS 114          2HB       LYS 114 -13.980   8.605   8.510
  880   1HG   LYS 114          1HG       LYS 114 -12.112   6.953  10.205
  881   2HG   LYS 114          2HG       LYS 114 -12.790   6.200   8.775
  882   1HD   LYS 114          1HD       LYS 114 -11.439   7.398   7.391
  883   2HD   LYS 114          2HD       LYS 114 -11.874   8.911   8.160
  884   1HE   LYS 114          1HE       LYS 114 -10.284   7.999  10.118
  885   2HE   LYS 114          2HE       LYS 114  -9.607   7.028   8.826
  886   1HZ   LYS 114          1HZ       LYS 114  -9.756   9.948   8.971
  887   2HZ   LYS 114          2HZ       LYS 114  -8.425   9.011   8.833
  888   3HZ   LYS 114          3HZ       LYS 114  -9.445   9.174   7.567
  889    H    LEU 115           H        LEU 115 -13.124  10.949   9.195
  890    HA   LEU 115           HA       LEU 115 -15.388  12.493  10.235
  891   1HB   LEU 115          1HB       LEU 115 -12.603  13.112   9.541
  892   2HB   LEU 115          2HB       LEU 115 -13.767  14.259   8.906
  893    HG   LEU 115           HG       LEU 115 -14.661  14.096  11.451
  894   1HD1  LEU 115          1HD1      LEU 115 -12.879  12.492  12.077
  895   2HD1  LEU 115          2HD1      LEU 115 -11.663  13.738  11.703
  896   3HD1  LEU 115          3HD1      LEU 115 -12.830  14.001  13.020
  897   1HD2  LEU 115          1HD2      LEU 115 -13.519  16.002   9.848
  898   2HD2  LEU 115          2HD2      LEU 115 -14.121  16.267  11.502
  899   3HD2  LEU 115          3HD2      LEU 115 -12.392  15.948  11.225
  900    H    GLU 116           H        GLU 116 -16.036  14.272   8.428
  901    HA   GLU 116           HA       GLU 116 -16.075  13.016   5.835
  902   1HB   GLU 116          1HB       GLU 116 -18.760  13.977   6.641
  903   2HB   GLU 116          2HB       GLU 116 -18.311  12.549   5.731
  904   1HG   GLU 116          1HG       GLU 116 -19.226  11.739   7.798
  905   2HG   GLU 116          2HG       GLU 116 -17.493  11.518   7.930
  906    H    TRP 117           H        TRP 117 -15.860  14.548   4.234
  907    HA   TRP 117           HA       TRP 117 -16.192  17.337   5.087
  908   1HB   TRP 117          1HB       TRP 117 -14.663  16.543   2.646
  909   2HB   TRP 117          2HB       TRP 117 -14.474  17.944   3.683
  910    HD1  TRP 117           HD       TRP 117 -14.102  16.384   6.499
  911    HE1  TRP 117           1HE      TRP 117 -11.894  15.052   7.064
  912    HE3  TRP 117           3HE      TRP 117 -12.614  15.769   1.676
  913    HZ2  TRP 117           2HZ      TRP 117  -9.820  13.917   5.466
  914    HZ3  TRP 117           3HZ      TRP 117 -10.485  14.538   1.265
  915    HH2  TRP 117           HH       TRP 117  -9.105  13.627   3.065
  916    H    SER 118           H        SER 118 -18.593  16.892   4.743
  917    HA   SER 118           HA       SER 118 -19.160  17.200   1.901
  918   1HB   SER 118          1HB       SER 118 -19.803  14.921   3.075
  919   2HB   SER 118          2HB       SER 118 -21.115  15.847   3.776
  920    HG   SER 118           HG       SER 118 -21.049  14.729   1.352
  Start of MODEL    4
    1   1H    MET   1           H        MET   1  -5.618   8.856   7.299
    2    HA   MET   1           HA       MET   1  -7.842   9.064   7.642
    3   1HB   MET   1          1HB       MET   1  -6.956  10.224   4.986
    4   2HB   MET   1          2HB       MET   1  -8.655  10.359   5.395
    5   1HG   MET   1          1HG       MET   1  -8.059  11.470   7.552
    6   2HG   MET   1          2HG       MET   1  -6.355  11.313   7.171
    7   1HE   MET   1          1HE       MET   1  -5.368  14.110   5.411
    8   2HE   MET   1          2HE       MET   1  -5.095  12.420   5.900
    9   3HE   MET   1          3HE       MET   1  -5.616  12.793   4.240
   10    H    ALA   2           H        ALA   2 -10.162   8.839   6.743
   11    HA   ALA   2           HA       ALA   2 -10.355   6.199   5.567
   12   1HB   ALA   2          1HB       ALA   2 -12.733   7.872   6.316
   13   2HB   ALA   2          2HB       ALA   2 -12.452   6.129   6.536
   14   3HB   ALA   2          3HB       ALA   2 -11.660   7.301   7.617
   15    H    LYS   3           H        LYS   3  -9.226   7.901   3.714
   16    HA   LYS   3           HA       LYS   3 -11.264   9.121   2.119
   17   1HB   LYS   3          1HB       LYS   3  -8.888   9.935   2.350
   18   2HB   LYS   3          2HB       LYS   3  -8.375   8.552   1.405
   19   1HG   LYS   3          1HG       LYS   3  -8.723   9.895  -0.408
   20   2HG   LYS   3          2HG       LYS   3 -10.420   9.529  -0.175
   21   1HD   LYS   3          1HD       LYS   3 -10.716  11.551   1.210
   22   2HD   LYS   3          2HD       LYS   3  -8.997  11.888   1.145
   23   1HE   LYS   3          1HE       LYS   3  -9.066  12.572  -1.101
   24   2HE   LYS   3          2HE       LYS   3 -10.471  11.592  -1.472
   25   1HZ   LYS   3          1HZ       LYS   3 -10.653  13.854   0.375
   26   2HZ   LYS   3          2HZ       LYS   3 -10.802  14.060  -1.238
   27   3HZ   LYS   3          3HZ       LYS   3 -11.860  13.109  -0.435
   28    H    GLU   4           H        GLU   4  -9.255   7.687  -0.102
   29    HA   GLU   4           HA       GLU   4  -9.422   6.033  -1.503
   30   1HB   GLU   4          1HB       GLU   4  -9.339   4.553   0.511
   31   2HB   GLU   4          2HB       GLU   4 -11.088   4.598   0.612
   32   1HG   GLU   4          1HG       GLU   4 -11.381   3.226  -1.242
   33   2HG   GLU   4          2HG       GLU   4  -9.937   3.811  -2.045
   34    H    ARG   5           H        ARG   5 -10.761   5.469  -3.288
   35    HA   ARG   5           HA       ARG   5 -13.578   5.980  -2.960
   36   1HB   ARG   5          1HB       ARG   5 -13.698   7.525  -4.849
   37   2HB   ARG   5          2HB       ARG   5 -12.512   8.148  -3.719
   38   1HG   ARG   5          1HG       ARG   5 -10.892   8.064  -5.301
   39   2HG   ARG   5          2HG       ARG   5 -11.161   6.348  -5.536
   40   1HD   ARG   5          1HD       ARG   5 -11.979   6.840  -7.599
   41   2HD   ARG   5          2HD       ARG   5 -13.370   7.559  -6.811
   42    HE   ARG   5           HE       ARG   5 -11.282   9.491  -6.765
   43   1HH1  ARG   5          2HH2      ARG   5 -13.315   7.844  -9.118
   44   2HH1  ARG   5          1HH2      ARG   5 -13.260   9.141 -10.264
   45   1HH2  ARG   5          2HH1      ARG   5 -11.209  11.203  -8.277
   46   2HH2  ARG   5          1HH1      ARG   5 -12.053  11.065  -9.783
   47    H    GLY   6           H        GLY   6 -12.502   3.468  -3.177
   48   1HA   GLY   6          1HA       GLY   6 -13.765   2.244  -5.244
   49   2HA   GLY   6          2HA       GLY   6 -12.198   2.643  -5.919
   50    H    LEU   7           H        LEU   7 -13.964   0.371  -4.075
   51    HA   LEU   7           HA       LEU   7 -11.818  -0.581  -2.461
   52   1HB   LEU   7          1HB       LEU   7 -14.551  -1.609  -3.187
   53   2HB   LEU   7          2HB       LEU   7 -13.425  -2.573  -2.252
   54    HG   LEU   7           HG       LEU   7 -15.084  -1.367  -0.869
   55   1HD1  LEU   7          1HD1      LEU   7 -13.544  -1.584   0.709
   56   2HD1  LEU   7          2HD1      LEU   7 -12.245  -1.470  -0.502
   57   3HD1  LEU   7          3HD1      LEU   7 -12.880   0.006   0.264
   58   1HD2  LEU   7          1HD2      LEU   7 -15.174   0.972  -0.666
   59   2HD2  LEU   7          2HD2      LEU   7 -13.654   1.199  -1.565
   60   3HD2  LEU   7          3HD2      LEU   7 -15.121   0.662  -2.418
   61    H    ILE   8           H        ILE   8 -10.773  -2.711  -2.702
   62    HA   ILE   8           HA       ILE   8 -10.116  -3.138  -5.496
   63    HB   ILE   8           HB       ILE   8  -8.260  -4.431  -4.640
   64   1HG1  ILE   8          1HG1      ILE   8  -9.519  -3.976  -1.922
   65   2HG1  ILE   8          2HG1      ILE   8  -9.264  -5.510  -2.730
   66   1HG2  ILE   8          1HG2      ILE   8  -8.659  -1.735  -3.324
   67   2HG2  ILE   8          2HG2      ILE   8  -7.110  -2.612  -3.352
   68   3HG2  ILE   8          3HG2      ILE   8  -7.865  -2.090  -4.877
   69   1HD1  ILE   8          1HD1      ILE   8  -7.310  -3.775  -1.288
   70   2HD1  ILE   8          2HD1      ILE   8  -7.354  -5.547  -1.453
   71   3HD1  ILE   8          3HD1      ILE   8  -6.706  -4.546  -2.774
   72    H    SER   9           H        SER   9 -12.711  -3.980  -3.907
   73    HA   SER   9           HA       SER   9 -14.130  -5.619  -3.986
   74   1HB   SER   9          1HB       SER   9 -12.566  -5.947  -6.414
   75   2HB   SER   9          2HB       SER   9 -13.069  -7.522  -5.832
   76    HG   SER   9           HG       SER   9 -15.060  -7.104  -6.480
   77    HA   PRO  10           HA       PRO  10 -12.656  -8.992  -1.650
   78   1HB   PRO  10          1HB       PRO  10 -14.225 -11.127  -2.320
   79   2HB   PRO  10          2HB       PRO  10 -14.757  -9.845  -1.251
   80   1HG   PRO  10          1HG       PRO  10 -15.505 -10.340  -4.067
   81   2HG   PRO  10          2HG       PRO  10 -16.322  -9.352  -2.872
   82   1HD   PRO  10          1HD       PRO  10 -14.674  -8.425  -5.030
   83   2HD   PRO  10          2HD       PRO  10 -15.395  -7.447  -3.767
   84    H    SER  11           H        SER  11 -12.017  -8.894  -4.832
   85    HA   SER  11           HA       SER  11 -10.877 -11.487  -5.040
   86   1HB   SER  11          1HB       SER  11 -11.722  -9.586  -6.852
   87   2HB   SER  11          2HB       SER  11  -9.985  -9.372  -6.935
   88    HG   SER  11           HG       SER  11 -10.028 -11.061  -8.248
   89    H    ASP  12           H        ASP  12  -9.648  -8.084  -4.735
   90    HA   ASP  12           HA       ASP  12  -6.966  -8.936  -4.601
   91   1HB   ASP  12          1HB       ASP  12  -8.496  -6.384  -4.340
   92   2HB   ASP  12          2HB       ASP  12  -6.979  -6.420  -3.463
   93    H    PHE  13           H        PHE  13  -9.553  -7.948  -2.279
   94    HA   PHE  13           HA       PHE  13  -8.025  -7.803   0.018
   95   1HB   PHE  13          1HB       PHE  13 -10.613  -7.388  -0.674
   96   2HB   PHE  13          2HB       PHE  13 -10.819  -9.021  -0.072
   97    HD1  PHE  13           1HD      PHE  13 -10.271  -5.554   0.821
   98    HD2  PHE  13           2HD      PHE  13 -10.366  -9.525   2.315
   99    HE1  PHE  13           1HE      PHE  13 -10.447  -4.669   3.164
  100    HE2  PHE  13           2HE      PHE  13 -10.542  -8.640   4.657
  101    HZ   PHE  13           HZ       PHE  13 -10.580  -6.222   5.053
  102    H    ALA  14           H        ALA  14  -9.386 -10.619  -1.722
  103    HA   ALA  14           HA       ALA  14  -9.080 -12.478   0.350
  104   1HB   ALA  14          1HB       ALA  14  -9.589 -12.453  -2.569
  105   2HB   ALA  14          2HB       ALA  14  -8.805 -13.931  -1.962
  106   3HB   ALA  14          3HB       ALA  14 -10.363 -13.406  -1.280
  107    H    GLN  15           H        GLN  15  -6.964 -11.746  -2.519
  108    HA   GLN  15           HA       GLN  15  -4.955 -13.454  -1.880
  109   1HB   GLN  15          1HB       GLN  15  -5.408 -11.458  -3.785
  110   2HB   GLN  15          2HB       GLN  15  -3.975 -10.887  -2.953
  111   1HG   GLN  15          1HG       GLN  15  -3.153 -12.283  -4.712
  112   2HG   GLN  15          2HG       GLN  15  -2.994 -13.247  -3.257
  113   1HE2  GLN  15          1HE2      GLN  15  -2.943 -15.034  -4.749
  114   2HE2  GLN  15          2HE2      GLN  15  -4.415 -15.745  -5.322
  115    H    LEU  16           H        LEU  16  -5.196  -9.932  -0.993
  116    HA   LEU  16           HA       LEU  16  -2.886  -9.793   0.491
  117   1HB   LEU  16          1HB       LEU  16  -4.584  -7.998  -0.291
  118   2HB   LEU  16          2HB       LEU  16  -5.387  -8.307   1.236
  119    HG   LEU  16           HG       LEU  16  -4.076  -6.604   1.926
  120   1HD1  LEU  16          1HD1      LEU  16  -2.046  -7.337   3.038
  121   2HD1  LEU  16          2HD1      LEU  16  -3.323  -8.566   3.208
  122   3HD1  LEU  16          3HD1      LEU  16  -2.002  -8.811   2.041
  123   1HD2  LEU  16          1HD2      LEU  16  -3.037  -6.717  -0.581
  124   2HD2  LEU  16          2HD2      LEU  16  -2.494  -5.594   0.689
  125   3HD2  LEU  16          3HD2      LEU  16  -1.601  -7.105   0.396
  126    H    GLN  17           H        GLN  17  -6.182 -10.897   1.439
  127    HA   GLN  17           HA       GLN  17  -5.684 -11.112   4.133
  128   1HB   GLN  17          1HB       GLN  17  -7.912 -11.316   2.892
  129   2HB   GLN  17          2HB       GLN  17  -7.471 -12.967   2.507
  130   1HG   GLN  17          1HG       GLN  17  -6.983 -12.905   5.232
  131   2HG   GLN  17          2HG       GLN  17  -8.333 -11.795   5.105
  132   1HE2  GLN  17          1HE2      GLN  17  -9.953 -12.667   3.271
  133   2HE2  GLN  17          2HE2      GLN  17 -10.531 -14.276   3.553
  134    H    LYS  18           H        LYS  18  -5.528 -13.712   1.587
  135    HA   LYS  18           HA       LYS  18  -4.578 -15.711   3.224
  136   1HB   LYS  18          1HB       LYS  18  -5.441 -15.835   0.828
  137   2HB   LYS  18          2HB       LYS  18  -3.837 -15.356   0.312
  138   1HG   LYS  18          1HG       LYS  18  -3.542 -17.465   2.263
  139   2HG   LYS  18          2HG       LYS  18  -4.750 -17.976   1.102
  140   1HD   LYS  18          1HD       LYS  18  -3.247 -18.013  -0.671
  141   2HD   LYS  18          2HD       LYS  18  -2.290 -16.690  -0.035
  142   1HE   LYS  18          1HE       LYS  18  -0.850 -18.117   0.997
  143   2HE   LYS  18          2HE       LYS  18  -2.160 -18.979   1.779
  144   1HZ   LYS  18          1HZ       LYS  18  -0.865 -19.539  -0.744
  145   2HZ   LYS  18          2HZ       LYS  18  -1.393 -20.571   0.407
  146   3HZ   LYS  18          3HZ       LYS  18  -2.455 -19.896  -0.634
  147    H    TYR  19           H        TYR  19  -2.648 -13.478   1.098
  148    HA   TYR  19           HA       TYR  19  -0.158 -14.337   1.888
  149   1HB   TYR  19          1HB       TYR  19  -1.425 -11.671   1.053
  150   2HB   TYR  19          2HB       TYR  19   0.301 -11.760   1.340
  151    HD1  TYR  19           1HD      TYR  19  -1.606 -11.319  -1.259
  152    HD2  TYR  19           2HD      TYR  19   0.939 -14.440   0.187
  153    HE1  TYR  19           1HE      TYR  19  -1.246 -12.139  -3.639
  154    HE2  TYR  19           2HE      TYR  19   1.290 -15.248  -2.198
  155    HH   TYR  19           HH       TYR  19  -0.656 -14.252  -4.743
  156    H    MET  20           H        MET  20  -2.351 -11.924   3.430
  157    HA   MET  20           HA       MET  20  -0.433 -11.102   5.303
  158   1HB   MET  20          1HB       MET  20  -2.361  -9.686   4.763
  159   2HB   MET  20          2HB       MET  20  -3.490 -10.963   5.170
  160   1HG   MET  20          1HG       MET  20  -2.601 -10.865   7.571
  161   2HG   MET  20          2HG       MET  20  -1.678  -9.450   7.109
  162   1HE   MET  20          1HE       MET  20  -4.275  -7.587   5.223
  163   2HE   MET  20          2HE       MET  20  -3.696  -6.689   6.648
  164   3HE   MET  20          3HE       MET  20  -2.574  -7.722   5.730
  165    H    GLU  21           H        GLU  21  -3.023 -13.599   5.285
  166    HA   GLU  21           HA       GLU  21  -3.112 -14.183   7.928
  167   1HB   GLU  21          1HB       GLU  21  -3.419 -15.885   5.441
  168   2HB   GLU  21          2HB       GLU  21  -3.566 -16.617   7.027
  169   1HG   GLU  21          1HG       GLU  21  -5.156 -14.373   7.332
  170   2HG   GLU  21          2HG       GLU  21  -5.403 -14.730   5.634
  171    H    TYR  22           H        TYR  22  -0.610 -15.011   5.522
  172    HA   TYR  22           HA       TYR  22   0.715 -16.859   7.276
  173   1HB   TYR  22          1HB       TYR  22   0.604 -16.159   4.528
  174   2HB   TYR  22          2HB       TYR  22   2.171 -15.546   5.016
  175    HD1  TYR  22           1HD      TYR  22   0.110 -18.665   5.393
  176    HD2  TYR  22           2HD      TYR  22   3.995 -16.967   4.818
  177    HE1  TYR  22           1HE      TYR  22   1.102 -20.995   5.159
  178    HE2  TYR  22           2HE      TYR  22   4.973 -19.302   4.586
  179    HH   TYR  22           HH       TYR  22   3.688 -21.719   3.772
  180    H    SER  23           H        SER  23   1.113 -13.433   6.220
  181    HA   SER  23           HA       SER  23   3.560 -13.161   7.601
  182   1HB   SER  23          1HB       SER  23   2.398 -10.593   7.214
  183   2HB   SER  23          2HB       SER  23   3.645 -11.358   6.249
  184    HG   SER  23           HG       SER  23   1.516 -10.660   5.180
  185    H    THR  24           H        THR  24   3.962 -12.098   9.622
  186    HA   THR  24           HA       THR  24   1.589 -11.362  11.177
  187    HB   THR  24           HB       THR  24   2.523 -12.700  13.091
  188    HG1  THR  24           1HG      THR  24   4.281 -14.236  12.258
  189   1HG2  THR  24          1HG2      THR  24   2.507 -14.604  10.729
  190   2HG2  THR  24          2HG2      THR  24   1.814 -14.832  12.353
  191   3HG2  THR  24          3HG2      THR  24   1.000 -13.770  11.179
  192    H    LYS  25           H        LYS  25   4.163 -10.191   9.718
  193    HA   LYS  25           HA       LYS  25   5.466  -8.935  11.953
  194   1HB   LYS  25          1HB       LYS  25   5.945  -9.295   9.094
  195   2HB   LYS  25          2HB       LYS  25   6.278  -7.655   9.614
  196   1HG   LYS  25          1HG       LYS  25   7.704  -8.549  11.480
  197   2HG   LYS  25          2HG       LYS  25   7.390 -10.182  10.925
  198   1HD   LYS  25          1HD       LYS  25   9.394  -9.792   9.817
  199   2HD   LYS  25          2HD       LYS  25   8.280  -9.223   8.589
  200   1HE   LYS  25          1HE       LYS  25   8.769  -6.968   8.977
  201   2HE   LYS  25          2HE       LYS  25   9.170  -7.228  10.663
  202   1HZ   LYS  25          1HZ       LYS  25  10.813  -7.986   8.350
  203   2HZ   LYS  25          2HZ       LYS  25  11.143  -6.822   9.447
  204   3HZ   LYS  25          3HZ       LYS  25  11.170  -8.394   9.891
  205    H    LYS  26           H        LYS  26   5.827  -6.343  11.409
  206    HA   LYS  26           HA       LYS  26   3.084  -5.310  11.426
  207   1HB   LYS  26          1HB       LYS  26   5.627  -4.224  12.669
  208   2HB   LYS  26          2HB       LYS  26   4.089  -3.384  12.663
  209   1HG   LYS  26          1HG       LYS  26   3.856  -6.181  13.599
  210   2HG   LYS  26          2HG       LYS  26   4.940  -5.225  14.590
  211   1HD   LYS  26          1HD       LYS  26   3.190  -3.510  14.923
  212   2HD   LYS  26          2HD       LYS  26   2.110  -4.358  13.833
  213   1HE   LYS  26          1HE       LYS  26   2.639  -6.398  15.552
  214   2HE   LYS  26          2HE       LYS  26   2.906  -5.055  16.647
  215   1HZ   LYS  26          1HZ       LYS  26   0.676  -5.422  16.823
  216   2HZ   LYS  26          2HZ       LYS  26   0.684  -4.238  15.698
  217   3HZ   LYS  26          3HZ       LYS  26   0.463  -5.791  15.246
  218    H    VAL  27           H        VAL  27   2.504  -3.544  10.113
  219    HA   VAL  27           HA       VAL  27   3.995  -3.367   7.697
  220    HB   VAL  27           HB       VAL  27   1.527  -3.312   7.875
  221   1HG1  VAL  27          1HG1      VAL  27   1.891  -0.490   8.932
  222   2HG1  VAL  27          2HG1      VAL  27   0.357  -1.339   8.624
  223   3HG1  VAL  27          3HG1      VAL  27   1.433  -1.890   9.931
  224   1HG2  VAL  27          1HG2      VAL  27   2.526  -0.739   6.636
  225   2HG2  VAL  27          2HG2      VAL  27   2.886  -2.337   5.941
  226   3HG2  VAL  27          3HG2      VAL  27   1.198  -1.793   6.093
  227    H    SER  28           H        SER  28   3.875  -1.614  10.753
  228    HA   SER  28           HA       SER  28   4.926   0.785   9.750
  229   1HB   SER  28          1HB       SER  28   3.844  -0.048  12.149
  230   2HB   SER  28          2HB       SER  28   5.539   0.073  12.574
  231    HG   SER  28           HG       SER  28   3.783   2.133  11.591
  232    H    ASP  29           H        ASP  29   6.299  -2.293  10.940
  233    HA   ASP  29           HA       ASP  29   8.918  -1.275  11.175
  234   1HB   ASP  29          1HB       ASP  29   7.740  -4.080  11.014
  235   2HB   ASP  29          2HB       ASP  29   9.468  -3.820  11.142
  236    H    VAL  30           H        VAL  30   6.879  -2.740   8.646
  237    HA   VAL  30           HA       VAL  30   9.011  -3.439   6.904
  238    HB   VAL  30           HB       VAL  30   6.036  -3.070   6.536
  239   1HG1  VAL  30          1HG1      VAL  30   6.463  -2.947   4.334
  240   2HG1  VAL  30          2HG1      VAL  30   8.161  -3.439   4.543
  241   3HG1  VAL  30          3HG1      VAL  30   6.881  -4.673   4.455
  242   1HG2  VAL  30          1HG2      VAL  30   7.111  -5.748   6.172
  243   2HG2  VAL  30          2HG2      VAL  30   7.517  -5.095   7.777
  244   3HG2  VAL  30          3HG2      VAL  30   5.818  -5.176   7.253
  245    H    LEU  31           H        LEU  31   6.950  -0.560   7.447
  246    HA   LEU  31           HA       LEU  31   7.806   0.761   5.087
  247   1HB   LEU  31          1HB       LEU  31   6.357   1.591   7.586
  248   2HB   LEU  31          2HB       LEU  31   6.848   2.770   6.387
  249    HG   LEU  31           HG       LEU  31   4.881   0.500   6.075
  250   1HD1  LEU  31          1HD1      LEU  31   3.966   2.513   7.047
  251   2HD1  LEU  31          2HD1      LEU  31   4.656   3.503   5.738
  252   3HD1  LEU  31          3HD1      LEU  31   3.365   2.331   5.381
  253   1HD2  LEU  31          1HD2      LEU  31   6.428   1.951   3.968
  254   2HD2  LEU  31          2HD2      LEU  31   5.878   0.259   4.031
  255   3HD2  LEU  31          3HD2      LEU  31   4.719   1.558   3.660
  256    H    LYS  32           H        LYS  32   9.037   0.397   8.394
  257    HA   LYS  32           HA       LYS  32  10.721   2.610   8.446
  258   1HB   LYS  32          1HB       LYS  32  11.478   1.747  10.411
  259   2HB   LYS  32          2HB       LYS  32  10.004   0.812  10.258
  260   1HG   LYS  32          1HG       LYS  32  11.375  -0.999  10.522
  261   2HG   LYS  32          2HG       LYS  32  11.736  -0.771   8.822
  262   1HD   LYS  32          1HD       LYS  32  13.701   0.629   9.392
  263   2HD   LYS  32          2HD       LYS  32  13.317   0.515  11.098
  264   1HE   LYS  32          1HE       LYS  32  13.399  -2.172  10.078
  265   2HE   LYS  32          2HE       LYS  32  14.815  -1.347   9.457
  266   1HZ   LYS  32          1HZ       LYS  32  14.542  -0.603  12.094
  267   2HZ   LYS  32          2HZ       LYS  32  14.328  -2.222  12.057
  268   3HZ   LYS  32          3HZ       LYS  32  15.693  -1.564  11.446
  269    H    LEU  33           H        LEU  33  10.869  -0.413   6.659
  270    HA   LEU  33           HA       LEU  33  13.681  -0.313   6.212
  271   1HB   LEU  33          1HB       LEU  33  11.381  -1.970   5.372
  272   2HB   LEU  33          2HB       LEU  33  12.719  -1.896   4.242
  273    HG   LEU  33           HG       LEU  33  12.869  -2.783   7.136
  274   1HD1  LEU  33          1HD1      LEU  33  13.607  -4.617   4.934
  275   2HD1  LEU  33          2HD1      LEU  33  12.743  -4.929   6.458
  276   3HD1  LEU  33          3HD1      LEU  33  11.878  -4.220   5.074
  277   1HD2  LEU  33          1HD2      LEU  33  15.218  -3.504   6.423
  278   2HD2  LEU  33          2HD2      LEU  33  15.018  -2.379   5.059
  279   3HD2  LEU  33          3HD2      LEU  33  14.944  -1.773   6.731
  280    H    PHE  34           H        PHE  34  10.758   1.026   4.688
  281    HA   PHE  34           HA       PHE  34  12.177   1.791   2.315
  282   1HB   PHE  34          1HB       PHE  34   9.430   2.196   3.590
  283   2HB   PHE  34          2HB       PHE  34   9.861   3.153   2.187
  284    HD1  PHE  34           1HD      PHE  34   9.830   2.213   0.006
  285    HD2  PHE  34           2HD      PHE  34   9.326  -0.297   3.391
  286    HE1  PHE  34           1HE      PHE  34   9.119   0.331  -1.495
  287    HE2  PHE  34           2HE      PHE  34   8.614  -2.179   1.890
  288    HZ   PHE  34           HZ       PHE  34   8.519  -1.842  -0.535
  289    H    GLU  35           H        GLU  35  11.860   3.011   5.528
  290    HA   GLU  35           HA       GLU  35  12.059   5.753   4.747
  291   1HB   GLU  35          1HB       GLU  35  11.499   6.201   6.911
  292   2HB   GLU  35          2HB       GLU  35  11.079   4.501   6.977
  293   1HG   GLU  35          1HG       GLU  35  13.361   3.951   7.810
  294   2HG   GLU  35          2HG       GLU  35  13.821   5.638   7.702
  295    H    ASP  36           H        ASP  36  14.171   3.222   6.243
  296    HA   ASP  36           HA       ASP  36  16.422   4.885   5.433
  297   1HB   ASP  36          1HB       ASP  36  15.711   3.878   8.081
  298   2HB   ASP  36          2HB       ASP  36  17.249   3.200   7.586
  299    H    GLY  37           H        GLY  37  14.926   1.682   6.010
  300   1HA   GLY  37          1HA       GLY  37  16.972  -0.071   5.526
  301   2HA   GLY  37          2HA       GLY  37  15.299  -0.330   5.073
  302    H    GLU  38           H        GLU  38  16.820  -1.568   3.361
  303    HA   GLU  38           HA       GLU  38  18.084  -0.077   1.414
  304   1HB   GLU  38          1HB       GLU  38  17.066  -2.869   1.692
  305   2HB   GLU  38          2HB       GLU  38  17.308  -2.319   0.046
  306   1HG   GLU  38          1HG       GLU  38  19.323  -3.433   1.287
  307   2HG   GLU  38          2HG       GLU  38  19.626  -1.986   0.346
  308    H    MET  39           H        MET  39  14.665  -1.029   1.857
  309    HA   MET  39           HA       MET  39  13.778  -0.492  -0.691
  310   1HB   MET  39          1HB       MET  39  12.575  -0.502   2.092
  311   2HB   MET  39          2HB       MET  39  11.594   0.136   0.788
  312   1HG   MET  39          1HG       MET  39  11.242  -2.335   1.193
  313   2HG   MET  39          2HG       MET  39  11.723  -1.962  -0.450
  314   1HE   MET  39          1HE       MET  39  13.608  -4.079  -1.372
  315   2HE   MET  39          2HE       MET  39  13.594  -2.304  -1.507
  316   3HE   MET  39          3HE       MET  39  15.080  -3.147  -1.006
  317    H    ALA  40           H        ALA  40  15.098   1.659   1.644
  318    HA   ALA  40           HA       ALA  40  13.544   3.953   0.965
  319   1HB   ALA  40          1HB       ALA  40  14.861   3.447   3.129
  320   2HB   ALA  40          2HB       ALA  40  16.308   3.925   2.210
  321   3HB   ALA  40          3HB       ALA  40  14.987   5.092   2.460
  322    H    LYS  41           H        LYS  41  15.655   2.088  -0.828
  323    HA   LYS  41           HA       LYS  41  17.169   4.200  -2.028
  324   1HB   LYS  41          1HB       LYS  41  18.156   2.505  -3.343
  325   2HB   LYS  41          2HB       LYS  41  17.923   1.804  -1.754
  326   1HG   LYS  41          1HG       LYS  41  15.861   0.666  -2.515
  327   2HG   LYS  41          2HG       LYS  41  15.979   1.440  -4.083
  328   1HD   LYS  41          1HD       LYS  41  17.001  -0.578  -4.600
  329   2HD   LYS  41          2HD       LYS  41  18.416   0.320  -4.090
  330   1HE   LYS  41          1HE       LYS  41  18.430  -0.709  -1.917
  331   2HE   LYS  41          2HE       LYS  41  16.789  -1.299  -2.092
  332   1HZ   LYS  41          1HZ       LYS  41  18.578  -2.209  -4.126
  333   2HZ   LYS  41          2HZ       LYS  41  18.969  -2.724  -2.626
  334   3HZ   LYS  41          3HZ       LYS  41  17.492  -3.049  -3.242
  335    H    TYR  42           H        TYR  42  13.974   2.834  -2.363
  336    HA   TYR  42           HA       TYR  42  13.674   4.328  -4.882
  337   1HB   TYR  42          1HB       TYR  42  12.582   1.680  -3.784
  338   2HB   TYR  42          2HB       TYR  42  11.717   2.516  -5.059
  339    HD1  TYR  42           1HD      TYR  42  13.915   3.516  -6.767
  340    HD2  TYR  42           2HD      TYR  42  13.465  -0.243  -4.774
  341    HE1  TYR  42           1HE      TYR  42  15.410   2.410  -8.501
  342    HE2  TYR  42           2HE      TYR  42  14.962  -1.337  -6.515
  343    HH   TYR  42           HH       TYR  42  15.999  -1.086  -8.405
  344    H    VAL  43           H        VAL  43  13.408   5.823  -2.632
  345    HA   VAL  43           HA       VAL  43  10.498   6.087  -2.442
  346    HB   VAL  43           HB       VAL  43  12.498   6.123  -0.178
  347   1HG1  VAL  43          1HG1      VAL  43  10.243   7.766  -0.433
  348   2HG1  VAL  43          2HG1      VAL  43   9.721   6.432   0.623
  349   3HG1  VAL  43          3HG1      VAL  43  11.147   7.404   1.057
  350   1HG2  VAL  43          1HG2      VAL  43   9.970   4.481  -0.350
  351   2HG2  VAL  43          2HG2      VAL  43  11.493   3.919  -1.081
  352   3HG2  VAL  43          3HG2      VAL  43  11.407   4.229   0.670
  353    H    GLN  44           H        GLN  44   9.784   8.154  -2.783
  354    HA   GLN  44           HA       GLN  44  11.898  10.129  -3.092
  355   1HB   GLN  44          1HB       GLN  44   9.129   9.862  -4.315
  356   2HB   GLN  44          2HB       GLN  44  10.020  11.369  -4.394
  357   1HG   GLN  44          1HG       GLN  44  11.951   9.543  -5.196
  358   2HG   GLN  44          2HG       GLN  44  10.493   8.815  -5.842
  359   1HE2  GLN  44          1HE2      GLN  44   9.960   9.402  -7.791
  360   2HE2  GLN  44          2HE2      GLN  44  10.303  10.910  -8.571
  361    H    GLY  45           H        GLY  45  12.022  10.595  -0.783
  362   1HA   GLY  45          1HA       GLY  45  11.571  11.991   0.935
  363   2HA   GLY  45          2HA       GLY  45  10.245  12.679   0.019
  364    H    ASP  46           H        ASP  46   8.111  11.961   0.348
  365    HA   ASP  46           HA       ASP  46   7.874   9.889   2.387
  366   1HB   ASP  46          1HB       ASP  46   6.725  12.613   2.177
  367   2HB   ASP  46          2HB       ASP  46   5.516  11.388   2.507
  368    H    ALA  47           H        ALA  47   7.691  10.254  -0.795
  369    HA   ALA  47           HA       ALA  47   5.155   8.791  -1.032
  370   1HB   ALA  47          1HB       ALA  47   5.517  11.356  -1.933
  371   2HB   ALA  47          2HB       ALA  47   6.011  10.415  -3.360
  372   3HB   ALA  47          3HB       ALA  47   4.391  10.183  -2.659
  373    H    ILE  48           H        ILE  48   5.275   6.901  -2.207
  374    HA   ILE  48           HA       ILE  48   7.872   6.383  -3.483
  375    HB   ILE  48           HB       ILE  48   7.603   5.119  -1.430
  376   1HG1  ILE  48          1HG1      ILE  48   7.267   3.253  -3.789
  377   2HG1  ILE  48          2HG1      ILE  48   8.731   4.172  -3.500
  378   1HG2  ILE  48          1HG2      ILE  48   5.165   5.079  -1.299
  379   2HG2  ILE  48          2HG2      ILE  48   5.097   3.976  -2.695
  380   3HG2  ILE  48          3HG2      ILE  48   5.844   3.438  -1.171
  381   1HD1  ILE  48          1HD1      ILE  48   7.647   1.819  -2.027
  382   2HD1  ILE  48          2HD1      ILE  48   9.335   2.327  -2.279
  383   3HD1  ILE  48          3HD1      ILE  48   8.354   3.096  -1.008
  384    H    GLY  49           H        GLY  49   7.799   4.938  -5.381
  385   1HA   GLY  49          1HA       GLY  49   5.427   5.524  -6.978
  386   2HA   GLY  49          2HA       GLY  49   6.978   4.936  -7.542
  387    H    TYR  50           H        TYR  50   5.293   3.489  -8.762
  388    HA   TYR  50           HA       TYR  50   3.899   1.506  -7.368
  389   1HB   TYR  50          1HB       TYR  50   4.022   2.443  -9.908
  390   2HB   TYR  50          2HB       TYR  50   5.210   1.170 -10.108
  391    HD1  TYR  50           1HD      TYR  50   1.652   1.888  -9.421
  392    HD2  TYR  50           2HD      TYR  50   4.557  -1.161 -10.181
  393    HE1  TYR  50           1HE      TYR  50  -0.210   0.206  -9.831
  394    HE2  TYR  50           2HE      TYR  50   2.685  -2.832 -10.588
  395    HH   TYR  50           HH       TYR  50   0.511  -3.031 -10.997
  396    H    GLU  51           H        GLU  51   7.127   1.420  -9.037
  397    HA   GLU  51           HA       GLU  51   7.704  -1.182  -8.590
  398   1HB   GLU  51          1HB       GLU  51   9.046   1.010  -9.603
  399   2HB   GLU  51          2HB       GLU  51   9.996   0.666  -8.171
  400   1HG   GLU  51          1HG       GLU  51  10.530  -1.544  -8.899
  401   2HG   GLU  51          2HG       GLU  51   9.216  -1.582 -10.058
  402    H    GLY  52           H        GLY  52   7.974   1.594  -6.328
  403   1HA   GLY  52          1HA       GLY  52   9.262   0.030  -4.275
  404   2HA   GLY  52          2HA       GLY  52   8.689   1.683  -4.168
  405    H    PHE  53           H        PHE  53   5.950   1.230  -5.064
  406    HA   PHE  53           HA       PHE  53   4.811   0.521  -2.605
  407   1HB   PHE  53          1HB       PHE  53   3.862   2.080  -4.357
  408   2HB   PHE  53          2HB       PHE  53   3.703   0.734  -5.469
  409    HD1  PHE  53           1HD      PHE  53   1.501   0.170  -5.796
  410    HD2  PHE  53           2HD      PHE  53   2.746   1.269  -1.891
  411    HE1  PHE  53           1HE      PHE  53  -0.815  -0.269  -4.935
  412    HE2  PHE  53           2HE      PHE  53   0.429   0.831  -1.030
  413    HZ   PHE  53           HZ       PHE  53  -1.324   0.068  -2.562
  414    H    GLN  54           H        GLN  54   5.252  -1.241  -5.717
  415    HA   GLN  54           HA       GLN  54   3.693  -3.433  -4.848
  416   1HB   GLN  54          1HB       GLN  54   4.560  -4.530  -6.915
  417   2HB   GLN  54          2HB       GLN  54   3.906  -2.935  -7.230
  418   1HG   GLN  54          1HG       GLN  54   5.884  -2.330  -8.152
  419   2HG   GLN  54          2HG       GLN  54   6.652  -2.521  -6.588
  420   1HE2  GLN  54          1HE2      GLN  54   7.058  -3.274  -9.630
  421   2HE2  GLN  54          2HE2      GLN  54   7.773  -4.849  -9.558
  422    H    GLN  55           H        GLN  55   7.076  -2.434  -4.585
  423    HA   GLN  55           HA       GLN  55   8.097  -5.000  -4.081
  424   1HB   GLN  55          1HB       GLN  55   9.756  -3.502  -4.729
  425   2HB   GLN  55          2HB       GLN  55   9.076  -2.173  -3.812
  426   1HG   GLN  55          1HG       GLN  55   9.897  -3.082  -1.713
  427   2HG   GLN  55          2HG       GLN  55  10.325  -4.606  -2.465
  428   1HE2  GLN  55          1HE2      GLN  55  10.975  -1.125  -2.530
  429   2HE2  GLN  55          2HE2      GLN  55  12.641  -1.212  -2.998
  430    H    PHE  56           H        PHE  56   6.545  -2.478  -2.112
  431    HA   PHE  56           HA       PHE  56   7.404  -3.250   0.396
  432   1HB   PHE  56          1HB       PHE  56   6.134  -1.232   0.212
  433   2HB   PHE  56          2HB       PHE  56   4.969  -1.957  -0.878
  434    HD1  PHE  56           1HD      PHE  56   3.008  -3.045  -0.046
  435    HD2  PHE  56           2HD      PHE  56   5.976  -1.659   2.651
  436    HE1  PHE  56           1HE      PHE  56   1.422  -3.377   1.870
  437    HE2  PHE  56           2HE      PHE  56   4.390  -1.991   4.568
  438    HZ   PHE  56           HZ       PHE  56   2.131  -2.846   4.154
  439    H    LEU  57           H        LEU  57   4.625  -4.444  -1.592
  440    HA   LEU  57           HA       LEU  57   3.485  -6.073   0.322
  441   1HB   LEU  57          1HB       LEU  57   3.603  -6.211  -2.683
  442   2HB   LEU  57          2HB       LEU  57   2.709  -7.383  -1.735
  443    HG   LEU  57           HG       LEU  57   1.874  -4.859  -0.791
  444   1HD1  LEU  57          1HD1      LEU  57   1.366  -4.762  -3.718
  445   2HD1  LEU  57          2HD1      LEU  57   1.529  -3.447  -2.529
  446   3HD1  LEU  57          3HD1      LEU  57   2.980  -4.263  -3.158
  447   1HD2  LEU  57          1HD2      LEU  57   0.247  -6.367  -2.793
  448   2HD2  LEU  57          2HD2      LEU  57   0.702  -7.178  -1.275
  449   3HD2  LEU  57          3HD2      LEU  57  -0.223  -5.658  -1.230
  450    H    LYS  58           H        LYS  58   6.535  -6.347  -1.361
  451    HA   LYS  58           HA       LYS  58   6.788  -9.155  -1.171
  452   1HB   LYS  58          1HB       LYS  58   8.049  -7.489  -2.677
  453   2HB   LYS  58          2HB       LYS  58   9.066  -7.175  -1.285
  454   1HG   LYS  58          1HG       LYS  58   9.381  -9.750  -1.132
  455   2HG   LYS  58          2HG       LYS  58   8.660  -9.827  -2.727
  456   1HD   LYS  58          1HD       LYS  58  10.433  -8.112  -3.479
  457   2HD   LYS  58          2HD       LYS  58  11.216  -8.367  -1.932
  458   1HE   LYS  58          1HE       LYS  58  11.103 -10.927  -2.554
  459   2HE   LYS  58          2HE       LYS  58  10.815 -10.361  -4.188
  460   1HZ   LYS  58          1HZ       LYS  58  13.002 -10.191  -4.299
  461   2HZ   LYS  58          2HZ       LYS  58  12.898  -8.870  -3.345
  462   3HZ   LYS  58          3HZ       LYS  58  13.216 -10.329  -2.686
  463    H    ILE  59           H        ILE  59   8.253  -6.451   0.773
  464    HA   ILE  59           HA       ILE  59   9.141  -8.278   2.766
  465    HB   ILE  59           HB       ILE  59   8.972  -5.264   2.694
  466   1HG1  ILE  59          1HG1      ILE  59  11.458  -6.948   2.413
  467   2HG1  ILE  59          2HG1      ILE  59  10.457  -6.577   1.023
  468   1HG2  ILE  59          1HG2      ILE  59  10.909  -6.472   4.526
  469   2HG2  ILE  59          2HG2      ILE  59   9.765  -5.131   4.776
  470   3HG2  ILE  59          3HG2      ILE  59   9.217  -6.815   4.960
  471   1HD1  ILE  59          1HD1      ILE  59  11.359  -4.507   0.883
  472   2HD1  ILE  59          2HD1      ILE  59  10.849  -4.146   2.550
  473   3HD1  ILE  59          3HD1      ILE  59  12.427  -4.912   2.249
  474    H    TYR  60           H        TYR  60   6.438  -5.893   2.466
  475    HA   TYR  60           HA       TYR  60   5.363  -5.922   4.912
  476   1HB   TYR  60          1HB       TYR  60   4.496  -4.839   2.779
  477   2HB   TYR  60          2HB       TYR  60   3.999  -6.413   2.190
  478    HD1  TYR  60           1HD      TYR  60   1.716  -5.448   1.875
  479    HD2  TYR  60           2HD      TYR  60   3.520  -5.767   5.741
  480    HE1  TYR  60           1HE      TYR  60  -0.557  -5.136   2.969
  481    HE2  TYR  60           2HE      TYR  60   1.240  -5.455   6.823
  482    HH   TYR  60           HH       TYR  60  -1.597  -4.711   4.864
  483    H    LEU  61           H        LEU  61   4.274  -8.314   2.394
  484    HA   LEU  61           HA       LEU  61   3.290 -10.004   4.523
  485   1HB   LEU  61          1HB       LEU  61   3.216 -10.521   1.556
  486   2HB   LEU  61          2HB       LEU  61   2.226 -11.249   2.805
  487    HG   LEU  61           HG       LEU  61   1.868  -8.395   2.880
  488   1HD1  LEU  61          1HD1      LEU  61   0.794  -9.246   0.281
  489   2HD1  LEU  61          2HD1      LEU  61   1.552  -7.712   0.772
  490   3HD1  LEU  61          3HD1      LEU  61   2.568  -9.105   0.328
  491   1HD2  LEU  61          1HD2      LEU  61  -0.362  -9.938   1.823
  492   2HD2  LEU  61          2HD2      LEU  61   0.377 -10.711   3.245
  493   3HD2  LEU  61          3HD2      LEU  61  -0.211  -9.034   3.349
  494    H    GLU  62           H        GLU  62   6.234  -9.472   2.899
  495    HA   GLU  62           HA       GLU  62   8.143 -10.518   3.026
  496   1HB   GLU  62          1HB       GLU  62   6.685 -11.766   5.142
  497   2HB   GLU  62          2HB       GLU  62   7.509 -13.055   4.287
  498   1HG   GLU  62          1HG       GLU  62   9.673 -11.967   4.561
  499   2HG   GLU  62          2HG       GLU  62   8.926 -10.498   5.159
  500    H    VAL  63           H        VAL  63   5.493 -11.420   1.332
  501    HA   VAL  63           HA       VAL  63   5.904 -13.954   0.382
  502    HB   VAL  63           HB       VAL  63   4.915 -12.903  -1.777
  503   1HG1  VAL  63          1HG1      VAL  63   3.790 -14.074   0.310
  504   2HG1  VAL  63          2HG1      VAL  63   3.158 -12.437   0.608
  505   3HG1  VAL  63          3HG1      VAL  63   2.804 -13.262  -0.929
  506   1HG2  VAL  63          1HG2      VAL  63   3.819 -10.656  -0.329
  507   2HG2  VAL  63          2HG2      VAL  63   5.594 -10.541  -0.388
  508   3HG2  VAL  63          3HG2      VAL  63   4.661 -10.690  -1.897
  509    H    ASP  64           H        ASP  64   6.958 -14.787  -1.555
  510    HA   ASP  64           HA       ASP  64   9.528 -13.573  -1.849
  511   1HB   ASP  64          1HB       ASP  64   8.243 -16.184  -2.438
  512   2HB   ASP  64          2HB       ASP  64   9.397 -15.692  -3.661
  513    H    ASN  65           H        ASN  65   6.436 -13.342  -3.302
  514    HA   ASN  65           HA       ASN  65   7.361 -11.689  -5.336
  515   1HB   ASN  65          1HB       ASN  65   6.137 -13.401  -7.115
  516   2HB   ASN  65          2HB       ASN  65   7.873 -13.312  -6.895
  517   1HD2  ASN  65          1HD2      ASN  65   4.934 -15.022  -6.087
  518   2HD2  ASN  65          2HD2      ASN  65   5.650 -16.497  -5.531
  519    H    VAL  66           H        VAL  66   5.645 -10.230  -5.370
  520    HA   VAL  66           HA       VAL  66   3.006 -11.234  -4.645
  521    HB   VAL  66           HB       VAL  66   4.489  -9.008  -3.920
  522   1HG1  VAL  66          1HG1      VAL  66   2.184  -8.062  -5.653
  523   2HG1  VAL  66          2HG1      VAL  66   3.331  -7.060  -4.733
  524   3HG1  VAL  66          3HG1      VAL  66   3.896  -7.997  -6.137
  525   1HG2  VAL  66          1HG2      VAL  66   2.994  -9.321  -2.290
  526   2HG2  VAL  66          2HG2      VAL  66   1.826  -8.411  -3.278
  527   3HG2  VAL  66          3HG2      VAL  66   1.888 -10.186  -3.385
  528    HA   PRO  67           HA       PRO  67   1.616 -10.909  -8.726
  529   1HB   PRO  67          1HB       PRO  67  -1.084 -10.749  -8.336
  530   2HB   PRO  67          2HB       PRO  67  -0.197 -12.259  -8.288
  531   1HG   PRO  67          1HG       PRO  67  -1.304 -10.689  -6.042
  532   2HG   PRO  67          2HG       PRO  67  -0.803 -12.368  -6.065
  533   1HD   PRO  67          1HD       PRO  67   0.645 -10.161  -4.943
  534   2HD   PRO  67          2HD       PRO  67   1.196 -11.820  -5.070
  535    H    ARG  68           H        ARG  68   1.638  -9.401 -10.279
  536    HA   ARG  68           HA       ARG  68   1.643  -6.767  -9.463
  537   1HB   ARG  68          1HB       ARG  68   2.610  -7.874 -11.622
  538   2HB   ARG  68          2HB       ARG  68   1.006  -7.687 -12.301
  539   1HG   ARG  68          1HG       ARG  68   1.321  -5.162 -11.385
  540   2HG   ARG  68          2HG       ARG  68   3.016  -5.570 -11.559
  541   1HD   ARG  68          1HD       ARG  68   1.781  -6.526 -13.937
  542   2HD   ARG  68          2HD       ARG  68   1.046  -4.963 -13.639
  543    HE   ARG  68           HE       ARG  68   3.796  -5.452 -14.434
  544   1HH1  ARG  68          2HH2      ARG  68   1.751  -3.249 -12.604
  545   2HH1  ARG  68          1HH2      ARG  68   2.820  -1.899 -12.789
  546   1HH2  ARG  68          2HH1      ARG  68   5.207  -3.671 -14.679
  547   2HH2  ARG  68          1HH1      ARG  68   4.799  -2.141 -13.977
  548    H    HIS  69           H        HIS  69  -0.942  -8.939 -10.597
  549    HA   HIS  69           HA       HIS  69  -2.817  -7.093 -11.390
  550   1HB   HIS  69          1HB       HIS  69  -3.321  -9.709  -9.947
  551   2HB   HIS  69          2HB       HIS  69  -4.463  -8.840 -10.952
  552    HD1  HIS  69           1HD      HIS  69  -3.110  -8.302 -13.524
  553    HD2  HIS  69           2HD      HIS  69  -2.359 -11.819 -11.365
  554    HE1  HIS  69           1HE      HIS  69  -2.197  -9.991 -15.204
  555    H    LEU  70           H        LEU  70  -2.028  -8.340  -8.096
  556    HA   LEU  70           HA       LEU  70  -4.112  -6.914  -6.832
  557   1HB   LEU  70          1HB       LEU  70  -3.411  -8.700  -5.608
  558   2HB   LEU  70          2HB       LEU  70  -1.721  -8.476  -6.013
  559    HG   LEU  70           HG       LEU  70  -1.939  -6.320  -4.516
  560   1HD1  LEU  70          1HD1      LEU  70  -3.539  -7.168  -2.538
  561   2HD1  LEU  70          2HD1      LEU  70  -4.086  -6.081  -3.837
  562   3HD1  LEU  70          3HD1      LEU  70  -4.433  -7.825  -3.930
  563   1HD2  LEU  70          1HD2      LEU  70  -0.435  -8.158  -4.042
  564   2HD2  LEU  70          2HD2      LEU  70  -1.262  -7.650  -2.549
  565   3HD2  LEU  70          3HD2      LEU  70  -1.778  -9.130  -3.394
  566    H    SER  71           H        SER  71  -0.598  -6.272  -7.390
  567    HA   SER  71           HA       SER  71  -0.464  -3.956  -5.937
  568   1HB   SER  71          1HB       SER  71   1.172  -5.395  -7.805
  569   2HB   SER  71          2HB       SER  71   1.177  -3.716  -8.307
  570    HG   SER  71           HG       SER  71   1.817  -4.709  -5.660
  571    H    LEU  72           H        LEU  72  -1.941  -4.641  -9.069
  572    HA   LEU  72           HA       LEU  72  -1.964  -1.953  -9.987
  573   1HB   LEU  72          1HB       LEU  72  -2.076  -3.508 -11.675
  574   2HB   LEU  72          2HB       LEU  72  -3.192  -4.546 -10.809
  575    HG   LEU  72           HG       LEU  72  -4.947  -2.717 -11.151
  576   1HD1  LEU  72          1HD1      LEU  72  -3.238  -1.777 -13.435
  577   2HD1  LEU  72          2HD1      LEU  72  -4.632  -0.991 -12.655
  578   3HD1  LEU  72          3HD1      LEU  72  -3.060  -1.049 -11.821
  579   1HD2  LEU  72          1HD2      LEU  72  -5.479  -4.484 -12.449
  580   2HD2  LEU  72          2HD2      LEU  72  -4.976  -3.394 -13.763
  581   3HD2  LEU  72          3HD2      LEU  72  -3.843  -4.616 -13.138
  582    H    ALA  73           H        ALA  73  -4.366  -4.127  -8.369
  583    HA   ALA  73           HA       ALA  73  -6.349  -2.102  -8.257
  584   1HB   ALA  73          1HB       ALA  73  -6.048  -4.906  -7.648
  585   2HB   ALA  73          2HB       ALA  73  -6.785  -4.079  -6.254
  586   3HB   ALA  73          3HB       ALA  73  -7.542  -3.963  -7.861
  587    H    LEU  74           H        LEU  74  -3.611  -3.119  -6.226
  588    HA   LEU  74           HA       LEU  74  -4.431  -1.891  -3.856
  589   1HB   LEU  74          1HB       LEU  74  -1.931  -2.965  -5.009
  590   2HB   LEU  74          2HB       LEU  74  -1.728  -1.775  -3.738
  591    HG   LEU  74           HG       LEU  74  -3.473  -4.226  -3.419
  592   1HD1  LEU  74          1HD1      LEU  74  -0.977  -4.657  -3.957
  593   2HD1  LEU  74          2HD1      LEU  74  -0.682  -4.035  -2.315
  594   3HD1  LEU  74          3HD1      LEU  74  -1.713  -5.466  -2.552
  595   1HD2  LEU  74          1HD2      LEU  74  -3.173  -3.780  -1.013
  596   2HD2  LEU  74          2HD2      LEU  74  -2.256  -2.308  -1.413
  597   3HD2  LEU  74          3HD2      LEU  74  -3.974  -2.436  -1.861
  598    H    PHE  75           H        PHE  75  -2.699  -0.673  -6.762
  599    HA   PHE  75           HA       PHE  75  -2.191   1.868  -5.599
  600   1HB   PHE  75          1HB       PHE  75  -0.856   0.853  -7.456
  601   2HB   PHE  75          2HB       PHE  75  -2.289   0.737  -8.458
  602    HD1  PHE  75           1HD      PHE  75  -0.176   3.264  -6.713
  603    HD2  PHE  75           2HD      PHE  75  -2.759   2.429  -9.975
  604    HE1  PHE  75           1HE      PHE  75   0.319   5.525  -7.684
  605    HE2  PHE  75           2HE      PHE  75  -2.264   4.690 -10.946
  606    HZ   PHE  75           HZ       PHE  75  -0.731   6.211  -9.789
  607    H    GLN  76           H        GLN  76  -4.695   0.488  -7.801
  608    HA   GLN  76           HA       GLN  76  -5.885   2.875  -8.471
  609   1HB   GLN  76          1HB       GLN  76  -6.672  -0.007  -8.455
  610   2HB   GLN  76          2HB       GLN  76  -7.998   1.137  -8.518
  611   1HG   GLN  76          1HG       GLN  76  -6.430   2.288 -10.392
  612   2HG   GLN  76          2HG       GLN  76  -5.803   0.657 -10.526
  613   1HE2  GLN  76          1HE2      GLN  76  -7.441  -1.100 -10.690
  614   2HE2  GLN  76          2HE2      GLN  76  -8.841  -0.833 -11.675
  615    H    SER  77           H        SER  77  -6.116   0.867  -5.540
  616    HA   SER  77           HA       SER  77  -8.461   1.750  -4.506
  617   1HB   SER  77          1HB       SER  77  -7.216  -0.007  -3.417
  618   2HB   SER  77          2HB       SER  77  -5.828   1.033  -3.161
  619    HG   SER  77           HG       SER  77  -7.857   0.606  -1.475
  620    H    PHE  78           H        PHE  78  -5.347   2.970  -3.117
  621    HA   PHE  78           HA       PHE  78  -6.640   5.515  -2.642
  622   1HB   PHE  78          1HB       PHE  78  -5.149   4.097  -1.021
  623   2HB   PHE  78          2HB       PHE  78  -3.790   4.541  -2.034
  624    HD1  PHE  78           1HD      PHE  78  -2.485   6.219  -1.170
  625    HD2  PHE  78           2HD      PHE  78  -6.666   6.340  -0.451
  626    HE1  PHE  78           1HE      PHE  78  -2.198   8.337   0.144
  627    HE2  PHE  78           2HE      PHE  78  -6.378   8.459   0.863
  628    HZ   PHE  78           HZ       PHE  78  -4.147   9.432   1.145
  629    H    GLU  79           H        GLU  79  -5.164   7.542  -2.955
  630    HA   GLU  79           HA       GLU  79  -3.173   7.508  -4.862
  631   1HB   GLU  79          1HB       GLU  79  -5.126   6.853  -6.357
  632   2HB   GLU  79          2HB       GLU  79  -5.841   8.417  -6.023
  633   1HG   GLU  79          1HG       GLU  79  -3.520   9.391  -6.803
  634   2HG   GLU  79          2HG       GLU  79  -3.264   7.807  -7.508
  635    H    THR  80           H        THR  80  -2.282   9.644  -5.182
  636    HA   THR  80           HA       THR  80  -3.711  11.785  -3.765
  637    HB   THR  80           HB       THR  80  -1.987  10.702  -2.268
  638    HG1  THR  80           1HG      THR  80  -2.518  13.102  -2.439
  639   1HG2  THR  80          1HG2      THR  80   0.121  10.250  -3.022
  640   2HG2  THR  80          2HG2      THR  80  -0.397  10.739  -4.654
  641   3HG2  THR  80          3HG2      THR  80   0.316  11.939  -3.549
  642    H    GLY  81           H        GLY  81  -0.952  13.234  -4.271
  643   1HA   GLY  81          1HA       GLY  81  -0.171  14.670  -5.810
  644   2HA   GLY  81          2HA       GLY  81  -0.557  13.459  -7.017
  645    H    HIS  82           H        HIS  82  -1.300  16.581  -5.818
  646    HA   HIS  82           HA       HIS  82  -3.923  16.976  -6.131
  647   1HB   HIS  82          1HB       HIS  82  -1.502  18.576  -6.447
  648   2HB   HIS  82          2HB       HIS  82  -2.803  19.156  -7.468
  649    HD1  HIS  82           1HD      HIS  82  -1.557  20.407  -4.680
  650    HD2  HIS  82           2HD      HIS  82  -5.291  18.592  -5.278
  651    HE1  HIS  82           1HE      HIS  82  -3.080  21.279  -2.829
  652    H    CYS  83           H        CYS  83  -1.547  17.200  -8.882
  653    HA   CYS  83           HA       CYS  83  -1.752  16.637 -11.002
  654   1HB   CYS  83          1HB       CYS  83  -3.809  14.985  -9.806
  655   2HB   CYS  83          2HB       CYS  83  -4.329  15.541 -11.385
  656    HG   CYS  83           HG       CYS  83  -3.273  13.375 -12.004
  657    H    LEU  84           H        LEU  84  -2.723  19.159  -9.672
  658    HA   LEU  84           HA       LEU  84  -4.573  20.012 -11.790
  659   1HB   LEU  84          1HB       LEU  84  -4.717  20.301  -8.865
  660   2HB   LEU  84          2HB       LEU  84  -5.000  21.782  -9.757
  661    HG   LEU  84           HG       LEU  84  -7.110  20.751  -9.329
  662   1HD1  LEU  84          1HD1      LEU  84  -8.053  20.812 -11.445
  663   2HD1  LEU  84          2HD1      LEU  84  -6.540  21.724 -11.665
  664   3HD1  LEU  84          3HD1      LEU  84  -6.648  20.033 -12.212
  665   1HD2  LEU  84          1HD2      LEU  84  -7.493  18.559  -9.247
  666   2HD2  LEU  84          2HD2      LEU  84  -6.820  18.297 -10.873
  667   3HD2  LEU  84          3HD2      LEU  84  -5.739  18.343  -9.460
  668    H    ASN  85           H        ASN  85  -1.776  19.938 -12.153
  669    HA   ASN  85           HA       ASN  85  -1.359  22.680 -12.674
  670   1HB   ASN  85          1HB       ASN  85   0.902  22.718 -11.421
  671   2HB   ASN  85          2HB       ASN  85  -0.529  22.840 -10.416
  672   1HD2  ASN  85          1HD2      ASN  85   1.380  22.130  -8.970
  673   2HD2  ASN  85          2HD2      ASN  85   1.504  20.433  -8.647
  674    H    GLU  86           H        GLU  86  -0.863  22.168 -14.843
  675    HA   GLU  86           HA       GLU  86   0.331  21.519 -16.542
  676   1HB   GLU  86          1HB       GLU  86   2.308  22.047 -14.980
  677   2HB   GLU  86          2HB       GLU  86   2.409  20.326 -14.665
  678   1HG   GLU  86          1HG       GLU  86   2.963  19.813 -16.931
  679   2HG   GLU  86          2HG       GLU  86   2.379  21.356 -17.521
  680    H    THR  87           H        THR  87   0.129  19.750 -17.925
  681    HA   THR  87           HA       THR  87  -0.985  17.362 -16.730
  682    HB   THR  87           HB       THR  87  -0.528  18.287 -19.616
  683    HG1  THR  87           1HG      THR  87  -2.449  19.285 -19.148
  684   1HG2  THR  87          1HG2      THR  87  -1.095  16.133 -20.172
  685   2HG2  THR  87          2HG2      THR  87  -1.450  15.720 -18.477
  686   3HG2  THR  87          3HG2      THR  87  -2.695  16.499 -19.483
  687    H    ASN  88           H        ASN  88   1.520  17.523 -15.731
  688    HA   ASN  88           HA       ASN  88   2.869  15.480 -17.311
  689   1HB   ASN  88          1HB       ASN  88   4.256  17.452 -17.518
  690   2HB   ASN  88          2HB       ASN  88   4.036  17.880 -15.833
  691   1HD2  ASN  88          1HD2      ASN  88   6.269  17.984 -15.557
  692   2HD2  ASN  88          2HD2      ASN  88   7.259  16.573 -15.389
  693    H    VAL  89           H        VAL  89   1.930  13.800 -15.956
  694    HA   VAL  89           HA       VAL  89   2.652  13.974 -13.115
  695    HB   VAL  89           HB       VAL  89   0.641  12.097 -14.335
  696   1HG1  VAL  89          1HG1      VAL  89   0.013  11.617 -12.202
  697   2HG1  VAL  89          2HG1      VAL  89   1.683  12.123 -11.851
  698   3HG1  VAL  89          3HG1      VAL  89   0.338  13.266 -11.615
  699   1HG2  VAL  89          1HG2      VAL  89   0.026  14.389 -15.017
  700   2HG2  VAL  89          2HG2      VAL  89  -1.130  13.705 -13.849
  701   3HG2  VAL  89          3HG2      VAL  89   0.075  14.900 -13.313
  702    H    THR  90           H        THR  90   4.672  13.393 -15.029
  703    HA   THR  90           HA       THR  90   4.955  10.615 -15.449
  704    HB   THR  90           HB       THR  90   6.078  12.536 -16.707
  705    HG1  THR  90           1HG      THR  90   6.894  10.339 -16.801
  706   1HG2  THR  90          1HG2      THR  90   8.473  12.803 -15.342
  707   2HG2  THR  90          2HG2      THR  90   7.191  14.037 -15.348
  708   3HG2  THR  90          3HG2      THR  90   7.300  12.874 -14.005
  709    H    LYS  91           H        LYS  91   5.015  12.436 -12.576
  710    HA   LYS  91           HA       LYS  91   6.780  10.454 -11.323
  711   1HB   LYS  91          1HB       LYS  91   6.099  13.312 -10.628
  712   2HB   LYS  91          2HB       LYS  91   6.756  12.215  -9.430
  713   1HG   LYS  91          1HG       LYS  91   8.811  11.968 -10.576
  714   2HG   LYS  91          2HG       LYS  91   8.126  12.432 -12.120
  715   1HD   LYS  91          1HD       LYS  91   9.369  14.345 -11.493
  716   2HD   LYS  91          2HD       LYS  91   7.731  14.775 -11.042
  717   1HE   LYS  91          1HE       LYS  91   8.135  14.418  -8.722
  718   2HE   LYS  91          2HE       LYS  91   9.542  13.417  -9.021
  719   1HZ   LYS  91          1HZ       LYS  91  10.517  15.506 -10.027
  720   2HZ   LYS  91          2HZ       LYS  91   9.313  16.318  -9.280
  721   3HZ   LYS  91          3HZ       LYS  91  10.384  15.456  -8.400
  722    H    ASP  92           H        ASP  92   5.164   8.792 -11.254
  723    HA   ASP  92           HA       ASP  92   2.738   9.433  -9.867
  724   1HB   ASP  92          1HB       ASP  92   2.405   6.860 -10.187
  725   2HB   ASP  92          2HB       ASP  92   2.363   7.888 -11.605
  726    H    VAL  93           H        VAL  93   2.684   9.334  -7.617
  727    HA   VAL  93           HA       VAL  93   4.157   7.198  -6.308
  728    HB   VAL  93           HB       VAL  93   4.964   8.906  -4.611
  729   1HG1  VAL  93          1HG1      VAL  93   7.026   9.092  -5.668
  730   2HG1  VAL  93          2HG1      VAL  93   6.282   7.723  -6.530
  731   3HG1  VAL  93          3HG1      VAL  93   6.300   9.340  -7.274
  732   1HG2  VAL  93          1HG2      VAL  93   4.192  10.995  -4.886
  733   2HG2  VAL  93          2HG2      VAL  93   5.389  11.136  -6.197
  734   3HG2  VAL  93          3HG2      VAL  93   3.707  10.688  -6.571
  735    H    VAL  94           H        VAL  94   3.541   7.265  -3.833
  736    HA   VAL  94           HA       VAL  94   0.918   8.411  -3.400
  737    HB   VAL  94           HB       VAL  94   0.271   6.385  -4.439
  738   1HG1  VAL  94          1HG1      VAL  94   1.220   4.292  -4.164
  739   2HG1  VAL  94          2HG1      VAL  94   2.641   5.348  -3.982
  740   3HG1  VAL  94          3HG1      VAL  94   1.848   4.668  -2.541
  741   1HG2  VAL  94          1HG2      VAL  94   0.155   5.975  -1.431
  742   2HG2  VAL  94          2HG2      VAL  94  -0.966   6.967  -2.394
  743   3HG2  VAL  94          3HG2      VAL  94  -0.902   5.205  -2.638
  744    H    CYS  95           H        CYS  95   0.317   8.375  -1.105
  745    HA   CYS  95           HA       CYS  95   2.626   8.695   0.514
  746   1HB   CYS  95          1HB       CYS  95  -0.342   8.955   1.000
  747   2HB   CYS  95          2HB       CYS  95   0.797   9.034   2.329
  748    HG   CYS  95           HG       CYS  95   1.249  11.338   2.077
  749    H    LEU  96           H        LEU  96   3.462   7.258   2.056
  750    HA   LEU  96           HA       LEU  96   2.494   4.553   1.883
  751   1HB   LEU  96          1HB       LEU  96   4.822   5.829   3.322
  752   2HB   LEU  96          2HB       LEU  96   4.457   4.116   3.380
  753    HG   LEU  96           HG       LEU  96   4.581   5.048   0.631
  754   1HD1  LEU  96          1HD1      LEU  96   6.236   6.576   2.102
  755   2HD1  LEU  96          2HD1      LEU  96   7.294   5.172   1.822
  756   3HD1  LEU  96          3HD1      LEU  96   6.597   6.050   0.440
  757   1HD2  LEU  96          1HD2      LEU  96   6.586   3.251   0.894
  758   2HD2  LEU  96          2HD2      LEU  96   5.598   2.840   2.317
  759   3HD2  LEU  96          3HD2      LEU  96   4.872   2.815   0.692
  760    H    ASN  97           H        ASN  97   2.838   7.134   4.397
  761    HA   ASN  97           HA       ASN  97   1.948   5.729   6.526
  762   1HB   ASN  97          1HB       ASN  97   1.623   8.639   5.699
  763   2HB   ASN  97          2HB       ASN  97   0.912   8.083   7.201
  764   1HD2  ASN  97          1HD2      ASN  97   3.756   8.981   5.536
  765   2HD2  ASN  97          2HD2      ASN  97   4.909   8.764   6.810
  766    H    ASP  98           H        ASP  98   0.117   7.335   3.867
  767    HA   ASP  98           HA       ASP  98  -2.397   7.083   5.015
  768   1HB   ASP  98          1HB       ASP  98  -1.314   7.453   2.222
  769   2HB   ASP  98          2HB       ASP  98  -3.011   7.051   2.392
  770    H    VAL  99           H        VAL  99  -0.349   4.974   2.932
  771    HA   VAL  99           HA       VAL  99  -2.388   3.049   2.459
  772    HB   VAL  99           HB       VAL  99   0.623   2.926   2.198
  773   1HG1  VAL  99          1HG1      VAL  99  -0.878   0.737   2.302
  774   2HG1  VAL  99          2HG1      VAL  99  -1.220   1.178   0.612
  775   3HG1  VAL  99          3HG1      VAL  99   0.458   0.896   1.137
  776   1HG2  VAL  99          1HG2      VAL  99  -1.187   3.162  -0.163
  777   2HG2  VAL  99          2HG2      VAL  99  -0.948   4.614   0.839
  778   3HG2  VAL  99          3HG2      VAL  99   0.453   3.805   0.097
  779    H    SER 100           H        SER 100   0.206   3.542   4.883
  780    HA   SER 100           HA       SER 100   0.162   1.024   5.976
  781   1HB   SER 100          1HB       SER 100   1.851   2.085   7.046
  782   2HB   SER 100          2HB       SER 100   1.189   3.661   6.662
  783    HG   SER 100           HG       SER 100   0.842   3.763   8.780
  784    H    CYS 101           H        CYS 101  -2.101   3.738   6.237
  785    HA   CYS 101           HA       CYS 101  -3.360   2.857   8.606
  786   1HB   CYS 101          1HB       CYS 101  -3.387   5.203   7.427
  787   2HB   CYS 101          2HB       CYS 101  -4.746   4.548   6.536
  788    HG   CYS 101           HG       CYS 101  -4.430   5.569   9.537
  789    H    TYR 102           H        TYR 102  -3.994   2.538   5.050
  790    HA   TYR 102           HA       TYR 102  -6.400   1.190   5.197
  791   1HB   TYR 102          1HB       TYR 102  -5.015   2.169   3.209
  792   2HB   TYR 102          2HB       TYR 102  -4.023   0.726   3.293
  793    HD1  TYR 102           1HD      TYR 102  -4.462  -0.318   1.228
  794    HD2  TYR 102           2HD      TYR 102  -7.732   0.950   3.678
  795    HE1  TYR 102           1HE      TYR 102  -6.091  -1.522  -0.310
  796    HE2  TYR 102           2HE      TYR 102  -9.349  -0.258   2.132
  797    HH   TYR 102           HH       TYR 102  -8.217  -1.742  -0.857
  798    H    PHE 103           H        PHE 103  -3.021  -0.132   5.136
  799    HA   PHE 103           HA       PHE 103  -3.834  -2.813   5.204
  800   1HB   PHE 103          1HB       PHE 103  -1.331  -1.242   6.042
  801   2HB   PHE 103          2HB       PHE 103  -1.369  -2.993   6.099
  802    HD1  PHE 103           1HD      PHE 103  -2.886  -3.582   3.603
  803    HD2  PHE 103           2HD      PHE 103   0.221  -0.793   4.360
  804    HE1  PHE 103           1HE      PHE 103  -2.212  -3.677   1.187
  805    HE2  PHE 103           2HE      PHE 103   0.894  -0.887   1.944
  806    HZ   PHE 103           HZ       PHE 103  -0.330  -2.328   0.386
  807    H    SER 104           H        SER 104  -3.154  -0.378   7.752
  808    HA   SER 104           HA       SER 104  -2.975  -2.123   9.870
  809   1HB   SER 104          1HB       SER 104  -2.496   0.403   9.788
  810   2HB   SER 104          2HB       SER 104  -4.219   0.654   9.986
  811    HG   SER 104           HG       SER 104  -3.627   0.620  12.075
  812    H    LEU 105           H        LEU 105  -5.797  -0.703   8.172
  813    HA   LEU 105           HA       LEU 105  -7.685  -1.591  10.106
  814   1HB   LEU 105          1HB       LEU 105  -7.631   0.020   7.743
  815   2HB   LEU 105          2HB       LEU 105  -8.897  -1.179   7.573
  816    HG   LEU 105           HG       LEU 105  -9.203  -0.187  10.182
  817   1HD1  LEU 105          1HD1      LEU 105  -8.049   1.765  10.098
  818   2HD1  LEU 105          2HD1      LEU 105  -8.178   1.903   8.328
  819   3HD1  LEU 105          3HD1      LEU 105  -9.567   2.329   9.357
  820   1HD2  LEU 105          1HD2      LEU 105 -10.789  -0.773   8.074
  821   2HD2  LEU 105          2HD2      LEU 105 -11.338   0.104   9.522
  822   3HD2  LEU 105          3HD2      LEU 105 -10.883   1.004   8.056
  823    H    LEU 106           H        LEU 106  -6.194  -2.911   7.142
  824    HA   LEU 106           HA       LEU 106  -7.987  -4.975   6.683
  825   1HB   LEU 106          1HB       LEU 106  -5.337  -4.169   5.839
  826   2HB   LEU 106          2HB       LEU 106  -5.438  -5.911   6.004
  827    HG   LEU 106           HG       LEU 106  -7.708  -5.502   4.619
  828   1HD1  LEU 106          1HD1      LEU 106  -6.523  -3.750   2.813
  829   2HD1  LEU 106          2HD1      LEU 106  -7.900  -3.410   3.889
  830   3HD1  LEU 106          3HD1      LEU 106  -6.246  -2.997   4.402
  831   1HD2  LEU 106          1HD2      LEU 106  -6.468  -7.029   3.551
  832   2HD2  LEU 106          2HD2      LEU 106  -5.918  -5.660   2.555
  833   3HD2  LEU 106          3HD2      LEU 106  -4.938  -6.207   3.937
  834    H    GLU 107           H        GLU 107  -4.768  -5.234   8.360
  835    HA   GLU 107           HA       GLU 107  -5.364  -7.749   9.377
  836   1HB   GLU 107          1HB       GLU 107  -3.359  -7.355  10.834
  837   2HB   GLU 107          2HB       GLU 107  -3.062  -7.006   9.143
  838   1HG   GLU 107          1HG       GLU 107  -3.242  -4.615   9.506
  839   2HG   GLU 107          2HG       GLU 107  -3.901  -4.838  11.114
  840    H    GLY 108           H        GLY 108  -5.958  -4.440  10.557
  841   1HA   GLY 108          1HA       GLY 108  -6.630  -5.248  13.233
  842   2HA   GLY 108          2HA       GLY 108  -6.840  -3.669  12.502
  843    H    GLY 109           H        GLY 109  -8.154  -5.711  10.240
  844   1HA   GLY 109          1HA       GLY 109 -10.798  -5.802  11.556
  845   2HA   GLY 109          2HA       GLY 109 -10.593  -5.099   9.964
  846    H    ARG 110           H        ARG 110  -8.864  -7.973  11.298
  847    HA   ARG 110           HA       ARG 110  -9.300  -9.423   8.982
  848   1HB   ARG 110          1HB       ARG 110  -7.644  -9.681  11.140
  849   2HB   ARG 110          2HB       ARG 110  -8.823 -10.910  11.552
  850   1HG   ARG 110          1HG       ARG 110  -8.513 -11.738   9.078
  851   2HG   ARG 110          2HG       ARG 110  -7.063 -10.754   9.079
  852   1HD   ARG 110          1HD       ARG 110  -7.527 -12.701  11.356
  853   2HD   ARG 110          2HD       ARG 110  -6.947 -13.308   9.818
  854    HE   ARG 110           HE       ARG 110  -5.326 -11.079  10.439
  855   1HH1  ARG 110          2HH2      ARG 110  -6.031 -14.236  11.824
  856   2HH1  ARG 110          1HH2      ARG 110  -4.476 -14.399  12.568
  857   1HH2  ARG 110          2HH1      ARG 110  -3.274 -11.293  11.421
  858   2HH2  ARG 110          1HH1      ARG 110  -2.897 -12.713  12.338
  859    HA   PRO 111           HA       PRO 111 -13.388 -10.751   9.962
  860   1HB   PRO 111          1HB       PRO 111 -13.933 -11.998   7.592
  861   2HB   PRO 111          2HB       PRO 111 -14.158 -10.278   7.844
  862   1HG   PRO 111          1HG       PRO 111 -12.021 -11.668   6.347
  863   2HG   PRO 111          2HG       PRO 111 -12.506  -9.986   6.262
  864   1HD   PRO 111          1HD       PRO 111 -10.200 -11.041   7.603
  865   2HD   PRO 111          2HD       PRO 111 -10.749  -9.377   7.614
  866    H    GLU 112           H        GLU 112 -14.589 -12.631  10.524
  867    HA   GLU 112           HA       GLU 112 -12.789 -14.928  10.589
  868   1HB   GLU 112          1HB       GLU 112 -14.384 -13.617  12.714
  869   2HB   GLU 112          2HB       GLU 112 -14.598 -15.355  12.656
  870   1HG   GLU 112          1HG       GLU 112 -12.208 -15.746  12.888
  871   2HG   GLU 112          2HG       GLU 112 -11.841 -14.051  12.635
  872    H    ASP 113           H        ASP 113 -16.114 -13.677  10.157
  873    HA   ASP 113           HA       ASP 113 -16.870 -16.336   9.238
  874   1HB   ASP 113          1HB       ASP 113 -18.336 -14.085  10.579
  875   2HB   ASP 113          2HB       ASP 113 -19.240 -14.984   9.377
  876    H    LYS 114           H        LYS 114 -15.584 -15.558   7.207
  877    HA   LYS 114           HA       LYS 114 -16.587 -13.394   5.701
  878   1HB   LYS 114          1HB       LYS 114 -14.885 -15.759   4.858
  879   2HB   LYS 114          2HB       LYS 114 -15.143 -14.304   3.918
  880   1HG   LYS 114          1HG       LYS 114 -13.911 -12.948   5.413
  881   2HG   LYS 114          2HG       LYS 114 -14.140 -14.045   6.761
  882   1HD   LYS 114          1HD       LYS 114 -12.725 -15.364   4.549
  883   2HD   LYS 114          2HD       LYS 114 -11.889 -13.910   5.056
  884   1HE   LYS 114          1HE       LYS 114 -11.898 -14.700   7.416
  885   2HE   LYS 114          2HE       LYS 114 -12.797 -16.130   6.951
  886   1HZ   LYS 114          1HZ       LYS 114 -10.337 -15.610   5.525
  887   2HZ   LYS 114          2HZ       LYS 114 -10.201 -16.103   7.075
  888   3HZ   LYS 114          3HZ       LYS 114 -10.990 -17.033   5.989
  889    H    LEU 115           H        LEU 115 -17.501 -13.698   3.415
  890    HA   LEU 115           HA       LEU 115 -19.995 -14.622   3.452
  891   1HB   LEU 115          1HB       LEU 115 -19.278 -15.210   0.873
  892   2HB   LEU 115          2HB       LEU 115 -19.785 -13.648   1.484
  893    HG   LEU 115           HG       LEU 115 -16.886 -14.327   1.700
  894   1HD1  LEU 115          1HD1      LEU 115 -17.988 -13.327  -0.923
  895   2HD1  LEU 115          2HD1      LEU 115 -16.356 -13.928  -0.546
  896   3HD1  LEU 115          3HD1      LEU 115 -17.728 -15.059  -0.607
  897   1HD2  LEU 115          1HD2      LEU 115 -17.566 -11.734   0.613
  898   2HD2  LEU 115          2HD2      LEU 115 -18.478 -12.059   2.106
  899   3HD2  LEU 115          3HD2      LEU 115 -16.700 -12.153   2.110
  900    H    GLU 116           H        GLU 116 -21.123 -16.552   2.677
  901    HA   GLU 116           HA       GLU 116 -19.457 -18.924   2.683
  902   1HB   GLU 116          1HB       GLU 116 -21.983 -19.361   4.121
  903   2HB   GLU 116          2HB       GLU 116 -20.354 -19.832   4.563
  904   1HG   GLU 116          1HG       GLU 116 -20.869 -18.287   6.254
  905   2HG   GLU 116          2HG       GLU 116 -20.006 -17.278   5.110
  906    H    TRP 117           H        TRP 117 -19.937 -20.147   0.911
  907    HA   TRP 117           HA       TRP 117 -22.572 -19.714  -0.311
  908   1HB   TRP 117          1HB       TRP 117 -20.236 -20.933  -1.737
  909   2HB   TRP 117          2HB       TRP 117 -21.637 -20.112  -2.394
  910    HD1  TRP 117           HD       TRP 117 -21.415 -17.369  -0.688
  911    HE1  TRP 117           1HE      TRP 117 -19.528 -15.587  -1.166
  912    HE3  TRP 117           3HE      TRP 117 -18.222 -20.591  -2.985
  913    HZ2  TRP 117           2HZ      TRP 117 -16.969 -15.722  -2.422
  914    HZ3  TRP 117           3HZ      TRP 117 -16.050 -19.685  -3.807
  915    HH2  TRP 117           HH       TRP 117 -15.404 -17.341  -3.557
  916    H    SER 118           H        SER 118 -23.357 -21.233   1.463
  917    HA   SER 118           HA       SER 118 -22.465 -23.749   1.838
  918   1HB   SER 118          1HB       SER 118 -24.368 -22.500   3.023
  919   2HB   SER 118          2HB       SER 118 -25.417 -23.008   1.714
  920    HG   SER 118           HG       SER 118 -24.055 -24.647   3.655
  Start of MODEL    5
    1   1H    MET   1           H        MET   1  -8.793   3.721   4.196
    2    HA   MET   1           HA       MET   1  -7.214   4.927   3.189
    3   1HB   MET   1          1HB       MET   1  -9.516   4.558   1.223
    4   2HB   MET   1          2HB       MET   1  -8.023   5.297   0.679
    5   1HG   MET   1          1HG       MET   1  -7.425   2.894   2.227
    6   2HG   MET   1          2HG       MET   1  -8.571   2.511   0.958
    7   1HE   MET   1          1HE       MET   1  -4.844   5.003   0.106
    8   2HE   MET   1          2HE       MET   1  -5.975   5.135   1.474
    9   3HE   MET   1          3HE       MET   1  -4.696   3.898   1.494
   10    H    ALA   2           H        ALA   2  -8.334   6.771   4.863
   11    HA   ALA   2           HA       ALA   2  -8.841   8.914   5.176
   12   1HB   ALA   2          1HB       ALA   2  -6.991   9.180   2.771
   13   2HB   ALA   2          2HB       ALA   2  -7.393  10.485   3.913
   14   3HB   ALA   2          3HB       ALA   2  -6.490   9.058   4.475
   15    H    LYS   3           H        LYS   3 -10.764   7.414   3.577
   16    HA   LYS   3           HA       LYS   3 -12.310   9.558   2.662
   17   1HB   LYS   3          1HB       LYS   3 -10.628   9.485   0.799
   18   2HB   LYS   3          2HB       LYS   3 -11.177   7.865   0.417
   19   1HG   LYS   3          1HG       LYS   3 -12.841   8.762  -0.831
   20   2HG   LYS   3          2HG       LYS   3 -13.549   9.416   0.632
   21   1HD   LYS   3          1HD       LYS   3 -13.211  11.436  -0.403
   22   2HD   LYS   3          2HD       LYS   3 -11.583  11.270   0.224
   23   1HE   LYS   3          1HE       LYS   3 -11.294   9.843  -2.080
   24   2HE   LYS   3          2HE       LYS   3 -12.583  10.917  -2.585
   25   1HZ   LYS   3          1HZ       LYS   3 -11.230  12.777  -1.907
   26   2HZ   LYS   3          2HZ       LYS   3 -10.032  11.783  -1.411
   27   3HZ   LYS   3          3HZ       LYS   3 -10.424  11.864  -2.995
   28    H    GLU   4           H        GLU   4 -13.010   7.152   0.476
   29    HA   GLU   4           HA       GLU   4 -13.826   4.981   1.757
   30   1HB   GLU   4          1HB       GLU   4 -15.381   7.241   2.734
   31   2HB   GLU   4          2HB       GLU   4 -16.439   6.096   1.934
   32   1HG   GLU   4          1HG       GLU   4 -14.590   4.563   3.512
   33   2HG   GLU   4          2HG       GLU   4 -15.165   5.870   4.527
   34    H    ARG   5           H        ARG   5 -15.419   3.697   0.495
   35    HA   ARG   5           HA       ARG   5 -16.381   3.054  -1.330
   36   1HB   ARG   5          1HB       ARG   5 -17.545   5.464  -0.968
   37   2HB   ARG   5          2HB       ARG   5 -16.713   5.835  -2.465
   38   1HG   ARG   5          1HG       ARG   5 -17.817   3.346  -3.033
   39   2HG   ARG   5          2HG       ARG   5 -19.038   4.048  -1.990
   40   1HD   ARG   5          1HD       ARG   5 -18.313   6.159  -3.730
   41   2HD   ARG   5          2HD       ARG   5 -18.344   4.742  -4.760
   42    HE   ARG   5           HE       ARG   5 -20.671   4.615  -3.151
   43   1HH1  ARG   5          2HH2      ARG   5 -19.317   6.722  -5.623
   44   2HH1  ARG   5          1HH2      ARG   5 -20.863   7.252  -6.199
   45   1HH2  ARG   5          2HH1      ARG   5 -22.710   5.315  -3.909
   46   2HH2  ARG   5          1HH1      ARG   5 -22.805   6.446  -5.217
   47    H    GLY   6           H        GLY   6 -15.538   2.254  -3.278
   48   1HA   GLY   6          1HA       GLY   6 -14.382   2.372  -5.276
   49   2HA   GLY   6          2HA       GLY   6 -13.664   3.898  -4.797
   50    H    LEU   7           H        LEU   7 -13.666   1.442  -2.315
   51    HA   LEU   7           HA       LEU   7 -10.812   1.352  -2.380
   52   1HB   LEU   7          1HB       LEU   7 -12.745  -0.204  -0.660
   53   2HB   LEU   7          2HB       LEU   7 -11.031   0.024  -0.376
   54    HG   LEU   7           HG       LEU   7 -11.914   1.551   1.083
   55   1HD1  LEU   7          1HD1      LEU   7 -11.332   3.679   0.365
   56   2HD1  LEU   7          2HD1      LEU   7 -10.438   2.624  -0.756
   57   3HD1  LEU   7          3HD1      LEU   7 -11.946   3.407  -1.283
   58   1HD2  LEU   7          1HD2      LEU   7 -14.280   1.094  -0.028
   59   2HD2  LEU   7          2HD2      LEU   7 -13.994   2.484   1.045
   60   3HD2  LEU   7          3HD2      LEU   7 -13.991   2.708  -0.721
   61    H    ILE   8           H        ILE   8  -9.956  -1.126  -1.853
   62    HA   ILE   8           HA       ILE   8 -10.234  -2.400  -4.384
   63    HB   ILE   8           HB       ILE   8  -8.708  -4.095  -3.279
   64   1HG1  ILE   8          1HG1      ILE   8  -8.225  -2.090  -1.113
   65   2HG1  ILE   8          2HG1      ILE   8  -9.576  -3.190  -0.928
   66   1HG2  ILE   8          1HG2      ILE   8  -7.831  -1.194  -3.355
   67   2HG2  ILE   8          2HG2      ILE   8  -6.766  -2.619  -3.421
   68   3HG2  ILE   8          3HG2      ILE   8  -7.914  -2.303  -4.745
   69   1HD1  ILE   8          1HD1      ILE   8  -6.716  -3.724  -0.662
   70   2HD1  ILE   8          2HD1      ILE   8  -8.098  -4.739  -0.184
   71   3HD1  ILE   8          3HD1      ILE   8  -7.460  -4.827  -1.844
   72    H    SER   9           H        SER   9 -11.766  -3.827  -4.989
   73    HA   SER   9           HA       SER   9 -13.838  -4.537  -3.395
   74   1HB   SER   9          1HB       SER   9 -12.982  -5.045  -6.045
   75   2HB   SER   9          2HB       SER   9 -13.259  -6.632  -5.355
   76    HG   SER   9           HG       SER   9 -15.269  -6.088  -6.057
   77    HA   PRO  10           HA       PRO  10 -12.623  -8.115  -1.204
   78   1HB   PRO  10          1HB       PRO  10 -14.469 -10.068  -1.700
   79   2HB   PRO  10          2HB       PRO  10 -14.761  -8.728  -0.609
   80   1HG   PRO  10          1HG       PRO  10 -15.805  -9.154  -3.342
   81   2HG   PRO  10          2HG       PRO  10 -16.399  -8.074  -2.096
   82   1HD   PRO  10          1HD       PRO  10 -14.856  -7.349  -4.403
   83   2HD   PRO  10          2HD       PRO  10 -15.351  -6.290  -3.098
   84    H    SER  11           H        SER  11 -12.272  -8.115  -4.436
   85    HA   SER  11           HA       SER  11 -11.435 -10.819  -4.690
   86   1HB   SER  11          1HB       SER  11 -12.243  -8.858  -6.458
   87   2HB   SER  11          2HB       SER  11 -10.509  -8.842  -6.711
   88    HG   SER  11           HG       SER  11 -12.223 -10.542  -7.780
   89    H    ASP  12           H        ASP  12  -9.826  -7.561  -4.621
   90    HA   ASP  12           HA       ASP  12  -7.252  -8.704  -4.689
   91   1HB   ASP  12          1HB       ASP  12  -7.862  -6.369  -5.459
   92   2HB   ASP  12          2HB       ASP  12  -8.129  -5.920  -3.786
   93    H    PHE  13           H        PHE  13  -9.578  -7.571  -2.206
   94    HA   PHE  13           HA       PHE  13  -7.776  -7.500  -0.052
   95   1HB   PHE  13          1HB       PHE  13 -10.253  -6.600  -0.452
   96   2HB   PHE  13          2HB       PHE  13 -10.755  -8.205   0.038
   97    HD1  PHE  13           1HD      PHE  13  -9.729  -9.033   2.330
   98    HD2  PHE  13           2HD      PHE  13 -10.044  -4.964   1.167
   99    HE1  PHE  13           1HE      PHE  13  -9.608  -8.336   4.738
  100    HE2  PHE  13           2HE      PHE  13  -9.924  -4.267   3.575
  101    HZ   PHE  13           HZ       PHE  13  -9.707  -5.961   5.332
  102    H    ALA  14           H        ALA  14 -10.018 -10.039  -1.326
  103    HA   ALA  14           HA       ALA  14  -9.695 -11.881   0.701
  104   1HB   ALA  14          1HB       ALA  14 -11.391 -12.127  -1.000
  105   2HB   ALA  14          2HB       ALA  14 -10.163 -12.208  -2.287
  106   3HB   ALA  14          3HB       ALA  14 -10.307 -13.535  -1.109
  107    H    GLN  15           H        GLN  15  -7.649 -11.164  -2.173
  108    HA   GLN  15           HA       GLN  15  -5.953 -13.360  -1.732
  109   1HB   GLN  15          1HB       GLN  15  -6.042 -12.451  -3.945
  110   2HB   GLN  15          2HB       GLN  15  -5.737 -10.820  -3.382
  111   1HG   GLN  15          1HG       GLN  15  -3.651 -11.546  -4.288
  112   2HG   GLN  15          2HG       GLN  15  -3.445 -11.666  -2.552
  113   1HE2  GLN  15          1HE2      GLN  15  -3.961 -13.778  -1.552
  114   2HE2  GLN  15          2HE2      GLN  15  -3.521 -15.229  -2.390
  115    H    LEU  16           H        LEU  16  -5.723  -9.815  -1.002
  116    HA   LEU  16           HA       LEU  16  -3.190  -9.918   0.151
  117   1HB   LEU  16          1HB       LEU  16  -4.657  -7.938  -0.624
  118   2HB   LEU  16          2HB       LEU  16  -5.352  -8.004   0.983
  119    HG   LEU  16           HG       LEU  16  -3.346  -7.380   2.026
  120   1HD1  LEU  16          1HD1      LEU  16  -1.199  -7.148   0.567
  121   2HD1  LEU  16          2HD1      LEU  16  -1.676  -8.743   1.196
  122   3HD1  LEU  16          3HD1      LEU  16  -2.017  -8.317  -0.498
  123   1HD2  LEU  16          1HD2      LEU  16  -3.894  -5.326   1.325
  124   2HD2  LEU  16          2HD2      LEU  16  -2.507  -5.497   0.222
  125   3HD2  LEU  16          3HD2      LEU  16  -4.152  -5.858  -0.354
  126    H    GLN  17           H        GLN  17  -6.488 -10.389   1.529
  127    HA   GLN  17           HA       GLN  17  -5.615 -10.549   4.165
  128   1HB   GLN  17          1HB       GLN  17  -8.043 -10.393   2.986
  129   2HB   GLN  17          2HB       GLN  17  -8.021 -12.119   3.289
  130   1HG   GLN  17          1HG       GLN  17  -7.087 -11.107   5.706
  131   2HG   GLN  17          2HG       GLN  17  -8.222  -9.866   5.214
  132   1HE2  GLN  17          1HE2      GLN  17 -10.218 -11.041   3.999
  133   2HE2  GLN  17          2HE2      GLN  17 -11.027 -12.216   4.981
  134    H    LYS  18           H        LYS  18  -6.149 -13.037   1.602
  135    HA   LYS  18           HA       LYS  18  -5.665 -15.251   3.243
  136   1HB   LYS  18          1HB       LYS  18  -6.799 -15.324   1.047
  137   2HB   LYS  18          2HB       LYS  18  -5.287 -14.941   0.249
  138   1HG   LYS  18          1HG       LYS  18  -4.255 -17.009   1.211
  139   2HG   LYS  18          2HG       LYS  18  -5.766 -17.392   2.011
  140   1HD   LYS  18          1HD       LYS  18  -6.013 -16.868  -0.914
  141   2HD   LYS  18          2HD       LYS  18  -5.060 -18.281  -0.507
  142   1HE   LYS  18          1HE       LYS  18  -7.376 -18.321   1.194
  143   2HE   LYS  18          2HE       LYS  18  -7.941 -17.961  -0.425
  144   1HZ   LYS  18          1HZ       LYS  18  -7.300 -19.961  -1.161
  145   2HZ   LYS  18          2HZ       LYS  18  -5.970 -20.049  -0.217
  146   3HZ   LYS  18          3HZ       LYS  18  -7.439 -20.394   0.408
  147    H    TYR  19           H        TYR  19  -3.507 -13.154   1.257
  148    HA   TYR  19           HA       TYR  19  -1.196 -14.717   1.779
  149   1HB   TYR  19          1HB       TYR  19  -2.038 -12.046   0.627
  150   2HB   TYR  19          2HB       TYR  19  -0.364 -12.148   1.133
  151    HD1  TYR  19           1HD      TYR  19   0.683 -12.000  -1.001
  152    HD2  TYR  19           2HD      TYR  19  -2.328 -14.959  -0.307
  153    HE1  TYR  19           1HE      TYR  19   1.274 -13.128  -3.202
  154    HE2  TYR  19           2HE      TYR  19  -1.727 -16.077  -2.510
  155    HH   TYR  19           HH       TYR  19   0.692 -16.042  -3.944
  156    H    MET  20           H        MET  20  -2.341 -11.490   3.014
  157    HA   MET  20           HA       MET  20  -0.262 -11.171   4.792
  158   1HB   MET  20          1HB       MET  20  -1.540  -9.317   5.577
  159   2HB   MET  20          2HB       MET  20  -2.174  -9.546   3.959
  160   1HG   MET  20          1HG       MET  20  -4.196  -9.513   5.081
  161   2HG   MET  20          2HG       MET  20  -3.854 -11.221   5.270
  162   1HE   MET  20          1HE       MET  20  -3.115  -7.828   6.435
  163   2HE   MET  20          2HE       MET  20  -3.579  -7.802   8.153
  164   3HE   MET  20          3HE       MET  20  -1.920  -8.247   7.685
  165    H    GLU  21           H        GLU  21  -3.019 -13.304   4.897
  166    HA   GLU  21           HA       GLU  21  -3.318 -13.446   7.664
  167   1HB   GLU  21          1HB       GLU  21  -4.156 -15.065   5.292
  168   2HB   GLU  21          2HB       GLU  21  -4.156 -15.906   6.829
  169   1HG   GLU  21          1HG       GLU  21  -5.359 -13.176   6.905
  170   2HG   GLU  21          2HG       GLU  21  -6.227 -14.330   5.912
  171    H    TYR  22           H        TYR  22  -1.344 -15.339   5.297
  172    HA   TYR  22           HA       TYR  22  -0.364 -17.218   7.105
  173   1HB   TYR  22          1HB       TYR  22  -0.228 -16.615   4.402
  174   2HB   TYR  22          2HB       TYR  22   1.358 -16.060   4.898
  175    HD1  TYR  22           1HD      TYR  22  -0.746 -18.961   4.258
  176    HD2  TYR  22           2HD      TYR  22   3.002 -17.674   5.871
  177    HE1  TYR  22           1HE      TYR  22   0.136 -21.341   4.127
  178    HE2  TYR  22           2HE      TYR  22   3.871 -20.059   5.735
  179    HH   TYR  22           HH       TYR  22   2.301 -22.450   3.956
  180    H    SER  23           H        SER  23   0.832 -13.942   6.170
  181    HA   SER  23           HA       SER  23   3.154 -14.241   7.770
  182   1HB   SER  23          1HB       SER  23   2.690 -11.481   7.255
  183   2HB   SER  23          2HB       SER  23   3.805 -12.550   6.427
  184    HG   SER  23           HG       SER  23   1.616 -11.389   5.414
  185    H    THR  24           H        THR  24   3.619 -12.364   9.472
  186    HA   THR  24           HA       THR  24   1.284 -11.446  10.886
  187    HB   THR  24           HB       THR  24   1.952 -13.998  11.491
  188    HG1  THR  24           1HG      THR  24   1.021 -13.366  13.590
  189   1HG2  THR  24          1HG2      THR  24   3.594 -14.233  13.126
  190   2HG2  THR  24          2HG2      THR  24   4.318 -12.865  12.246
  191   3HG2  THR  24          3HG2      THR  24   3.372 -12.572  13.725
  192    H    LYS  25           H        LYS  25   3.782 -10.478   9.448
  193    HA   LYS  25           HA       LYS  25   5.397  -9.420  11.567
  194   1HB   LYS  25          1HB       LYS  25   5.357  -8.960   8.572
  195   2HB   LYS  25          2HB       LYS  25   6.506  -8.206   9.659
  196   1HG   LYS  25          1HG       LYS  25   7.414 -10.356  10.337
  197   2HG   LYS  25          2HG       LYS  25   6.110 -11.228   9.555
  198   1HD   LYS  25          1HD       LYS  25   7.665 -11.438   7.866
  199   2HD   LYS  25          2HD       LYS  25   7.024  -9.878   7.391
  200   1HE   LYS  25          1HE       LYS  25   9.261  -9.298   7.453
  201   2HE   LYS  25          2HE       LYS  25   8.887  -8.993   9.137
  202   1HZ   LYS  25          1HZ       LYS  25   9.946 -10.868   9.782
  203   2HZ   LYS  25          2HZ       LYS  25   9.658 -11.687   8.399
  204   3HZ   LYS  25          3HZ       LYS  25  10.829 -10.549   8.445
  205    H    LYS  26           H        LYS  26   5.865  -6.840  11.203
  206    HA   LYS  26           HA       LYS  26   3.216  -5.635  11.556
  207   1HB   LYS  26          1HB       LYS  26   5.930  -4.819  12.635
  208   2HB   LYS  26          2HB       LYS  26   4.457  -3.893  12.844
  209   1HG   LYS  26          1HG       LYS  26   3.627  -6.406  13.657
  210   2HG   LYS  26          2HG       LYS  26   5.304  -6.424  14.163
  211   1HD   LYS  26          1HD       LYS  26   4.966  -4.265  15.380
  212   2HD   LYS  26          2HD       LYS  26   3.291  -4.235  14.865
  213   1HE   LYS  26          1HE       LYS  26   3.698  -6.812  16.028
  214   2HE   LYS  26          2HE       LYS  26   4.491  -5.675  17.099
  215   1HZ   LYS  26          1HZ       LYS  26   2.173  -4.452  16.489
  216   2HZ   LYS  26          2HZ       LYS  26   1.722  -6.019  16.590
  217   3HZ   LYS  26          3HZ       LYS  26   2.462  -5.299  17.855
  218    H    VAL  27           H        VAL  27   2.561  -3.923  10.289
  219    HA   VAL  27           HA       VAL  27   3.985  -3.551   7.858
  220    HB   VAL  27           HB       VAL  27   1.504  -3.569   8.160
  221   1HG1  VAL  27          1HG1      VAL  27   1.106  -0.800   8.738
  222   2HG1  VAL  27          2HG1      VAL  27   0.520  -2.220   9.636
  223   3HG1  VAL  27          3HG1      VAL  27   2.097  -1.499  10.040
  224   1HG2  VAL  27          1HG2      VAL  27   1.381  -1.194   6.790
  225   2HG2  VAL  27          2HG2      VAL  27   3.096  -1.633   6.608
  226   3HG2  VAL  27          3HG2      VAL  27   1.827  -2.765   6.081
  227    H    SER  28           H        SER  28   3.970  -2.041  11.027
  228    HA   SER  28           HA       SER  28   4.918   0.459  10.140
  229   1HB   SER  28          1HB       SER  28   3.914  -0.553  12.514
  230   2HB   SER  28          2HB       SER  28   5.614  -0.381  12.903
  231    HG   SER  28           HG       SER  28   5.496   1.792  12.737
  232    H    ASP  29           H        ASP  29   6.332  -2.697  10.692
  233    HA   ASP  29           HA       ASP  29   8.923  -1.813  11.297
  234   1HB   ASP  29          1HB       ASP  29   7.585  -4.375  10.523
  235   2HB   ASP  29          2HB       ASP  29   9.297  -4.289  10.159
  236    H    VAL  30           H        VAL  30   7.180  -2.900   8.306
  237    HA   VAL  30           HA       VAL  30   9.455  -2.607   6.628
  238    HB   VAL  30           HB       VAL  30   6.494  -2.891   6.093
  239   1HG1  VAL  30          1HG1      VAL  30   8.818  -2.551   4.235
  240   2HG1  VAL  30          2HG1      VAL  30   7.529  -3.693   3.783
  241   3HG1  VAL  30          3HG1      VAL  30   7.137  -1.983   4.084
  242   1HG2  VAL  30          1HG2      VAL  30   8.659  -4.757   6.718
  243   2HG2  VAL  30          2HG2      VAL  30   6.896  -5.004   6.720
  244   3HG2  VAL  30          3HG2      VAL  30   7.817  -5.164   5.204
  245    H    LEU  31           H        LEU  31   6.818  -0.517   7.781
  246    HA   LEU  31           HA       LEU  31   6.988   1.462   5.839
  247   1HB   LEU  31          1HB       LEU  31   5.646   0.997   8.283
  248   2HB   LEU  31          2HB       LEU  31   6.425   2.559   8.432
  249    HG   LEU  31           HG       LEU  31   5.343   2.965   6.043
  250   1HD1  LEU  31          1HD1      LEU  31   4.483   0.638   5.879
  251   2HD1  LEU  31          2HD1      LEU  31   3.404   0.978   7.253
  252   3HD1  LEU  31          3HD1      LEU  31   3.218   1.882   5.731
  253   1HD2  LEU  31          1HD2      LEU  31   3.708   4.252   7.075
  254   2HD2  LEU  31          2HD2      LEU  31   3.485   3.092   8.405
  255   3HD2  LEU  31          3HD2      LEU  31   4.953   4.095   8.337
  256    H    LYS  32           H        LYS  32   8.655   1.214   9.058
  257    HA   LYS  32           HA       LYS  32  10.166   3.524   8.741
  258   1HB   LYS  32          1HB       LYS  32  11.512   2.652  10.570
  259   2HB   LYS  32          2HB       LYS  32   9.807   2.403  10.885
  260   1HG   LYS  32          1HG       LYS  32   9.948   0.094  10.661
  261   2HG   LYS  32          2HG       LYS  32  11.221   0.175   9.459
  262   1HD   LYS  32          1HD       LYS  32  12.925   0.453  11.080
  263   2HD   LYS  32          2HD       LYS  32  11.815   1.057  12.295
  264   1HE   LYS  32          1HE       LYS  32  12.113  -1.108  13.094
  265   2HE   LYS  32          2HE       LYS  32  10.723  -1.375  12.061
  266   1HZ   LYS  32          1HZ       LYS  32  13.532  -1.848  11.345
  267   2HZ   LYS  32          2HZ       LYS  32  12.379  -2.980  11.583
  268   3HZ   LYS  32          3HZ       LYS  32  12.289  -1.981  10.294
  269    H    LEU  33           H        LEU  33  10.544   0.234   7.457
  270    HA   LEU  33           HA       LEU  33  13.250   0.392   6.799
  271   1HB   LEU  33          1HB       LEU  33  10.957  -1.316   6.228
  272   2HB   LEU  33          2HB       LEU  33  12.060  -1.203   4.871
  273    HG   LEU  33           HG       LEU  33  12.699  -2.139   7.677
  274   1HD1  LEU  33          1HD1      LEU  33  11.855  -4.016   6.739
  275   2HD1  LEU  33          2HD1      LEU  33  12.177  -3.470   5.075
  276   3HD1  LEU  33          3HD1      LEU  33  13.499  -4.132   6.066
  277   1HD2  LEU  33          1HD2      LEU  33  14.951  -2.676   6.247
  278   2HD2  LEU  33          2HD2      LEU  33  14.475  -1.103   5.564
  279   3HD2  LEU  33          3HD2      LEU  33  14.737  -1.270   7.317
  280    H    PHE  34           H        PHE  34  10.266   1.433   5.069
  281    HA   PHE  34           HA       PHE  34  11.789   2.289   2.795
  282   1HB   PHE  34          1HB       PHE  34   8.927   2.244   3.804
  283   2HB   PHE  34          2HB       PHE  34   9.293   3.399   2.537
  284    HD1  PHE  34           1HD      PHE  34   9.265  -0.198   3.373
  285    HD2  PHE  34           2HD      PHE  34   9.589   2.697   0.287
  286    HE1  PHE  34           1HE      PHE  34   9.002  -2.004   1.650
  287    HE2  PHE  34           2HE      PHE  34   9.326   0.891  -1.436
  288    HZ   PHE  34           HZ       PHE  34   9.036  -1.438  -0.734
  289    H    GLU  35           H        GLU  35  11.069   3.562   5.914
  290    HA   GLU  35           HA       GLU  35  10.997   6.283   5.029
  291   1HB   GLU  35          1HB       GLU  35  11.169   5.125   7.847
  292   2HB   GLU  35          2HB       GLU  35  10.844   6.802   7.456
  293   1HG   GLU  35          1HG       GLU  35   9.022   5.078   5.967
  294   2HG   GLU  35          2HG       GLU  35   8.956   4.674   7.671
  295    H    ASP  36           H        ASP  36  13.182   4.260   7.125
  296    HA   ASP  36           HA       ASP  36  15.299   6.124   6.385
  297   1HB   ASP  36          1HB       ASP  36  14.603   4.694   8.926
  298   2HB   ASP  36          2HB       ASP  36  16.312   4.796   8.555
  299    H    GLY  37           H        GLY  37  14.172   2.752   6.750
  300   1HA   GLY  37          1HA       GLY  37  16.501   1.305   6.482
  301   2HA   GLY  37          2HA       GLY  37  14.923   0.812   5.899
  302    H    GLU  38           H        GLU  38  16.482  -0.237   4.228
  303    HA   GLU  38           HA       GLU  38  17.673   1.524   2.370
  304   1HB   GLU  38          1HB       GLU  38  17.392  -1.411   2.743
  305   2HB   GLU  38          2HB       GLU  38  17.509  -0.908   1.069
  306   1HG   GLU  38          1HG       GLU  38  19.441   0.341   3.009
  307   2HG   GLU  38          2HG       GLU  38  19.693  -1.346   2.610
  308    H    MET  39           H        MET  39  14.535  -0.119   2.711
  309    HA   MET  39           HA       MET  39  13.686  -0.008   0.110
  310   1HB   MET  39          1HB       MET  39  12.172   0.328   2.756
  311   2HB   MET  39          2HB       MET  39  11.358   0.094   1.222
  312   1HG   MET  39          1HG       MET  39  13.481  -1.856   2.212
  313   2HG   MET  39          2HG       MET  39  11.799  -2.019   2.676
  314   1HE   MET  39          1HE       MET  39  14.472  -2.143   0.386
  315   2HE   MET  39          2HE       MET  39  13.985  -3.505  -0.651
  316   3HE   MET  39          3HE       MET  39  13.793  -1.833  -1.229
  317    H    ALA  40           H        ALA  40  14.411   2.593   2.266
  318    HA   ALA  40           HA       ALA  40  12.524   4.458   1.211
  319   1HB   ALA  40          1HB       ALA  40  13.491   5.956   2.724
  320   2HB   ALA  40          2HB       ALA  40  13.787   4.387   3.512
  321   3HB   ALA  40          3HB       ALA  40  15.095   5.192   2.613
  322    H    LYS  41           H        LYS  41  15.118   2.875  -0.177
  323    HA   LYS  41           HA       LYS  41  16.441   5.032  -1.437
  324   1HB   LYS  41          1HB       LYS  41  17.600   3.364  -2.661
  325   2HB   LYS  41          2HB       LYS  41  17.363   2.726  -1.046
  326   1HG   LYS  41          1HG       LYS  41  15.494   1.339  -1.784
  327   2HG   LYS  41          2HG       LYS  41  15.466   2.113  -3.356
  328   1HD   LYS  41          1HD       LYS  41  16.713   0.262  -3.944
  329   2HD   LYS  41          2HD       LYS  41  18.036   1.272  -3.396
  330   1HE   LYS  41          1HE       LYS  41  18.471  -0.082  -1.610
  331   2HE   LYS  41          2HE       LYS  41  16.782  -0.162  -1.153
  332   1HZ   LYS  41          1HZ       LYS  41  18.075  -1.753  -3.257
  333   2HZ   LYS  41          2HZ       LYS  41  17.544  -2.300  -1.813
  334   3HZ   LYS  41          3HZ       LYS  41  16.475  -1.784  -2.934
  335    H    TYR  42           H        TYR  42  13.303   3.705  -1.779
  336    HA   TYR  42           HA       TYR  42  13.091   4.971  -4.424
  337   1HB   TYR  42          1HB       TYR  42  12.031   2.352  -3.231
  338   2HB   TYR  42          2HB       TYR  42  11.189   3.094  -4.577
  339    HD1  TYR  42           1HD      TYR  42  13.054   3.912  -6.500
  340    HD2  TYR  42           2HD      TYR  42  13.373   0.573  -3.844
  341    HE1  TYR  42           1HE      TYR  42  14.645   2.766  -8.119
  342    HE2  TYR  42           2HE      TYR  42  14.962  -0.561  -5.472
  343    HH   TYR  42           HH       TYR  42  16.102  -0.367  -7.301
  344    H    VAL  43           H        VAL  43  12.693   6.530  -2.202
  345    HA   VAL  43           HA       VAL  43   9.794   6.849  -2.282
  346    HB   VAL  43           HB       VAL  43  11.486   6.686   0.218
  347   1HG1  VAL  43          1HG1      VAL  43   8.837   7.967  -0.294
  348   2HG1  VAL  43          2HG1      VAL  43   9.030   7.038   1.212
  349   3HG1  VAL  43          3HG1      VAL  43  10.119   8.402   0.862
  350   1HG2  VAL  43          1HG2      VAL  43   9.473   5.043   0.737
  351   2HG2  VAL  43          2HG2      VAL  43   9.388   4.953  -1.039
  352   3HG2  VAL  43          3HG2      VAL  43  10.890   4.503  -0.196
  353    H    GLN  44           H        GLN  44   9.235   8.944  -2.672
  354    HA   GLN  44           HA       GLN  44  11.368  10.895  -2.272
  355   1HB   GLN  44          1HB       GLN  44  10.105  12.142  -4.198
  356   2HB   GLN  44          2HB       GLN  44  11.164  10.807  -4.606
  357   1HG   GLN  44          1HG       GLN  44   8.335  10.055  -3.989
  358   2HG   GLN  44          2HG       GLN  44   8.559  11.004  -5.446
  359   1HE2  GLN  44          1HE2      GLN  44  10.295  10.285  -6.935
  360   2HE2  GLN  44          2HE2      GLN  44  10.522   8.587  -7.190
  361    H    GLY  45           H        GLY  45  10.897  12.345  -0.683
  362   1HA   GLY  45          1HA       GLY  45   9.733  13.685   0.693
  363   2HA   GLY  45          2HA       GLY  45   8.525  13.819  -0.569
  364    H    ASP  46           H        ASP  46   9.476  10.686   0.871
  365    HA   ASP  46           HA       ASP  46   8.491   9.419   2.381
  366   1HB   ASP  46          1HB       ASP  46   7.568  11.704   3.352
  367   2HB   ASP  46          2HB       ASP  46   6.071  11.240   2.569
  368    H    ALA  47           H        ALA  47   7.376  10.559  -0.588
  369    HA   ALA  47           HA       ALA  47   5.089   8.736  -0.693
  370   1HB   ALA  47          1HB       ALA  47   5.103  11.251  -1.448
  371   2HB   ALA  47          2HB       ALA  47   5.932  10.624  -2.893
  372   3HB   ALA  47          3HB       ALA  47   4.305  10.034  -2.473
  373    H    ILE  48           H        ILE  48   5.120   6.879  -1.927
  374    HA   ILE  48           HA       ILE  48   7.675   6.328  -3.261
  375    HB   ILE  48           HB       ILE  48   7.368   4.838  -1.467
  376   1HG1  ILE  48          1HG1      ILE  48   6.453   3.376  -3.961
  377   2HG1  ILE  48          2HG1      ILE  48   8.107   3.863  -3.646
  378   1HG2  ILE  48          1HG2      ILE  48   5.174   3.347  -1.579
  379   2HG2  ILE  48          2HG2      ILE  48   5.222   4.897  -0.704
  380   3HG2  ILE  48          3HG2      ILE  48   4.514   4.817  -2.335
  381   1HD1  ILE  48          1HD1      ILE  48   7.920   2.565  -1.418
  382   2HD1  ILE  48          2HD1      ILE  48   6.420   1.874  -2.081
  383   3HD1  ILE  48          3HD1      ILE  48   7.971   1.593  -2.908
  384    H    GLY  49           H        GLY  49   7.582   5.087  -5.297
  385   1HA   GLY  49          1HA       GLY  49   5.483   6.116  -6.992
  386   2HA   GLY  49          2HA       GLY  49   6.894   5.192  -7.467
  387    H    TYR  50           H        TYR  50   4.973   4.242  -8.853
  388    HA   TYR  50           HA       TYR  50   3.272   2.417  -7.429
  389   1HB   TYR  50          1HB       TYR  50   2.482   3.527  -9.471
  390   2HB   TYR  50          2HB       TYR  50   3.969   3.159 -10.323
  391    HD1  TYR  50           1HD      TYR  50   1.872   0.811  -8.311
  392    HD2  TYR  50           2HD      TYR  50   3.197   1.976 -12.209
  393    HE1  TYR  50           1HE      TYR  50   0.793  -1.265  -9.307
  394    HE2  TYR  50           2HE      TYR  50   2.114  -0.104 -13.191
  395    HH   TYR  50           HH       TYR  50   0.706  -1.753 -12.798
  396    H    GLU  51           H        GLU  51   6.333   2.315  -9.277
  397    HA   GLU  51           HA       GLU  51   6.324  -0.479  -9.554
  398   1HB   GLU  51          1HB       GLU  51   7.696   1.418 -10.799
  399   2HB   GLU  51          2HB       GLU  51   8.861   1.167  -9.514
  400   1HG   GLU  51          1HG       GLU  51   7.904  -1.385 -10.635
  401   2HG   GLU  51          2HG       GLU  51   8.615  -0.361 -11.867
  402    H    GLY  52           H        GLY  52   7.795   1.828  -7.196
  403   1HA   GLY  52          1HA       GLY  52   9.352   0.077  -5.733
  404   2HA   GLY  52          2HA       GLY  52   8.575   1.519  -5.111
  405    H    PHE  53           H        PHE  53   5.808   0.761  -5.531
  406    HA   PHE  53           HA       PHE  53   5.281  -0.542  -3.171
  407   1HB   PHE  53          1HB       PHE  53   3.902   0.782  -5.161
  408   2HB   PHE  53          2HB       PHE  53   3.432  -0.861  -5.548
  409    HD1  PHE  53           1HD      PHE  53   2.969   1.917  -3.294
  410    HD2  PHE  53           2HD      PHE  53   2.216  -2.224  -3.838
  411    HE1  PHE  53           1HE      PHE  53   1.190   2.008  -1.526
  412    HE2  PHE  53           2HE      PHE  53   0.437  -2.133  -2.069
  413    HZ   PHE  53           HZ       PHE  53  -0.054  -0.018  -0.934
  414    H    GLN  54           H        GLN  54   6.106  -1.855  -6.349
  415    HA   GLN  54           HA       GLN  54   4.967  -4.375  -5.960
  416   1HB   GLN  54          1HB       GLN  54   7.426  -3.825  -7.658
  417   2HB   GLN  54          2HB       GLN  54   6.177  -5.025  -7.926
  418   1HG   GLN  54          1HG       GLN  54   4.956  -2.386  -7.772
  419   2HG   GLN  54          2HG       GLN  54   6.272  -2.348  -8.929
  420   1HE2  GLN  54          1HE2      GLN  54   5.027  -2.202 -10.725
  421   2HE2  GLN  54          2HE2      GLN  54   4.012  -3.470 -11.326
  422    H    GLN  55           H        GLN  55   8.229  -2.985  -5.286
  423    HA   GLN  55           HA       GLN  55   9.260  -5.469  -4.423
  424   1HB   GLN  55          1HB       GLN  55  11.244  -4.203  -3.815
  425   2HB   GLN  55          2HB       GLN  55  10.652  -3.597  -5.349
  426   1HG   GLN  55          1HG       GLN  55  10.135  -1.536  -4.487
  427   2HG   GLN  55          2HG       GLN  55   9.465  -2.209  -3.014
  428   1HE2  GLN  55          1HE2      GLN  55  10.784  -0.073  -2.550
  429   2HE2  GLN  55          2HE2      GLN  55  12.376  -0.322  -1.916
  430    H    PHE  56           H        PHE  56   7.314  -2.937  -2.994
  431    HA   PHE  56           HA       PHE  56   8.088  -3.309  -0.313
  432   1HB   PHE  56          1HB       PHE  56   6.874  -1.312  -1.075
  433   2HB   PHE  56          2HB       PHE  56   5.617  -2.284  -1.814
  434    HD1  PHE  56           1HD      PHE  56   3.948  -3.440  -0.384
  435    HD2  PHE  56           2HD      PHE  56   6.795  -0.748   1.246
  436    HE1  PHE  56           1HE      PHE  56   2.571  -3.249   1.705
  437    HE2  PHE  56           2HE      PHE  56   5.417  -0.556   3.335
  438    HZ   PHE  56           HZ       PHE  56   3.321  -1.809   3.540
  439    H    LEU  57           H        LEU  57   5.366  -4.629  -2.316
  440    HA   LEU  57           HA       LEU  57   4.121  -6.050  -0.303
  441   1HB   LEU  57          1HB       LEU  57   4.288  -6.315  -3.282
  442   2HB   LEU  57          2HB       LEU  57   3.475  -7.554  -2.346
  443    HG   LEU  57           HG       LEU  57   2.688  -4.724  -1.825
  444   1HD1  LEU  57          1HD1      LEU  57   2.936  -5.063  -4.362
  445   2HD1  LEU  57          2HD1      LEU  57   1.532  -6.148  -4.215
  446   3HD1  LEU  57          3HD1      LEU  57   1.389  -4.438  -3.743
  447   1HD2  LEU  57          1HD2      LEU  57   1.789  -7.157  -0.957
  448   2HD2  LEU  57          2HD2      LEU  57   0.852  -5.643  -0.931
  449   3HD2  LEU  57          3HD2      LEU  57   0.649  -6.793  -2.275
  450    H    LYS  58           H        LYS  58   7.198  -6.573  -1.892
  451    HA   LYS  58           HA       LYS  58   7.366  -9.352  -1.455
  452   1HB   LYS  58          1HB       LYS  58   8.729  -8.014  -3.078
  453   2HB   LYS  58          2HB       LYS  58   9.612  -7.333  -1.726
  454   1HG   LYS  58          1HG       LYS  58  10.030  -9.829  -1.017
  455   2HG   LYS  58          2HG       LYS  58   9.535 -10.227  -2.650
  456   1HD   LYS  58          1HD       LYS  58  11.581  -8.043  -2.340
  457   2HD   LYS  58          2HD       LYS  58  12.109  -9.680  -2.000
  458   1HE   LYS  58          1HE       LYS  58  12.041 -10.290  -4.206
  459   2HE   LYS  58          2HE       LYS  58  10.497  -9.506  -4.473
  460   1HZ   LYS  58          1HZ       LYS  58  11.502  -7.551  -4.983
  461   2HZ   LYS  58          2HZ       LYS  58  12.843  -7.836  -4.095
  462   3HZ   LYS  58          3HZ       LYS  58  12.643  -8.581  -5.534
  463    H    ILE  59           H        ILE  59   8.849  -6.552   0.334
  464    HA   ILE  59           HA       ILE  59   9.601  -8.242   2.494
  465    HB   ILE  59           HB       ILE  59   9.502  -5.233   2.243
  466   1HG1  ILE  59          1HG1      ILE  59  12.095  -5.765   2.079
  467   2HG1  ILE  59          2HG1      ILE  59  11.522  -7.305   1.468
  468   1HG2  ILE  59          1HG2      ILE  59  11.404  -5.658   4.073
  469   2HG2  ILE  59          2HG2      ILE  59   9.694  -5.408   4.496
  470   3HG2  ILE  59          3HG2      ILE  59  10.362  -7.056   4.430
  471   1HD1  ILE  59          1HD1      ILE  59  10.861  -6.399  -0.514
  472   2HD1  ILE  59          2HD1      ILE  59  10.073  -5.019   0.288
  473   3HD1  ILE  59          3HD1      ILE  59  11.823  -4.979  -0.035
  474    H    TYR  60           H        TYR  60   6.998  -5.791   1.929
  475    HA   TYR  60           HA       TYR  60   5.856  -5.767   4.402
  476   1HB   TYR  60          1HB       TYR  60   5.099  -4.363   2.533
  477   2HB   TYR  60          2HB       TYR  60   4.810  -5.761   1.517
  478    HD1  TYR  60           1HD      TYR  60   3.700  -5.083   5.033
  479    HD2  TYR  60           2HD      TYR  60   2.543  -5.694   0.959
  480    HE1  TYR  60           1HE      TYR  60   1.252  -5.082   5.720
  481    HE2  TYR  60           2HE      TYR  60   0.100  -5.690   1.660
  482    HH   TYR  60           HH       TYR  60  -0.888  -6.112   4.752
  483    H    LEU  61           H        LEU  61   4.428  -7.730   1.704
  484    HA   LEU  61           HA       LEU  61   3.098  -9.404   3.569
  485   1HB   LEU  61          1HB       LEU  61   3.267  -9.071   0.645
  486   2HB   LEU  61          2HB       LEU  61   2.931 -10.704   1.185
  487    HG   LEU  61           HG       LEU  61   1.311  -8.218   1.790
  488   1HD1  LEU  61          1HD1      LEU  61   1.217 -10.214  -0.300
  489   2HD1  LEU  61          2HD1      LEU  61  -0.290 -10.214   0.648
  490   3HD1  LEU  61          3HD1      LEU  61   0.282  -8.711  -0.114
  491   1HD2  LEU  61          1HD2      LEU  61   0.977  -9.334   3.756
  492   2HD2  LEU  61          2HD2      LEU  61  -0.276 -10.101   2.750
  493   3HD2  LEU  61          3HD2      LEU  61   1.271 -10.934   3.034
  494    H    GLU  62           H        GLU  62   6.331  -9.188   2.625
  495    HA   GLU  62           HA       GLU  62   8.059 -10.463   2.950
  496   1HB   GLU  62          1HB       GLU  62   6.516 -11.123   5.055
  497   2HB   GLU  62          2HB       GLU  62   6.524 -12.689   4.269
  498   1HG   GLU  62          1HG       GLU  62   9.194 -12.050   4.104
  499   2HG   GLU  62          2HG       GLU  62   8.766 -11.213   5.583
  500    H    VAL  63           H        VAL  63   5.740 -11.030   0.822
  501    HA   VAL  63           HA       VAL  63   6.159 -13.744   0.102
  502    HB   VAL  63           HB       VAL  63   5.085 -12.838  -2.075
  503   1HG1  VAL  63          1HG1      VAL  63   3.831 -13.035   0.652
  504   2HG1  VAL  63          2HG1      VAL  63   2.839 -12.571  -0.752
  505   3HG1  VAL  63          3HG1      VAL  63   3.695 -14.131  -0.744
  506   1HG2  VAL  63          1HG2      VAL  63   4.198 -10.707  -2.132
  507   2HG2  VAL  63          2HG2      VAL  63   4.190 -10.543  -0.359
  508   3HG2  VAL  63          3HG2      VAL  63   5.721 -10.413  -1.258
  509    H    ASP  64           H        ASP  64   7.340 -14.573  -1.725
  510    HA   ASP  64           HA       ASP  64   9.730 -13.037  -2.158
  511   1HB   ASP  64          1HB       ASP  64   9.152 -15.767  -1.883
  512   2HB   ASP  64          2HB       ASP  64   9.451 -15.606  -3.602
  513    H    ASN  65           H        ASN  65   6.658 -13.616  -3.617
  514    HA   ASN  65           HA       ASN  65   7.437 -12.191  -5.936
  515   1HB   ASN  65          1HB       ASN  65   6.050 -14.562  -6.929
  516   2HB   ASN  65          2HB       ASN  65   7.577 -13.888  -7.464
  517   1HD2  ASN  65          1HD2      ASN  65   9.516 -14.492  -6.431
  518   2HD2  ASN  65          2HD2      ASN  65   9.671 -15.987  -5.570
  519    H    VAL  66           H        VAL  66   5.724 -10.718  -5.664
  520    HA   VAL  66           HA       VAL  66   3.103 -11.781  -4.970
  521    HB   VAL  66           HB       VAL  66   4.522  -9.602  -4.126
  522   1HG1  VAL  66          1HG1      VAL  66   3.396  -7.596  -4.952
  523   2HG1  VAL  66          2HG1      VAL  66   4.200  -8.456  -6.288
  524   3HG1  VAL  66          3HG1      VAL  66   2.436  -8.580  -6.084
  525   1HG2  VAL  66          1HG2      VAL  66   1.589  -9.266  -3.974
  526   2HG2  VAL  66          2HG2      VAL  66   2.192 -10.863  -3.469
  527   3HG2  VAL  66          3HG2      VAL  66   2.803  -9.390  -2.678
  528    HA   PRO  67           HA       PRO  67   1.679 -11.384  -9.033
  529   1HB   PRO  67          1HB       PRO  67  -1.020 -11.250  -8.623
  530   2HB   PRO  67          2HB       PRO  67  -0.122 -12.755  -8.609
  531   1HG   PRO  67          1HG       PRO  67  -1.225 -11.233  -6.327
  532   2HG   PRO  67          2HG       PRO  67  -0.713 -12.908  -6.385
  533   1HD   PRO  67          1HD       PRO  67   0.727 -10.712  -5.231
  534   2HD   PRO  67          2HD       PRO  67   1.288 -12.364  -5.392
  535    H    ARG  68           H        ARG  68   1.577  -9.873 -10.595
  536    HA   ARG  68           HA       ARG  68   1.634  -7.246  -9.742
  537   1HB   ARG  68          1HB       ARG  68   1.448  -6.714 -12.211
  538   2HB   ARG  68          2HB       ARG  68   2.677  -7.910 -11.850
  539   1HG   ARG  68          1HG       ARG  68   1.530  -9.616 -12.899
  540   2HG   ARG  68          2HG       ARG  68  -0.037  -9.034 -12.371
  541   1HD   ARG  68          1HD       ARG  68   0.019  -7.237 -14.084
  542   2HD   ARG  68          2HD       ARG  68   1.629  -7.724 -14.576
  543    HE   ARG  68           HE       ARG  68  -0.362  -9.885 -14.693
  544   1HH1  ARG  68          2HH2      ARG  68   1.184  -7.254 -16.445
  545   2HH1  ARG  68          1HH2      ARG  68   0.808  -7.903 -18.007
  546   1HH2  ARG  68          2HH1      ARG  68  -0.858 -10.742 -16.753
  547   2HH2  ARG  68          1HH1      ARG  68  -0.361  -9.900 -18.183
  548    H    HIS  69           H        HIS  69  -1.004  -9.428 -10.606
  549    HA   HIS  69           HA       HIS  69  -2.918  -7.573 -11.368
  550   1HB   HIS  69          1HB       HIS  69  -2.976 -10.101 -11.557
  551   2HB   HIS  69          2HB       HIS  69  -3.419 -10.150  -9.862
  552    HD1  HIS  69           1HD      HIS  69  -5.075 -10.677 -12.794
  553    HD2  HIS  69           2HD      HIS  69  -5.753  -7.887  -9.736
  554    HE1  HIS  69           1HE      HIS  69  -7.523  -9.984 -12.989
  555    H    LEU  70           H        LEU  70  -1.979  -8.839  -8.116
  556    HA   LEU  70           HA       LEU  70  -3.975  -7.321  -6.780
  557   1HB   LEU  70          1HB       LEU  70  -3.391  -9.183  -5.606
  558   2HB   LEU  70          2HB       LEU  70  -1.696  -9.078  -6.038
  559    HG   LEU  70           HG       LEU  70  -1.709  -6.953  -4.493
  560   1HD1  LEU  70          1HD1      LEU  70  -3.767  -6.507  -3.710
  561   2HD1  LEU  70          2HD1      LEU  70  -4.347  -8.169  -3.972
  562   3HD1  LEU  70          3HD1      LEU  70  -3.390  -7.778  -2.523
  563   1HD2  LEU  70          1HD2      LEU  70  -0.690  -9.380  -4.223
  564   2HD2  LEU  70          2HD2      LEU  70  -0.695  -8.212  -2.879
  565   3HD2  LEU  70          3HD2      LEU  70  -1.923  -9.499  -2.945
  566    H    SER  71           H        SER  71  -0.465  -6.912  -7.496
  567    HA   SER  71           HA       SER  71  -0.065  -4.680  -5.962
  568   1HB   SER  71          1HB       SER  71   1.583  -6.153  -7.381
  569   2HB   SER  71          2HB       SER  71   1.234  -5.030  -8.680
  570    HG   SER  71           HG       SER  71   2.462  -3.538  -7.748
  571    H    LEU  72           H        LEU  72  -1.371  -5.046  -9.300
  572    HA   LEU  72           HA       LEU  72  -1.402  -2.328  -9.942
  573   1HB   LEU  72          1HB       LEU  72  -1.649  -3.614 -11.780
  574   2HB   LEU  72          2HB       LEU  72  -2.611  -4.826 -10.959
  575    HG   LEU  72           HG       LEU  72  -4.545  -3.198 -11.001
  576   1HD1  LEU  72          1HD1      LEU  72  -4.312  -1.112 -11.718
  577   2HD1  LEU  72          2HD1      LEU  72  -2.559  -1.396 -11.847
  578   3HD1  LEU  72          3HD1      LEU  72  -3.610  -1.665 -13.258
  579   1HD2  LEU  72          1HD2      LEU  72  -5.175  -3.733 -13.261
  580   2HD2  LEU  72          2HD2      LEU  72  -3.477  -4.008 -13.717
  581   3HD2  LEU  72          3HD2      LEU  72  -4.279  -5.107 -12.569
  582    H    ALA  73           H        ALA  73  -3.906  -4.486  -8.461
  583    HA   ALA  73           HA       ALA  73  -5.812  -2.419  -8.217
  584   1HB   ALA  73          1HB       ALA  73  -6.643  -4.623  -8.222
  585   2HB   ALA  73          2HB       ALA  73  -5.433  -5.182  -7.043
  586   3HB   ALA  73          3HB       ALA  73  -6.773  -4.136  -6.515
  587    H    LEU  74           H        LEU  74  -3.037  -3.516  -6.291
  588    HA   LEU  74           HA       LEU  74  -3.820  -2.259  -3.890
  589   1HB   LEU  74          1HB       LEU  74  -1.405  -3.559  -4.999
  590   2HB   LEU  74          2HB       LEU  74  -1.128  -2.397  -3.717
  591    HG   LEU  74           HG       LEU  74  -3.121  -4.649  -3.426
  592   1HD1  LEU  74          1HD1      LEU  74  -0.346  -4.852  -2.307
  593   2HD1  LEU  74          2HD1      LEU  74  -1.531  -6.131  -2.666
  594   3HD1  LEU  74          3HD1      LEU  74  -0.658  -5.328  -3.994
  595   1HD2  LEU  74          1HD2      LEU  74  -3.250  -4.106  -1.215
  596   2HD2  LEU  74          2HD2      LEU  74  -1.599  -3.443  -1.159
  597   3HD2  LEU  74          3HD2      LEU  74  -2.914  -2.495  -1.895
  598    H    PHE  75           H        PHE  75  -1.820  -1.256  -6.722
  599    HA   PHE  75           HA       PHE  75  -1.205   1.268  -5.565
  600   1HB   PHE  75          1HB       PHE  75   0.286   0.294  -7.226
  601   2HB   PHE  75          2HB       PHE  75  -1.044  -0.098  -8.298
  602    HD1  PHE  75           1HD      PHE  75  -1.360   1.233 -10.152
  603    HD2  PHE  75           2HD      PHE  75   0.548   2.908  -6.752
  604    HE1  PHE  75           1HE      PHE  75  -0.965   3.363 -11.422
  605    HE2  PHE  75           2HE      PHE  75   0.942   5.037  -8.021
  606    HZ   PHE  75           HZ       PHE  75   0.181   5.239 -10.341
  607    H    GLN  76           H        GLN  76  -3.372   0.185  -8.279
  608    HA   GLN  76           HA       GLN  76  -4.368   2.638  -8.900
  609   1HB   GLN  76          1HB       GLN  76  -5.885   1.489 -10.217
  610   2HB   GLN  76          2HB       GLN  76  -4.744   0.196  -9.904
  611   1HG   GLN  76          1HG       GLN  76  -6.171  -0.492  -7.910
  612   2HG   GLN  76          2HG       GLN  76  -7.349   0.710  -8.396
  613   1HE2  GLN  76          1HE2      GLN  76  -5.314  -1.646 -10.134
  614   2HE2  GLN  76          2HE2      GLN  76  -6.585  -2.424 -11.017
  615    H    SER  77           H        SER  77  -4.852   0.748  -6.013
  616    HA   SER  77           HA       SER  77  -7.336   1.309  -5.212
  617   1HB   SER  77          1HB       SER  77  -5.489   0.054  -3.967
  618   2HB   SER  77          2HB       SER  77  -4.901   1.606  -3.404
  619    HG   SER  77           HG       SER  77  -6.406   0.460  -1.922
  620    H    PHE  78           H        PHE  78  -4.440   3.475  -4.870
  621    HA   PHE  78           HA       PHE  78  -6.198   5.759  -5.011
  622   1HB   PHE  78          1HB       PHE  78  -4.802   4.707  -2.570
  623   2HB   PHE  78          2HB       PHE  78  -4.511   6.410  -2.865
  624    HD1  PHE  78           1HD      PHE  78  -6.102   8.009  -2.241
  625    HD2  PHE  78           2HD      PHE  78  -7.242   3.927  -2.445
  626    HE1  PHE  78           1HE      PHE  78  -8.303   8.570  -1.174
  627    HE2  PHE  78           2HE      PHE  78  -9.443   4.488  -1.378
  628    HZ   PHE  78           HZ       PHE  78  -9.948   6.803  -0.755
  629    H    GLU  79           H        GLU  79  -4.518   7.819  -4.471
  630    HA   GLU  79           HA       GLU  79  -1.892   7.408  -5.308
  631   1HB   GLU  79          1HB       GLU  79  -3.104   6.999  -7.500
  632   2HB   GLU  79          2HB       GLU  79  -3.686   8.651  -7.438
  633   1HG   GLU  79          1HG       GLU  79  -1.531   9.572  -7.747
  634   2HG   GLU  79          2HG       GLU  79  -0.717   8.140  -7.150
  635    H    THR  80           H        THR  80  -0.832   9.668  -5.858
  636    HA   THR  80           HA       THR  80  -2.050  12.066  -5.383
  637    HB   THR  80           HB       THR  80  -2.750  11.705  -3.191
  638    HG1  THR  80           1HG      THR  80  -1.248  12.995  -2.175
  639   1HG2  THR  80          1HG2      THR  80  -2.260   9.533  -2.518
  640   2HG2  THR  80          2HG2      THR  80  -0.632   9.576  -3.238
  641   3HG2  THR  80          3HG2      THR  80  -0.929  10.350  -1.663
  642    H    GLY  81           H        GLY  81  -0.646  13.646  -5.923
  643   1HA   GLY  81          1HA       GLY  81   2.222  13.108  -5.535
  644   2HA   GLY  81          2HA       GLY  81   1.617  13.484  -7.136
  645    H    HIS  82           H        HIS  82   2.711  15.483  -7.355
  646    HA   HIS  82           HA       HIS  82   1.417  17.642  -5.961
  647   1HB   HIS  82          1HB       HIS  82   3.153  17.220  -4.382
  648   2HB   HIS  82          2HB       HIS  82   4.363  17.049  -5.639
  649    HD1  HIS  82           1HD      HIS  82   5.833  18.944  -4.633
  650    HD2  HIS  82           2HD      HIS  82   1.984  20.173  -5.760
  651    HE1  HIS  82           1HE      HIS  82   5.855  21.495  -4.588
  652    H    CYS  83           H        CYS  83   0.789  17.283  -8.436
  653    HA   CYS  83           HA       CYS  83   2.132  19.391  -9.810
  654   1HB   CYS  83          1HB       CYS  83   3.576  17.356 -10.292
  655   2HB   CYS  83          2HB       CYS  83   2.207  16.671 -11.146
  656    HG   CYS  83           HG       CYS  83   3.597  19.639 -11.648
  657    H    LEU  84           H        LEU  84   0.620  20.399 -11.159
  658    HA   LEU  84           HA       LEU  84  -1.828  18.873 -11.705
  659   1HB   LEU  84          1HB       LEU  84  -1.461  21.449 -10.309
  660   2HB   LEU  84          2HB       LEU  84  -2.727  21.424 -11.520
  661    HG   LEU  84           HG       LEU  84  -3.645  20.937  -9.338
  662   1HD1  LEU  84          1HD1      LEU  84  -4.411  19.721 -11.494
  663   2HD1  LEU  84          2HD1      LEU  84  -3.683  18.280 -10.746
  664   3HD1  LEU  84          3HD1      LEU  84  -4.999  19.145  -9.917
  665   1HD2  LEU  84          1HD2      LEU  84  -2.906  19.338  -7.856
  666   2HD2  LEU  84          2HD2      LEU  84  -2.117  18.366  -9.121
  667   3HD2  LEU  84          3HD2      LEU  84  -1.373  19.887  -8.574
  668    H    ASN  85           H        ASN  85   0.362  18.904 -13.453
  669    HA   ASN  85           HA       ASN  85  -0.861  20.342 -15.621
  670   1HB   ASN  85          1HB       ASN  85   1.781  21.031 -14.420
  671   2HB   ASN  85          2HB       ASN  85   1.835  20.807 -16.157
  672   1HD2  ASN  85          1HD2      ASN  85   1.794  23.125 -14.075
  673   2HD2  ASN  85          2HD2      ASN  85   0.740  24.304 -14.781
  674    H    GLU  86           H        GLU  86   0.270  19.608 -17.779
  675    HA   GLU  86           HA       GLU  86   1.178  18.106 -19.083
  676   1HB   GLU  86          1HB       GLU  86   2.987  17.918 -17.252
  677   2HB   GLU  86          2HB       GLU  86   2.135  16.495 -16.685
  678   1HG   GLU  86          1HG       GLU  86   3.391  15.340 -18.195
  679   2HG   GLU  86          2HG       GLU  86   2.305  15.987 -19.408
  680    H    THR  87           H        THR  87   0.067  16.529 -20.207
  681    HA   THR  87           HA       THR  87  -2.160  15.293 -18.834
  682    HB   THR  87           HB       THR  87  -2.335  16.402 -21.101
  683    HG1  THR  87           1HG      THR  87  -3.852  14.812 -21.411
  684   1HG2  THR  87          1HG2      THR  87  -0.244  15.770 -22.191
  685   2HG2  THR  87          2HG2      THR  87  -0.537  14.045 -21.863
  686   3HG2  THR  87          3HG2      THR  87  -1.553  14.913 -23.039
  687    H    ASN  88           H        ASN  88   0.988  14.579 -18.723
  688    HA   ASN  88           HA       ASN  88   0.549  11.743 -19.189
  689   1HB   ASN  88          1HB       ASN  88   2.535  12.925 -20.294
  690   2HB   ASN  88          2HB       ASN  88   3.187  13.219 -18.694
  691   1HD2  ASN  88          1HD2      ASN  88   5.019  12.013 -19.209
  692   2HD2  ASN  88          2HD2      ASN  88   5.026  10.281 -19.231
  693    H    VAL  89           H        VAL  89  -0.741  11.837 -17.053
  694    HA   VAL  89           HA       VAL  89   1.002  12.102 -14.718
  695    HB   VAL  89           HB       VAL  89  -2.008  11.873 -14.857
  696   1HG1  VAL  89          1HG1      VAL  89  -1.679  13.101 -12.577
  697   2HG1  VAL  89          2HG1      VAL  89  -1.420  11.342 -12.671
  698   3HG1  VAL  89          3HG1      VAL  89  -0.025  12.448 -12.665
  699   1HG2  VAL  89          1HG2      VAL  89  -1.006  14.510 -14.164
  700   2HG2  VAL  89          2HG2      VAL  89  -0.449  14.013 -15.780
  701   3HG2  VAL  89          3HG2      VAL  89  -2.189  14.031 -15.405
  702    H    THR  90           H        THR  90   1.428   9.870 -16.445
  703    HA   THR  90           HA       THR  90   0.028   7.649 -15.191
  704    HB   THR  90           HB       THR  90   0.480   7.895 -17.716
  705    HG1  THR  90           1HG      THR  90   0.072   5.849 -16.514
  706   1HG2  THR  90          1HG2      THR  90   2.864   8.644 -17.596
  707   2HG2  THR  90          2HG2      THR  90   3.290   7.131 -16.760
  708   3HG2  THR  90          3HG2      THR  90   2.730   7.087 -18.449
  709    H    LYS  91           H        LYS  91   2.656   9.604 -14.438
  710    HA   LYS  91           HA       LYS  91   3.833   7.396 -12.904
  711   1HB   LYS  91          1HB       LYS  91   5.325   7.934 -14.755
  712   2HB   LYS  91          2HB       LYS  91   5.299   9.634 -14.331
  713   1HG   LYS  91          1HG       LYS  91   6.015   8.447 -11.915
  714   2HG   LYS  91          2HG       LYS  91   6.801   7.401 -13.080
  715   1HD   LYS  91          1HD       LYS  91   8.466   8.981 -12.993
  716   2HD   LYS  91          2HD       LYS  91   7.460   9.823 -14.155
  717   1HE   LYS  91          1HE       LYS  91   7.323  11.551 -12.690
  718   2HE   LYS  91          2HE       LYS  91   6.362  10.526 -11.643
  719   1HZ   LYS  91          1HZ       LYS  91   9.180  11.151 -11.489
  720   2HZ   LYS  91          2HZ       LYS  91   8.085  10.981 -10.290
  721   3HZ   LYS  91          3HZ       LYS  91   8.727   9.659 -11.002
  722    H    ASP  92           H        ASP  92   3.068   7.734 -10.871
  723    HA   ASP  92           HA       ASP  92   3.599  10.363  -9.780
  724   1HB   ASP  92          1HB       ASP  92   0.957   8.860  -9.718
  725   2HB   ASP  92          2HB       ASP  92   1.354  10.016  -8.462
  726    H    VAL  93           H        VAL  93   2.835  10.027  -7.167
  727    HA   VAL  93           HA       VAL  93   4.041   7.464  -6.381
  728    HB   VAL  93           HB       VAL  93   4.891   8.722  -4.394
  729   1HG1  VAL  93          1HG1      VAL  93   6.761   9.836  -5.655
  730   2HG1  VAL  93          2HG1      VAL  93   6.427   8.159  -6.151
  731   3HG1  VAL  93          3HG1      VAL  93   5.862   9.515  -7.157
  732   1HG2  VAL  93          1HG2      VAL  93   3.422  10.643  -4.411
  733   2HG2  VAL  93          2HG2      VAL  93   5.101  11.197  -4.618
  734   3HG2  VAL  93          3HG2      VAL  93   4.006  11.128  -6.020
  735    H    VAL  94           H        VAL  94   3.467   7.106  -3.869
  736    HA   VAL  94           HA       VAL  94   0.665   7.858  -3.473
  737    HB   VAL  94           HB       VAL  94   1.835   5.076  -3.280
  738   1HG1  VAL  94          1HG1      VAL  94  -0.256   4.306  -2.462
  739   2HG1  VAL  94          2HG1      VAL  94   0.165   5.722  -1.470
  740   3HG1  VAL  94          3HG1      VAL  94  -1.042   5.873  -2.770
  741   1HG2  VAL  94          1HG2      VAL  94  -0.533   5.306  -4.910
  742   2HG2  VAL  94          2HG2      VAL  94   0.699   6.464  -5.468
  743   3HG2  VAL  94          3HG2      VAL  94   1.093   4.732  -5.355
  744    H    CYS  95           H        CYS  95   0.010   7.906  -1.229
  745    HA   CYS  95           HA       CYS  95   2.160   8.680   0.458
  746   1HB   CYS  95          1HB       CYS  95  -0.068   9.793   0.470
  747   2HB   CYS  95          2HB       CYS  95  -0.781   8.333   1.128
  748    HG   CYS  95           HG       CYS  95   1.687  10.156   2.381
  749    H    LEU  96           H        LEU  96   3.059   7.514   2.201
  750    HA   LEU  96           HA       LEU  96   2.527   4.674   2.153
  751   1HB   LEU  96          1HB       LEU  96   4.655   6.472   3.194
  752   2HB   LEU  96          2HB       LEU  96   4.422   4.941   4.015
  753    HG   LEU  96           HG       LEU  96   4.505   4.570   1.132
  754   1HD1  LEU  96          1HD1      LEU  96   6.516   6.376   2.332
  755   2HD1  LEU  96          2HD1      LEU  96   7.162   5.044   1.343
  756   3HD1  LEU  96          3HD1      LEU  96   5.992   6.188   0.642
  757   1HD2  LEU  96          1HD2      LEU  96   4.791   2.841   2.925
  758   2HD2  LEU  96          2HD2      LEU  96   6.059   2.842   1.675
  759   3HD2  LEU  96          3HD2      LEU  96   6.385   3.552   3.275
  760    H    ASN  97           H        ASN  97   2.451   7.409   4.534
  761    HA   ASN  97           HA       ASN  97   1.614   6.001   6.686
  762   1HB   ASN  97          1HB       ASN  97   2.190   8.480   6.585
  763   2HB   ASN  97          2HB       ASN  97   0.622   8.782   5.864
  764   1HD2  ASN  97          1HD2      ASN  97  -1.053   9.140   7.125
  765   2HD2  ASN  97          2HD2      ASN  97  -1.145   8.864   8.832
  766    H    ASP  98           H        ASP  98  -0.250   7.325   3.895
  767    HA   ASP  98           HA       ASP  98  -2.777   6.972   4.885
  768   1HB   ASP  98          1HB       ASP  98  -1.637   6.793   2.067
  769   2HB   ASP  98          2HB       ASP  98  -3.358   6.650   2.363
  770    H    VAL  99           H        VAL  99  -0.751   4.785   2.781
  771    HA   VAL  99           HA       VAL  99  -2.572   2.666   2.750
  772    HB   VAL  99           HB       VAL  99   0.418   2.820   2.350
  773   1HG1  VAL  99          1HG1      VAL  99   0.081   0.607   1.132
  774   2HG1  VAL  99          2HG1      VAL  99   0.027   0.549   2.911
  775   3HG1  VAL  99          3HG1      VAL  99  -1.484   0.495   1.972
  776   1HG2  VAL  99          1HG2      VAL  99  -0.303   2.516  -0.074
  777   2HG2  VAL  99          2HG2      VAL  99  -1.962   2.849   0.478
  778   3HG2  VAL  99          3HG2      VAL  99  -0.694   4.082   0.676
  779    H    SER 100           H        SER 100   0.049   3.612   5.008
  780    HA   SER 100           HA       SER 100   0.133   1.231   6.407
  781   1HB   SER 100          1HB       SER 100   1.831   3.028   6.598
  782   2HB   SER 100          2HB       SER 100   0.661   4.078   7.370
  783    HG   SER 100           HG       SER 100   0.903   1.575   8.614
  784    H    CYS 101           H        CYS 101  -2.242   3.808   6.300
  785    HA   CYS 101           HA       CYS 101  -3.332   3.295   8.879
  786   1HB   CYS 101          1HB       CYS 101  -3.470   5.435   7.285
  787   2HB   CYS 101          2HB       CYS 101  -4.936   4.644   6.742
  788    HG   CYS 101           HG       CYS 101  -3.999   5.470   9.807
  789    H    TYR 102           H        TYR 102  -3.976   2.366   5.453
  790    HA   TYR 102           HA       TYR 102  -6.392   1.026   5.928
  791   1HB   TYR 102          1HB       TYR 102  -5.658   1.679   3.681
  792   2HB   TYR 102          2HB       TYR 102  -4.092   0.925   3.902
  793    HD1  TYR 102           1HD      TYR 102  -3.703  -1.264   3.132
  794    HD2  TYR 102           2HD      TYR 102  -7.727   0.118   3.580
  795    HE1  TYR 102           1HE      TYR 102  -4.560  -3.365   1.986
  796    HE2  TYR 102           2HE      TYR 102  -8.570  -1.988   2.432
  797    HH   TYR 102           HH       TYR 102  -6.279  -4.444   1.264
  798    H    PHE 103           H        PHE 103  -3.013  -0.260   5.514
  799    HA   PHE 103           HA       PHE 103  -3.672  -2.903   6.002
  800   1HB   PHE 103          1HB       PHE 103  -1.189  -1.156   6.455
  801   2HB   PHE 103          2HB       PHE 103  -1.133  -2.889   6.711
  802    HD1  PHE 103           1HD      PHE 103   0.217  -0.859   4.614
  803    HD2  PHE 103           2HD      PHE 103  -2.833  -3.803   4.428
  804    HE1  PHE 103           1HE      PHE 103   0.698  -1.203   2.175
  805    HE2  PHE 103           2HE      PHE 103  -2.353  -4.147   1.989
  806    HZ   PHE 103           HZ       PHE 103  -0.593  -2.843   0.891
  807    H    SER 104           H        SER 104  -3.301  -0.166   8.201
  808    HA   SER 104           HA       SER 104  -2.649  -1.572  10.488
  809   1HB   SER 104          1HB       SER 104  -2.527   0.898  10.273
  810   2HB   SER 104          2HB       SER 104  -4.275   0.991  10.178
  811    HG   SER 104           HG       SER 104  -2.641   0.765  12.407
  812    H    LEU 105           H        LEU 105  -5.797  -0.816   8.912
  813    HA   LEU 105           HA       LEU 105  -7.348  -1.867  11.051
  814   1HB   LEU 105          1HB       LEU 105  -7.865  -0.911   8.264
  815   2HB   LEU 105          2HB       LEU 105  -9.102  -1.830   9.098
  816    HG   LEU 105           HG       LEU 105  -8.097   0.266  10.822
  817   1HD1  LEU 105          1HD1      LEU 105  -7.656   1.863   9.318
  818   2HD1  LEU 105          2HD1      LEU 105  -8.464   0.983   7.998
  819   3HD1  LEU 105          3HD1      LEU 105  -9.423   1.965   9.130
  820   1HD2  LEU 105          1HD2      LEU 105 -10.801  -0.352   9.607
  821   2HD2  LEU 105          2HD2      LEU 105 -10.201  -0.814  11.218
  822   3HD2  LEU 105          3HD2      LEU 105 -10.510   0.898  10.841
  823    H    LEU 106           H        LEU 106  -5.741  -3.158   8.166
  824    HA   LEU 106           HA       LEU 106  -7.200  -5.507   7.893
  825   1HB   LEU 106          1HB       LEU 106  -4.652  -4.401   6.986
  826   2HB   LEU 106          2HB       LEU 106  -4.610  -6.143   7.173
  827    HG   LEU 106           HG       LEU 106  -6.877  -6.018   5.797
  828   1HD1  LEU 106          1HD1      LEU 106  -5.468  -3.653   4.582
  829   2HD1  LEU 106          2HD1      LEU 106  -7.134  -4.229   4.335
  830   3HD1  LEU 106          3HD1      LEU 106  -6.683  -3.440   5.866
  831   1HD2  LEU 106          1HD2      LEU 106  -4.158  -6.560   5.209
  832   2HD2  LEU 106          2HD2      LEU 106  -5.614  -7.158   4.378
  833   3HD2  LEU 106          3HD2      LEU 106  -4.829  -5.658   3.828
  834    H    GLU 107           H        GLU 107  -3.979  -5.084   9.535
  835    HA   GLU 107           HA       GLU 107  -4.084  -7.587  10.715
  836   1HB   GLU 107          1HB       GLU 107  -2.294  -5.363  10.616
  837   2HB   GLU 107          2HB       GLU 107  -2.530  -5.728  12.313
  838   1HG   GLU 107          1HG       GLU 107  -2.259  -8.261  11.072
  839   2HG   GLU 107          2HG       GLU 107  -1.067  -7.251  10.279
  840    H    GLY 108           H        GLY 108  -5.253  -4.366  11.760
  841   1HA   GLY 108          1HA       GLY 108  -5.709  -4.850  14.451
  842   2HA   GLY 108          2HA       GLY 108  -6.613  -3.744  13.436
  843    H    GLY 109           H        GLY 109  -8.249  -4.922  11.847
  844   1HA   GLY 109          1HA       GLY 109  -9.318  -7.358  12.088
  845   2HA   GLY 109          2HA       GLY 109  -9.922  -6.587  13.542
  846    H    ARG 110           H        ARG 110  -9.881  -6.466   9.964
  847    HA   ARG 110           HA       ARG 110 -12.112  -4.609  10.122
  848   1HB   ARG 110          1HB       ARG 110 -10.163  -3.841   8.759
  849   2HB   ARG 110          2HB       ARG 110 -10.275  -5.281   7.767
  850   1HG   ARG 110          1HG       ARG 110 -11.656  -4.086   6.412
  851   2HG   ARG 110          2HG       ARG 110 -12.878  -4.275   7.655
  852   1HD   ARG 110          1HD       ARG 110 -12.877  -2.026   7.964
  853   2HD   ARG 110          2HD       ARG 110 -11.220  -2.121   8.529
  854    HE   ARG 110           HE       ARG 110 -10.474  -1.339   6.444
  855   1HH1  ARG 110          2HH2      ARG 110 -13.839  -2.337   6.189
  856   2HH1  ARG 110          1HH2      ARG 110 -14.044  -1.688   4.596
  857   1HH2  ARG 110          2HH1      ARG 110 -10.744  -0.483   4.342
  858   2HH2  ARG 110          1HH1      ARG 110 -12.272  -0.626   3.539
  859    HA   PRO 111           HA       PRO 111 -14.215  -8.347   8.899
  860   1HB   PRO 111          1HB       PRO 111 -16.679  -7.650   9.854
  861   2HB   PRO 111          2HB       PRO 111 -15.476  -8.480  10.821
  862   1HG   PRO 111          1HG       PRO 111 -16.304  -5.644  10.926
  863   2HG   PRO 111          2HG       PRO 111 -15.441  -6.581  12.130
  864   1HD   PRO 111          1HD       PRO 111 -14.321  -4.642  10.338
  865   2HD   PRO 111          2HD       PRO 111 -13.443  -5.662  11.461
  866    H    GLU 112           H        GLU 112 -16.589  -8.658   7.821
  867    HA   GLU 112           HA       GLU 112 -17.467  -6.585   6.256
  868   1HB   GLU 112          1HB       GLU 112 -15.025  -7.170   5.293
  869   2HB   GLU 112          2HB       GLU 112 -15.914  -8.420   4.444
  870   1HG   GLU 112          1HG       GLU 112 -16.834  -6.919   3.003
  871   2HG   GLU 112          2HG       GLU 112 -17.348  -5.870   4.309
  872    H    ASP 113           H        ASP 113 -16.831 -10.088   6.609
  873    HA   ASP 113           HA       ASP 113 -18.013 -11.859   6.143
  874   1HB   ASP 113          1HB       ASP 113 -19.335 -10.968   8.027
  875   2HB   ASP 113          2HB       ASP 113 -20.274  -9.967   6.936
  876    H    LYS 114           H        LYS 114 -17.474 -10.153   3.828
  877    HA   LYS 114           HA       LYS 114 -19.956 -10.218   2.304
  878   1HB   LYS 114          1HB       LYS 114 -17.391  -8.732   2.153
  879   2HB   LYS 114          2HB       LYS 114 -18.106  -9.171   0.615
  880   1HG   LYS 114          1HG       LYS 114 -20.227  -8.226   2.330
  881   2HG   LYS 114          2HG       LYS 114 -18.910  -7.074   2.427
  882   1HD   LYS 114          1HD       LYS 114 -19.004  -6.551   0.136
  883   2HD   LYS 114          2HD       LYS 114 -19.699  -8.099  -0.301
  884   1HE   LYS 114          1HE       LYS 114 -21.481  -6.640   1.515
  885   2HE   LYS 114          2HE       LYS 114 -21.091  -5.664   0.113
  886   1HZ   LYS 114          1HZ       LYS 114 -21.577  -8.238  -0.769
  887   2HZ   LYS 114          2HZ       LYS 114 -22.791  -7.853   0.253
  888   3HZ   LYS 114          3HZ       LYS 114 -22.477  -6.901  -1.036
  889    H    LEU 115           H        LEU 115 -19.755 -11.048  -0.029
  890    HA   LEU 115           HA       LEU 115 -18.759 -13.725   0.143
  891   1HB   LEU 115          1HB       LEU 115 -20.530 -12.151  -1.600
  892   2HB   LEU 115          2HB       LEU 115 -19.591 -13.371  -2.437
  893    HG   LEU 115           HG       LEU 115 -21.342 -13.929  -0.027
  894   1HD1  LEU 115          1HD1      LEU 115 -23.032 -13.565  -1.462
  895   2HD1  LEU 115          2HD1      LEU 115 -21.984 -13.682  -2.896
  896   3HD1  LEU 115          3HD1      LEU 115 -22.584 -15.162  -2.109
  897   1HD2  LEU 115          1HD2      LEU 115 -20.629 -16.107  -1.881
  898   2HD2  LEU 115          2HD2      LEU 115 -19.268 -15.432  -0.953
  899   3HD2  LEU 115          3HD2      LEU 115 -20.693 -16.076  -0.102
  900    H    GLU 116           H        GLU 116 -17.639 -14.511  -2.101
  901    HA   GLU 116           HA       GLU 116 -15.679 -12.578  -2.928
  902   1HB   GLU 116          1HB       GLU 116 -14.417 -15.156  -2.178
  903   2HB   GLU 116          2HB       GLU 116 -13.823 -13.519  -1.976
  904   1HG   GLU 116          1HG       GLU 116 -15.434 -13.210  -0.053
  905   2HG   GLU 116          2HG       GLU 116 -15.925 -14.883  -0.228
  906    H    TRP 117           H        TRP 117 -15.221 -12.841  -5.092
  907    HA   TRP 117           HA       TRP 117 -16.411 -15.163  -6.377
  908   1HB   TRP 117          1HB       TRP 117 -15.295 -12.581  -7.483
  909   2HB   TRP 117          2HB       TRP 117 -15.954 -13.879  -8.459
  910    HD1  TRP 117           HD       TRP 117 -17.881 -13.236  -5.252
  911    HE1  TRP 117           1HE      TRP 117 -20.195 -12.050  -5.704
  912    HE3  TRP 117           3HE      TRP 117 -16.968 -12.156 -10.136
  913    HZ2  TRP 117           2HZ      TRP 117 -21.357 -10.822  -8.003
  914    HZ3  TRP 117           3HZ      TRP 117 -18.745 -10.961 -11.413
  915    HH2  TRP 117           HH       TRP 117 -20.879 -10.298 -10.423
  916    H    SER 118           H        SER 118 -13.897 -13.783  -8.230
  917    HA   SER 118           HA       SER 118 -11.881 -15.522  -7.121
  918   1HB   SER 118          1HB       SER 118 -13.097 -16.924  -8.780
  919   2HB   SER 118          2HB       SER 118 -12.820 -15.715 -10.018
  920    HG   SER 118           HG       SER 118 -11.211 -17.748  -9.341
  Start of MODEL    6
    1   1H    MET   1           H        MET   1  -7.603   6.386  14.094
    2    HA   MET   1           HA       MET   1  -6.979   7.601  12.102
    3   1HB   MET   1          1HB       MET   1  -4.892   5.391  12.143
    4   2HB   MET   1          2HB       MET   1  -5.390   6.038  10.592
    5   1HG   MET   1          1HG       MET   1  -4.392   7.770  12.905
    6   2HG   MET   1          2HG       MET   1  -3.363   7.193  11.609
    7   1HE   MET   1          1HE       MET   1  -3.905   7.342   9.271
    8   2HE   MET   1          2HE       MET   1  -4.689   8.721   8.463
    9   3HE   MET   1          3HE       MET   1  -3.119   8.940   9.272
   10    H    ALA   2           H        ALA   2  -9.113   7.197  11.500
   11    HA   ALA   2           HA       ALA   2  -9.511   4.757   9.972
   12   1HB   ALA   2          1HB       ALA   2 -11.657   5.552  11.925
   13   2HB   ALA   2          2HB       ALA   2 -11.305   3.960  11.210
   14   3HB   ALA   2          3HB       ALA   2 -10.270   4.601  12.509
   15    H    LYS   3           H        LYS   3  -9.072   6.821   8.528
   16    HA   LYS   3           HA       LYS   3 -11.382   8.537   8.313
   17   1HB   LYS   3          1HB       LYS   3  -8.975   9.292   8.055
   18   2HB   LYS   3          2HB       LYS   3  -8.936   8.429   6.531
   19   1HG   LYS   3          1HG       LYS   3  -9.945  10.174   5.499
   20   2HG   LYS   3          2HG       LYS   3 -11.345   9.993   6.538
   21   1HD   LYS   3          1HD       LYS   3 -10.129  11.356   8.310
   22   2HD   LYS   3          2HD       LYS   3  -8.842  11.631   7.153
   23   1HE   LYS   3          1HE       LYS   3 -11.534  12.234   6.064
   24   2HE   LYS   3          2HE       LYS   3 -11.116  13.219   7.451
   25   1HZ   LYS   3          1HZ       LYS   3  -8.939  13.575   6.251
   26   2HZ   LYS   3          2HZ       LYS   3  -9.676  12.983   4.919
   27   3HZ   LYS   3          3HZ       LYS   3 -10.252  14.330   5.639
   28    H    GLU   4           H        GLU   4 -10.343   8.201   5.200
   29    HA   GLU   4           HA       GLU   4 -11.759   5.801   4.584
   30   1HB   GLU   4          1HB       GLU   4 -13.275   8.148   4.737
   31   2HB   GLU   4          2HB       GLU   4 -12.923   8.017   3.025
   32   1HG   GLU   4          1HG       GLU   4 -13.637   5.500   3.293
   33   2HG   GLU   4          2HG       GLU   4 -14.357   6.016   4.805
   34    H    ARG   5           H        ARG   5 -12.268   6.666   1.776
   35    HA   ARG   5           HA       ARG   5 -11.266   6.869  -0.131
   36   1HB   ARG   5          1HB       ARG   5  -9.559   8.528   1.601
   37   2HB   ARG   5          2HB       ARG   5  -8.629   7.817   0.297
   38   1HG   ARG   5          1HG       ARG   5  -9.904   8.882  -1.383
   39   2HG   ARG   5          2HG       ARG   5 -11.302   9.080  -0.345
   40   1HD   ARG   5          1HD       ARG   5 -10.607  11.193   0.110
   41   2HD   ARG   5          2HD       ARG   5  -9.224  10.521   0.951
   42    HE   ARG   5           HE       ARG   5  -8.631  10.454  -1.830
   43   1HH1  ARG   5          2HH2      ARG   5  -9.183  12.837   0.700
   44   2HH1  ARG   5          1HH2      ARG   5  -8.186  14.044  -0.042
   45   1HH2  ARG   5          2HH1      ARG   5  -7.315  12.046  -2.809
   46   2HH2  ARG   5          1HH1      ARG   5  -7.117  13.591  -2.051
   47    H    GLY   6           H        GLY   6 -10.564   5.055  -1.218
   48   1HA   GLY   6          1HA       GLY   6  -8.910   3.535  -1.846
   49   2HA   GLY   6          2HA       GLY   6  -8.133   3.708  -0.285
   50    H    LEU   7           H        LEU   7 -10.299   1.825  -2.193
   51    HA   LEU   7           HA       LEU   7 -10.760   0.095   0.101
   52   1HB   LEU   7          1HB       LEU   7 -12.997   0.970  -1.729
   53   2HB   LEU   7          2HB       LEU   7 -13.109  -0.168  -0.402
   54    HG   LEU   7           HG       LEU   7 -12.170   1.986   0.940
   55   1HD1  LEU   7          1HD1      LEU   7 -13.238   4.015   0.165
   56   2HD1  LEU   7          2HD1      LEU   7 -12.150   3.385  -1.095
   57   3HD1  LEU   7          3HD1      LEU   7 -13.910   3.161  -1.245
   58   1HD2  LEU   7          1HD2      LEU   7 -14.057   1.641   2.053
   59   2HD2  LEU   7          2HD2      LEU   7 -15.033   2.261   0.700
   60   3HD2  LEU   7          3HD2      LEU   7 -14.572   0.543   0.750
   61    H    ILE   8           H        ILE   8 -10.590  -2.067  -0.415
   62    HA   ILE   8           HA       ILE   8 -10.268  -2.633  -3.281
   63    HB   ILE   8           HB       ILE   8  -8.714  -4.454  -2.490
   64   1HG1  ILE   8          1HG1      ILE   8  -8.427  -2.848   0.043
   65   2HG1  ILE   8          2HG1      ILE   8  -9.572  -4.171  -0.051
   66   1HG2  ILE   8          1HG2      ILE   8  -8.117  -2.154  -3.481
   67   2HG2  ILE   8          2HG2      ILE   8  -7.654  -1.715  -1.819
   68   3HG2  ILE   8          3HG2      ILE   8  -6.843  -3.070  -2.641
   69   1HD1  ILE   8          1HD1      ILE   8  -7.848  -5.780  -0.518
   70   2HD1  ILE   8          2HD1      ILE   8  -6.656  -4.504  -0.862
   71   3HD1  ILE   8          3HD1      ILE   8  -7.223  -4.766   0.804
   72    H    SER   9           H        SER   9 -11.721  -4.031  -4.119
   73    HA   SER   9           HA       SER   9 -13.839  -4.950  -2.723
   74   1HB   SER   9          1HB       SER   9 -14.479  -5.818  -4.732
   75   2HB   SER   9          2HB       SER   9 -13.040  -5.025  -5.342
   76    HG   SER   9           HG       SER   9 -11.887  -6.967  -5.257
   77    HA   PRO  10           HA       PRO  10 -12.672  -8.717  -0.843
   78   1HB   PRO  10          1HB       PRO  10 -14.434 -10.644  -1.651
   79   2HB   PRO  10          2HB       PRO  10 -14.826  -9.430  -0.450
   80   1HG   PRO  10          1HG       PRO  10 -15.690  -9.592  -3.273
   81   2HG   PRO  10          2HG       PRO  10 -16.387  -8.659  -1.963
   82   1HD   PRO  10          1HD       PRO  10 -14.727  -7.668  -4.082
   83   2HD   PRO  10          2HD       PRO  10 -15.328  -6.759  -2.709
   84    H    SER  11           H        SER  11 -12.310  -8.490  -4.123
   85    HA   SER  11           HA       SER  11 -11.259 -11.104  -4.479
   86   1HB   SER  11          1HB       SER  11 -11.868  -8.760  -6.132
   87   2HB   SER  11          2HB       SER  11 -10.324  -9.460  -6.577
   88    HG   SER  11           HG       SER  11 -12.024 -11.525  -6.225
   89    H    ASP  12           H        ASP  12  -9.935  -7.739  -4.193
   90    HA   ASP  12           HA       ASP  12  -7.270  -8.632  -4.376
   91   1HB   ASP  12          1HB       ASP  12  -8.669  -6.152  -4.347
   92   2HB   ASP  12          2HB       ASP  12  -7.594  -6.088  -2.965
   93    H    PHE  13           H        PHE  13  -9.623  -7.839  -1.772
   94    HA   PHE  13           HA       PHE  13  -7.771  -7.875   0.347
   95   1HB   PHE  13          1HB       PHE  13 -10.354  -7.105  -0.018
   96   2HB   PHE  13          2HB       PHE  13 -10.688  -8.722   0.570
   97    HD1  PHE  13           1HD      PHE  13 -10.573  -5.482   1.589
   98    HD2  PHE  13           2HD      PHE  13  -9.038  -9.267   2.740
   99    HE1  PHE  13           1HE      PHE  13 -10.344  -4.671   3.954
  100    HE2  PHE  13           2HE      PHE  13  -8.808  -8.456   5.104
  101    HZ   PHE  13           HZ       PHE  13  -9.464  -6.167   5.683
  102    H    ALA  14           H        ALA  14  -9.757 -10.383  -1.281
  103    HA   ALA  14           HA       ALA  14  -9.501 -12.384   0.623
  104   1HB   ALA  14          1HB       ALA  14  -9.892 -12.322  -2.377
  105   2HB   ALA  14          2HB       ALA  14  -9.770 -13.865  -1.499
  106   3HB   ALA  14          3HB       ALA  14 -11.069 -12.715  -1.102
  107    H    GLN  15           H        GLN  15  -7.492 -11.774  -2.350
  108    HA   GLN  15           HA       GLN  15  -5.675 -13.756  -1.866
  109   1HB   GLN  15          1HB       GLN  15  -5.991 -12.227  -3.936
  110   2HB   GLN  15          2HB       GLN  15  -4.947 -11.082  -3.116
  111   1HG   GLN  15          1HG       GLN  15  -4.131 -13.986  -3.551
  112   2HG   GLN  15          2HG       GLN  15  -3.813 -12.745  -4.746
  113   1HE2  GLN  15          1HE2      GLN  15  -1.756 -14.111  -3.666
  114   2HE2  GLN  15          2HE2      GLN  15  -0.807 -13.115  -2.612
  115    H    LEU  16           H        LEU  16  -5.436 -10.232  -0.994
  116    HA   LEU  16           HA       LEU  16  -3.011 -10.387   0.313
  117   1HB   LEU  16          1HB       LEU  16  -5.228  -8.525   0.064
  118   2HB   LEU  16          2HB       LEU  16  -4.497  -8.453   1.655
  119    HG   LEU  16           HG       LEU  16  -3.066  -8.085  -0.991
  120   1HD1  LEU  16          1HD1      LEU  16  -4.275  -6.225   0.979
  121   2HD1  LEU  16          2HD1      LEU  16  -2.678  -5.777   0.333
  122   3HD1  LEU  16          3HD1      LEU  16  -4.040  -6.057  -0.778
  123   1HD2  LEU  16          1HD2      LEU  16  -1.173  -7.324   0.584
  124   2HD2  LEU  16          2HD2      LEU  16  -2.034  -8.256   1.833
  125   3HD2  LEU  16          3HD2      LEU  16  -1.445  -9.070   0.363
  126    H    GLN  17           H        GLN  17  -6.350 -11.042   1.485
  127    HA   GLN  17           HA       GLN  17  -5.773 -11.245   4.147
  128   1HB   GLN  17          1HB       GLN  17  -8.058 -11.273   3.136
  129   2HB   GLN  17          2HB       GLN  17  -7.772 -12.895   2.539
  130   1HG   GLN  17          1HG       GLN  17  -7.217 -13.458   5.064
  131   2HG   GLN  17          2HG       GLN  17  -8.074 -11.969   5.411
  132   1HE2  GLN  17          1HE2      GLN  17 -10.176 -11.746   4.053
  133   2HE2  GLN  17          2HE2      GLN  17 -11.240 -13.112   4.079
  134    H    LYS  18           H        LYS  18  -5.966 -13.969   1.735
  135    HA   LYS  18           HA       LYS  18  -5.101 -15.964   3.404
  136   1HB   LYS  18          1HB       LYS  18  -6.066 -16.187   1.097
  137   2HB   LYS  18          2HB       LYS  18  -4.510 -15.721   0.442
  138   1HG   LYS  18          1HG       LYS  18  -4.024 -17.776   2.396
  139   2HG   LYS  18          2HG       LYS  18  -5.357 -18.319   1.397
  140   1HD   LYS  18          1HD       LYS  18  -3.983 -17.793  -0.659
  141   2HD   LYS  18          2HD       LYS  18  -2.642 -17.354   0.381
  142   1HE   LYS  18          1HE       LYS  18  -2.654 -19.664   1.361
  143   2HE   LYS  18          2HE       LYS  18  -3.983 -20.101   0.306
  144   1HZ   LYS  18          1HZ       LYS  18  -1.211 -19.621  -0.363
  145   2HZ   LYS  18          2HZ       LYS  18  -2.242 -20.747  -0.944
  146   3HZ   LYS  18          3HZ       LYS  18  -2.326 -19.208  -1.483
  147    H    TYR  19           H        TYR  19  -3.059 -14.010   1.113
  148    HA   TYR  19           HA       TYR  19  -0.627 -15.028   1.848
  149   1HB   TYR  19          1HB       TYR  19  -1.851 -12.578   0.659
  150   2HB   TYR  19          2HB       TYR  19  -0.315 -12.230   1.429
  151    HD1  TYR  19           1HD      TYR  19   0.949 -11.717  -0.530
  152    HD2  TYR  19           2HD      TYR  19  -1.144 -15.439  -0.251
  153    HE1  TYR  19           1HE      TYR  19   2.170 -12.567  -2.592
  154    HE2  TYR  19           2HE      TYR  19   0.085 -16.276  -2.314
  155    HH   TYR  19           HH       TYR  19   2.135 -15.843  -3.484
  156    H    MET  20           H        MET  20  -2.294 -12.108   3.234
  157    HA   MET  20           HA       MET  20  -0.332 -11.526   5.063
  158   1HB   MET  20          1HB       MET  20  -3.356 -11.096   4.987
  159   2HB   MET  20          2HB       MET  20  -2.406 -10.483   6.327
  160   1HG   MET  20          1HG       MET  20  -1.000  -9.159   4.765
  161   2HG   MET  20          2HG       MET  20  -1.862  -9.823   3.391
  162   1HE   MET  20          1HE       MET  20  -2.573  -6.571   6.149
  163   2HE   MET  20          2HE       MET  20  -3.639  -7.786   6.893
  164   3HE   MET  20          3HE       MET  20  -1.924  -8.165   6.603
  165    H    GLU  21           H        GLU  21  -3.281 -13.604   5.403
  166    HA   GLU  21           HA       GLU  21  -3.208 -14.130   8.024
  167   1HB   GLU  21          1HB       GLU  21  -3.886 -15.858   5.635
  168   2HB   GLU  21          2HB       GLU  21  -3.973 -16.542   7.245
  169   1HG   GLU  21          1HG       GLU  21  -5.287 -14.123   7.603
  170   2HG   GLU  21          2HG       GLU  21  -5.729 -14.519   5.955
  171    H    TYR  22           H        TYR  22  -1.036 -15.433   5.488
  172    HA   TYR  22           HA       TYR  22   0.191 -17.341   7.214
  173   1HB   TYR  22          1HB       TYR  22   0.004 -16.737   4.484
  174   2HB   TYR  22          2HB       TYR  22   1.614 -16.145   4.842
  175    HD1  TYR  22           1HD      TYR  22   0.226 -18.730   3.304
  176    HD2  TYR  22           2HD      TYR  22   2.678 -18.083   6.750
  177    HE1  TYR  22           1HE      TYR  22   1.146 -21.091   3.102
  178    HE2  TYR  22           2HE      TYR  22   3.590 -20.446   6.535
  179    HH   TYR  22           HH       TYR  22   3.889 -22.105   4.772
  180    H    SER  23           H        SER  23   0.834 -13.950   6.224
  181    HA   SER  23           HA       SER  23   3.362 -13.997   7.564
  182   1HB   SER  23          1HB       SER  23   2.248 -12.486   5.490
  183   2HB   SER  23          2HB       SER  23   2.277 -11.353   6.826
  184    HG   SER  23           HG       SER  23   4.593 -12.018   7.121
  185    H    THR  24           H        THR  24   3.869 -12.355   9.315
  186    HA   THR  24           HA       THR  24   1.512 -11.554  10.855
  187    HB   THR  24           HB       THR  24   2.382 -13.842  11.615
  188    HG1  THR  24           1HG      THR  24   2.486 -12.949  13.877
  189   1HG2  THR  24          1HG2      THR  24   4.739 -13.835  11.561
  190   2HG2  THR  24          2HG2      THR  24   4.839 -12.121  12.033
  191   3HG2  THR  24          3HG2      THR  24   4.449 -13.359  13.252
  192    H    LYS  25           H        LYS  25   3.863 -10.411   9.100
  193    HA   LYS  25           HA       LYS  25   5.289  -8.828  11.010
  194   1HB   LYS  25          1HB       LYS  25   5.337  -9.317   8.102
  195   2HB   LYS  25          2HB       LYS  25   5.736  -7.673   8.559
  196   1HG   LYS  25          1HG       LYS  25   7.298  -8.790  10.360
  197   2HG   LYS  25          2HG       LYS  25   7.116 -10.244   9.401
  198   1HD   LYS  25          1HD       LYS  25   8.449  -9.453   7.713
  199   2HD   LYS  25          2HD       LYS  25   7.735  -7.854   7.764
  200   1HE   LYS  25          1HE       LYS  25   9.461  -7.047   9.002
  201   2HE   LYS  25          2HE       LYS  25   9.255  -8.302  10.207
  202   1HZ   LYS  25          1HZ       LYS  25  10.585  -8.844   7.656
  203   2HZ   LYS  25          2HZ       LYS  25  11.405  -8.266   8.944
  204   3HZ   LYS  25          3HZ       LYS  25  10.657  -9.714   9.036
  205    H    LYS  26           H        LYS  26   5.331  -6.269  10.099
  206    HA   LYS  26           HA       LYS  26   2.531  -5.429  10.002
  207   1HB   LYS  26          1HB       LYS  26   4.592  -4.617  12.056
  208   2HB   LYS  26          2HB       LYS  26   3.223  -3.594  11.670
  209   1HG   LYS  26          1HG       LYS  26   2.113  -6.182  11.994
  210   2HG   LYS  26          2HG       LYS  26   3.305  -6.049  13.271
  211   1HD   LYS  26          1HD       LYS  26   2.259  -4.128  14.225
  212   2HD   LYS  26          2HD       LYS  26   1.365  -3.771  12.760
  213   1HE   LYS  26          1HE       LYS  26  -0.328  -5.237  13.276
  214   2HE   LYS  26          2HE       LYS  26   0.775  -6.458  13.880
  215   1HZ   LYS  26          1HZ       LYS  26  -0.756  -5.146  15.476
  216   2HZ   LYS  26          2HZ       LYS  26   0.756  -5.552  15.943
  217   3HZ   LYS  26          3HZ       LYS  26   0.438  -4.032  15.436
  218    H    VAL  27           H        VAL  27   2.161  -3.549   8.795
  219    HA   VAL  27           HA       VAL  27   4.188  -2.951   6.900
  220    HB   VAL  27           HB       VAL  27   1.771  -3.017   6.424
  221   1HG1  VAL  27          1HG1      VAL  27   0.838  -2.071   8.429
  222   2HG1  VAL  27          2HG1      VAL  27   1.694  -0.533   8.166
  223   3HG1  VAL  27          3HG1      VAL  27   0.386  -1.023   7.063
  224   1HG2  VAL  27          1HG2      VAL  27   2.266  -1.744   4.663
  225   2HG2  VAL  27          2HG2      VAL  27   2.116  -0.272   5.652
  226   3HG2  VAL  27          3HG2      VAL  27   3.682  -1.110   5.537
  227    H    SER  28           H        SER  28   3.058  -1.561   9.970
  228    HA   SER  28           HA       SER  28   4.146   0.964   9.621
  229   1HB   SER  28          1HB       SER  28   2.545  -0.048  11.469
  230   2HB   SER  28          2HB       SER  28   4.035  -0.397  12.323
  231    HG   SER  28           HG       SER  28   3.338   2.227  11.314
  232    H    ASP  29           H        ASP  29   5.487  -2.131  10.897
  233    HA   ASP  29           HA       ASP  29   7.923  -0.933  11.671
  234   1HB   ASP  29          1HB       ASP  29   7.172  -3.849  11.156
  235   2HB   ASP  29          2HB       ASP  29   8.680  -3.339  11.890
  236    H    VAL  30           H        VAL  30   6.623  -2.751   8.845
  237    HA   VAL  30           HA       VAL  30   9.034  -3.225   7.536
  238    HB   VAL  30           HB       VAL  30   6.168  -2.943   6.667
  239   1HG1  VAL  30          1HG1      VAL  30   7.189  -4.111   4.503
  240   2HG1  VAL  30          2HG1      VAL  30   7.060  -2.341   4.644
  241   3HG1  VAL  30          3HG1      VAL  30   8.615  -3.148   4.960
  242   1HG2  VAL  30          1HG2      VAL  30   7.784  -5.431   6.334
  243   2HG2  VAL  30          2HG2      VAL  30   7.334  -4.954   7.988
  244   3HG2  VAL  30          3HG2      VAL  30   6.070  -5.224   6.765
  245    H    LEU  31           H        LEU  31   6.879  -0.366   7.681
  246    HA   LEU  31           HA       LEU  31   8.037   1.035   5.564
  247   1HB   LEU  31          1HB       LEU  31   6.479   1.814   8.011
  248   2HB   LEU  31          2HB       LEU  31   7.128   3.036   6.935
  249    HG   LEU  31           HG       LEU  31   5.290   0.809   6.023
  250   1HD1  LEU  31          1HD1      LEU  31   4.107   2.162   7.651
  251   2HD1  LEU  31          2HD1      LEU  31   4.594   3.652   6.807
  252   3HD1  LEU  31          3HD1      LEU  31   3.495   2.499   6.014
  253   1HD2  LEU  31          1HD2      LEU  31   6.795   2.894   4.654
  254   2HD2  LEU  31          2HD2      LEU  31   5.948   1.470   4.002
  255   3HD2  LEU  31          3HD2      LEU  31   5.051   2.977   4.307
  256    H    LYS  32           H        LYS  32   9.168   0.278   8.797
  257    HA   LYS  32           HA       LYS  32  10.889   2.423   9.199
  258   1HB   LYS  32          1HB       LYS  32  11.537   1.284  11.042
  259   2HB   LYS  32          2HB       LYS  32  10.120   0.321  10.674
  260   1HG   LYS  32          1HG       LYS  32  11.596  -1.243   9.327
  261   2HG   LYS  32          2HG       LYS  32  12.991  -0.316   9.844
  262   1HD   LYS  32          1HD       LYS  32  12.610  -0.881  12.180
  263   2HD   LYS  32          2HD       LYS  32  11.035  -1.564  11.824
  264   1HE   LYS  32          1HE       LYS  32  12.657  -3.384  12.111
  265   2HE   LYS  32          2HE       LYS  32  12.122  -3.349  10.442
  266   1HZ   LYS  32          1HZ       LYS  32  14.388  -3.470  10.279
  267   2HZ   LYS  32          2HZ       LYS  32  14.155  -1.861  10.120
  268   3HZ   LYS  32          3HZ       LYS  32  14.676  -2.474  11.541
  269    H    LEU  33           H        LEU  33  11.016  -0.303   6.983
  270    HA   LEU  33           HA       LEU  33  13.852  -0.031   6.555
  271   1HB   LEU  33          1HB       LEU  33  11.740  -1.668   5.144
  272   2HB   LEU  33          2HB       LEU  33  13.460  -1.746   4.818
  273    HG   LEU  33           HG       LEU  33  12.687  -2.175   7.648
  274   1HD1  LEU  33          1HD1      LEU  33  11.232  -3.826   7.388
  275   2HD1  LEU  33          2HD1      LEU  33  11.217  -3.520   5.634
  276   3HD1  LEU  33          3HD1      LEU  33  12.363  -4.694   6.323
  277   1HD2  LEU  33          1HD2      LEU  33  14.917  -2.642   5.976
  278   2HD2  LEU  33          2HD2      LEU  33  14.732  -3.029   7.704
  279   3HD2  LEU  33          3HD2      LEU  33  14.302  -4.238   6.470
  280    H    PHE  34           H        PHE  34  10.817   1.252   5.288
  281    HA   PHE  34           HA       PHE  34  11.945   2.105   2.813
  282   1HB   PHE  34          1HB       PHE  34   9.432   2.670   4.477
  283   2HB   PHE  34          2HB       PHE  34   9.705   3.519   2.969
  284    HD1  PHE  34           1HD      PHE  34   9.523   0.056   4.340
  285    HD2  PHE  34           2HD      PHE  34   8.930   2.592   0.990
  286    HE1  PHE  34           1HE      PHE  34   8.491  -1.852   3.078
  287    HE2  PHE  34           2HE      PHE  34   7.898   0.684  -0.272
  288    HZ   PHE  34           HZ       PHE  34   7.691  -1.516   0.787
  289    H    GLU  35           H        GLU  35  12.236   3.174   6.056
  290    HA   GLU  35           HA       GLU  35  12.668   5.912   5.179
  291   1HB   GLU  35          1HB       GLU  35  12.658   6.438   7.642
  292   2HB   GLU  35          2HB       GLU  35  11.153   5.753   7.063
  293   1HG   GLU  35          1HG       GLU  35  11.840   3.504   7.885
  294   2HG   GLU  35          2HG       GLU  35  13.375   4.156   8.425
  295    H    ASP  36           H        ASP  36  14.177   3.161   6.972
  296    HA   ASP  36           HA       ASP  36  16.719   4.549   6.640
  297   1HB   ASP  36          1HB       ASP  36  15.506   3.096   8.869
  298   2HB   ASP  36          2HB       ASP  36  17.026   2.346   8.424
  299    H    GLY  37           H        GLY  37  14.794   1.562   6.236
  300   1HA   GLY  37          1HA       GLY  37  16.837  -0.221   5.514
  301   2HA   GLY  37          2HA       GLY  37  15.140  -0.344   5.096
  302    H    GLU  38           H        GLU  38  17.408  -1.042   3.381
  303    HA   GLU  38           HA       GLU  38  18.142   0.885   1.620
  304   1HB   GLU  38          1HB       GLU  38  18.952  -0.855   0.309
  305   2HB   GLU  38          2HB       GLU  38  18.748  -1.686   1.839
  306   1HG   GLU  38          1HG       GLU  38  16.413  -2.377   1.054
  307   2HG   GLU  38          2HG       GLU  38  16.806  -1.706  -0.517
  308    H    MET  39           H        MET  39  14.991  -0.547   2.106
  309    HA   MET  39           HA       MET  39  13.961  -0.250  -0.446
  310   1HB   MET  39          1HB       MET  39  12.707  -1.539   1.152
  311   2HB   MET  39          2HB       MET  39  12.802  -0.285   2.373
  312   1HG   MET  39          1HG       MET  39  10.523  -0.400   1.378
  313   2HG   MET  39          2HG       MET  39  11.267   1.157   1.074
  314   1HE   MET  39          1HE       MET  39  10.960  -2.357  -1.809
  315   2HE   MET  39          2HE       MET  39  12.617  -1.990  -1.274
  316   3HE   MET  39          3HE       MET  39  11.359  -2.374  -0.074
  317    H    ALA  40           H        ALA  40  15.068   2.129   1.747
  318    HA   ALA  40           HA       ALA  40  13.147   4.150   1.135
  319   1HB   ALA  40          1HB       ALA  40  14.976   5.598   2.222
  320   2HB   ALA  40          2HB       ALA  40  14.262   4.315   3.227
  321   3HB   ALA  40          3HB       ALA  40  15.862   4.078   2.486
  322    H    LYS  41           H        LYS  41  15.393   2.567  -0.759
  323    HA   LYS  41           HA       LYS  41  16.556   4.811  -2.074
  324   1HB   LYS  41          1HB       LYS  41  17.518   3.186  -3.554
  325   2HB   LYS  41          2HB       LYS  41  17.629   2.578  -1.915
  326   1HG   LYS  41          1HG       LYS  41  15.514   1.240  -2.319
  327   2HG   LYS  41          2HG       LYS  41  15.529   1.781  -3.986
  328   1HD   LYS  41          1HD       LYS  41  17.931   0.377  -2.747
  329   2HD   LYS  41          2HD       LYS  41  16.610  -0.527  -3.460
  330   1HE   LYS  41          1HE       LYS  41  17.207   0.032  -5.610
  331   2HE   LYS  41          2HE       LYS  41  17.612   1.682  -5.180
  332   1HZ   LYS  41          1HZ       LYS  41  19.723   1.126  -4.882
  333   2HZ   LYS  41          2HZ       LYS  41  19.387  -0.245  -4.062
  334   3HZ   LYS  41          3HZ       LYS  41  19.386  -0.249  -5.695
  335    H    TYR  42           H        TYR  42  13.579   2.904  -2.354
  336    HA   TYR  42           HA       TYR  42  12.954   4.316  -4.849
  337   1HB   TYR  42          1HB       TYR  42  11.845   1.874  -3.334
  338   2HB   TYR  42          2HB       TYR  42  11.081   2.499  -4.782
  339    HD1  TYR  42           1HD      TYR  42  12.817  -0.175  -3.836
  340    HD2  TYR  42           2HD      TYR  42  13.281   3.061  -6.595
  341    HE1  TYR  42           1HE      TYR  42  14.350  -1.609  -5.271
  342    HE2  TYR  42           2HE      TYR  42  14.813   1.617  -8.020
  343    HH   TYR  42           HH       TYR  42  16.376  -0.423  -7.482
  344    H    VAL  43           H        VAL  43  12.928   5.678  -2.233
  345    HA   VAL  43           HA       VAL  43  10.043   6.219  -2.112
  346    HB   VAL  43           HB       VAL  43  12.047   6.071   0.146
  347   1HG1  VAL  43          1HG1      VAL  43  10.567   7.070   1.593
  348   2HG1  VAL  43          2HG1      VAL  43  10.202   7.975   0.105
  349   3HG1  VAL  43          3HG1      VAL  43   9.143   6.638   0.616
  350   1HG2  VAL  43          1HG2      VAL  43  10.999   4.152   0.859
  351   2HG2  VAL  43          2HG2      VAL  43   9.452   4.572   0.084
  352   3HG2  VAL  43          3HG2      VAL  43  10.810   3.978  -0.902
  353    H    GLN  44           H        GLN  44   9.496   8.317  -2.493
  354    HA   GLN  44           HA       GLN  44  11.726  10.141  -2.796
  355   1HB   GLN  44          1HB       GLN  44   8.835  10.267  -3.754
  356   2HB   GLN  44          2HB       GLN  44   9.982  11.571  -3.984
  357   1HG   GLN  44          1HG       GLN  44  11.525   9.743  -5.067
  358   2HG   GLN  44          2HG       GLN  44  10.073   8.766  -5.151
  359   1HE2  GLN  44          1HE2      GLN  44  10.903  12.198  -5.657
  360   2HE2  GLN  44          2HE2      GLN  44  10.158  12.377  -7.211
  361    H    GLY  45           H        GLY  45  12.198  10.928  -0.733
  362   1HA   GLY  45          1HA       GLY  45  11.962  12.227   1.087
  363   2HA   GLY  45          2HA       GLY  45  10.554  12.946   0.331
  364    H    ASP  46           H        ASP  46   8.445  12.237   0.873
  365    HA   ASP  46           HA       ASP  46   8.412  10.235   2.993
  366   1HB   ASP  46          1HB       ASP  46   6.288  11.506   3.749
  367   2HB   ASP  46          2HB       ASP  46   7.832  12.273   4.065
  368    H    ALA  47           H        ALA  47   8.055  10.149  -0.072
  369    HA   ALA  47           HA       ALA  47   5.396   8.913  -0.038
  370   1HB   ALA  47          1HB       ALA  47   5.657  11.295  -1.166
  371   2HB   ALA  47          2HB       ALA  47   6.386  10.354  -2.488
  372   3HB   ALA  47          3HB       ALA  47   4.718  10.013  -1.968
  373    H    ILE  48           H        ILE  48   5.246   7.610  -2.323
  374    HA   ILE  48           HA       ILE  48   7.825   6.438  -2.948
  375    HB   ILE  48           HB       ILE  48   7.138   5.116  -1.073
  376   1HG1  ILE  48          1HG1      ILE  48   6.626   3.598  -3.649
  377   2HG1  ILE  48          2HG1      ILE  48   8.210   3.999  -3.016
  378   1HG2  ILE  48          1HG2      ILE  48   4.538   4.581  -2.536
  379   2HG2  ILE  48          2HG2      ILE  48   5.037   3.918  -0.961
  380   3HG2  ILE  48          3HG2      ILE  48   4.730   5.663  -1.136
  381   1HD1  ILE  48          1HD1      ILE  48   8.124   2.068  -1.833
  382   2HD1  ILE  48          2HD1      ILE  48   6.867   2.825  -0.826
  383   3HD1  ILE  48          3HD1      ILE  48   6.405   1.838  -2.233
  384    H    GLY  49           H        GLY  49   7.796   5.245  -4.975
  385   1HA   GLY  49          1HA       GLY  49   5.867   6.355  -6.815
  386   2HA   GLY  49          2HA       GLY  49   7.262   5.363  -7.188
  387    H    TYR  50           H        TYR  50   5.364   4.512  -8.689
  388    HA   TYR  50           HA       TYR  50   3.410   2.864  -7.464
  389   1HB   TYR  50          1HB       TYR  50   3.212   3.889  -9.734
  390   2HB   TYR  50          2HB       TYR  50   4.701   3.121 -10.247
  391    HD1  TYR  50           1HD      TYR  50   4.759   0.610 -10.552
  392    HD2  TYR  50           2HD      TYR  50   1.117   2.755  -9.888
  393    HE1  TYR  50           1HE      TYR  50   3.426  -1.362 -11.445
  394    HE2  TYR  50           2HE      TYR  50  -0.203   0.776 -10.783
  395    HH   TYR  50           HH       TYR  50   1.476  -2.143 -11.926
  396    H    GLU  51           H        GLU  51   6.676   2.313  -8.883
  397    HA   GLU  51           HA       GLU  51   6.488  -0.468  -8.814
  398   1HB   GLU  51          1HB       GLU  51   8.437   1.538  -9.526
  399   2HB   GLU  51          2HB       GLU  51   9.226   0.351  -8.506
  400   1HG   GLU  51          1HG       GLU  51   8.145  -1.459 -10.004
  401   2HG   GLU  51          2HG       GLU  51   7.707  -0.161 -11.098
  402    H    GLY  52           H        GLY  52   6.819   1.903  -6.318
  403   1HA   GLY  52          1HA       GLY  52   8.356   0.353  -4.470
  404   2HA   GLY  52          2HA       GLY  52   7.432   1.805  -4.142
  405    H    PHE  53           H        PHE  53   4.965   0.490  -5.477
  406    HA   PHE  53           HA       PHE  53   3.877  -0.527  -3.080
  407   1HB   PHE  53          1HB       PHE  53   3.099   0.366  -5.716
  408   2HB   PHE  53          2HB       PHE  53   2.452  -1.253  -5.547
  409    HD1  PHE  53           1HD      PHE  53   1.124  -1.717  -3.337
  410    HD2  PHE  53           2HD      PHE  53   1.893   2.161  -4.880
  411    HE1  PHE  53           1HE      PHE  53  -0.806  -0.808  -2.014
  412    HE2  PHE  53           2HE      PHE  53  -0.037   3.070  -3.557
  413    HZ   PHE  53           HZ       PHE  53  -1.363   1.575  -2.140
  414    H    GLN  54           H        GLN  54   4.726  -2.057  -6.265
  415    HA   GLN  54           HA       GLN  54   4.003  -4.615  -5.391
  416   1HB   GLN  54          1HB       GLN  54   5.399  -5.313  -7.455
  417   2HB   GLN  54          2HB       GLN  54   4.006  -4.287  -7.734
  418   1HG   GLN  54          1HG       GLN  54   6.327  -2.625  -7.159
  419   2HG   GLN  54          2HG       GLN  54   6.729  -3.762  -8.430
  420   1HE2  GLN  54          1HE2      GLN  54   3.552  -2.422  -7.647
  421   2HE2  GLN  54          2HE2      GLN  54   3.297  -1.554  -9.124
  422    H    GLN  55           H        GLN  55   6.927  -2.639  -5.114
  423    HA   GLN  55           HA       GLN  55   8.625  -4.831  -4.556
  424   1HB   GLN  55          1HB       GLN  55   8.848  -1.932  -4.857
  425   2HB   GLN  55          2HB       GLN  55   9.777  -2.479  -3.476
  426   1HG   GLN  55          1HG       GLN  55   9.959  -3.803  -6.220
  427   2HG   GLN  55          2HG       GLN  55  11.011  -2.490  -5.727
  428   1HE2  GLN  55          1HE2      GLN  55  11.942  -2.823  -3.425
  429   2HE2  GLN  55          2HE2      GLN  55  12.661  -4.367  -3.113
  430    H    PHE  56           H        PHE  56   6.333  -2.888  -2.750
  431    HA   PHE  56           HA       PHE  56   7.514  -3.327  -0.198
  432   1HB   PHE  56          1HB       PHE  56   6.052  -1.449  -0.347
  433   2HB   PHE  56          2HB       PHE  56   4.953  -2.274  -1.436
  434    HD1  PHE  56           1HD      PHE  56   3.106  -3.544  -0.601
  435    HD2  PHE  56           2HD      PHE  56   5.943  -1.894   2.090
  436    HE1  PHE  56           1HE      PHE  56   1.565  -4.027   1.321
  437    HE2  PHE  56           2HE      PHE  56   4.402  -2.377   4.011
  438    HZ   PHE  56           HZ       PHE  56   2.231  -3.438   3.604
  439    H    LEU  57           H        LEU  57   4.791  -4.799  -2.078
  440    HA   LEU  57           HA       LEU  57   3.880  -6.507  -0.112
  441   1HB   LEU  57          1HB       LEU  57   3.895  -6.650  -3.117
  442   2HB   LEU  57          2HB       LEU  57   3.169  -7.910  -2.140
  443    HG   LEU  57           HG       LEU  57   2.125  -5.460  -1.170
  444   1HD1  LEU  57          1HD1      LEU  57   3.011  -4.909  -3.686
  445   2HD1  LEU  57          2HD1      LEU  57   1.349  -5.456  -4.014
  446   3HD1  LEU  57          3HD1      LEU  57   1.637  -4.105  -2.891
  447   1HD2  LEU  57          1HD2      LEU  57   0.189  -6.587  -1.297
  448   2HD2  LEU  57          2HD2      LEU  57   0.432  -7.025  -3.005
  449   3HD2  LEU  57          3HD2      LEU  57   1.224  -7.971  -1.723
  450    H    LYS  58           H        LYS  58   6.884  -6.508  -1.891
  451    HA   LYS  58           HA       LYS  58   7.407  -9.279  -1.704
  452   1HB   LYS  58          1HB       LYS  58   8.473  -7.686  -3.312
  453   2HB   LYS  58          2HB       LYS  58   9.362  -6.978  -1.979
  454   1HG   LYS  58          1HG       LYS  58  10.821  -8.740  -1.844
  455   2HG   LYS  58          2HG       LYS  58   9.556  -9.934  -2.059
  456   1HD   LYS  58          1HD       LYS  58   9.541  -8.974  -4.568
  457   2HD   LYS  58          2HD       LYS  58  11.171  -8.479  -4.155
  458   1HE   LYS  58          1HE       LYS  58  10.408 -11.296  -3.438
  459   2HE   LYS  58          2HE       LYS  58  10.579 -10.945  -5.147
  460   1HZ   LYS  58          1HZ       LYS  58  12.762  -9.906  -4.490
  461   2HZ   LYS  58          2HZ       LYS  58  12.596 -10.658  -3.049
  462   3HZ   LYS  58          3HZ       LYS  58  12.680 -11.535  -4.424
  463    H    ILE  59           H        ILE  59   8.676  -6.443   0.189
  464    HA   ILE  59           HA       ILE  59   9.772  -8.180   2.163
  465    HB   ILE  59           HB       ILE  59   9.353  -5.189   2.138
  466   1HG1  ILE  59          1HG1      ILE  59  11.980  -6.562   1.656
  467   2HG1  ILE  59          2HG1      ILE  59  10.834  -6.412   0.339
  468   1HG2  ILE  59          1HG2      ILE  59  11.527  -6.280   3.771
  469   2HG2  ILE  59          2HG2      ILE  59  10.313  -5.035   4.149
  470   3HG2  ILE  59          3HG2      ILE  59   9.906  -6.759   4.328
  471   1HD1  ILE  59          1HD1      ILE  59  12.209  -4.214   1.907
  472   2HD1  ILE  59          2HD1      ILE  59  12.111  -4.438   0.144
  473   3HD1  ILE  59          3HD1      ILE  59  10.683  -3.885   1.051
  474    H    TYR  60           H        TYR  60   6.863  -6.057   1.890
  475    HA   TYR  60           HA       TYR  60   5.858  -6.095   4.362
  476   1HB   TYR  60          1HB       TYR  60   4.856  -5.221   2.169
  477   2HB   TYR  60          2HB       TYR  60   4.441  -6.867   1.734
  478    HD1  TYR  60           1HD      TYR  60   4.099  -5.745   5.218
  479    HD2  TYR  60           2HD      TYR  60   2.074  -6.297   1.490
  480    HE1  TYR  60           1HE      TYR  60   1.857  -5.494   6.391
  481    HE2  TYR  60           2HE      TYR  60  -0.161  -6.044   2.675
  482    HH   TYR  60           HH       TYR  60  -0.583  -4.667   5.448
  483    H    LEU  61           H        LEU  61   5.017  -8.707   1.969
  484    HA   LEU  61           HA       LEU  61   4.297 -10.398   4.219
  485   1HB   LEU  61          1HB       LEU  61   4.022 -10.977   1.272
  486   2HB   LEU  61          2HB       LEU  61   3.236 -11.797   2.607
  487    HG   LEU  61           HG       LEU  61   2.527  -9.047   2.791
  488   1HD1  LEU  61          1HD1      LEU  61   3.167  -8.743   0.479
  489   2HD1  LEU  61          2HD1      LEU  61   2.210 -10.163  -0.008
  490   3HD1  LEU  61          3HD1      LEU  61   1.393  -8.712   0.619
  491   1HD2  LEU  61          1HD2      LEU  61   1.249 -11.678   2.544
  492   2HD2  LEU  61          2HD2      LEU  61   0.829 -10.280   3.564
  493   3HD2  LEU  61          3HD2      LEU  61   0.290 -10.339   1.868
  494    H    GLU  62           H        GLU  62   7.059  -9.610   2.442
  495    HA   GLU  62           HA       GLU  62   9.058 -10.476   2.426
  496   1HB   GLU  62          1HB       GLU  62   7.945 -11.719   4.677
  497   2HB   GLU  62          2HB       GLU  62   8.587 -13.064   3.755
  498   1HG   GLU  62          1HG       GLU  62  10.416 -10.728   3.869
  499   2HG   GLU  62          2HG       GLU  62  10.070 -11.422   5.441
  500    H    VAL  63           H        VAL  63   6.417 -11.603   0.879
  501    HA   VAL  63           HA       VAL  63   6.986 -14.097  -0.097
  502    HB   VAL  63           HB       VAL  63   5.801 -13.122  -2.201
  503   1HG1  VAL  63          1HG1      VAL  63   3.616 -12.983  -0.774
  504   2HG1  VAL  63          2HG1      VAL  63   4.518 -14.515  -0.854
  505   3HG1  VAL  63          3HG1      VAL  63   4.678 -13.462   0.572
  506   1HG2  VAL  63          1HG2      VAL  63   6.346 -10.723  -0.844
  507   2HG2  VAL  63          2HG2      VAL  63   5.298 -10.948  -2.266
  508   3HG2  VAL  63          3HG2      VAL  63   4.601 -11.001  -0.629
  509    H    ASP  64           H        ASP  64   7.879 -14.759  -2.239
  510    HA   ASP  64           HA       ASP  64  10.327 -13.288  -2.667
  511   1HB   ASP  64          1HB       ASP  64  10.254 -15.819  -2.301
  512   2HB   ASP  64          2HB       ASP  64   9.440 -15.961  -3.846
  513    H    ASN  65           H        ASN  65   7.151 -13.527  -3.888
  514    HA   ASN  65           HA       ASN  65   7.780 -11.978  -6.134
  515   1HB   ASN  65          1HB       ASN  65   6.475 -13.901  -7.609
  516   2HB   ASN  65          2HB       ASN  65   8.219 -13.730  -7.573
  517   1HD2  ASN  65          1HD2      ASN  65   9.465 -15.036  -6.178
  518   2HD2  ASN  65          2HD2      ASN  65   8.898 -16.571  -5.610
  519    H    VAL  66           H        VAL  66   6.004 -10.594  -6.068
  520    HA   VAL  66           HA       VAL  66   3.472 -11.709  -5.110
  521    HB   VAL  66           HB       VAL  66   4.921  -9.460  -4.392
  522   1HG1  VAL  66          1HG1      VAL  66   3.686  -7.522  -5.065
  523   2HG1  VAL  66          2HG1      VAL  66   4.134  -8.407  -6.543
  524   3HG1  VAL  66          3HG1      VAL  66   2.473  -8.512  -5.911
  525   1HG2  VAL  66          1HG2      VAL  66   3.542  -9.880  -2.686
  526   2HG2  VAL  66          2HG2      VAL  66   2.281  -8.984  -3.567
  527   3HG2  VAL  66          3HG2      VAL  66   2.404 -10.751  -3.741
  528    HA   PRO  67           HA       PRO  67   1.796 -11.276  -9.072
  529   1HB   PRO  67          1HB       PRO  67  -0.875 -11.204  -8.498
  530   2HB   PRO  67          2HB       PRO  67   0.052 -12.690  -8.563
  531   1HG   PRO  67          1HG       PRO  67  -0.941 -11.228  -6.194
  532   2HG   PRO  67          2HG       PRO  67  -0.401 -12.891  -6.311
  533   1HD   PRO  67          1HD       PRO  67   1.063 -10.684  -5.208
  534   2HD   PRO  67          2HD       PRO  67   1.646 -12.322  -5.431
  535    H    ARG  68           H        ARG  68   2.005  -9.623 -10.428
  536    HA   ARG  68           HA       ARG  68   1.820  -7.060  -9.511
  537   1HB   ARG  68          1HB       ARG  68   1.696  -6.453 -11.994
  538   2HB   ARG  68          2HB       ARG  68   3.015  -7.524 -11.564
  539   1HG   ARG  68          1HG       ARG  68   2.239  -9.118 -12.976
  540   2HG   ARG  68          2HG       ARG  68   0.696  -9.151 -12.145
  541   1HD   ARG  68          1HD       ARG  68   0.010  -7.092 -13.495
  542   2HD   ARG  68          2HD       ARG  68   1.497  -7.260 -14.408
  543    HE   ARG  68           HE       ARG  68   0.160  -9.787 -14.417
  544   1HH1  ARG  68          2HH2      ARG  68  -0.225  -6.540 -15.718
  545   2HH1  ARG  68          1HH2      ARG  68  -1.124  -7.064 -17.103
  546   1HH2  ARG  68          2HH1      ARG  68  -1.026 -10.479 -16.244
  547   2HH2  ARG  68          1HH1      ARG  68  -1.583  -9.319 -17.404
  548    H    HIS  69           H        HIS  69  -0.665  -9.276 -10.752
  549    HA   HIS  69           HA       HIS  69  -2.602  -7.503 -11.533
  550   1HB   HIS  69          1HB       HIS  69  -2.510 -10.072 -11.655
  551   2HB   HIS  69          2HB       HIS  69  -3.183 -10.062 -10.038
  552    HD1  HIS  69           1HD      HIS  69  -4.293 -10.461 -13.345
  553    HD2  HIS  69           2HD      HIS  69  -5.664  -8.136 -10.134
  554    HE1  HIS  69           1HE      HIS  69  -6.733  -9.911 -13.851
  555    H    LEU  70           H        LEU  70  -1.969  -8.861  -8.229
  556    HA   LEU  70           HA       LEU  70  -4.034  -7.325  -7.044
  557   1HB   LEU  70          1HB       LEU  70  -3.634  -9.141  -5.781
  558   2HB   LEU  70          2HB       LEU  70  -1.933  -9.209  -6.196
  559    HG   LEU  70           HG       LEU  70  -1.674  -7.147  -4.648
  560   1HD1  LEU  70          1HD1      LEU  70  -4.394  -8.156  -3.782
  561   2HD1  LEU  70          2HD1      LEU  70  -3.351  -7.104  -2.794
  562   3HD1  LEU  70          3HD1      LEU  70  -3.967  -6.528  -4.362
  563   1HD2  LEU  70          1HD2      LEU  70  -0.842  -8.555  -3.110
  564   2HD2  LEU  70          2HD2      LEU  70  -2.375  -9.442  -2.934
  565   3HD2  LEU  70          3HD2      LEU  70  -1.282  -9.815  -4.288
  566    H    SER  71           H        SER  71  -0.447  -6.981  -7.336
  567    HA   SER  71           HA       SER  71  -0.205  -4.758  -5.761
  568   1HB   SER  71          1HB       SER  71   1.962  -4.604  -6.608
  569   2HB   SER  71          2HB       SER  71   1.574  -6.269  -6.991
  570    HG   SER  71           HG       SER  71   0.803  -5.343  -9.147
  571    H    LEU  72           H        LEU  72  -1.557  -5.156  -8.993
  572    HA   LEU  72           HA       LEU  72  -1.276  -2.442  -9.783
  573   1HB   LEU  72          1HB       LEU  72  -1.454  -3.879 -11.556
  574   2HB   LEU  72          2HB       LEU  72  -2.674  -4.874 -10.787
  575    HG   LEU  72           HG       LEU  72  -4.372  -3.149 -11.182
  576   1HD1  LEU  72          1HD1      LEU  72  -2.544  -1.283 -11.142
  577   2HD1  LEU  72          2HD1      LEU  72  -2.463  -1.590 -12.894
  578   3HD1  LEU  72          3HD1      LEU  72  -3.999  -1.089 -12.149
  579   1HD2  LEU  72          1HD2      LEU  72  -4.796  -3.828 -13.297
  580   2HD2  LEU  72          2HD2      LEU  72  -3.166  -3.416 -13.881
  581   3HD2  LEU  72          3HD2      LEU  72  -3.430  -4.921 -12.969
  582    H    ALA  73           H        ALA  73  -3.957  -4.437  -8.385
  583    HA   ALA  73           HA       ALA  73  -5.727  -2.216  -8.263
  584   1HB   ALA  73          1HB       ALA  73  -6.754  -4.325  -8.416
  585   2HB   ALA  73          2HB       ALA  73  -5.680  -5.044  -7.192
  586   3HB   ALA  73          3HB       ALA  73  -6.954  -3.903  -6.699
  587    H    LEU  74           H        LEU  74  -3.304  -3.720  -6.109
  588    HA   LEU  74           HA       LEU  74  -4.099  -2.571  -3.721
  589   1HB   LEU  74          1HB       LEU  74  -1.707  -3.837  -4.840
  590   2HB   LEU  74          2HB       LEU  74  -1.350  -2.664  -3.588
  591    HG   LEU  74           HG       LEU  74  -3.304  -4.955  -3.252
  592   1HD1  LEU  74          1HD1      LEU  74  -0.849  -5.578  -3.672
  593   2HD1  LEU  74          2HD1      LEU  74  -0.531  -4.861  -2.074
  594   3HD1  LEU  74          3HD1      LEU  74  -1.645  -6.241  -2.225
  595   1HD2  LEU  74          1HD2      LEU  74  -2.647  -2.629  -1.644
  596   2HD2  LEU  74          2HD2      LEU  74  -3.947  -3.829  -1.447
  597   3HD2  LEU  74          3HD2      LEU  74  -2.333  -4.146  -0.766
  598    H    PHE  75           H        PHE  75  -2.116  -1.269  -6.427
  599    HA   PHE  75           HA       PHE  75  -1.458   1.115  -5.051
  600   1HB   PHE  75          1HB       PHE  75  -0.144   0.212  -6.952
  601   2HB   PHE  75          2HB       PHE  75  -1.562   0.196  -7.981
  602    HD1  PHE  75           1HD      PHE  75  -2.549   2.385  -8.731
  603    HD2  PHE  75           2HD      PHE  75   1.200   2.151  -6.756
  604    HE1  PHE  75           1HE      PHE  75  -1.962   4.675  -9.573
  605    HE2  PHE  75           2HE      PHE  75   1.787   4.442  -7.598
  606    HZ   PHE  75           HZ       PHE  75   0.199   5.676  -8.997
  607    H    GLN  76           H        GLN  76  -4.105   0.083  -7.241
  608    HA   GLN  76           HA       GLN  76  -5.062   2.595  -7.839
  609   1HB   GLN  76          1HB       GLN  76  -6.279  -0.167  -7.730
  610   2HB   GLN  76          2HB       GLN  76  -7.325   1.209  -8.015
  611   1HG   GLN  76          1HG       GLN  76  -5.431   1.845  -9.814
  612   2HG   GLN  76          2HG       GLN  76  -5.099   0.125  -9.741
  613   1HE2  GLN  76          1HE2      GLN  76  -5.759   0.332 -12.019
  614   2HE2  GLN  76          2HE2      GLN  76  -7.432   0.153 -12.432
  615    H    SER  77           H        SER  77  -5.664   0.422  -5.035
  616    HA   SER  77           HA       SER  77  -7.797   1.578  -3.911
  617   1HB   SER  77          1HB       SER  77  -6.267  -0.375  -3.099
  618   2HB   SER  77          2HB       SER  77  -5.365   0.859  -2.241
  619    HG   SER  77           HG       SER  77  -8.143   1.028  -1.866
  620    H    PHE  78           H        PHE  78  -4.360   2.499  -3.106
  621    HA   PHE  78           HA       PHE  78  -5.381   5.194  -2.540
  622   1HB   PHE  78          1HB       PHE  78  -3.931   3.228  -0.964
  623   2HB   PHE  78          2HB       PHE  78  -2.817   4.540  -1.293
  624    HD1  PHE  78           1HD      PHE  78  -4.328   6.944  -1.130
  625    HD2  PHE  78           2HD      PHE  78  -4.783   3.403   1.164
  626    HE1  PHE  78           1HE      PHE  78  -5.353   8.281   0.730
  627    HE2  PHE  78           2HE      PHE  78  -5.808   4.740   3.024
  628    HZ   PHE  78           HZ       PHE  78  -6.081   7.163   2.785
  629    H    GLU  79           H        GLU  79  -4.450   6.860  -3.660
  630    HA   GLU  79           HA       GLU  79  -1.897   6.279  -4.931
  631   1HB   GLU  79          1HB       GLU  79  -4.228   6.330  -6.367
  632   2HB   GLU  79          2HB       GLU  79  -3.787   8.024  -6.448
  633   1HG   GLU  79          1HG       GLU  79  -1.556   7.443  -7.345
  634   2HG   GLU  79          2HG       GLU  79  -1.896   5.734  -7.161
  635    H    THR  80           H        THR  80  -2.086   8.995  -6.297
  636    HA   THR  80           HA       THR  80  -0.926  10.493  -4.172
  637    HB   THR  80           HB       THR  80  -1.762  11.299  -7.009
  638    HG1  THR  80           1HG      THR  80  -0.312   9.462  -6.947
  639   1HG2  THR  80          1HG2      THR  80  -1.089  13.298  -5.821
  640   2HG2  THR  80          2HG2      THR  80   0.202  12.428  -4.959
  641   3HG2  THR  80          3HG2      THR  80   0.359  12.755  -6.701
  642    H    GLY  81           H        GLY  81  -4.163   9.868  -5.051
  643   1HA   GLY  81          1HA       GLY  81  -6.081  10.674  -4.181
  644   2HA   GLY  81          2HA       GLY  81  -5.145  11.684  -3.097
  645    H    HIS  82           H        HIS  82  -4.992  11.648  -6.705
  646    HA   HIS  82           HA       HIS  82  -6.395  14.190  -6.747
  647   1HB   HIS  82          1HB       HIS  82  -3.515  13.770  -7.468
  648   2HB   HIS  82          2HB       HIS  82  -4.462  14.910  -8.404
  649    HD1  HIS  82           1HD      HIS  82  -2.293  14.848  -5.588
  650    HD2  HIS  82           2HD      HIS  82  -5.906  16.806  -6.433
  651    HE1  HIS  82           1HE      HIS  82  -2.432  16.821  -3.975
  652    H    CYS  83           H        CYS  83  -4.346  13.091  -9.413
  653    HA   CYS  83           HA       CYS  83  -4.802  12.279 -11.398
  654   1HB   CYS  83          1HB       CYS  83  -6.487  10.668  -9.638
  655   2HB   CYS  83          2HB       CYS  83  -7.169  10.798 -11.247
  656    HG   CYS  83           HG       CYS  83  -4.518  10.494 -12.253
  657    H    LEU  84           H        LEU  84  -5.730  14.909 -10.666
  658    HA   LEU  84           HA       LEU  84  -8.381  15.117 -11.839
  659   1HB   LEU  84          1HB       LEU  84  -7.042  16.447  -9.795
  660   2HB   LEU  84          2HB       LEU  84  -7.051  17.599 -11.115
  661    HG   LEU  84           HG       LEU  84  -8.960  17.943  -9.659
  662   1HD1  LEU  84          1HD1      LEU  84  -9.475  16.988 -12.461
  663   2HD1  LEU  84          2HD1      LEU  84 -10.821  17.529 -11.429
  664   3HD1  LEU  84          3HD1      LEU  84  -9.482  18.641 -11.802
  665   1HD2  LEU  84          1HD2      LEU  84  -9.358  15.011 -10.063
  666   2HD2  LEU  84          2HD2      LEU  84  -9.536  16.006  -8.597
  667   3HD2  LEU  84          3HD2      LEU  84 -10.794  16.043  -9.856
  668    H    ASN  85           H        ASN  85  -6.372  14.096 -13.579
  669    HA   ASN  85           HA       ASN  85  -5.434  14.412 -15.513
  670   1HB   ASN  85          1HB       ASN  85  -7.515  16.645 -15.787
  671   2HB   ASN  85          2HB       ASN  85  -6.632  15.942 -17.127
  672   1HD2  ASN  85          1HD2      ASN  85  -9.295  15.702 -15.038
  673   2HD2  ASN  85          2HD2      ASN  85  -9.940  14.182 -15.560
  674    H    GLU  86           H        GLU  86  -3.353  15.222 -14.770
  675    HA   GLU  86           HA       GLU  86  -3.080  18.098 -15.144
  676   1HB   GLU  86          1HB       GLU  86  -2.419  16.468 -12.767
  677   2HB   GLU  86          2HB       GLU  86  -1.077  17.452 -13.316
  678   1HG   GLU  86          1HG       GLU  86  -3.456  19.077 -13.447
  679   2HG   GLU  86          2HG       GLU  86  -3.443  18.286 -11.884
  680    H    THR  87           H        THR  87  -2.665  15.650 -16.893
  681    HA   THR  87           HA       THR  87  -1.051  14.629 -18.102
  682    HB   THR  87           HB       THR  87  -0.146  17.543 -18.349
  683    HG1  THR  87           1HG      THR  87  -2.179  17.790 -19.192
  684   1HG2  THR  87          1HG2      THR  87   1.172  16.502 -19.951
  685   2HG2  THR  87          2HG2      THR  87   0.152  15.043 -19.978
  686   3HG2  THR  87          3HG2      THR  87  -0.348  16.496 -20.877
  687    H    ASN  88           H        ASN  88  -0.378  14.120 -15.535
  688    HA   ASN  88           HA       ASN  88   2.491  14.205 -15.766
  689   1HB   ASN  88          1HB       ASN  88   1.958  16.158 -14.314
  690   2HB   ASN  88          2HB       ASN  88   0.973  15.146 -13.276
  691   1HD2  ASN  88          1HD2      ASN  88   2.332  15.865 -11.562
  692   2HD2  ASN  88          2HD2      ASN  88   3.865  15.119 -11.255
  693    H    VAL  89           H        VAL  89   1.988  11.879 -16.252
  694    HA   VAL  89           HA       VAL  89   1.434  10.390 -13.785
  695    HB   VAL  89           HB       VAL  89   0.447   9.720 -16.565
  696   1HG1  VAL  89          1HG1      VAL  89   0.084   7.651 -15.822
  697   2HG1  VAL  89          2HG1      VAL  89   0.885   8.074 -14.289
  698   3HG1  VAL  89          3HG1      VAL  89  -0.874   8.282 -14.461
  699   1HG2  VAL  89          1HG2      VAL  89  -1.075  11.326 -16.049
  700   2HG2  VAL  89          2HG2      VAL  89  -1.805  10.005 -15.105
  701   3HG2  VAL  89          3HG2      VAL  89  -0.772  11.209 -14.298
  702    H    THR  90           H        THR  90   4.004  11.226 -14.705
  703    HA   THR  90           HA       THR  90   5.076   8.743 -15.861
  704    HB   THR  90           HB       THR  90   5.491  10.864 -17.126
  705    HG1  THR  90           1HG      THR  90   7.801  10.442 -17.141
  706   1HG2  THR  90          1HG2      THR  90   5.860  12.002 -14.553
  707   2HG2  THR  90          2HG2      THR  90   7.496  11.898 -15.246
  708   3HG2  THR  90          3HG2      THR  90   6.218  12.783 -16.112
  709    H    LYS  91           H        LYS  91   4.579  10.349 -12.913
  710    HA   LYS  91           HA       LYS  91   6.186   8.461 -11.554
  711   1HB   LYS  91          1HB       LYS  91   7.751  10.047 -10.483
  712   2HB   LYS  91          2HB       LYS  91   8.038   9.859 -12.201
  713   1HG   LYS  91          1HG       LYS  91   7.500  12.039 -12.660
  714   2HG   LYS  91          2HG       LYS  91   6.117  12.028 -11.585
  715   1HD   LYS  91          1HD       LYS  91   8.533  11.835  -9.989
  716   2HD   LYS  91          2HD       LYS  91   8.708  13.169 -11.113
  717   1HE   LYS  91          1HE       LYS  91   6.442  14.032 -10.370
  718   2HE   LYS  91          2HE       LYS  91   6.380  12.750  -9.177
  719   1HZ   LYS  91          1HZ       LYS  91   7.902  13.768  -7.918
  720   2HZ   LYS  91          2HZ       LYS  91   8.781  14.332  -9.173
  721   3HZ   LYS  91          3HZ       LYS  91   7.426  15.116  -8.708
  722    H    ASP  92           H        ASP  92   3.924   8.159 -10.859
  723    HA   ASP  92           HA       ASP  92   2.795  10.305  -9.349
  724   1HB   ASP  92          1HB       ASP  92   1.904   7.399  -9.669
  725   2HB   ASP  92          2HB       ASP  92   0.944   8.670  -8.939
  726    H    VAL  93           H        VAL  93   3.166  10.570  -7.137
  727    HA   VAL  93           HA       VAL  93   4.367   8.295  -5.726
  728    HB   VAL  93           HB       VAL  93   5.017  10.211  -4.115
  729   1HG1  VAL  93          1HG1      VAL  93   6.325   8.916  -6.155
  730   2HG1  VAL  93          2HG1      VAL  93   6.575  10.626  -6.581
  731   3HG1  VAL  93          3HG1      VAL  93   7.085  10.022  -4.986
  732   1HG2  VAL  93          1HG2      VAL  93   3.496  11.855  -5.351
  733   2HG2  VAL  93          2HG2      VAL  93   5.142  12.413  -4.966
  734   3HG2  VAL  93          3HG2      VAL  93   4.744  11.887  -6.619
  735    H    VAL  94           H        VAL  94   3.445   7.532  -3.819
  736    HA   VAL  94           HA       VAL  94   0.914   8.830  -3.077
  737    HB   VAL  94           HB       VAL  94  -0.117   6.770  -2.823
  738   1HG1  VAL  94          1HG1      VAL  94   0.392   7.424  -5.219
  739   2HG1  VAL  94          2HG1      VAL  94   1.704   6.221  -5.183
  740   3HG1  VAL  94          3HG1      VAL  94   0.016   5.705  -4.951
  741   1HG2  VAL  94          1HG2      VAL  94   1.159   5.322  -1.618
  742   2HG2  VAL  94          2HG2      VAL  94   1.463   4.627  -3.228
  743   3HG2  VAL  94          3HG2      VAL  94   2.652   5.730  -2.496
  744    H    CYS  95           H        CYS  95   0.650   9.323  -0.928
  745    HA   CYS  95           HA       CYS  95   2.915   9.306   0.702
  746   1HB   CYS  95          1HB       CYS  95   1.078  10.958   0.882
  747   2HB   CYS  95          2HB       CYS  95   0.009   9.709   1.489
  748    HG   CYS  95           HG       CYS  95   0.525  10.294   3.735
  749    H    LEU  96           H        LEU  96   3.681   7.765   2.145
  750    HA   LEU  96           HA       LEU  96   2.525   5.180   2.066
  751   1HB   LEU  96          1HB       LEU  96   4.824   6.458   3.512
  752   2HB   LEU  96          2HB       LEU  96   4.305   4.836   3.925
  753    HG   LEU  96           HG       LEU  96   4.785   5.383   1.038
  754   1HD1  LEU  96          1HD1      LEU  96   6.938   5.926   1.137
  755   2HD1  LEU  96          2HD1      LEU  96   6.703   6.243   2.873
  756   3HD1  LEU  96          3HD1      LEU  96   7.278   4.648   2.329
  757   1HD2  LEU  96          1HD2      LEU  96   5.007   3.154   0.893
  758   2HD2  LEU  96          2HD2      LEU  96   5.987   3.047   2.375
  759   3HD2  LEU  96          3HD2      LEU  96   4.214   3.150   2.487
  760    H    ASN  97           H        ASN  97   2.633   7.859   4.481
  761    HA   ASN  97           HA       ASN  97   1.578   6.591   6.604
  762   1HB   ASN  97          1HB       ASN  97   1.128   9.411   5.528
  763   2HB   ASN  97          2HB       ASN  97   0.429   8.910   7.055
  764   1HD2  ASN  97          1HD2      ASN  97   2.844  10.592   5.847
  765   2HD2  ASN  97          2HD2      ASN  97   4.118  10.315   6.987
  766    H    ASP  98           H        ASP  98  -0.002   7.725   3.597
  767    HA   ASP  98           HA       ASP  98  -2.626   7.512   4.534
  768   1HB   ASP  98          1HB       ASP  98  -1.223   7.963   1.976
  769   2HB   ASP  98          2HB       ASP  98  -2.697   7.039   1.761
  770    H    VAL  99           H        VAL  99  -0.276   5.318   2.916
  771    HA   VAL  99           HA       VAL  99  -2.181   3.249   2.452
  772    HB   VAL  99           HB       VAL  99   0.839   3.344   2.405
  773   1HG1  VAL  99          1HG1      VAL  99  -0.276   1.045   2.823
  774   2HG1  VAL  99          2HG1      VAL  99  -0.832   1.175   1.137
  775   3HG1  VAL  99          3HG1      VAL  99   0.910   1.185   1.503
  776   1HG2  VAL  99          1HG2      VAL  99  -1.252   4.134   0.531
  777   2HG2  VAL  99          2HG2      VAL  99   0.498   4.456   0.493
  778   3HG2  VAL  99          3HG2      VAL  99  -0.142   2.934  -0.172
  779    H    SER 100           H        SER 100   0.207   4.094   4.996
  780    HA   SER 100           HA       SER 100   0.199   1.712   6.335
  781   1HB   SER 100          1HB       SER 100   1.787   3.358   6.990
  782   2HB   SER 100          2HB       SER 100   0.560   4.588   7.219
  783    HG   SER 100           HG       SER 100   1.497   2.665   8.999
  784    H    CYS 101           H        CYS 101  -2.310   4.141   5.998
  785    HA   CYS 101           HA       CYS 101  -3.705   3.441   8.377
  786   1HB   CYS 101          1HB       CYS 101  -3.800   5.670   7.080
  787   2HB   CYS 101          2HB       CYS 101  -4.901   4.855   5.987
  788    HG   CYS 101           HG       CYS 101  -5.482   6.307   8.611
  789    H    TYR 102           H        TYR 102  -4.102   2.842   4.811
  790    HA   TYR 102           HA       TYR 102  -6.358   1.278   4.913
  791   1HB   TYR 102          1HB       TYR 102  -5.496   1.914   2.768
  792   2HB   TYR 102          2HB       TYR 102  -3.842   1.562   3.230
  793    HD1  TYR 102           1HD      TYR 102  -6.903  -0.606   3.315
  794    HD2  TYR 102           2HD      TYR 102  -3.009   0.048   1.667
  795    HE1  TYR 102           1HE      TYR 102  -7.033  -2.837   2.103
  796    HE2  TYR 102           2HE      TYR 102  -3.153  -2.185   0.460
  797    HH   TYR 102           HH       TYR 102  -5.291  -4.526   1.253
  798    H    PHE 103           H        PHE 103  -2.894   0.164   4.970
  799    HA   PHE 103           HA       PHE 103  -3.584  -2.530   5.348
  800   1HB   PHE 103          1HB       PHE 103  -1.154  -0.719   5.715
  801   2HB   PHE 103          2HB       PHE 103  -1.050  -2.379   6.269
  802    HD1  PHE 103           1HD      PHE 103   0.218  -0.604   3.848
  803    HD2  PHE 103           2HD      PHE 103  -2.530  -3.822   4.174
  804    HE1  PHE 103           1HE      PHE 103   0.806  -1.343   1.522
  805    HE2  PHE 103           2HE      PHE 103  -1.941  -4.561   1.849
  806    HZ   PHE 103           HZ       PHE 103  -0.280  -3.313   0.551
  807    H    SER 104           H        SER 104  -3.048   0.215   7.568
  808    HA   SER 104           HA       SER 104  -2.605  -1.229   9.864
  809   1HB   SER 104          1HB       SER 104  -2.206   1.051  10.111
  810   2HB   SER 104          2HB       SER 104  -3.640   1.515   9.217
  811    HG   SER 104           HG       SER 104  -3.598   1.813  11.669
  812    H    LEU 105           H        LEU 105  -5.558  -0.586   8.011
  813    HA   LEU 105           HA       LEU 105  -7.340  -1.267  10.132
  814   1HB   LEU 105          1HB       LEU 105  -7.561   0.082   7.787
  815   2HB   LEU 105          2HB       LEU 105  -8.243  -1.466   7.329
  816    HG   LEU 105           HG       LEU 105  -9.974   0.097   8.037
  817   1HD1  LEU 105          1HD1      LEU 105 -10.245  -1.647  10.336
  818   2HD1  LEU 105          2HD1      LEU 105 -11.175  -1.601   8.818
  819   3HD1  LEU 105          3HD1      LEU 105  -9.665  -2.540   8.909
  820   1HD2  LEU 105          1HD2      LEU 105  -9.921   1.381   9.874
  821   2HD2  LEU 105          2HD2      LEU 105  -9.280   0.073  10.898
  822   3HD2  LEU 105          3HD2      LEU 105  -8.177   1.022   9.872
  823    H    LEU 106           H        LEU 106  -5.826  -2.953   7.335
  824    HA   LEU 106           HA       LEU 106  -7.282  -5.310   7.535
  825   1HB   LEU 106          1HB       LEU 106  -4.725  -4.430   6.330
  826   2HB   LEU 106          2HB       LEU 106  -4.899  -6.154   6.595
  827    HG   LEU 106           HG       LEU 106  -7.062  -6.067   5.312
  828   1HD1  LEU 106          1HD1      LEU 106  -6.227  -3.197   5.019
  829   2HD1  LEU 106          2HD1      LEU 106  -7.148  -4.002   3.725
  830   3HD1  LEU 106          3HD1      LEU 106  -7.830  -3.889   5.365
  831   1HD2  LEU 106          1HD2      LEU 106  -4.366  -5.527   4.141
  832   2HD2  LEU 106          2HD2      LEU 106  -5.394  -6.976   4.039
  833   3HD2  LEU 106          3HD2      LEU 106  -5.781  -5.540   3.061
  834    H    GLU 107           H        GLU 107  -4.013  -4.510   8.914
  835    HA   GLU 107           HA       GLU 107  -3.747  -6.862  10.298
  836   1HB   GLU 107          1HB       GLU 107  -2.037  -5.662  11.625
  837   2HB   GLU 107          2HB       GLU 107  -1.896  -5.281   9.921
  838   1HG   GLU 107          1HG       GLU 107  -3.390  -3.215  10.415
  839   2HG   GLU 107          2HG       GLU 107  -3.115  -3.551  12.113
  840    H    GLY 108           H        GLY 108  -5.328  -3.762  11.222
  841   1HA   GLY 108          1HA       GLY 108  -6.465  -3.175  13.096
  842   2HA   GLY 108          2HA       GLY 108  -7.305  -4.680  12.777
  843    H    GLY 109           H        GLY 109  -4.231  -3.470  14.298
  844   1HA   GLY 109          1HA       GLY 109  -4.127  -5.776  16.053
  845   2HA   GLY 109          2HA       GLY 109  -2.982  -4.453  15.946
  846    H    ARG 110           H        ARG 110  -6.575  -4.384  16.447
  847    HA   ARG 110           HA       ARG 110  -6.009  -3.191  19.040
  848   1HB   ARG 110          1HB       ARG 110  -6.772  -1.501  17.293
  849   2HB   ARG 110          2HB       ARG 110  -8.279  -2.385  17.152
  850   1HG   ARG 110          1HG       ARG 110  -7.567  -1.742  19.957
  851   2HG   ARG 110          2HG       ARG 110  -7.775  -0.318  18.957
  852   1HD   ARG 110          1HD       ARG 110  -9.926  -2.022  18.234
  853   2HD   ARG 110          2HD       ARG 110  -9.806  -2.174  19.975
  854    HE   ARG 110           HE       ARG 110 -10.692  -0.029  20.136
  855   1HH1  ARG 110          2HH2      ARG 110  -9.010  -0.301  17.057
  856   2HH1  ARG 110          1HH2      ARG 110  -9.423   1.302  16.544
  857   1HH2  ARG 110          2HH1      ARG 110 -11.237   2.085  19.460
  858   2HH2  ARG 110          1HH1      ARG 110 -10.698   2.668  17.921
  859    HA   PRO 111           HA       PRO 111  -8.745  -6.525  20.036
  860   1HB   PRO 111          1HB       PRO 111  -8.251  -6.568  22.724
  861   2HB   PRO 111          2HB       PRO 111  -7.278  -7.441  21.556
  862   1HG   PRO 111          1HG       PRO 111  -6.636  -4.948  23.010
  863   2HG   PRO 111          2HG       PRO 111  -5.550  -6.049  22.186
  864   1HD   PRO 111          1HD       PRO 111  -6.458  -3.500  21.234
  865   2HD   PRO 111          2HD       PRO 111  -5.466  -4.652  20.362
  866    H    GLU 112           H        GLU 112 -10.794  -6.892  21.007
  867    HA   GLU 112           HA       GLU 112 -11.901  -5.024  22.700
  868   1HB   GLU 112          1HB       GLU 112 -11.737  -3.496  20.728
  869   2HB   GLU 112          2HB       GLU 112 -12.716  -4.606  19.789
  870   1HG   GLU 112          1HG       GLU 112 -14.047  -4.030  22.319
  871   2HG   GLU 112          2HG       GLU 112 -13.623  -2.527  21.523
  872    H    ASP 113           H        ASP 113 -12.336  -7.358  20.017
  873    HA   ASP 113           HA       ASP 113 -13.823  -9.074  21.562
  874   1HB   ASP 113          1HB       ASP 113 -15.529  -7.147  21.167
  875   2HB   ASP 113          2HB       ASP 113 -15.563  -7.669  19.494
  876    H    LYS 114           H        LYS 114 -12.557 -10.684  20.514
  877    HA   LYS 114           HA       LYS 114 -12.380 -10.666  17.632
  878   1HB   LYS 114          1HB       LYS 114 -11.205 -12.502  19.740
  879   2HB   LYS 114          2HB       LYS 114 -10.908 -12.647  18.020
  880   1HG   LYS 114          1HG       LYS 114 -10.473  -9.889  18.781
  881   2HG   LYS 114          2HG       LYS 114  -9.602 -10.911  19.907
  882   1HD   LYS 114          1HD       LYS 114  -7.978 -11.070  18.324
  883   2HD   LYS 114          2HD       LYS 114  -9.067 -12.123  17.443
  884   1HE   LYS 114          1HE       LYS 114  -9.818  -9.347  16.974
  885   2HE   LYS 114          2HE       LYS 114  -8.109  -9.549  16.648
  886   1HZ   LYS 114          1HZ       LYS 114 -10.259 -11.208  15.524
  887   2HZ   LYS 114          2HZ       LYS 114  -9.423 -10.056  14.724
  888   3HZ   LYS 114          3HZ       LYS 114  -8.666 -11.412  15.228
  889    H    LEU 115           H        LEU 115 -12.798 -12.810  16.446
  890    HA   LEU 115           HA       LEU 115 -15.510 -13.459  16.818
  891   1HB   LEU 115          1HB       LEU 115 -13.589 -15.103  15.204
  892   2HB   LEU 115          2HB       LEU 115 -15.287 -14.779  14.913
  893    HG   LEU 115           HG       LEU 115 -13.838 -12.290  14.880
  894   1HD1  LEU 115          1HD1      LEU 115 -12.239 -12.578  13.189
  895   2HD1  LEU 115          2HD1      LEU 115 -11.944 -13.917  14.323
  896   3HD1  LEU 115          3HD1      LEU 115 -12.811 -14.217  12.798
  897   1HD2  LEU 115          1HD2      LEU 115 -14.943 -11.964  12.824
  898   2HD2  LEU 115          2HD2      LEU 115 -15.104 -13.713  12.536
  899   3HD2  LEU 115          3HD2      LEU 115 -16.059 -12.931  13.818
  900    H    GLU 116           H        GLU 116 -16.071 -16.015  16.768
  901    HA   GLU 116           HA       GLU 116 -14.816 -17.004  19.200
  902   1HB   GLU 116          1HB       GLU 116 -17.463 -17.915  18.004
  903   2HB   GLU 116          2HB       GLU 116 -16.866 -18.224  19.622
  904   1HG   GLU 116          1HG       GLU 116 -17.195 -15.360  18.695
  905   2HG   GLU 116          2HG       GLU 116 -18.613 -16.266  19.185
  906    H    TRP 117           H        TRP 117 -16.154 -19.708  18.616
  907    HA   TRP 117           HA       TRP 117 -15.096 -20.725  16.228
  908   1HB   TRP 117          1HB       TRP 117 -13.224 -20.553  18.478
  909   2HB   TRP 117          2HB       TRP 117 -13.398 -22.174  17.834
  910    HD1  TRP 117           HD       TRP 117 -13.871 -19.702  15.075
  911    HE1  TRP 117           1HE      TRP 117 -11.744 -19.456  13.532
  912    HE3  TRP 117           3HE      TRP 117 -10.689 -22.175  18.175
  913    HZ2  TRP 117           2HZ      TRP 117  -9.030 -20.305  13.777
  914    HZ3  TRP 117           3HZ      TRP 117  -8.318 -22.423  17.448
  915    HH2  TRP 117           HH       TRP 117  -7.474 -21.536  15.333
  916    H    SER 118           H        SER 118 -14.599 -22.462  19.292
  917    HA   SER 118           HA       SER 118 -17.284 -23.479  19.231
  918   1HB   SER 118          1HB       SER 118 -15.828 -24.890  17.633
  919   2HB   SER 118          2HB       SER 118 -14.957 -25.433  19.053
  920    HG   SER 118           HG       SER 118 -17.758 -25.612  19.278
  Start of MODEL    7
    1   1H    MET   1           H        MET   1  -8.743  13.866   1.219
    2    HA   MET   1           HA       MET   1  -8.929  11.599   0.328
    3   1HB   MET   1          1HB       MET   1  -8.040  11.115   3.185
    4   2HB   MET   1          2HB       MET   1  -9.131   9.944   2.471
    5   1HG   MET   1          1HG       MET   1  -6.491  10.822   1.204
    6   2HG   MET   1          2HG       MET   1  -6.687   9.367   2.161
    7   1HE   MET   1          1HE       MET   1  -7.678   7.056   1.110
    8   2HE   MET   1          2HE       MET   1  -9.042   8.023   1.719
    9   3HE   MET   1          3HE       MET   1  -9.153   7.231   0.129
   10    H    ALA   2           H        ALA   2 -10.909  12.883  -0.020
   11    HA   ALA   2           HA       ALA   2 -12.994  12.044   1.846
   12   1HB   ALA   2          1HB       ALA   2 -12.071  14.805   1.305
   13   2HB   ALA   2          2HB       ALA   2 -13.828  14.567   1.149
   14   3HB   ALA   2          3HB       ALA   2 -13.006  14.159   2.674
   15    H    LYS   3           H        LYS   3 -12.369  10.722  -0.506
   16    HA   LYS   3           HA       LYS   3 -14.752  11.281  -2.038
   17   1HB   LYS   3          1HB       LYS   3 -12.991  12.710  -3.079
   18   2HB   LYS   3          2HB       LYS   3 -12.039  11.273  -3.392
   19   1HG   LYS   3          1HG       LYS   3 -13.177  11.063  -5.346
   20   2HG   LYS   3          2HG       LYS   3 -14.572  10.592  -4.395
   21   1HD   LYS   3          1HD       LYS   3 -14.060  13.540  -4.617
   22   2HD   LYS   3          2HD       LYS   3 -14.567  12.733  -6.088
   23   1HE   LYS   3          1HE       LYS   3 -16.676  12.202  -5.248
   24   2HE   LYS   3          2HE       LYS   3 -16.109  12.066  -3.596
   25   1HZ   LYS   3          1HZ       LYS   3 -16.532  14.195  -3.246
   26   2HZ   LYS   3          2HZ       LYS   3 -15.834  14.695  -4.635
   27   3HZ   LYS   3          3HZ       LYS   3 -17.386  14.187  -4.638
   28    H    GLU   4           H        GLU   4 -12.676   9.491  -3.956
   29    HA   GLU   4           HA       GLU   4 -12.301   7.127  -2.748
   30   1HB   GLU   4          1HB       GLU   4 -15.114   7.574  -2.953
   31   2HB   GLU   4          2HB       GLU   4 -14.725   6.347  -4.143
   32   1HG   GLU   4          1HG       GLU   4 -14.184   4.781  -2.550
   33   2HG   GLU   4          2HG       GLU   4 -13.361   5.947  -1.534
   34    H    ARG   5           H        ARG   5 -11.844   5.349  -4.327
   35    HA   ARG   5           HA       ARG   5 -12.298   5.610  -7.012
   36   1HB   ARG   5          1HB       ARG   5 -10.020   6.291  -7.837
   37   2HB   ARG   5          2HB       ARG   5 -10.840   7.589  -6.993
   38   1HG   ARG   5          1HG       ARG   5  -9.453   6.194  -4.958
   39   2HG   ARG   5          2HG       ARG   5  -8.334   6.222  -6.307
   40   1HD   ARG   5          1HD       ARG   5  -8.353   8.624  -6.425
   41   2HD   ARG   5          2HD       ARG   5  -9.800   8.746  -5.444
   42    HE   ARG   5           HE       ARG   5  -7.839   7.420  -3.873
   43   1HH1  ARG   5          2HH2      ARG   5  -8.361  10.583  -5.324
   44   2HH1  ARG   5          1HH2      ARG   5  -7.434  11.426  -4.128
   45   1HH2  ARG   5          2HH1      ARG   5  -6.616   8.532  -2.294
   46   2HH2  ARG   5          1HH1      ARG   5  -6.435  10.251  -2.393
   47    H    GLY   6           H        GLY   6 -11.400   3.773  -8.173
   48   1HA   GLY   6          1HA       GLY   6 -10.640   1.666  -8.344
   49   2HA   GLY   6          2HA       GLY   6  -9.294   2.177  -7.345
   50    H    LEU   7           H        LEU   7 -12.047   0.152  -7.538
   51    HA   LEU   7           HA       LEU   7 -11.955  -0.270  -4.631
   52   1HB   LEU   7          1HB       LEU   7 -14.246  -0.416  -6.577
   53   2HB   LEU   7          2HB       LEU   7 -14.293  -1.241  -5.032
   54    HG   LEU   7           HG       LEU   7 -13.582   1.270  -4.235
   55   1HD1  LEU   7          1HD1      LEU   7 -13.766   2.599  -6.056
   56   2HD1  LEU   7          2HD1      LEU   7 -14.911   1.513  -6.879
   57   3HD1  LEU   7          3HD1      LEU   7 -15.484   2.598  -5.589
   58   1HD2  LEU   7          1HD2      LEU   7 -15.311  -0.089  -3.218
   59   2HD2  LEU   7          2HD2      LEU   7 -15.942   1.539  -3.566
   60   3HD2  LEU   7          3HD2      LEU   7 -16.380   0.170  -4.617
   61    H    ILE   8           H        ILE   8 -10.964  -2.123  -4.062
   62    HA   ILE   8           HA       ILE   8 -10.669  -4.164  -6.122
   63    HB   ILE   8           HB       ILE   8  -9.029  -5.111  -4.461
   64   1HG1  ILE   8          1HG1      ILE   8  -8.990  -2.436  -3.113
   65   2HG1  ILE   8          2HG1      ILE   8 -10.170  -3.620  -2.586
   66   1HG2  ILE   8          1HG2      ILE   8  -8.039  -2.390  -5.058
   67   2HG2  ILE   8          2HG2      ILE   8  -7.380  -3.983  -5.499
   68   3HG2  ILE   8          3HG2      ILE   8  -8.721  -3.285  -6.438
   69   1HD1  ILE   8          1HD1      ILE   8  -7.468  -4.770  -2.961
   70   2HD1  ILE   8          2HD1      ILE   8  -7.538  -3.497  -1.719
   71   3HD1  ILE   8          3HD1      ILE   8  -8.589  -4.927  -1.587
   72    H    SER   9           H        SER   9 -12.108  -5.794  -6.206
   73    HA   SER   9           HA       SER   9 -14.132  -6.141  -4.454
   74   1HB   SER   9          1HB       SER   9 -13.136  -7.446  -6.761
   75   2HB   SER   9          2HB       SER   9 -13.280  -8.713  -5.559
   76    HG   SER   9           HG       SER   9 -15.287  -8.595  -6.549
   77    HA   PRO  10           HA       PRO  10 -12.642  -8.581  -1.152
   78   1HB   PRO  10          1HB       PRO  10 -14.272 -10.762  -0.925
   79   2HB   PRO  10          2HB       PRO  10 -14.729  -9.163  -0.372
   80   1HG   PRO  10          1HG       PRO  10 -15.637 -10.622  -2.778
   81   2HG   PRO  10          2HG       PRO  10 -16.373  -9.242  -1.987
   82   1HD   PRO  10          1HD       PRO  10 -14.835  -9.214  -4.408
   83   2HD   PRO  10          2HD       PRO  10 -15.473  -7.822  -3.555
   84    H    SER  11           H        SER  11 -12.174  -9.660  -4.177
   85    HA   SER  11           HA       SER  11 -11.082 -12.189  -3.480
   86   1HB   SER  11          1HB       SER  11 -11.848 -10.829  -5.868
   87   2HB   SER  11          2HB       SER  11 -10.138 -11.171  -6.037
   88    HG   SER  11           HG       SER  11 -11.048 -13.428  -5.084
   89    H    ASP  12           H        ASP  12  -9.786  -8.957  -4.519
   90    HA   ASP  12           HA       ASP  12  -7.117  -9.757  -4.260
   91   1HB   ASP  12          1HB       ASP  12  -8.007  -6.884  -3.929
   92   2HB   ASP  12          2HB       ASP  12  -6.589  -7.499  -4.753
   93    H    PHE  13           H        PHE  13  -9.588  -8.266  -2.130
   94    HA   PHE  13           HA       PHE  13  -7.779  -7.488  -0.096
   95   1HB   PHE  13          1HB       PHE  13 -10.221  -6.718  -0.668
   96   2HB   PHE  13          2HB       PHE  13 -10.761  -8.206   0.082
   97    HD1  PHE  13           1HD      PHE  13  -9.676  -4.830   0.639
   98    HD2  PHE  13           2HD      PHE  13 -10.241  -8.588   2.527
   99    HE1  PHE  13           1HE      PHE  13  -9.657  -3.706   2.883
  100    HE2  PHE  13           2HE      PHE  13 -10.222  -7.464   4.771
  101    HZ   PHE  13           HZ       PHE  13  -9.930  -5.036   4.922
  102    H    ALA  14           H        ALA  14  -9.708 -10.426  -0.811
  103    HA   ALA  14           HA       ALA  14  -9.313 -11.603   1.733
  104   1HB   ALA  14          1HB       ALA  14 -11.167 -12.347   0.455
  105   2HB   ALA  14          2HB       ALA  14 -10.172 -12.597  -1.000
  106   3HB   ALA  14          3HB       ALA  14 -10.006 -13.694   0.391
  107    H    GLN  15           H        GLN  15  -7.565 -11.635  -1.406
  108    HA   GLN  15           HA       GLN  15  -5.851 -13.717  -0.748
  109   1HB   GLN  15          1HB       GLN  15  -5.961 -13.147  -3.037
  110   2HB   GLN  15          2HB       GLN  15  -5.768 -11.433  -2.729
  111   1HG   GLN  15          1HG       GLN  15  -3.672 -12.236  -3.640
  112   2HG   GLN  15          2HG       GLN  15  -3.400 -11.893  -1.943
  113   1HE2  GLN  15          1HE2      GLN  15  -3.422 -14.237  -4.421
  114   2HE2  GLN  15          2HE2      GLN  15  -2.966 -15.630  -3.499
  115    H    LEU  16           H        LEU  16  -5.429 -10.113  -0.546
  116    HA   LEU  16           HA       LEU  16  -2.866 -10.184   0.529
  117   1HB   LEU  16          1HB       LEU  16  -4.694  -8.274  -0.278
  118   2HB   LEU  16          2HB       LEU  16  -4.542  -7.972   1.442
  119    HG   LEU  16           HG       LEU  16  -2.069  -7.814   1.166
  120   1HD1  LEU  16          1HD1      LEU  16  -2.270  -9.184  -1.087
  121   2HD1  LEU  16          2HD1      LEU  16  -2.391  -7.554  -1.793
  122   3HD1  LEU  16          3HD1      LEU  16  -0.965  -8.001  -0.826
  123   1HD2  LEU  16          1HD2      LEU  16  -2.858  -5.700   1.276
  124   2HD2  LEU  16          2HD2      LEU  16  -2.329  -5.658  -0.423
  125   3HD2  LEU  16          3HD2      LEU  16  -4.040  -5.950  -0.031
  126    H    GLN  17           H        GLN  17  -6.113 -10.097   2.129
  127    HA   GLN  17           HA       GLN  17  -5.072 -10.033   4.704
  128   1HB   GLN  17          1HB       GLN  17  -7.524  -9.661   3.714
  129   2HB   GLN  17          2HB       GLN  17  -7.719 -11.356   4.114
  130   1HG   GLN  17          1HG       GLN  17  -6.514 -10.390   6.417
  131   2HG   GLN  17          2HG       GLN  17  -7.463  -9.004   5.919
  132   1HE2  GLN  17          1HE2      GLN  17  -9.712  -9.771   4.962
  133   2HE2  GLN  17          2HE2      GLN  17 -10.632 -10.797   6.012
  134    H    LYS  18           H        LYS  18  -5.364 -12.592   2.334
  135    HA   LYS  18           HA       LYS  18  -5.285 -14.703   4.290
  136   1HB   LYS  18          1HB       LYS  18  -6.524 -14.951   2.177
  137   2HB   LYS  18          2HB       LYS  18  -5.040 -14.757   1.267
  138   1HG   LYS  18          1HG       LYS  18  -4.814 -16.818   3.375
  139   2HG   LYS  18          2HG       LYS  18  -6.079 -17.179   2.218
  140   1HD   LYS  18          1HD       LYS  18  -4.530 -17.835   0.701
  141   2HD   LYS  18          2HD       LYS  18  -3.816 -16.235   0.718
  142   1HE   LYS  18          1HE       LYS  18  -2.330 -16.820   2.555
  143   2HE   LYS  18          2HE       LYS  18  -3.179 -18.325   2.846
  144   1HZ   LYS  18          1HZ       LYS  18  -1.648 -17.657   0.429
  145   2HZ   LYS  18          2HZ       LYS  18  -1.209 -18.718   1.589
  146   3HZ   LYS  18          3HZ       LYS  18  -2.494 -19.038   0.634
  147    H    TYR  19           H        TYR  19  -3.060 -13.314   1.779
  148    HA   TYR  19           HA       TYR  19  -0.877 -14.918   2.484
  149   1HB   TYR  19          1HB       TYR  19  -1.545 -12.369   1.006
  150   2HB   TYR  19          2HB       TYR  19   0.136 -12.522   1.477
  151    HD1  TYR  19           1HD      TYR  19   0.495 -15.496   1.152
  152    HD2  TYR  19           2HD      TYR  19  -1.448 -12.607  -1.335
  153    HE1  TYR  19           1HE      TYR  19   0.930 -16.949  -0.888
  154    HE2  TYR  19           2HE      TYR  19  -1.006 -14.070  -3.367
  155    HH   TYR  19           HH       TYR  19   1.192 -16.362  -3.492
  156    H    MET  20           H        MET  20  -1.738 -11.510   3.407
  157    HA   MET  20           HA       MET  20   0.495 -11.138   4.996
  158   1HB   MET  20          1HB       MET  20  -0.644  -9.134   5.707
  159   2HB   MET  20          2HB       MET  20  -1.250  -9.430   4.089
  160   1HG   MET  20          1HG       MET  20  -3.306  -9.199   5.097
  161   2HG   MET  20          2HG       MET  20  -3.074 -10.886   5.511
  162   1HE   MET  20          1HE       MET  20  -0.942  -7.865   7.732
  163   2HE   MET  20          2HE       MET  20  -1.894  -7.505   6.271
  164   3HE   MET  20          3HE       MET  20  -2.558  -7.134   7.881
  165    H    GLU  21           H        GLU  21  -2.473 -12.933   5.537
  166    HA   GLU  21           HA       GLU  21  -2.528 -12.757   8.315
  167   1HB   GLU  21          1HB       GLU  21  -3.848 -14.323   6.195
  168   2HB   GLU  21          2HB       GLU  21  -3.635 -15.247   7.669
  169   1HG   GLU  21          1HG       GLU  21  -4.649 -12.425   7.945
  170   2HG   GLU  21          2HG       GLU  21  -5.755 -13.615   7.288
  171    H    TYR  22           H        TYR  22  -1.203 -15.305   6.085
  172    HA   TYR  22           HA       TYR  22  -0.267 -17.097   7.870
  173   1HB   TYR  22          1HB       TYR  22   0.100 -16.273   5.147
  174   2HB   TYR  22          2HB       TYR  22   1.724 -16.345   5.801
  175    HD1  TYR  22           1HD      TYR  22   2.858 -18.393   5.902
  176    HD2  TYR  22           2HD      TYR  22  -1.401 -18.383   5.504
  177    HE1  TYR  22           1HE      TYR  22   2.877 -20.913   5.563
  178    HE2  TYR  22           2HE      TYR  22  -1.369 -20.902   5.166
  179    HH   TYR  22           HH       TYR  22   0.995 -22.805   6.031
  180    H    SER  23           H        SER  23   1.320 -13.993   6.908
  181    HA   SER  23           HA       SER  23   3.541 -14.538   8.593
  182   1HB   SER  23          1HB       SER  23   3.251 -12.999   6.397
  183   2HB   SER  23          2HB       SER  23   2.945 -11.762   7.600
  184    HG   SER  23           HG       SER  23   5.335 -12.910   6.854
  185    H    THR  24           H        THR  24   4.197 -12.880  10.348
  186    HA   THR  24           HA       THR  24   1.805 -11.871  11.735
  187    HB   THR  24           HB       THR  24   2.986 -14.130  12.546
  188    HG1  THR  24           1HG      THR  24   1.324 -12.699  13.606
  189   1HG2  THR  24          1HG2      THR  24   5.179 -12.402  12.775
  190   2HG2  THR  24          2HG2      THR  24   4.477 -12.375  14.411
  191   3HG2  THR  24          3HG2      THR  24   4.974 -13.921  13.681
  192    H    LYS  25           H        LYS  25   4.046 -10.741   9.897
  193    HA   LYS  25           HA       LYS  25   5.505  -9.044  11.679
  194   1HB   LYS  25          1HB       LYS  25   5.591  -9.810   8.899
  195   2HB   LYS  25          2HB       LYS  25   5.628  -8.063   9.025
  196   1HG   LYS  25          1HG       LYS  25   7.368  -8.714  11.043
  197   2HG   LYS  25          2HG       LYS  25   7.625 -10.079   9.975
  198   1HD   LYS  25          1HD       LYS  25   7.537  -7.718   8.331
  199   2HD   LYS  25          2HD       LYS  25   8.587  -7.365   9.690
  200   1HE   LYS  25          1HE       LYS  25   9.328  -9.978   8.942
  201   2HE   LYS  25          2HE       LYS  25   9.032  -9.180   7.411
  202   1HZ   LYS  25          1HZ       LYS  25  10.424  -7.411   9.009
  203   2HZ   LYS  25          2HZ       LYS  25  11.190  -8.848   9.129
  204   3HZ   LYS  25          3HZ       LYS  25  10.952  -8.170   7.663
  205    H    LYS  26           H        LYS  26   5.437  -6.523  10.723
  206    HA   LYS  26           HA       LYS  26   2.614  -5.760  10.675
  207   1HB   LYS  26          1HB       LYS  26   4.683  -4.939  12.701
  208   2HB   LYS  26          2HB       LYS  26   3.383  -3.844  12.276
  209   1HG   LYS  26          1HG       LYS  26   2.146  -6.385  12.646
  210   2HG   LYS  26          2HG       LYS  26   3.297  -6.229  13.958
  211   1HD   LYS  26          1HD       LYS  26   2.285  -3.779  14.183
  212   2HD   LYS  26          2HD       LYS  26   0.935  -4.454  13.293
  213   1HE   LYS  26          1HE       LYS  26   0.147  -5.242  15.273
  214   2HE   LYS  26          2HE       LYS  26   1.458  -6.405  15.248
  215   1HZ   LYS  26          1HZ       LYS  26   2.184  -5.385  17.045
  216   2HZ   LYS  26          2HZ       LYS  26   2.584  -4.093  16.130
  217   3HZ   LYS  26          3HZ       LYS  26   1.139  -4.140  16.890
  218    H    VAL  27           H        VAL  27   2.193  -3.769   9.585
  219    HA   VAL  27           HA       VAL  27   3.968  -3.261   7.468
  220    HB   VAL  27           HB       VAL  27   1.493  -3.009   7.458
  221   1HG1  VAL  27          1HG1      VAL  27   0.605  -0.776   8.271
  222   2HG1  VAL  27          2HG1      VAL  27   1.035  -1.948   9.540
  223   3HG1  VAL  27          3HG1      VAL  27   2.129  -0.593   9.172
  224   1HG2  VAL  27          1HG2      VAL  27   1.625  -1.601   5.697
  225   2HG2  VAL  27          2HG2      VAL  27   2.405  -0.315   6.649
  226   3HG2  VAL  27          3HG2      VAL  27   3.376  -1.665   6.014
  227    H    SER  28           H        SER  28   3.549  -1.901  10.722
  228    HA   SER  28           HA       SER  28   4.766   0.517  10.356
  229   1HB   SER  28          1HB       SER  28   4.772  -1.375  12.743
  230   2HB   SER  28          2HB       SER  28   5.420   0.251  12.826
  231    HG   SER  28           HG       SER  28   2.918  -0.415  13.245
  232    H    ASP  29           H        ASP  29   6.165  -2.760  10.845
  233    HA   ASP  29           HA       ASP  29   8.797  -1.789  11.121
  234   1HB   ASP  29          1HB       ASP  29   7.566  -4.515  10.575
  235   2HB   ASP  29          2HB       ASP  29   9.306  -4.305  10.563
  236    H    VAL  30           H        VAL  30   6.831  -3.371   8.506
  237    HA   VAL  30           HA       VAL  30   8.817  -3.525   6.583
  238    HB   VAL  30           HB       VAL  30   5.829  -3.142   6.315
  239   1HG1  VAL  30          1HG1      VAL  30   7.591  -4.437   4.239
  240   2HG1  VAL  30          2HG1      VAL  30   5.952  -3.763   4.070
  241   3HG1  VAL  30          3HG1      VAL  30   7.347  -2.674   4.256
  242   1HG2  VAL  30          1HG2      VAL  30   6.658  -5.796   5.722
  243   2HG2  VAL  30          2HG2      VAL  30   7.420  -5.335   7.264
  244   3HG2  VAL  30          3HG2      VAL  30   5.653  -5.229   7.077
  245    H    LEU  31           H        LEU  31   6.751  -0.812   7.654
  246    HA   LEU  31           HA       LEU  31   7.427   0.858   5.461
  247   1HB   LEU  31          1HB       LEU  31   6.095   1.235   8.121
  248   2HB   LEU  31          2HB       LEU  31   6.548   2.626   7.157
  249    HG   LEU  31           HG       LEU  31   4.557   0.457   6.494
  250   1HD1  LEU  31          1HD1      LEU  31   4.396   3.118   7.536
  251   2HD1  LEU  31          2HD1      LEU  31   3.615   3.073   5.938
  252   3HD1  LEU  31          3HD1      LEU  31   3.090   1.952   7.217
  253   1HD2  LEU  31          1HD2      LEU  31   6.112   2.179   4.630
  254   2HD2  LEU  31          2HD2      LEU  31   5.418   0.556   4.397
  255   3HD2  LEU  31          3HD2      LEU  31   4.370   1.992   4.315
  256    H    LYS  32           H        LYS  32   8.772   0.209   8.715
  257    HA   LYS  32           HA       LYS  32  10.483   2.395   8.844
  258   1HB   LYS  32          1HB       LYS  32  10.038  -0.101  10.266
  259   2HB   LYS  32          2HB       LYS  32  11.749   0.260  10.156
  260   1HG   LYS  32          1HG       LYS  32  11.179   2.648  10.933
  261   2HG   LYS  32          2HG       LYS  32   9.559   2.070  11.266
  262   1HD   LYS  32          1HD       LYS  32  10.420   1.596  13.339
  263   2HD   LYS  32          2HD       LYS  32  10.993   0.136  12.558
  264   1HE   LYS  32          1HE       LYS  32  13.191   1.112  12.159
  265   2HE   LYS  32          2HE       LYS  32  12.639   2.704  12.640
  266   1HZ   LYS  32          1HZ       LYS  32  12.737   2.155  14.798
  267   2HZ   LYS  32          2HZ       LYS  32  12.296   0.598  14.578
  268   3HZ   LYS  32          3HZ       LYS  32  13.834   1.060  14.284
  269    H    LEU  33           H        LEU  33  10.511  -0.450   6.817
  270    HA   LEU  33           HA       LEU  33  13.330  -0.367   6.324
  271   1HB   LEU  33          1HB       LEU  33  10.996  -1.965   5.434
  272   2HB   LEU  33          2HB       LEU  33  12.343  -1.859   4.318
  273    HG   LEU  33           HG       LEU  33  12.434  -2.894   7.164
  274   1HD1  LEU  33          1HD1      LEU  33  11.961  -4.883   6.310
  275   2HD1  LEU  33          2HD1      LEU  33  11.777  -4.150   4.698
  276   3HD1  LEU  33          3HD1      LEU  33  13.363  -4.766   5.219
  277   1HD2  LEU  33          1HD2      LEU  33  14.811  -3.578   6.436
  278   2HD2  LEU  33          2HD2      LEU  33  14.636  -2.318   5.192
  279   3HD2  LEU  33          3HD2      LEU  33  14.521  -1.889   6.915
  280    H    PHE  34           H        PHE  34  10.355   1.024   4.943
  281    HA   PHE  34           HA       PHE  34  11.700   1.917   2.576
  282   1HB   PHE  34          1HB       PHE  34   8.994   2.034   3.914
  283   2HB   PHE  34          2HB       PHE  34   9.333   3.342   2.799
  284    HD1  PHE  34           1HD      PHE  34   9.040  -0.331   3.076
  285    HD2  PHE  34           2HD      PHE  34   9.265   2.998   0.454
  286    HE1  PHE  34           1HE      PHE  34   8.386  -1.803   1.151
  287    HE2  PHE  34           2HE      PHE  34   8.611   1.526  -1.471
  288    HZ   PHE  34           HZ       PHE  34   8.180  -0.857  -1.100
  289    H    GLU  35           H        GLU  35  11.513   2.967   5.852
  290    HA   GLU  35           HA       GLU  35  11.697   5.748   5.190
  291   1HB   GLU  35          1HB       GLU  35  12.042   4.371   7.889
  292   2HB   GLU  35          2HB       GLU  35  11.808   6.088   7.629
  293   1HG   GLU  35          1HG       GLU  35   9.684   4.745   6.242
  294   2HG   GLU  35          2HG       GLU  35   9.807   3.996   7.821
  295    H    ASP  36           H        ASP  36  13.796   3.295   6.873
  296    HA   ASP  36           HA       ASP  36  16.055   4.942   6.043
  297   1HB   ASP  36          1HB       ASP  36  15.320   3.909   8.605
  298   2HB   ASP  36          2HB       ASP  36  16.704   2.967   8.089
  299    H    GLY  37           H        GLY  37  14.536   1.716   6.279
  300   1HA   GLY  37          1HA       GLY  37  16.588   0.002   5.670
  301   2HA   GLY  37          2HA       GLY  37  14.921  -0.205   5.173
  302    H    GLU  38           H        GLU  38  16.388  -1.289   3.352
  303    HA   GLU  38           HA       GLU  38  17.624   0.473   1.555
  304   1HB   GLU  38          1HB       GLU  38  17.033  -2.418   1.734
  305   2HB   GLU  38          2HB       GLU  38  17.014  -1.817   0.088
  306   1HG   GLU  38          1HG       GLU  38  19.287  -0.940   1.863
  307   2HG   GLU  38          2HG       GLU  38  19.295  -2.599   1.298
  308    H    MET  39           H        MET  39  14.313  -0.684   2.030
  309    HA   MET  39           HA       MET  39  13.316  -0.296  -0.494
  310   1HB   MET  39          1HB       MET  39  12.220  -0.191   2.329
  311   2HB   MET  39          2HB       MET  39  11.171   0.358   1.037
  312   1HG   MET  39          1HG       MET  39  10.728  -2.004   1.353
  313   2HG   MET  39          2HG       MET  39  11.592  -1.846  -0.164
  314   1HE   MET  39          1HE       MET  39  13.608  -2.282  -0.700
  315   2HE   MET  39          2HE       MET  39  15.008  -2.345   0.399
  316   3HE   MET  39          3HE       MET  39  14.261  -3.854  -0.179
  317    H    ALA  40           H        ALA  40  14.599   2.029   1.718
  318    HA   ALA  40           HA       ALA  40  12.969   4.224   0.884
  319   1HB   ALA  40          1HB       ALA  40  15.694   4.401   2.190
  320   2HB   ALA  40          2HB       ALA  40  14.294   5.485   2.372
  321   3HB   ALA  40          3HB       ALA  40  14.267   3.864   3.106
  322    H    LYS  41           H        LYS  41  15.187   2.338  -0.745
  323    HA   LYS  41           HA       LYS  41  16.787   4.318  -1.967
  324   1HB   LYS  41          1HB       LYS  41  17.526   2.555  -3.404
  325   2HB   LYS  41          2HB       LYS  41  17.358   1.900  -1.788
  326   1HG   LYS  41          1HG       LYS  41  15.133   0.953  -2.381
  327   2HG   LYS  41          2HG       LYS  41  15.249   1.649  -3.985
  328   1HD   LYS  41          1HD       LYS  41  15.991  -0.546  -4.370
  329   2HD   LYS  41          2HD       LYS  41  17.508   0.306  -4.160
  330   1HE   LYS  41          1HE       LYS  41  17.676  -0.427  -1.826
  331   2HE   LYS  41          2HE       LYS  41  16.061  -1.107  -1.872
  332   1HZ   LYS  41          1HZ       LYS  41  17.556  -2.852  -2.212
  333   2HZ   LYS  41          2HZ       LYS  41  16.909  -2.565  -3.684
  334   3HZ   LYS  41          3HZ       LYS  41  18.419  -2.046  -3.340
  335    H    TYR  42           H        TYR  42  13.564   2.921  -2.612
  336    HA   TYR  42           HA       TYR  42  13.384   4.663  -4.974
  337   1HB   TYR  42          1HB       TYR  42  11.793   2.211  -3.989
  338   2HB   TYR  42          2HB       TYR  42  11.474   3.041  -5.499
  339    HD1  TYR  42           1HD      TYR  42  12.166   0.067  -5.076
  340    HD2  TYR  42           2HD      TYR  42  14.553   3.472  -6.083
  341    HE1  TYR  42           1HE      TYR  42  13.833  -1.443  -6.262
  342    HE2  TYR  42           2HE      TYR  42  16.212   1.951  -7.265
  343    HH   TYR  42           HH       TYR  42  16.149  -0.269  -8.363
  344    H    VAL  43           H        VAL  43  13.180   5.862  -2.404
  345    HA   VAL  43           HA       VAL  43  10.295   6.422  -2.342
  346    HB   VAL  43           HB       VAL  43  12.266   6.243  -0.057
  347   1HG1  VAL  43          1HG1      VAL  43   9.572   6.597   0.841
  348   2HG1  VAL  43          2HG1      VAL  43  10.989   7.635   1.125
  349   3HG1  VAL  43          3HG1      VAL  43   9.961   7.905  -0.302
  350   1HG2  VAL  43          1HG2      VAL  43   9.704   4.687  -0.523
  351   2HG2  VAL  43          2HG2      VAL  43  11.325   4.094  -0.957
  352   3HG2  VAL  43          3HG2      VAL  43  10.924   4.421   0.746
  353    H    GLN  44           H        GLN  44   9.694   8.606  -2.238
  354    HA   GLN  44           HA       GLN  44  11.950  10.425  -2.569
  355   1HB   GLN  44          1HB       GLN  44   9.209  10.338  -3.850
  356   2HB   GLN  44          2HB       GLN  44  10.061  11.865  -3.729
  357   1HG   GLN  44          1HG       GLN  44  12.096  10.406  -4.720
  358   2HG   GLN  44          2HG       GLN  44  10.787   9.404  -5.315
  359   1HE2  GLN  44          1HE2      GLN  44   9.197  10.301  -6.688
  360   2HE2  GLN  44          2HE2      GLN  44   9.516  11.693  -7.668
  361    H    GLY  45           H        GLY  45  12.088  10.690  -0.218
  362   1HA   GLY  45          1HA       GLY  45  11.753  12.123   1.522
  363   2HA   GLY  45          2HA       GLY  45  10.344  12.791   0.722
  364    H    ASP  46           H        ASP  46   8.263  11.970   1.155
  365    HA   ASP  46           HA       ASP  46   8.238   9.816   3.120
  366   1HB   ASP  46          1HB       ASP  46   6.606  12.375   2.945
  367   2HB   ASP  46          2HB       ASP  46   6.005  10.995   3.841
  368    H    ALA  47           H        ALA  47   7.625  10.628  -0.033
  369    HA   ALA  47           HA       ALA  47   5.061   9.207  -0.160
  370   1HB   ALA  47          1HB       ALA  47   5.716  11.615  -1.217
  371   2HB   ALA  47          2HB       ALA  47   6.217  10.556  -2.556
  372   3HB   ALA  47          3HB       ALA  47   4.538  10.511  -1.967
  373    H    ILE  48           H        ILE  48   4.832   7.373  -1.517
  374    HA   ILE  48           HA       ILE  48   7.410   6.213  -2.312
  375    HB   ILE  48           HB       ILE  48   6.405   4.050  -1.974
  376   1HG1  ILE  48          1HG1      ILE  48   3.913   5.318  -0.854
  377   2HG1  ILE  48          2HG1      ILE  48   4.040   4.967  -2.566
  378   1HG2  ILE  48          1HG2      ILE  48   5.828   4.362   0.560
  379   2HG2  ILE  48          2HG2      ILE  48   7.472   4.691  -0.038
  380   3HG2  ILE  48          3HG2      ILE  48   6.351   6.039   0.269
  381   1HD1  ILE  48          1HD1      ILE  48   3.130   3.156  -0.768
  382   2HD1  ILE  48          2HD1      ILE  48   3.988   2.679  -2.253
  383   3HD1  ILE  48          3HD1      ILE  48   4.866   2.766  -0.707
  384    H    GLY  49           H        GLY  49   7.363   4.832  -4.288
  385   1HA   GLY  49          1HA       GLY  49   5.696   6.127  -6.320
  386   2HA   GLY  49          2HA       GLY  49   7.148   5.182  -6.581
  387    H    TYR  50           H        TYR  50   4.609   4.820  -7.966
  388    HA   TYR  50           HA       TYR  50   3.059   2.775  -6.893
  389   1HB   TYR  50          1HB       TYR  50   2.286   4.000  -8.828
  390   2HB   TYR  50          2HB       TYR  50   3.839   3.878  -9.630
  391    HD1  TYR  50           1HD      TYR  50   3.156   3.002 -11.728
  392    HD2  TYR  50           2HD      TYR  50   1.949   1.046  -8.119
  393    HE1  TYR  50           1HE      TYR  50   2.299   1.026 -13.077
  394    HE2  TYR  50           2HE      TYR  50   1.096  -0.924  -9.481
  395    HH   TYR  50           HH       TYR  50   0.607  -1.642 -11.491
  396    H    GLU  51           H        GLU  51   6.137   2.717  -8.737
  397    HA   GLU  51           HA       GLU  51   6.023  -0.064  -9.174
  398   1HB   GLU  51          1HB       GLU  51   7.396   1.832 -10.397
  399   2HB   GLU  51          2HB       GLU  51   8.595   1.534  -9.155
  400   1HG   GLU  51          1HG       GLU  51   7.436  -0.581 -11.033
  401   2HG   GLU  51          2HG       GLU  51   9.015   0.162 -11.196
  402    H    GLY  52           H        GLY  52   7.760   2.079  -6.824
  403   1HA   GLY  52          1HA       GLY  52   9.241   0.166  -5.489
  404   2HA   GLY  52          2HA       GLY  52   8.628   1.654  -4.795
  405    H    PHE  53           H        PHE  53   5.780   1.119  -5.103
  406    HA   PHE  53           HA       PHE  53   5.275  -0.183  -2.730
  407   1HB   PHE  53          1HB       PHE  53   3.767   1.387  -4.031
  408   2HB   PHE  53          2HB       PHE  53   3.576   0.165  -5.273
  409    HD1  PHE  53           1HD      PHE  53   2.198   1.524  -2.332
  410    HD2  PHE  53           2HD      PHE  53   2.592  -2.126  -4.460
  411    HE1  PHE  53           1HE      PHE  53   0.206   0.601  -1.117
  412    HE2  PHE  53           2HE      PHE  53   0.600  -3.050  -3.244
  413    HZ   PHE  53           HZ       PHE  53  -0.570  -1.675  -1.587
  414    H    GLN  54           H        GLN  54   5.803  -1.478  -5.978
  415    HA   GLN  54           HA       GLN  54   4.470  -3.893  -5.605
  416   1HB   GLN  54          1HB       GLN  54   6.920  -3.511  -7.362
  417   2HB   GLN  54          2HB       GLN  54   5.577  -4.608  -7.616
  418   1HG   GLN  54          1HG       GLN  54   4.571  -1.885  -7.374
  419   2HG   GLN  54          2HG       GLN  54   5.846  -1.929  -8.575
  420   1HE2  GLN  54          1HE2      GLN  54   4.434  -1.573 -10.257
  421   2HE2  GLN  54          2HE2      GLN  54   3.344  -2.774 -10.865
  422    H    GLN  55           H        GLN  55   7.664  -2.689  -4.627
  423    HA   GLN  55           HA       GLN  55   8.705  -5.264  -4.094
  424   1HB   GLN  55          1HB       GLN  55   9.650  -2.537  -4.112
  425   2HB   GLN  55          2HB       GLN  55  10.075  -3.250  -2.568
  426   1HG   GLN  55          1HG       GLN  55  10.803  -5.324  -4.128
  427   2HG   GLN  55          2HG       GLN  55  10.938  -4.065  -5.340
  428   1HE2  GLN  55          1HE2      GLN  55  11.632  -4.389  -1.856
  429   2HE2  GLN  55          2HE2      GLN  55  13.250  -3.772  -1.897
  430    H    PHE  56           H        PHE  56   6.894  -2.774  -2.291
  431    HA   PHE  56           HA       PHE  56   7.398  -3.609   0.286
  432   1HB   PHE  56          1HB       PHE  56   6.155  -1.550  -0.375
  433   2HB   PHE  56          2HB       PHE  56   4.907  -2.511  -1.143
  434    HD1  PHE  56           1HD      PHE  56   3.184  -3.591   0.167
  435    HD2  PHE  56           2HD      PHE  56   6.269  -1.379   2.065
  436    HE1  PHE  56           1HE      PHE  56   1.869  -3.590   2.304
  437    HE2  PHE  56           2HE      PHE  56   4.953  -1.378   4.202
  438    HZ   PHE  56           HZ       PHE  56   2.769  -2.484   4.296
  439    H    LEU  57           H        LEU  57   4.967  -4.794  -2.111
  440    HA   LEU  57           HA       LEU  57   3.612  -6.486  -0.360
  441   1HB   LEU  57          1HB       LEU  57   3.983  -6.439  -3.345
  442   2HB   LEU  57          2HB       LEU  57   3.034  -7.682  -2.555
  443    HG   LEU  57           HG       LEU  57   2.230  -5.039  -1.652
  444   1HD1  LEU  57          1HD1      LEU  57   2.547  -3.912  -3.570
  445   2HD1  LEU  57          2HD1      LEU  57   2.705  -5.393  -4.544
  446   3HD1  LEU  57          3HD1      LEU  57   1.091  -4.784  -4.106
  447   1HD2  LEU  57          1HD2      LEU  57   1.105  -7.529  -1.926
  448   2HD2  LEU  57          2HD2      LEU  57   0.224  -6.023  -1.575
  449   3HD2  LEU  57          3HD2      LEU  57   0.341  -6.616  -3.249
  450    H    LYS  58           H        LYS  58   6.797  -6.666  -1.785
  451    HA   LYS  58           HA       LYS  58   7.035  -9.488  -1.710
  452   1HB   LYS  58          1HB       LYS  58   8.393  -7.758  -3.058
  453   2HB   LYS  58          2HB       LYS  58   9.316  -7.515  -1.589
  454   1HG   LYS  58          1HG       LYS  58  10.581  -9.242  -2.435
  455   2HG   LYS  58          2HG       LYS  58   9.365 -10.229  -1.648
  456   1HD   LYS  58          1HD       LYS  58   9.219 -11.169  -3.752
  457   2HD   LYS  58          2HD       LYS  58   8.079  -9.861  -3.995
  458   1HE   LYS  58          1HE       LYS  58   9.397  -8.941  -5.598
  459   2HE   LYS  58          2HE       LYS  58  10.751  -8.850  -4.490
  460   1HZ   LYS  58          1HZ       LYS  58  11.625 -10.373  -5.820
  461   2HZ   LYS  58          2HZ       LYS  58  10.652 -11.456  -5.081
  462   3HZ   LYS  58          3HZ       LYS  58  10.200 -10.789  -6.502
  463    H    ILE  59           H        ILE  59   8.370  -6.867   0.430
  464    HA   ILE  59           HA       ILE  59   9.123  -8.768   2.406
  465    HB   ILE  59           HB       ILE  59   8.868  -5.774   2.671
  466   1HG1  ILE  59          1HG1      ILE  59  11.554  -6.552   2.150
  467   2HG1  ILE  59          2HG1      ILE  59  10.560  -7.285   0.906
  468   1HG2  ILE  59          1HG2      ILE  59   9.361  -6.358   4.792
  469   2HG2  ILE  59          2HG2      ILE  59  10.015  -7.946   4.324
  470   3HG2  ILE  59          3HG2      ILE  59  11.015  -6.484   4.147
  471   1HD1  ILE  59          1HD1      ILE  59   9.982  -4.419   1.622
  472   2HD1  ILE  59          2HD1      ILE  59  11.454  -4.765   0.683
  473   3HD1  ILE  59          3HD1      ILE  59   9.861  -5.241   0.048
  474    H    TYR  60           H        TYR  60   6.445  -6.362   2.035
  475    HA   TYR  60           HA       TYR  60   5.210  -6.515   4.403
  476   1HB   TYR  60          1HB       TYR  60   4.405  -5.249   2.420
  477   2HB   TYR  60          2HB       TYR  60   4.158  -6.733   1.520
  478    HD1  TYR  60           1HD      TYR  60   3.146  -6.404   5.058
  479    HD2  TYR  60           2HD      TYR  60   1.846  -6.257   0.984
  480    HE1  TYR  60           1HE      TYR  60   0.721  -6.467   5.821
  481    HE2  TYR  60           2HE      TYR  60  -0.574  -6.320   1.761
  482    HH   TYR  60           HH       TYR  60  -1.709  -5.514   4.178
  483    H    LEU  61           H        LEU  61   4.068  -8.665   1.711
  484    HA   LEU  61           HA       LEU  61   3.011 -10.487   3.663
  485   1HB   LEU  61          1HB       LEU  61   3.107 -10.867   0.679
  486   2HB   LEU  61          2HB       LEU  61   2.001 -11.586   1.833
  487    HG   LEU  61           HG       LEU  61   1.763  -8.727   1.994
  488   1HD1  LEU  61          1HD1      LEU  61   2.534  -9.505  -0.586
  489   2HD1  LEU  61          2HD1      LEU  61   0.771  -9.271  -0.666
  490   3HD1  LEU  61          3HD1      LEU  61   1.818  -7.954  -0.086
  491   1HD2  LEU  61          1HD2      LEU  61   0.110 -10.574   2.575
  492   2HD2  LEU  61          2HD2      LEU  61  -0.536  -9.152   1.721
  493   3HD2  LEU  61          3HD2      LEU  61  -0.239 -10.665   0.832
  494    H    GLU  62           H        GLU  62   6.082  -9.891   2.482
  495    HA   GLU  62           HA       GLU  62   7.949 -10.997   2.555
  496   1HB   GLU  62          1HB       GLU  62   6.535 -12.078   4.658
  497   2HB   GLU  62          2HB       GLU  62   6.918 -13.523   3.744
  498   1HG   GLU  62          1HG       GLU  62   9.259 -11.786   3.862
  499   2HG   GLU  62          2HG       GLU  62   8.645 -12.061   5.480
  500    H    VAL  63           H        VAL  63   5.540 -11.622   0.560
  501    HA   VAL  63           HA       VAL  63   5.985 -14.208  -0.413
  502    HB   VAL  63           HB       VAL  63   4.938 -13.188  -2.509
  503   1HG1  VAL  63          1HG1      VAL  63   2.772 -12.625  -0.962
  504   2HG1  VAL  63          2HG1      VAL  63   3.316 -14.272  -1.364
  505   3HG1  VAL  63          3HG1      VAL  63   3.775 -13.538   0.192
  506   1HG2  VAL  63          1HG2      VAL  63   5.618 -10.783  -1.166
  507   2HG2  VAL  63          2HG2      VAL  63   4.735 -10.976  -2.699
  508   3HG2  VAL  63          3HG2      VAL  63   3.841 -10.896  -1.162
  509    H    ASP  64           H        ASP  64   6.970 -14.761  -2.569
  510    HA   ASP  64           HA       ASP  64   9.485 -13.330  -2.763
  511   1HB   ASP  64          1HB       ASP  64   9.464 -15.832  -2.399
  512   2HB   ASP  64          2HB       ASP  64   8.647 -16.024  -3.937
  513    H    ASN  65           H        ASN  65   6.399 -13.574  -4.199
  514    HA   ASN  65           HA       ASN  65   7.235 -12.071  -6.435
  515   1HB   ASN  65          1HB       ASN  65   5.778 -14.052  -7.804
  516   2HB   ASN  65          2HB       ASN  65   7.509 -13.800  -7.912
  517   1HD2  ASN  65          1HD2      ASN  65   8.912 -14.944  -6.482
  518   2HD2  ASN  65          2HD2      ASN  65   8.470 -16.491  -5.840
  519    H    VAL  66           H        VAL  66   5.577 -10.545  -6.367
  520    HA   VAL  66           HA       VAL  66   2.927 -11.467  -5.547
  521    HB   VAL  66           HB       VAL  66   4.516  -9.302  -4.815
  522   1HG1  VAL  66          1HG1      VAL  66   3.387  -7.309  -5.519
  523   2HG1  VAL  66          2HG1      VAL  66   3.810  -8.228  -6.983
  524   3HG1  VAL  66          3HG1      VAL  66   2.138  -8.246  -6.374
  525   1HG2  VAL  66          1HG2      VAL  66   3.099  -9.700  -3.128
  526   2HG2  VAL  66          2HG2      VAL  66   1.943  -8.651  -3.983
  527   3HG2  VAL  66          3HG2      VAL  66   1.883 -10.414  -4.214
  528    HA   PRO  67           HA       PRO  67   1.461 -10.957  -9.582
  529   1HB   PRO  67          1HB       PRO  67  -1.221 -10.697  -9.126
  530   2HB   PRO  67          2HB       PRO  67  -0.397 -12.244  -9.143
  531   1HG   PRO  67          1HG       PRO  67  -1.388 -10.696  -6.827
  532   2HG   PRO  67          2HG       PRO  67  -0.960 -12.393  -6.911
  533   1HD   PRO  67          1HD       PRO  67   0.604 -10.283  -5.758
  534   2HD   PRO  67          2HD       PRO  67   1.081 -11.959  -5.946
  535    H    ARG  68           H        ARG  68   1.157  -9.467 -11.185
  536    HA   ARG  68           HA       ARG  68   1.425  -6.829 -10.281
  537   1HB   ARG  68          1HB       ARG  68   2.345  -7.766 -12.457
  538   2HB   ARG  68          2HB       ARG  68   0.710  -7.826 -13.085
  539   1HG   ARG  68          1HG       ARG  68   1.596  -5.760 -13.892
  540   2HG   ARG  68          2HG       ARG  68   0.544  -5.307 -12.566
  541   1HD   ARG  68          1HD       ARG  68   2.566  -4.060 -12.225
  542   2HD   ARG  68          2HD       ARG  68   2.617  -5.352 -11.043
  543    HE   ARG  68           HE       ARG  68   4.291  -5.129 -13.480
  544   1HH1  ARG  68          2HH2      ARG  68   3.307  -7.071 -10.714
  545   2HH1  ARG  68          1HH2      ARG  68   4.685  -8.117 -10.797
  546   1HH2  ARG  68          2HH1      ARG  68   6.109  -6.510 -13.589
  547   2HH2  ARG  68          1HH1      ARG  68   6.290  -7.796 -12.443
  548    H    HIS  69           H        HIS  69  -1.284  -8.907 -11.240
  549    HA   HIS  69           HA       HIS  69  -3.139  -6.990 -11.942
  550   1HB   HIS  69          1HB       HIS  69  -3.202  -9.794 -10.956
  551   2HB   HIS  69          2HB       HIS  69  -4.693  -8.886 -10.801
  552    HD1  HIS  69           1HD      HIS  69  -2.096  -9.244 -13.621
  553    HD2  HIS  69           2HD      HIS  69  -6.242  -9.341 -12.987
  554    HE1  HIS  69           1HE      HIS  69  -3.159  -9.677 -15.901
  555    H    LEU  70           H        LEU  70  -2.351  -8.394  -8.695
  556    HA   LEU  70           HA       LEU  70  -4.246  -6.744  -7.371
  557   1HB   LEU  70          1HB       LEU  70  -3.860  -8.660  -6.215
  558   2HB   LEU  70          2HB       LEU  70  -2.158  -8.717  -6.628
  559    HG   LEU  70           HG       LEU  70  -1.954  -6.650  -5.038
  560   1HD1  LEU  70          1HD1      LEU  70  -4.565  -7.861  -4.092
  561   2HD1  LEU  70          2HD1      LEU  70  -3.580  -6.695  -3.177
  562   3HD1  LEU  70          3HD1      LEU  70  -4.313  -6.218  -4.727
  563   1HD2  LEU  70          1HD2      LEU  70  -2.466  -8.970  -3.331
  564   2HD2  LEU  70          2HD2      LEU  70  -1.490  -9.354  -4.769
  565   3HD2  LEU  70          3HD2      LEU  70  -0.957  -8.081  -3.645
  566    H    SER  71           H        SER  71  -0.669  -6.644  -7.889
  567    HA   SER  71           HA       SER  71  -0.184  -4.450  -6.324
  568   1HB   SER  71          1HB       SER  71   1.268  -6.092  -8.079
  569   2HB   SER  71          2HB       SER  71   1.428  -4.498  -8.788
  570    HG   SER  71           HG       SER  71   3.107  -4.930  -7.222
  571    H    LEU  72           H        LEU  72  -1.570  -4.741  -9.590
  572    HA   LEU  72           HA       LEU  72  -1.216  -2.023 -10.301
  573   1HB   LEU  72          1HB       LEU  72  -1.475  -3.340 -12.131
  574   2HB   LEU  72          2HB       LEU  72  -2.640  -4.399 -11.361
  575    HG   LEU  72           HG       LEU  72  -4.395  -2.702 -11.625
  576   1HD1  LEU  72          1HD1      LEU  72  -3.703  -0.794 -13.321
  577   2HD1  LEU  72          2HD1      LEU  72  -3.502  -0.600 -11.563
  578   3HD1  LEU  72          3HD1      LEU  72  -2.104  -1.036 -12.576
  579   1HD2  LEU  72          1HD2      LEU  72  -3.859  -4.424 -13.399
  580   2HD2  LEU  72          2HD2      LEU  72  -4.766  -2.993 -13.945
  581   3HD2  LEU  72          3HD2      LEU  72  -3.024  -3.127 -14.285
  582    H    ALA  73           H        ALA  73  -3.961  -3.945  -8.927
  583    HA   ALA  73           HA       ALA  73  -5.665  -1.686  -8.762
  584   1HB   ALA  73          1HB       ALA  73  -6.274  -4.179  -8.876
  585   2HB   ALA  73          2HB       ALA  73  -5.853  -4.249  -7.148
  586   3HB   ALA  73          3HB       ALA  73  -7.173  -3.190  -7.700
  587    H    LEU  74           H        LEU  74  -3.084  -3.052  -6.776
  588    HA   LEU  74           HA       LEU  74  -3.876  -1.865  -4.343
  589   1HB   LEU  74          1HB       LEU  74  -1.536  -3.289  -5.433
  590   2HB   LEU  74          2HB       LEU  74  -1.180  -2.165  -4.136
  591    HG   LEU  74           HG       LEU  74  -3.300  -4.312  -3.913
  592   1HD1  LEU  74          1HD1      LEU  74  -0.569  -4.575  -2.689
  593   2HD1  LEU  74          2HD1      LEU  74  -1.790  -5.825  -3.027
  594   3HD1  LEU  74          3HD1      LEU  74  -0.864  -5.100  -4.364
  595   1HD2  LEU  74          1HD2      LEU  74  -2.198  -3.671  -1.408
  596   2HD2  LEU  74          2HD2      LEU  74  -2.469  -2.118  -2.236
  597   3HD2  LEU  74          3HD2      LEU  74  -3.816  -3.263  -2.028
  598    H    PHE  75           H        PHE  75  -2.194  -0.725  -7.246
  599    HA   PHE  75           HA       PHE  75  -1.088   1.573  -5.993
  600   1HB   PHE  75          1HB       PHE  75  -0.098   0.691  -8.040
  601   2HB   PHE  75          2HB       PHE  75  -1.659   0.567  -8.827
  602    HD1  PHE  75           1HD      PHE  75  -1.495   1.888 -10.728
  603    HD2  PHE  75           2HD      PHE  75  -0.140   3.454  -7.025
  604    HE1  PHE  75           1HE      PHE  75  -1.126   4.123 -11.808
  605    HE2  PHE  75           2HE      PHE  75   0.228   5.690  -8.105
  606    HZ   PHE  75           HZ       PHE  75  -0.269   5.998 -10.484
  607    H    GLN  76           H        GLN  76  -3.859   1.054  -8.296
  608    HA   GLN  76           HA       GLN  76  -4.678   3.700  -8.208
  609   1HB   GLN  76          1HB       GLN  76  -6.910   2.660  -9.037
  610   2HB   GLN  76          2HB       GLN  76  -5.482   2.434 -10.027
  611   1HG   GLN  76          1HG       GLN  76  -5.258   0.167  -9.446
  612   2HG   GLN  76          2HG       GLN  76  -6.082   0.365  -7.912
  613   1HE2  GLN  76          1HE2      GLN  76  -6.338  -1.026 -10.800
  614   2HE2  GLN  76          2HE2      GLN  76  -8.052  -1.062 -11.045
  615    H    SER  77           H        SER  77  -5.044   1.052  -5.946
  616    HA   SER  77           HA       SER  77  -7.398   1.616  -4.740
  617   1HB   SER  77          1HB       SER  77  -5.994  -0.311  -4.147
  618   2HB   SER  77          2HB       SER  77  -4.761   0.742  -3.481
  619    HG   SER  77           HG       SER  77  -7.460   0.406  -2.481
  620    H    PHE  78           H        PHE  78  -4.373   3.448  -4.711
  621    HA   PHE  78           HA       PHE  78  -5.714   5.498  -3.143
  622   1HB   PHE  78          1HB       PHE  78  -3.311   3.835  -2.448
  623   2HB   PHE  78          2HB       PHE  78  -3.056   5.557  -2.249
  624    HD1  PHE  78           1HD      PHE  78  -5.430   2.847  -1.305
  625    HD2  PHE  78           2HD      PHE  78  -3.734   6.601  -0.286
  626    HE1  PHE  78           1HE      PHE  78  -6.576   2.759   0.926
  627    HE2  PHE  78           2HE      PHE  78  -4.880   6.513   1.945
  628    HZ   PHE  78           HZ       PHE  78  -6.287   4.593   2.525
  629    H    GLU  79           H        GLU  79  -4.502   7.630  -3.268
  630    HA   GLU  79           HA       GLU  79  -2.396   8.012  -4.978
  631   1HB   GLU  79          1HB       GLU  79  -4.672   7.359  -6.472
  632   2HB   GLU  79          2HB       GLU  79  -4.641   9.110  -6.544
  633   1HG   GLU  79          1HG       GLU  79  -2.209   8.993  -7.248
  634   2HG   GLU  79          2HG       GLU  79  -2.335   7.246  -7.279
  635    H    THR  80           H        THR  80  -2.178  10.442  -5.581
  636    HA   THR  80           HA       THR  80  -3.674  12.041  -3.608
  637    HB   THR  80           HB       THR  80  -1.608  13.195  -3.105
  638    HG1  THR  80           1HG      THR  80  -0.056  13.228  -4.704
  639   1HG2  THR  80          1HG2      THR  80  -0.246  11.499  -2.205
  640   2HG2  THR  80          2HG2      THR  80  -1.767  10.602  -2.428
  641   3HG2  THR  80          3HG2      THR  80  -0.457  10.444  -3.622
  642    H    GLY  81           H        GLY  81  -1.876  14.302  -4.881
  643   1HA   GLY  81          1HA       GLY  81  -3.879  15.428  -6.456
  644   2HA   GLY  81          2HA       GLY  81  -2.196  15.915  -6.411
  645    H    HIS  82           H        HIS  82  -4.632  13.928  -8.065
  646    HA   HIS  82           HA       HIS  82  -2.865  12.653  -9.832
  647   1HB   HIS  82          1HB       HIS  82  -5.133  11.855  -9.348
  648   2HB   HIS  82          2HB       HIS  82  -5.818  13.284 -10.096
  649    HD1  HIS  82           1HD      HIS  82  -7.068  11.757 -11.835
  650    HD2  HIS  82           2HD      HIS  82  -2.882  11.558 -12.016
  651    HE1  HIS  82           1HE      HIS  82  -6.503  10.593 -14.033
  652    H    CYS  83           H        CYS  83  -5.356  15.088 -10.820
  653    HA   CYS  83           HA       CYS  83  -3.533  16.946 -11.800
  654   1HB   CYS  83          1HB       CYS  83  -3.362  14.789 -13.416
  655   2HB   CYS  83          2HB       CYS  83  -4.710  15.603 -14.185
  656    HG   CYS  83           HG       CYS  83  -3.131  18.015 -13.639
  657    H    LEU  84           H        LEU  84  -4.709  18.791 -12.668
  658    HA   LEU  84           HA       LEU  84  -7.555  18.627 -12.082
  659   1HB   LEU  84          1HB       LEU  84  -5.642  20.930 -12.446
  660   2HB   LEU  84          2HB       LEU  84  -7.374  21.139 -12.284
  661    HG   LEU  84           HG       LEU  84  -5.940  21.456 -10.199
  662   1HD1  LEU  84          1HD1      LEU  84  -7.977  21.390  -9.320
  663   2HD1  LEU  84          2HD1      LEU  84  -8.531  20.231 -10.553
  664   3HD1  LEU  84          3HD1      LEU  84  -7.758  19.642  -9.062
  665   1HD2  LEU  84          1HD2      LEU  84  -4.523  19.446 -10.568
  666   2HD2  LEU  84          2HD2      LEU  84  -5.261  19.516  -8.949
  667   3HD2  LEU  84          3HD2      LEU  84  -5.932  18.427 -10.187
  668    H    ASN  85           H        ASN  85  -7.260  17.132 -14.236
  669    HA   ASN  85           HA       ASN  85  -7.914  16.856 -16.284
  670   1HB   ASN  85          1HB       ASN  85  -9.163  19.522 -15.648
  671   2HB   ASN  85          2HB       ASN  85  -9.104  19.083 -17.343
  672   1HD2  ASN  85          1HD2      ASN  85 -10.043  17.919 -14.135
  673   2HD2  ASN  85          2HD2      ASN  85 -11.369  16.922 -14.631
  674    H    GLU  86           H        GLU  86  -5.397  17.025 -16.541
  675    HA   GLU  86           HA       GLU  86  -4.899  19.004 -18.589
  676   1HB   GLU  86          1HB       GLU  86  -3.985  19.519 -16.070
  677   2HB   GLU  86          2HB       GLU  86  -2.643  18.567 -16.674
  678   1HG   GLU  86          1HG       GLU  86  -2.024  20.158 -18.237
  679   2HG   GLU  86          2HG       GLU  86  -3.676  20.653 -18.552
  680    H    THR  87           H        THR  87  -1.942  18.202 -18.450
  681    HA   THR  87           HA       THR  87  -2.164  15.394 -19.265
  682    HB   THR  87           HB       THR  87  -1.062  17.739 -20.892
  683    HG1  THR  87           1HG      THR  87  -2.759  16.952 -22.280
  684   1HG2  THR  87          1HG2      THR  87  -0.853  15.652 -22.578
  685   2HG2  THR  87          2HG2      THR  87   0.502  16.098 -21.514
  686   3HG2  THR  87          3HG2      THR  87  -0.580  14.758 -21.063
  687    H    ASN  88           H        ASN  88  -1.294  16.221 -16.762
  688    HA   ASN  88           HA       ASN  88   1.537  15.639 -17.068
  689   1HB   ASN  88          1HB       ASN  88   0.914  18.120 -16.395
  690   2HB   ASN  88          2HB       ASN  88   0.498  17.435 -14.836
  691   1HD2  ASN  88          1HD2      ASN  88   2.136  18.587 -13.831
  692   2HD2  ASN  88          2HD2      ASN  88   3.808  18.148 -13.943
  693    H    VAL  89           H        VAL  89   1.167  13.415 -16.469
  694    HA   VAL  89           HA       VAL  89   0.128  13.063 -13.742
  695    HB   VAL  89           HB       VAL  89  -0.158  11.216 -16.121
  696   1HG1  VAL  89          1HG1      VAL  89  -0.573   9.580 -14.666
  697   2HG1  VAL  89          2HG1      VAL  89  -0.255  10.690 -13.310
  698   3HG1  VAL  89          3HG1      VAL  89  -1.902  10.537 -13.968
  699   1HG2  VAL  89          1HG2      VAL  89  -2.591  12.229 -14.814
  700   2HG2  VAL  89          2HG2      VAL  89  -1.620  13.491 -15.609
  701   3HG2  VAL  89          3HG2      VAL  89  -2.188  12.086 -16.542
  702    H    THR  90           H        THR  90   2.845  13.713 -14.370
  703    HA   THR  90           HA       THR  90   4.256  11.165 -14.312
  704    HB   THR  90           HB       THR  90   5.103  12.941 -15.791
  705    HG1  THR  90           1HG      THR  90   6.996  12.130 -14.980
  706   1HG2  THR  90          1HG2      THR  90   4.790  15.113 -15.105
  707   2HG2  THR  90          2HG2      THR  90   4.581  14.624 -13.406
  708   3HG2  THR  90          3HG2      THR  90   6.216  14.849 -14.072
  709    H    LYS  91           H        LYS  91   6.212  11.132 -12.702
  710    HA   LYS  91           HA       LYS  91   6.581  10.584 -10.560
  711   1HB   LYS  91          1HB       LYS  91   6.887  12.615  -9.139
  712   2HB   LYS  91          2HB       LYS  91   7.658  12.708 -10.709
  713   1HG   LYS  91          1HG       LYS  91   5.957  14.168 -11.585
  714   2HG   LYS  91          2HG       LYS  91   4.859  13.816 -10.265
  715   1HD   LYS  91          1HD       LYS  91   7.517  14.958  -9.484
  716   2HD   LYS  91          2HD       LYS  91   6.446  16.040 -10.352
  717   1HE   LYS  91          1HE       LYS  91   4.980  16.211  -8.594
  718   2HE   LYS  91          2HE       LYS  91   5.072  14.502  -8.219
  719   1HZ   LYS  91          1HZ       LYS  91   6.969  16.593  -7.434
  720   2HZ   LYS  91          2HZ       LYS  91   6.070  15.638  -6.461
  721   3HZ   LYS  91          3HZ       LYS  91   7.320  15.003  -7.299
  722    H    ASP  92           H        ASP  92   4.581   9.223 -10.505
  723    HA   ASP  92           HA       ASP  92   2.411  10.464  -9.067
  724   1HB   ASP  92          1HB       ASP  92   1.426   8.067  -9.358
  725   2HB   ASP  92          2HB       ASP  92   1.588   9.071 -10.785
  726    H    VAL  93           H        VAL  93   3.118  10.649  -6.880
  727    HA   VAL  93           HA       VAL  93   4.145   8.188  -5.653
  728    HB   VAL  93           HB       VAL  93   5.006   9.721  -3.902
  729   1HG1  VAL  93          1HG1      VAL  93   6.059  10.619  -6.585
  730   2HG1  VAL  93          2HG1      VAL  93   6.949  10.296  -5.078
  731   3HG1  VAL  93          3HG1      VAL  93   6.273   8.945  -6.020
  732   1HG2  VAL  93          1HG2      VAL  93   4.636  11.945  -3.855
  733   2HG2  VAL  93          2HG2      VAL  93   4.792  12.113  -5.620
  734   3HG2  VAL  93          3HG2      VAL  93   3.254  11.565  -4.911
  735    H    VAL  94           H        VAL  94   3.530   8.183  -3.147
  736    HA   VAL  94           HA       VAL  94   0.847   9.192  -2.723
  737    HB   VAL  94           HB       VAL  94   0.300   7.155  -3.781
  738   1HG1  VAL  94          1HG1      VAL  94   2.534   6.111  -3.703
  739   2HG1  VAL  94          2HG1      VAL  94   2.300   5.753  -1.975
  740   3HG1  VAL  94          3HG1      VAL  94   1.255   4.983  -3.193
  741   1HG2  VAL  94          1HG2      VAL  94   0.216   6.822  -0.766
  742   2HG2  VAL  94          2HG2      VAL  94  -1.031   7.540  -1.814
  743   3HG2  VAL  94          3HG2      VAL  94  -0.680   5.797  -1.912
  744    H    CYS  95           H        CYS  95   0.251   9.173  -0.448
  745    HA   CYS  95           HA       CYS  95   2.510   9.582   1.199
  746   1HB   CYS  95          1HB       CYS  95   0.023  10.589   1.234
  747   2HB   CYS  95          2HB       CYS  95  -0.212   9.303   2.401
  748    HG   CYS  95           HG       CYS  95   0.959  10.237   4.246
  749    H    LEU  96           H        LEU  96   3.382   8.213   2.800
  750    HA   LEU  96           HA       LEU  96   2.888   5.448   2.483
  751   1HB   LEU  96          1HB       LEU  96   4.639   7.172   4.164
  752   2HB   LEU  96          2HB       LEU  96   4.369   5.523   4.691
  753    HG   LEU  96           HG       LEU  96   5.065   5.710   1.846
  754   1HD1  LEU  96          1HD1      LEU  96   6.620   7.263   3.772
  755   2HD1  LEU  96          2HD1      LEU  96   7.590   6.039   2.918
  756   3HD1  LEU  96          3HD1      LEU  96   6.671   7.250   1.992
  757   1HD2  LEU  96          1HD2      LEU  96   6.745   3.978   2.588
  758   2HD2  LEU  96          2HD2      LEU  96   6.068   4.137   4.226
  759   3HD2  LEU  96          3HD2      LEU  96   5.036   3.579   2.888
  760    H    ASN  97           H        ASN  97   2.161   7.837   5.111
  761    HA   ASN  97           HA       ASN  97   1.030   6.131   6.872
  762   1HB   ASN  97          1HB       ASN  97   1.036   8.990   6.370
  763   2HB   ASN  97          2HB       ASN  97  -0.595   8.522   6.808
  764   1HD2  ASN  97          1HD2      ASN  97   2.441   9.342   7.916
  765   2HD2  ASN  97          2HD2      ASN  97   2.322   8.841   9.570
  766    H    ASP  98           H        ASP  98  -0.404   7.767   3.981
  767    HA   ASP  98           HA       ASP  98  -3.020   7.095   4.397
  768   1HB   ASP  98          1HB       ASP  98  -1.317   7.620   1.958
  769   2HB   ASP  98          2HB       ASP  98  -2.948   7.028   1.710
  770    H    VAL  99           H        VAL  99  -0.287   5.302   2.860
  771    HA   VAL  99           HA       VAL  99  -1.922   3.123   2.018
  772    HB   VAL  99           HB       VAL  99   1.044   3.624   2.207
  773   1HG1  VAL  99          1HG1      VAL  99   1.291   1.384   2.314
  774   2HG1  VAL  99          2HG1      VAL  99  -0.392   1.071   1.825
  775   3HG1  VAL  99          3HG1      VAL  99   0.841   1.428   0.592
  776   1HG2  VAL  99          1HG2      VAL  99   0.981   4.099  -0.037
  777   2HG2  VAL  99          2HG2      VAL  99  -0.423   3.046  -0.337
  778   3HG2  VAL  99          3HG2      VAL  99  -0.651   4.638   0.426
  779    H    SER 100           H        SER 100   0.053   3.966   4.878
  780    HA   SER 100           HA       SER 100   0.042   1.380   5.945
  781   1HB   SER 100          1HB       SER 100   1.632   3.217   6.587
  782   2HB   SER 100          2HB       SER 100   0.316   4.057   7.383
  783    HG   SER 100           HG       SER 100   0.772   1.340   8.118
  784    H    CYS 101           H        CYS 101  -2.288   4.025   5.845
  785    HA   CYS 101           HA       CYS 101  -3.777   3.222   8.109
  786   1HB   CYS 101          1HB       CYS 101  -3.719   5.488   6.660
  787   2HB   CYS 101          2HB       CYS 101  -5.104   4.728   5.901
  788    HG   CYS 101           HG       CYS 101  -4.614   4.938   9.168
  789    H    TYR 102           H        TYR 102  -3.755   2.501   4.592
  790    HA   TYR 102           HA       TYR 102  -6.215   1.076   4.618
  791   1HB   TYR 102          1HB       TYR 102  -5.369   2.017   2.539
  792   2HB   TYR 102          2HB       TYR 102  -3.746   1.431   2.845
  793    HD1  TYR 102           1HD      TYR 102  -3.007  -0.378   1.596
  794    HD2  TYR 102           2HD      TYR 102  -7.201   0.042   2.331
  795    HE1  TYR 102           1HE      TYR 102  -3.474  -2.408   0.138
  796    HE2  TYR 102           2HE      TYR 102  -7.653  -1.989   0.870
  797    HH   TYR 102           HH       TYR 102  -6.170  -4.111   0.232
  798    H    PHE 103           H        PHE 103  -2.716   0.115   4.624
  799    HA   PHE 103           HA       PHE 103  -3.276  -2.642   4.660
  800   1HB   PHE 103          1HB       PHE 103  -0.955  -0.765   5.290
  801   2HB   PHE 103          2HB       PHE 103  -0.778  -2.464   5.679
  802    HD1  PHE 103           1HD      PHE 103  -2.162  -3.731   3.388
  803    HD2  PHE 103           2HD      PHE 103   0.496  -0.424   3.505
  804    HE1  PHE 103           1HE      PHE 103  -1.473  -4.201   1.021
  805    HE2  PHE 103           2HE      PHE 103   1.184  -0.894   1.137
  806    HZ   PHE 103           HZ       PHE 103   0.192  -2.777  -0.076
  807    H    SER 104           H        SER 104  -3.183  -0.133   7.145
  808    HA   SER 104           HA       SER 104  -2.638  -1.790   9.308
  809   1HB   SER 104          1HB       SER 104  -2.416   0.570   9.613
  810   2HB   SER 104          2HB       SER 104  -4.030   0.891   9.009
  811    HG   SER 104           HG       SER 104  -4.882  -0.212  10.922
  812    H    LEU 105           H        LEU 105  -5.500  -1.276   7.329
  813    HA   LEU 105           HA       LEU 105  -7.371  -2.178   9.281
  814   1HB   LEU 105          1HB       LEU 105  -7.382  -1.105   6.602
  815   2HB   LEU 105          2HB       LEU 105  -8.431  -2.506   6.700
  816    HG   LEU 105           HG       LEU 105  -9.677  -0.460   7.098
  817   1HD1  LEU 105          1HD1      LEU 105  -9.366  -2.338   9.436
  818   2HD1  LEU 105          2HD1      LEU 105 -10.562  -1.019   9.441
  819   3HD1  LEU 105          3HD1      LEU 105 -10.641  -2.287   8.194
  820   1HD2  LEU 105          1HD2      LEU 105  -7.480   0.083   9.033
  821   2HD2  LEU 105          2HD2      LEU 105  -8.367   1.186   7.954
  822   3HD2  LEU 105          3HD2      LEU 105  -9.117   0.629   9.469
  823    H    LEU 106           H        LEU 106  -5.437  -3.642   6.637
  824    HA   LEU 106           HA       LEU 106  -6.658  -6.069   6.426
  825   1HB   LEU 106          1HB       LEU 106  -3.786  -5.207   6.229
  826   2HB   LEU 106          2HB       LEU 106  -4.244  -6.881   5.988
  827    HG   LEU 106           HG       LEU 106  -3.996  -5.326   3.937
  828   1HD1  LEU 106          1HD1      LEU 106  -5.450  -6.668   2.683
  829   2HD1  LEU 106          2HD1      LEU 106  -5.001  -7.676   4.079
  830   3HD1  LEU 106          3HD1      LEU 106  -6.586  -6.868   4.039
  831   1HD2  LEU 106          1HD2      LEU 106  -6.103  -4.178   3.285
  832   2HD2  LEU 106          2HD2      LEU 106  -6.729  -4.471   4.925
  833   3HD2  LEU 106          3HD2      LEU 106  -5.293  -3.446   4.690
  834    H    GLU 107           H        GLU 107  -3.931  -5.256   8.693
  835    HA   GLU 107           HA       GLU 107  -4.377  -7.692  10.087
  836   1HB   GLU 107          1HB       GLU 107  -2.480  -7.048  11.433
  837   2HB   GLU 107          2HB       GLU 107  -2.117  -6.603   9.778
  838   1HG   GLU 107          1HG       GLU 107  -1.527  -4.623  10.848
  839   2HG   GLU 107          2HG       GLU 107  -3.204  -4.268  10.483
  840    H    GLY 108           H        GLY 108  -5.389  -4.311  10.344
  841   1HA   GLY 108          1HA       GLY 108  -5.977  -3.850  12.913
  842   2HA   GLY 108          2HA       GLY 108  -7.062  -3.434  11.602
  843    H    GLY 109           H        GLY 109  -8.043  -5.848  10.681
  844   1HA   GLY 109          1HA       GLY 109  -9.127  -7.806  11.322
  845   2HA   GLY 109          2HA       GLY 109  -8.989  -7.353  13.009
  846    H    ARG 110           H        ARG 110 -10.336  -5.767  10.017
  847    HA   ARG 110           HA       ARG 110 -12.656  -5.113  11.634
  848   1HB   ARG 110          1HB       ARG 110 -11.500  -3.187  10.576
  849   2HB   ARG 110          2HB       ARG 110 -11.647  -3.933   8.997
  850   1HG   ARG 110          1HG       ARG 110 -14.270  -3.970   9.711
  851   2HG   ARG 110          2HG       ARG 110 -13.754  -2.600  10.674
  852   1HD   ARG 110          1HD       ARG 110 -12.720  -1.594   8.573
  853   2HD   ARG 110          2HD       ARG 110 -13.417  -2.912   7.652
  854    HE   ARG 110           HE       ARG 110 -15.445  -1.634   9.271
  855   1HH1  ARG 110          2HH2      ARG 110 -13.561  -1.209   6.330
  856   2HH1  ARG 110          1HH2      ARG 110 -14.743  -0.198   5.567
  857   1HH2  ARG 110          2HH1      ARG 110 -17.005  -0.301   8.265
  858   2HH2  ARG 110          1HH1      ARG 110 -16.715   0.322   6.675
  859    HA   PRO 111           HA       PRO 111 -14.537  -8.212   9.075
  860   1HB   PRO 111          1HB       PRO 111 -16.738  -8.631  10.639
  861   2HB   PRO 111          2HB       PRO 111 -15.224  -9.482  10.868
  862   1HG   PRO 111          1HG       PRO 111 -16.374  -7.280  12.471
  863   2HG   PRO 111          2HG       PRO 111 -15.108  -8.411  12.908
  864   1HD   PRO 111          1HD       PRO 111 -14.768  -5.672  12.125
  865   2HD   PRO 111          2HD       PRO 111 -13.498  -6.835  12.449
  866    H    GLU 112           H        GLU 112 -16.320  -8.437   7.625
  867    HA   GLU 112           HA       GLU 112 -18.405  -6.658   7.653
  868   1HB   GLU 112          1HB       GLU 112 -16.264  -5.141   7.115
  869   2HB   GLU 112          2HB       GLU 112 -16.513  -5.746   5.490
  870   1HG   GLU 112          1HG       GLU 112 -18.667  -4.386   7.178
  871   2HG   GLU 112          2HG       GLU 112 -17.724  -3.584   5.938
  872    H    ASP 113           H        ASP 113 -16.048  -8.573   5.761
  873    HA   ASP 113           HA       ASP 113 -18.198 -10.009   4.604
  874   1HB   ASP 113          1HB       ASP 113 -17.616  -7.827   3.148
  875   2HB   ASP 113          2HB       ASP 113 -16.292  -8.825   2.580
  876    H    LYS 114           H        LYS 114 -17.346 -12.061   5.004
  877    HA   LYS 114           HA       LYS 114 -14.544 -12.478   5.188
  878   1HB   LYS 114          1HB       LYS 114 -15.114 -14.723   5.770
  879   2HB   LYS 114          2HB       LYS 114 -16.265 -13.659   6.553
  880   1HG   LYS 114          1HG       LYS 114 -17.278 -14.337   3.921
  881   2HG   LYS 114          2HG       LYS 114 -16.807 -15.815   4.735
  882   1HD   LYS 114          1HD       LYS 114 -18.256 -13.940   6.510
  883   2HD   LYS 114          2HD       LYS 114 -19.206 -14.431   5.122
  884   1HE   LYS 114          1HE       LYS 114 -19.678 -16.102   6.744
  885   2HE   LYS 114          2HE       LYS 114 -18.499 -16.866   5.697
  886   1HZ   LYS 114          1HZ       LYS 114 -17.147 -15.462   7.679
  887   2HZ   LYS 114          2HZ       LYS 114 -18.287 -16.379   8.405
  888   3HZ   LYS 114          3HZ       LYS 114 -17.180 -17.075   7.427
  889    H    LEU 115           H        LEU 115 -13.697 -14.609   3.933
  890    HA   LEU 115           HA       LEU 115 -13.453 -13.793   1.268
  891   1HB   LEU 115          1HB       LEU 115 -12.865 -16.602   2.041
  892   2HB   LEU 115          2HB       LEU 115 -11.939 -15.482   1.062
  893    HG   LEU 115           HG       LEU 115 -11.808 -14.279   3.526
  894   1HD1  LEU 115          1HD1      LEU 115 -12.934 -16.576   4.269
  895   2HD1  LEU 115          2HD1      LEU 115 -11.236 -17.112   4.253
  896   3HD1  LEU 115          3HD1      LEU 115 -11.725 -15.735   5.271
  897   1HD2  LEU 115          1HD2      LEU 115  -9.753 -14.313   2.656
  898   2HD2  LEU 115          2HD2      LEU 115  -9.556 -15.871   3.494
  899   3HD2  LEU 115          3HD2      LEU 115 -10.047 -15.836   1.783
  900    H    GLU 116           H        GLU 116 -13.823 -15.631  -0.552
  901    HA   GLU 116           HA       GLU 116 -16.668 -16.196  -0.339
  902   1HB   GLU 116          1HB       GLU 116 -15.166 -16.327  -2.950
  903   2HB   GLU 116          2HB       GLU 116 -16.839 -15.893  -2.658
  904   1HG   GLU 116          1HG       GLU 116 -15.775 -13.846  -1.325
  905   2HG   GLU 116          2HG       GLU 116 -14.352 -14.207  -2.283
  906    H    TRP 117           H        TRP 117 -16.323 -17.998  -2.816
  907    HA   TRP 117           HA       TRP 117 -16.408 -20.226  -3.034
  908   1HB   TRP 117          1HB       TRP 117 -14.375 -20.959  -3.581
  909   2HB   TRP 117          2HB       TRP 117 -13.883 -19.314  -3.228
  910    HD1  TRP 117           HD       TRP 117 -12.879 -18.972  -0.571
  911    HE1  TRP 117           1HE      TRP 117 -11.347 -20.536   0.902
  912    HE3  TRP 117           3HE      TRP 117 -13.853 -23.241  -3.156
  913    HZ2  TRP 117           2HZ      TRP 117 -10.729 -23.321   0.823
  914    HZ3  TRP 117           3HZ      TRP 117 -12.745 -25.339  -2.393
  915    HH2  TRP 117           HH       TRP 117 -11.229 -25.424  -0.477
  916    H    SER 118           H        SER 118 -17.380 -19.157  -0.433
  917    HA   SER 118           HA       SER 118 -16.808 -21.531   1.163
  918   1HB   SER 118          1HB       SER 118 -17.355 -18.696   2.149
  919   2HB   SER 118          2HB       SER 118 -17.230 -20.098   3.193
  920    HG   SER 118           HG       SER 118 -15.136 -19.163   1.418
  Start of MODEL    8
    1   1H    MET   1           H        MET   1  -4.843  10.849   1.063
    2    HA   MET   1           HA       MET   1  -6.019   9.856  -1.332
    3   1HB   MET   1          1HB       MET   1  -5.243   7.903   0.434
    4   2HB   MET   1          2HB       MET   1  -6.807   8.290   1.124
    5   1HG   MET   1          1HG       MET   1  -7.241   8.134  -1.689
    6   2HG   MET   1          2HG       MET   1  -6.196   6.781  -1.303
    7   1HE   MET   1          1HE       MET   1 -10.065   7.661   1.023
    8   2HE   MET   1          2HE       MET   1  -8.707   8.774   0.731
    9   3HE   MET   1          3HE       MET   1  -9.837   8.383  -0.588
   10    H    ALA   2           H        ALA   2  -7.958  10.894  -1.614
   11    HA   ALA   2           HA       ALA   2  -9.722  11.373   0.553
   12   1HB   ALA   2          1HB       ALA   2  -9.503  13.689   0.851
   13   2HB   ALA   2          2HB       ALA   2  -7.811  13.148   0.753
   14   3HB   ALA   2          3HB       ALA   2  -8.589  13.898  -0.662
   15    H    LYS   3           H        LYS   3  -9.945   9.949  -1.846
   16    HA   LYS   3           HA       LYS   3 -12.034  11.495  -3.113
   17   1HB   LYS   3          1HB       LYS   3  -9.965  12.068  -4.380
   18   2HB   LYS   3          2HB       LYS   3  -9.743  10.371  -4.751
   19   1HG   LYS   3          1HG       LYS   3 -11.227  10.497  -6.460
   20   2HG   LYS   3          2HG       LYS   3 -12.477  11.091  -5.384
   21   1HD   LYS   3          1HD       LYS   3 -10.328  13.026  -6.245
   22   2HD   LYS   3          2HD       LYS   3 -11.543  12.577  -7.425
   23   1HE   LYS   3          1HE       LYS   3 -12.610  13.271  -4.721
   24   2HE   LYS   3          2HE       LYS   3 -11.853  14.598  -5.580
   25   1HZ   LYS   3          1HZ       LYS   3 -13.951  14.670  -6.393
   26   2HZ   LYS   3          2HZ       LYS   3 -13.286  13.690  -7.518
   27   3HZ   LYS   3          3HZ       LYS   3 -14.197  13.057  -6.319
   28    H    GLU   4           H        GLU   4 -11.096   9.016  -5.177
   29    HA   GLU   4           HA       GLU   4 -13.252   7.420  -4.290
   30   1HB   GLU   4          1HB       GLU   4 -11.251   6.413  -6.302
   31   2HB   GLU   4          2HB       GLU   4 -12.997   6.266  -6.307
   32   1HG   GLU   4          1HG       GLU   4 -12.744   8.999  -6.451
   33   2HG   GLU   4          2HG       GLU   4 -11.277   8.511  -7.276
   34    H    ARG   5           H        ARG   5 -13.007   6.291  -2.387
   35    HA   ARG   5           HA       ARG   5 -10.685   5.524  -1.271
   36   1HB   ARG   5          1HB       ARG   5 -12.044   3.864   0.022
   37   2HB   ARG   5          2HB       ARG   5 -12.857   5.411  -0.104
   38   1HG   ARG   5          1HG       ARG   5 -13.502   3.619  -2.363
   39   2HG   ARG   5          2HG       ARG   5 -13.933   2.920  -0.815
   40   1HD   ARG   5          1HD       ARG   5 -14.725   5.693  -0.759
   41   2HD   ARG   5          2HD       ARG   5 -15.290   5.016  -2.273
   42    HE   ARG   5           HE       ARG   5 -16.842   3.742  -1.082
   43   1HH1  ARG   5          2HH2      ARG   5 -14.272   4.732   1.109
   44   2HH1  ARG   5          1HH2      ARG   5 -15.050   4.090   2.517
   45   1HH2  ARG   5          2HH1      ARG   5 -17.869   2.894   0.775
   46   2HH2  ARG   5          1HH1      ARG   5 -17.110   3.038   2.326
   47    H    GLY   6           H        GLY   6 -10.323   2.904  -0.770
   48   1HA   GLY   6          1HA       GLY   6  -9.424   1.849  -3.299
   49   2HA   GLY   6          2HA       GLY   6  -9.166   1.178  -1.700
   50    H    LEU   7           H        LEU   7 -11.603   1.575  -4.325
   51    HA   LEU   7           HA       LEU   7 -13.379  -0.327  -3.128
   52   1HB   LEU   7          1HB       LEU   7 -13.375   0.889  -5.893
   53   2HB   LEU   7          2HB       LEU   7 -14.686  -0.015  -5.161
   54    HG   LEU   7           HG       LEU   7 -13.615   2.622  -4.119
   55   1HD1  LEU   7          1HD1      LEU   7 -15.611   1.978  -6.190
   56   2HD1  LEU   7          2HD1      LEU   7 -16.155   3.138  -4.955
   57   3HD1  LEU   7          3HD1      LEU   7 -14.684   3.469  -5.902
   58   1HD2  LEU   7          1HD2      LEU   7 -15.789   2.595  -2.822
   59   2HD2  LEU   7          2HD2      LEU   7 -15.930   0.877  -3.263
   60   3HD2  LEU   7          3HD2      LEU   7 -14.545   1.436  -2.294
   61    H    ILE   8           H        ILE   8 -11.388  -1.861  -2.897
   62    HA   ILE   8           HA       ILE   8 -10.821  -3.252  -5.383
   63    HB   ILE   8           HB       ILE   8  -9.294  -4.571  -3.831
   64   1HG1  ILE   8          1HG1      ILE   8  -9.733  -2.249  -1.944
   65   2HG1  ILE   8          2HG1      ILE   8 -10.555  -3.785  -1.752
   66   1HG2  ILE   8          1HG2      ILE   8  -8.727  -1.607  -4.064
   67   2HG2  ILE   8          2HG2      ILE   8  -7.555  -2.945  -4.006
   68   3HG2  ILE   8          3HG2      ILE   8  -8.618  -2.755  -5.420
   69   1HD1  ILE   8          1HD1      ILE   8  -8.727  -4.516  -0.629
   70   2HD1  ILE   8          2HD1      ILE   8  -7.855  -4.494  -2.181
   71   3HD1  ILE   8          3HD1      ILE   8  -7.793  -3.077  -1.106
   72    H    SER   9           H        SER   9 -12.100  -4.878  -6.061
   73    HA   SER   9           HA       SER   9 -14.245  -5.795  -4.701
   74   1HB   SER   9          1HB       SER   9 -12.945  -6.357  -7.152
   75   2HB   SER   9          2HB       SER   9 -13.096  -7.913  -6.362
   76    HG   SER   9           HG       SER   9 -15.363  -6.162  -6.401
   77    HA   PRO  10           HA       PRO  10 -12.876  -8.980  -2.043
   78   1HB   PRO  10          1HB       PRO  10 -14.339 -11.220  -2.600
   79   2HB   PRO  10          2HB       PRO  10 -14.972  -9.864  -1.687
   80   1HG   PRO  10          1HG       PRO  10 -15.534 -10.640  -4.484
   81   2HG   PRO  10          2HG       PRO  10 -16.449  -9.575  -3.435
   82   1HD   PRO  10          1HD       PRO  10 -14.701  -8.794  -5.571
   83   2HD   PRO  10          2HD       PRO  10 -15.525  -7.730  -4.449
   84    H    SER  11           H        SER  11 -12.049  -9.151  -5.179
   85    HA   SER  11           HA       SER  11 -10.823 -11.712  -5.076
   86   1HB   SER  11          1HB       SER  11 -11.446  -9.748  -7.072
   87   2HB   SER  11          2HB       SER  11  -9.717 -10.022  -7.150
   88    HG   SER  11           HG       SER  11 -11.649 -11.575  -8.156
   89    H    ASP  12           H        ASP  12  -9.742  -8.252  -4.965
   90    HA   ASP  12           HA       ASP  12  -7.037  -8.963  -4.654
   91   1HB   ASP  12          1HB       ASP  12  -8.655  -6.543  -4.872
   92   2HB   ASP  12          2HB       ASP  12  -7.486  -6.354  -3.580
   93    H    PHE  13           H        PHE  13  -9.821  -8.188  -2.527
   94    HA   PHE  13           HA       PHE  13  -8.362  -7.816  -0.159
   95   1HB   PHE  13          1HB       PHE  13 -10.953  -7.522  -1.039
   96   2HB   PHE  13          2HB       PHE  13 -11.127  -9.059  -0.215
   97    HD1  PHE  13           1HD      PHE  13  -9.967  -9.053   2.228
   98    HD2  PHE  13           2HD      PHE  13 -11.438  -5.637   0.184
   99    HE1  PHE  13           1HE      PHE  13 -10.217  -7.850   4.417
  100    HE2  PHE  13           2HE      PHE  13 -11.688  -4.435   2.373
  101    HZ   PHE  13           HZ       PHE  13 -11.074  -5.556   4.464
  102    H    ALA  14           H        ALA  14  -9.969 -10.702  -1.639
  103    HA   ALA  14           HA       ALA  14  -9.563 -12.437   0.490
  104   1HB   ALA  14          1HB       ALA  14  -9.831 -14.196  -1.268
  105   2HB   ALA  14          2HB       ALA  14 -11.066 -12.918  -1.368
  106   3HB   ALA  14          3HB       ALA  14  -9.702 -12.930  -2.511
  107    H    GLN  15           H        GLN  15  -7.560 -11.965  -2.512
  108    HA   GLN  15           HA       GLN  15  -5.583 -13.701  -1.872
  109   1HB   GLN  15          1HB       GLN  15  -6.045 -11.952  -3.915
  110   2HB   GLN  15          2HB       GLN  15  -4.720 -11.123  -3.122
  111   1HG   GLN  15          1HG       GLN  15  -3.773 -12.627  -4.784
  112   2HG   GLN  15          2HG       GLN  15  -3.378 -13.260  -3.199
  113   1HE2  GLN  15          1HE2      GLN  15  -3.332 -15.374  -3.394
  114   2HE2  GLN  15          2HE2      GLN  15  -4.574 -16.385  -4.056
  115    H    LEU  16           H        LEU  16  -5.722 -10.153  -1.088
  116    HA   LEU  16           HA       LEU  16  -3.322 -10.074   0.308
  117   1HB   LEU  16          1HB       LEU  16  -5.165  -8.275  -0.516
  118   2HB   LEU  16          2HB       LEU  16  -5.521  -8.309   1.199
  119    HG   LEU  16           HG       LEU  16  -3.310  -7.600   1.773
  120   1HD1  LEU  16          1HD1      LEU  16  -2.659  -8.491  -0.971
  121   2HD1  LEU  16          2HD1      LEU  16  -1.828  -7.018  -0.416
  122   3HD1  LEU  16          3HD1      LEU  16  -1.685  -8.526   0.519
  123   1HD2  LEU  16          1HD2      LEU  16  -3.589  -5.746  -0.486
  124   2HD2  LEU  16          2HD2      LEU  16  -5.101  -6.031   0.410
  125   3HD2  LEU  16          3HD2      LEU  16  -3.654  -5.448   1.267
  126    H    GLN  17           H        GLN  17  -6.669 -10.891   1.346
  127    HA   GLN  17           HA       GLN  17  -6.190 -10.934   4.045
  128   1HB   GLN  17          1HB       GLN  17  -8.410 -11.175   2.736
  129   2HB   GLN  17          2HB       GLN  17  -8.035 -12.882   2.613
  130   1HG   GLN  17          1HG       GLN  17  -8.131 -13.202   4.982
  131   2HG   GLN  17          2HG       GLN  17  -7.983 -11.487   5.311
  132   1HE2  GLN  17          1HE2      GLN  17 -10.066 -13.997   3.987
  133   2HE2  GLN  17          2HE2      GLN  17 -11.585 -13.201   4.236
  134    H    LYS  18           H        LYS  18  -6.048 -13.685   1.668
  135    HA   LYS  18           HA       LYS  18  -5.178 -15.581   3.509
  136   1HB   LYS  18          1HB       LYS  18  -6.147 -15.977   1.218
  137   2HB   LYS  18          2HB       LYS  18  -4.602 -15.512   0.534
  138   1HG   LYS  18          1HG       LYS  18  -3.531 -17.439   1.261
  139   2HG   LYS  18          2HG       LYS  18  -4.499 -17.563   2.717
  140   1HD   LYS  18          1HD       LYS  18  -6.448 -17.993   0.848
  141   2HD   LYS  18          2HD       LYS  18  -5.064 -18.604  -0.036
  142   1HE   LYS  18          1HE       LYS  18  -5.480 -19.462   2.841
  143   2HE   LYS  18          2HE       LYS  18  -6.432 -20.213   1.576
  144   1HZ   LYS  18          1HZ       LYS  18  -4.369 -20.770   0.455
  145   2HZ   LYS  18          2HZ       LYS  18  -3.497 -20.101   1.662
  146   3HZ   LYS  18          3HZ       LYS  18  -4.417 -21.418   1.953
  147    H    TYR  19           H        TYR  19  -3.243 -13.689   1.078
  148    HA   TYR  19           HA       TYR  19  -0.762 -14.549   1.852
  149   1HB   TYR  19          1HB       TYR  19  -2.086 -12.142   0.611
  150   2HB   TYR  19          2HB       TYR  19  -0.468 -11.839   1.212
  151    HD1  TYR  19           1HD      TYR  19  -1.725 -15.003  -0.317
  152    HD2  TYR  19           2HD      TYR  19   0.740 -11.538  -0.795
  153    HE1  TYR  19           1HE      TYR  19  -0.746 -15.984  -2.448
  154    HE2  TYR  19           2HE      TYR  19   1.711 -12.532  -2.925
  155    HH   TYR  19           HH       TYR  19   1.233 -14.094  -4.560
  156    H    MET  20           H        MET  20  -2.549 -11.622   3.063
  157    HA   MET  20           HA       MET  20  -0.636 -10.767   4.797
  158   1HB   MET  20          1HB       MET  20  -3.693 -10.693   4.880
  159   2HB   MET  20          2HB       MET  20  -2.737  -9.865   6.094
  160   1HG   MET  20          1HG       MET  20  -2.012  -9.362   3.215
  161   2HG   MET  20          2HG       MET  20  -3.514  -8.665   3.788
  162   1HE   MET  20          1HE       MET  20  -3.053  -5.960   5.617
  163   2HE   MET  20          2HE       MET  20  -3.865  -7.541   5.718
  164   3HE   MET  20          3HE       MET  20  -2.675  -7.070   6.955
  165    H    GLU  21           H        GLU  21  -3.341 -13.104   5.412
  166    HA   GLU  21           HA       GLU  21  -3.131 -13.488   8.026
  167   1HB   GLU  21          1HB       GLU  21  -3.894 -15.147   5.720
  168   2HB   GLU  21          2HB       GLU  21  -3.323 -16.118   7.062
  169   1HG   GLU  21          1HG       GLU  21  -4.938 -14.275   8.365
  170   2HG   GLU  21          2HG       GLU  21  -5.782 -14.462   6.840
  171    H    TYR  22           H        TYR  22  -1.050 -15.144   5.548
  172    HA   TYR  22           HA       TYR  22   0.495 -16.612   7.300
  173   1HB   TYR  22          1HB       TYR  22   0.284 -16.030   4.565
  174   2HB   TYR  22          2HB       TYR  22   1.806 -15.253   4.951
  175    HD1  TYR  22           1HD      TYR  22   0.132 -18.394   4.323
  176    HD2  TYR  22           2HD      TYR  22   3.682 -16.644   5.947
  177    HE1  TYR  22           1HE      TYR  22   1.329 -20.629   4.135
  178    HE2  TYR  22           2HE      TYR  22   4.867 -18.885   5.754
  179    HH   TYR  22           HH       TYR  22   3.112 -21.781   4.873
  180    H    SER  23           H        SER  23   0.795 -13.180   6.255
  181    HA   SER  23           HA       SER  23   3.289 -12.893   7.576
  182   1HB   SER  23          1HB       SER  23   1.686 -11.390   5.726
  183   2HB   SER  23          2HB       SER  23   1.992 -10.354   7.105
  184    HG   SER  23           HG       SER  23   4.345 -11.376   6.727
  185    H    THR  24           H        THR  24   3.698 -12.025   9.638
  186    HA   THR  24           HA       THR  24   1.359 -11.118  11.164
  187    HB   THR  24           HB       THR  24   2.191 -13.643  11.478
  188    HG1  THR  24           1HG      THR  24   1.770 -11.561  13.499
  189   1HG2  THR  24          1HG2      THR  24   4.578 -12.386  12.126
  190   2HG2  THR  24          2HG2      THR  24   3.788 -12.494  13.717
  191   3HG2  THR  24          3HG2      THR  24   4.078 -13.970  12.766
  192    H    LYS  25           H        LYS  25   3.820  -9.920   9.701
  193    HA   LYS  25           HA       LYS  25   5.214  -8.779  11.976
  194   1HB   LYS  25          1HB       LYS  25   5.848  -9.352   9.243
  195   2HB   LYS  25          2HB       LYS  25   6.027  -7.627   9.492
  196   1HG   LYS  25          1HG       LYS  25   7.248  -8.422  11.750
  197   2HG   LYS  25          2HG       LYS  25   7.481  -9.902  10.842
  198   1HD   LYS  25          1HD       LYS  25   8.115  -7.363   9.382
  199   2HD   LYS  25          2HD       LYS  25   9.184  -7.765  10.711
  200   1HE   LYS  25          1HE       LYS  25   8.654 -10.158   9.130
  201   2HE   LYS  25          2HE       LYS  25   9.196  -8.867   8.076
  202   1HZ   LYS  25          1HZ       LYS  25  10.659 -10.310  10.016
  203   2HZ   LYS  25          2HZ       LYS  25  11.205  -9.378   8.792
  204   3HZ   LYS  25          3HZ       LYS  25  10.826  -8.699  10.228
  205    H    LYS  26           H        LYS  26   5.706  -6.219  11.441
  206    HA   LYS  26           HA       LYS  26   3.017  -5.058  11.337
  207   1HB   LYS  26          1HB       LYS  26   5.551  -4.048  12.662
  208   2HB   LYS  26          2HB       LYS  26   4.025  -3.188  12.625
  209   1HG   LYS  26          1HG       LYS  26   3.713  -5.980  13.538
  210   2HG   LYS  26          2HG       LYS  26   4.814  -5.070  14.552
  211   1HD   LYS  26          1HD       LYS  26   3.037  -3.226  14.668
  212   2HD   LYS  26          2HD       LYS  26   1.940  -4.321  13.852
  213   1HE   LYS  26          1HE       LYS  26   3.266  -5.635  16.126
  214   2HE   LYS  26          2HE       LYS  26   2.421  -4.185  16.631
  215   1HZ   LYS  26          1HZ       LYS  26   0.444  -5.006  15.609
  216   2HZ   LYS  26          2HZ       LYS  26   1.215  -6.311  15.001
  217   3HZ   LYS  26          3HZ       LYS  26   1.020  -6.157  16.614
  218    H    VAL  27           H        VAL  27   2.624  -3.175  10.069
  219    HA   VAL  27           HA       VAL  27   4.131  -3.135   7.662
  220    HB   VAL  27           HB       VAL  27   1.676  -2.796   7.872
  221   1HG1  VAL  27          1HG1      VAL  27   1.537  -1.415   9.837
  222   2HG1  VAL  27          2HG1      VAL  27   2.520  -0.141   9.075
  223   3HG1  VAL  27          3HG1      VAL  27   0.885  -0.490   8.463
  224   1HG2  VAL  27          1HG2      VAL  27   3.330  -1.860   6.000
  225   2HG2  VAL  27          2HG2      VAL  27   1.581  -1.532   5.966
  226   3HG2  VAL  27          3HG2      VAL  27   2.706  -0.301   6.589
  227    H    SER  28           H        SER  28   4.016  -1.215  10.669
  228    HA   SER  28           HA       SER  28   5.429   0.965   9.675
  229   1HB   SER  28          1HB       SER  28   4.115   0.969  11.793
  230   2HB   SER  28          2HB       SER  28   5.277  -0.122  12.522
  231    HG   SER  28           HG       SER  28   6.933   1.578  12.080
  232    H    ASP  29           H        ASP  29   6.382  -2.234  10.920
  233    HA   ASP  29           HA       ASP  29   9.069  -1.564  11.356
  234   1HB   ASP  29          1HB       ASP  29   7.444  -3.732  11.900
  235   2HB   ASP  29          2HB       ASP  29   8.408  -4.371  10.584
  236    H    VAL  30           H        VAL  30   7.134  -2.948   8.640
  237    HA   VAL  30           HA       VAL  30   9.392  -3.511   7.009
  238    HB   VAL  30           HB       VAL  30   6.419  -3.329   6.538
  239   1HG1  VAL  30          1HG1      VAL  30   7.302  -4.689   4.368
  240   2HG1  VAL  30          2HG1      VAL  30   6.971  -2.940   4.373
  241   3HG1  VAL  30          3HG1      VAL  30   8.637  -3.532   4.577
  242   1HG2  VAL  30          1HG2      VAL  30   6.463  -5.710   6.492
  243   2HG2  VAL  30          2HG2      VAL  30   8.242  -5.748   6.436
  244   3HG2  VAL  30          3HG2      VAL  30   7.409  -5.215   7.916
  245    H    LEU  31           H        LEU  31   7.136  -0.761   7.457
  246    HA   LEU  31           HA       LEU  31   7.995   0.648   5.171
  247   1HB   LEU  31          1HB       LEU  31   6.520   1.390   7.684
  248   2HB   LEU  31          2HB       LEU  31   6.964   2.598   6.495
  249    HG   LEU  31           HG       LEU  31   5.157   0.206   6.063
  250   1HD1  LEU  31          1HD1      LEU  31   3.680   1.630   6.976
  251   2HD1  LEU  31          2HD1      LEU  31   4.715   3.052   6.702
  252   3HD1  LEU  31          3HD1      LEU  31   3.718   2.409   5.375
  253   1HD2  LEU  31          1HD2      LEU  31   6.669   1.804   4.144
  254   2HD2  LEU  31          2HD2      LEU  31   5.777   0.279   3.924
  255   3HD2  LEU  31          3HD2      LEU  31   4.915   1.834   3.838
  256    H    LYS  32           H        LYS  32   9.328   0.125   8.382
  257    HA   LYS  32           HA       LYS  32  10.878   2.424   8.602
  258   1HB   LYS  32          1HB       LYS  32  11.571   1.465  10.505
  259   2HB   LYS  32          2HB       LYS  32  10.365   0.243  10.158
  260   1HG   LYS  32          1HG       LYS  32  12.095  -1.106   8.939
  261   2HG   LYS  32          2HG       LYS  32  13.299   0.111   9.311
  262   1HD   LYS  32          1HD       LYS  32  13.545  -0.611  11.470
  263   2HD   LYS  32          2HD       LYS  32  11.818  -0.794  11.707
  264   1HE   LYS  32          1HE       LYS  32  11.853  -3.025  11.179
  265   2HE   LYS  32          2HE       LYS  32  12.935  -2.787   9.822
  266   1HZ   LYS  32          1HZ       LYS  32  14.656  -2.375  11.658
  267   2HZ   LYS  32          2HZ       LYS  32  13.607  -3.166  12.628
  268   3HZ   LYS  32          3HZ       LYS  32  14.222  -3.911  11.312
  269    H    LEU  33           H        LEU  33  11.146  -0.406   6.531
  270    HA   LEU  33           HA       LEU  33  13.926  -0.085   6.007
  271   1HB   LEU  33          1HB       LEU  33  11.693  -1.780   5.049
  272   2HB   LEU  33          2HB       LEU  33  13.014  -1.531   3.925
  273    HG   LEU  33           HG       LEU  33  13.231  -2.681   6.721
  274   1HD1  LEU  33          1HD1      LEU  33  14.199  -4.466   4.752
  275   2HD1  LEU  33          2HD1      LEU  33  12.758  -4.633   5.783
  276   3HD1  LEU  33          3HD1      LEU  33  12.622  -3.870   4.181
  277   1HD2  LEU  33          1HD2      LEU  33  15.337  -1.930   4.701
  278   2HD2  LEU  33          2HD2      LEU  33  15.253  -1.552   6.439
  279   3HD2  LEU  33          3HD2      LEU  33  15.614  -3.212   5.906
  280    H    PHE  34           H        PHE  34  10.883   1.234   4.731
  281    HA   PHE  34           HA       PHE  34  12.148   2.293   2.387
  282   1HB   PHE  34          1HB       PHE  34   9.455   2.504   3.830
  283   2HB   PHE  34          2HB       PHE  34   9.787   3.537   2.453
  284    HD1  PHE  34           1HD      PHE  34   9.039   0.148   3.544
  285    HD2  PHE  34           2HD      PHE  34  10.044   2.570   0.208
  286    HE1  PHE  34           1HE      PHE  34   8.306  -1.684   1.992
  287    HE2  PHE  34           2HE      PHE  34   9.311   0.738  -1.344
  288    HZ   PHE  34           HZ       PHE  34   8.451  -1.367  -0.433
  289    H    GLU  35           H        GLU  35  11.966   3.177   5.715
  290    HA   GLU  35           HA       GLU  35  12.025   5.991   5.188
  291   1HB   GLU  35          1HB       GLU  35  12.447   4.467   7.797
  292   2HB   GLU  35          2HB       GLU  35  12.212   6.197   7.654
  293   1HG   GLU  35          1HG       GLU  35  10.065   4.939   6.215
  294   2HG   GLU  35          2HG       GLU  35  10.209   4.105   7.750
  295    H    ASP  36           H        ASP  36  14.259   3.550   6.709
  296    HA   ASP  36           HA       ASP  36  16.429   5.331   5.919
  297   1HB   ASP  36          1HB       ASP  36  15.790   4.113   8.439
  298   2HB   ASP  36          2HB       ASP  36  17.233   3.313   7.851
  299    H    GLY  37           H        GLY  37  15.047   2.040   6.022
  300   1HA   GLY  37          1HA       GLY  37  17.172   0.454   5.290
  301   2HA   GLY  37          2HA       GLY  37  15.500   0.180   4.842
  302    H    GLU  38           H        GLU  38  16.826  -0.759   2.895
  303    HA   GLU  38           HA       GLU  38  17.874   1.203   1.129
  304   1HB   GLU  38          1HB       GLU  38  17.665  -1.755   1.243
  305   2HB   GLU  38          2HB       GLU  38  17.569  -1.101  -0.381
  306   1HG   GLU  38          1HG       GLU  38  19.694   0.138   1.291
  307   2HG   GLU  38          2HG       GLU  38  19.925  -1.575   1.008
  308    H    MET  39           H        MET  39  14.738  -0.065   1.877
  309    HA   MET  39           HA       MET  39  13.628   0.168  -0.698
  310   1HB   MET  39          1HB       MET  39  12.243   0.329   2.035
  311   2HB   MET  39          2HB       MET  39  11.480  -0.112   0.521
  312   1HG   MET  39          1HG       MET  39  13.656  -1.691   1.974
  313   2HG   MET  39          2HG       MET  39  11.971  -2.147   1.819
  314   1HE   MET  39          1HE       MET  39  10.888  -1.817  -0.672
  315   2HE   MET  39          2HE       MET  39  12.038  -0.741  -1.502
  316   3HE   MET  39          3HE       MET  39  11.721  -2.371  -2.145
  317    H    ALA  40           H        ALA  40  14.889   2.518   1.321
  318    HA   ALA  40           HA       ALA  40  12.825   4.489   1.004
  319   1HB   ALA  40          1HB       ALA  40  14.254   5.871   2.289
  320   2HB   ALA  40          2HB       ALA  40  14.531   4.234   2.929
  321   3HB   ALA  40          3HB       ALA  40  15.708   4.963   1.811
  322    H    LYS  41           H        LYS  41  14.927   3.017  -1.131
  323    HA   LYS  41           HA       LYS  41  15.800   5.382  -2.509
  324   1HB   LYS  41          1HB       LYS  41  16.958   3.915  -3.941
  325   2HB   LYS  41          2HB       LYS  41  17.081   3.200  -2.346
  326   1HG   LYS  41          1HG       LYS  41  15.415   1.537  -2.836
  327   2HG   LYS  41          2HG       LYS  41  14.850   2.399  -4.253
  328   1HD   LYS  41          1HD       LYS  41  16.184   0.887  -5.361
  329   2HD   LYS  41          2HD       LYS  41  17.441   2.052  -4.995
  330   1HE   LYS  41          1HE       LYS  41  18.532   0.512  -3.739
  331   2HE   LYS  41          2HE       LYS  41  17.145   0.368  -2.679
  332   1HZ   LYS  41          1HZ       LYS  41  17.464  -1.080  -5.216
  333   2HZ   LYS  41          2HZ       LYS  41  17.718  -1.715  -3.733
  334   3HZ   LYS  41          3HZ       LYS  41  16.218  -1.245  -4.174
  335    H    TYR  42           H        TYR  42  12.911   3.513  -2.290
  336    HA   TYR  42           HA       TYR  42  12.042   4.514  -4.914
  337   1HB   TYR  42          1HB       TYR  42  11.225   2.234  -3.018
  338   2HB   TYR  42          2HB       TYR  42  10.209   2.693  -4.370
  339    HD1  TYR  42           1HD      TYR  42  12.272   3.220  -6.473
  340    HD2  TYR  42           2HD      TYR  42  11.971   0.081  -3.581
  341    HE1  TYR  42           1HE      TYR  42  13.607   1.681  -7.993
  342    HE2  TYR  42           2HE      TYR  42  13.308  -1.447  -5.111
  343    HH   TYR  42           HH       TYR  42  15.126  -0.925  -7.033
  344    H    VAL  43           H        VAL  43  12.218   6.052  -2.310
  345    HA   VAL  43           HA       VAL  43   9.340   6.524  -1.946
  346    HB   VAL  43           HB       VAL  43  11.707   6.696  -0.108
  347   1HG1  VAL  43          1HG1      VAL  43  10.433   7.980   1.502
  348   2HG1  VAL  43          2HG1      VAL  43  10.533   8.892  -0.023
  349   3HG1  VAL  43          3HG1      VAL  43   9.032   8.037   0.406
  350   1HG2  VAL  43          1HG2      VAL  43  10.769   4.917   0.860
  351   2HG2  VAL  43          2HG2      VAL  43   9.215   5.768   1.035
  352   3HG2  VAL  43          3HG2      VAL  43   9.580   4.883  -0.465
  353    H    GLN  44           H        GLN  44   8.524   8.566  -2.342
  354    HA   GLN  44           HA       GLN  44  10.507  10.598  -2.983
  355   1HB   GLN  44          1HB       GLN  44   8.307   9.520  -4.712
  356   2HB   GLN  44          2HB       GLN  44   8.564  11.252  -4.760
  357   1HG   GLN  44          1HG       GLN  44  11.171  10.259  -4.891
  358   2HG   GLN  44          2HG       GLN  44  10.270   9.068  -5.807
  359   1HE2  GLN  44          1HE2      GLN  44   9.161   9.647  -7.666
  360   2HE2  GLN  44          2HE2      GLN  44   9.467  11.117  -8.531
  361    H    GLY  45           H        GLY  45  10.162  12.458  -1.841
  362   1HA   GLY  45          1HA       GLY  45   9.180  13.820  -0.323
  363   2HA   GLY  45          2HA       GLY  45   7.907  13.890  -1.525
  364    H    ASP  46           H        ASP  46   9.105  11.758   1.164
  365    HA   ASP  46           HA       ASP  46   8.055  10.477   2.574
  366   1HB   ASP  46          1HB       ASP  46   6.179  12.862   2.417
  367   2HB   ASP  46          2HB       ASP  46   5.820  11.527   3.494
  368    H    ALA  47           H        ALA  47   7.382  10.207  -0.394
  369    HA   ALA  47           HA       ALA  47   4.849   8.765  -0.045
  370   1HB   ALA  47          1HB       ALA  47   5.447   9.953  -2.713
  371   2HB   ALA  47          2HB       ALA  47   3.893   9.769  -1.864
  372   3HB   ALA  47          3HB       ALA  47   4.995  11.096  -1.425
  373    H    ILE  48           H        ILE  48   4.609   7.236  -2.138
  374    HA   ILE  48           HA       ILE  48   7.235   6.187  -2.851
  375    HB   ILE  48           HB       ILE  48   6.638   4.942  -0.891
  376   1HG1  ILE  48          1HG1      ILE  48   5.989   3.065  -3.150
  377   2HG1  ILE  48          2HG1      ILE  48   7.556   3.845  -3.084
  378   1HG2  ILE  48          1HG2      ILE  48   4.560   3.526  -0.878
  379   2HG2  ILE  48          2HG2      ILE  48   4.287   5.278  -0.725
  380   3HG2  ILE  48          3HG2      ILE  48   3.993   4.464  -2.280
  381   1HD1  ILE  48          1HD1      ILE  48   6.315   2.160  -0.861
  382   2HD1  ILE  48          2HD1      ILE  48   7.640   1.662  -1.940
  383   3HD1  ILE  48          3HD1      ILE  48   7.895   2.975  -0.765
  384    H    GLY  49           H        GLY  49   7.222   4.940  -4.829
  385   1HA   GLY  49          1HA       GLY  49   4.946   5.670  -6.538
  386   2HA   GLY  49          2HA       GLY  49   6.564   5.247  -7.061
  387    H    TYR  50           H        TYR  50   5.114   3.824  -8.543
  388    HA   TYR  50           HA       TYR  50   3.736   1.636  -7.493
  389   1HB   TYR  50          1HB       TYR  50   4.157   2.841  -9.927
  390   2HB   TYR  50          2HB       TYR  50   5.316   1.537 -10.089
  391    HD1  TYR  50           1HD      TYR  50   1.715   2.294  -9.582
  392    HD2  TYR  50           2HD      TYR  50   4.613  -0.696 -10.567
  393    HE1  TYR  50           1HE      TYR  50  -0.144   0.724 -10.317
  394    HE2  TYR  50           2HE      TYR  50   2.743  -2.256 -11.298
  395    HH   TYR  50           HH       TYR  50  -0.595  -1.136 -11.419
  396    H    GLU  51           H        GLU  51   7.071   1.797  -8.945
  397    HA   GLU  51           HA       GLU  51   7.736  -0.794  -8.546
  398   1HB   GLU  51          1HB       GLU  51   9.055   1.604  -9.284
  399   2HB   GLU  51          2HB       GLU  51  10.013   0.945  -7.973
  400   1HG   GLU  51          1HG       GLU  51  10.930  -0.508  -9.451
  401   2HG   GLU  51          2HG       GLU  51   9.372  -1.302  -9.568
  402    H    GLY  52           H        GLY  52   7.657   1.892  -6.191
  403   1HA   GLY  52          1HA       GLY  52   9.051   0.469  -4.129
  404   2HA   GLY  52          2HA       GLY  52   8.172   1.978  -3.986
  405    H    PHE  53           H        PHE  53   5.682   0.780  -5.259
  406    HA   PHE  53           HA       PHE  53   4.545  -0.161  -2.828
  407   1HB   PHE  53          1HB       PHE  53   3.768   1.020  -5.300
  408   2HB   PHE  53          2HB       PHE  53   3.062  -0.582  -5.372
  409    HD1  PHE  53           1HD      PHE  53   3.453   2.049  -2.738
  410    HD2  PHE  53           2HD      PHE  53   0.857  -0.643  -4.743
  411    HE1  PHE  53           1HE      PHE  53   1.543   2.826  -1.308
  412    HE2  PHE  53           2HE      PHE  53  -1.054   0.134  -3.312
  413    HZ   PHE  53           HZ       PHE  53  -0.688   1.860  -1.612
  414    H    GLN  54           H        GLN  54   5.098  -1.621  -6.112
  415    HA   GLN  54           HA       GLN  54   4.102  -4.106  -5.414
  416   1HB   GLN  54          1HB       GLN  54   5.461  -4.884  -7.439
  417   2HB   GLN  54          2HB       GLN  54   4.322  -3.585  -7.734
  418   1HG   GLN  54          1HG       GLN  54   6.022  -2.318  -8.532
  419   2HG   GLN  54          2HG       GLN  54   6.731  -2.301  -6.930
  420   1HE2  GLN  54          1HE2      GLN  54   7.391  -2.880 -10.026
  421   2HE2  GLN  54          2HE2      GLN  54   8.641  -4.075  -9.921
  422    H    GLN  55           H        GLN  55   7.264  -2.566  -4.915
  423    HA   GLN  55           HA       GLN  55   8.599  -4.992  -4.353
  424   1HB   GLN  55          1HB       GLN  55   9.227  -2.069  -4.247
  425   2HB   GLN  55          2HB       GLN  55  10.177  -3.094  -3.190
  426   1HG   GLN  55          1HG       GLN  55   9.793  -3.666  -6.164
  427   2HG   GLN  55          2HG       GLN  55  11.143  -2.744  -5.533
  428   1HE2  GLN  55          1HE2      GLN  55  12.014  -3.916  -3.384
  429   2HE2  GLN  55          2HE2      GLN  55  12.483  -5.565  -3.627
  430    H    PHE  56           H        PHE  56   6.893  -2.467  -2.457
  431    HA   PHE  56           HA       PHE  56   7.738  -3.191   0.067
  432   1HB   PHE  56          1HB       PHE  56   6.438  -1.193  -0.177
  433   2HB   PHE  56          2HB       PHE  56   5.280  -1.968  -1.239
  434    HD1  PHE  56           1HD      PHE  56   3.532  -3.459  -0.277
  435    HD2  PHE  56           2HD      PHE  56   6.118  -1.165   2.185
  436    HE1  PHE  56           1HE      PHE  56   1.963  -3.768   1.658
  437    HE2  PHE  56           2HE      PHE  56   4.549  -1.474   4.120
  438    HZ   PHE  56           HZ       PHE  56   2.491  -2.771   3.833
  439    H    LEU  57           H        LEU  57   5.000  -4.461  -1.929
  440    HA   LEU  57           HA       LEU  57   3.869  -6.079   0.002
  441   1HB   LEU  57          1HB       LEU  57   4.007  -6.251  -3.000
  442   2HB   LEU  57          2HB       LEU  57   3.130  -7.430  -2.045
  443    HG   LEU  57           HG       LEU  57   2.266  -4.880  -1.152
  444   1HD1  LEU  57          1HD1      LEU  57   3.301  -4.439  -3.622
  445   2HD1  LEU  57          2HD1      LEU  57   1.626  -4.880  -4.035
  446   3HD1  LEU  57          3HD1      LEU  57   1.942  -3.529  -2.919
  447   1HD2  LEU  57          1HD2      LEU  57   0.222  -5.804  -1.391
  448   2HD2  LEU  57          2HD2      LEU  57   0.551  -6.385  -3.041
  449   3HD2  LEU  57          3HD2      LEU  57   1.161  -7.295  -1.638
  450    H    LYS  58           H        LYS  58   6.934  -6.328  -1.659
  451    HA   LYS  58           HA       LYS  58   7.227  -9.131  -1.426
  452   1HB   LYS  58          1HB       LYS  58   8.470  -7.435  -2.941
  453   2HB   LYS  58          2HB       LYS  58   9.495  -7.146  -1.550
  454   1HG   LYS  58          1HG       LYS  58  10.507  -9.211  -1.687
  455   2HG   LYS  58          2HG       LYS  58   9.023 -10.027  -2.140
  456   1HD   LYS  58          1HD       LYS  58   9.469  -9.848  -4.373
  457   2HD   LYS  58          2HD       LYS  58   9.941  -8.166  -4.236
  458   1HE   LYS  58          1HE       LYS  58  11.950  -9.817  -2.937
  459   2HE   LYS  58          2HE       LYS  58  11.648 -10.449  -4.543
  460   1HZ   LYS  58          1HZ       LYS  58  12.065  -7.588  -4.100
  461   2HZ   LYS  58          2HZ       LYS  58  13.323  -8.607  -4.314
  462   3HZ   LYS  58          3HZ       LYS  58  12.208  -8.428  -5.493
  463    H    ILE  59           H        ILE  59   8.652  -6.375   0.475
  464    HA   ILE  59           HA       ILE  59   9.565  -8.152   2.499
  465    HB   ILE  59           HB       ILE  59   9.314  -5.143   2.441
  466   1HG1  ILE  59          1HG1      ILE  59  11.899  -6.613   2.097
  467   2HG1  ILE  59          2HG1      ILE  59  10.807  -6.520   0.729
  468   1HG2  ILE  59          1HG2      ILE  59   9.988  -6.948   4.579
  469   2HG2  ILE  59          2HG2      ILE  59  11.405  -5.963   4.143
  470   3HG2  ILE  59          3HG2      ILE  59   9.873  -5.172   4.587
  471   1HD1  ILE  59          1HD1      ILE  59  12.630  -4.581   1.332
  472   2HD1  ILE  59          2HD1      ILE  59  11.116  -4.258   0.454
  473   3HD1  ILE  59          3HD1      ILE  59  11.211  -3.956   2.205
  474    H    TYR  60           H        TYR  60   6.809  -5.838   2.149
  475    HA   TYR  60           HA       TYR  60   5.754  -5.939   4.641
  476   1HB   TYR  60          1HB       TYR  60   4.962  -4.704   2.540
  477   2HB   TYR  60          2HB       TYR  60   4.356  -6.222   1.907
  478    HD1  TYR  60           1HD      TYR  60   2.040  -6.236   1.896
  479    HD2  TYR  60           2HD      TYR  60   4.072  -4.541   5.258
  480    HE1  TYR  60           1HE      TYR  60  -0.190  -5.817   3.042
  481    HE2  TYR  60           2HE      TYR  60   1.835  -4.128   6.393
  482    HH   TYR  60           HH       TYR  60  -0.666  -5.491   5.989
  483    H    LEU  61           H        LEU  61   4.649  -8.128   1.951
  484    HA   LEU  61           HA       LEU  61   3.559  -9.918   3.941
  485   1HB   LEU  61          1HB       LEU  61   3.547 -10.107   0.926
  486   2HB   LEU  61          2HB       LEU  61   2.615 -11.090   2.038
  487    HG   LEU  61           HG       LEU  61   1.982  -8.396   2.647
  488   1HD1  LEU  61          1HD1      LEU  61   2.943  -7.793   0.457
  489   2HD1  LEU  61          2HD1      LEU  61   1.811  -8.917  -0.333
  490   3HD1  LEU  61          3HD1      LEU  61   1.190  -7.497   0.541
  491   1HD2  LEU  61          1HD2      LEU  61  -0.127  -9.180   2.576
  492   2HD2  LEU  61          2HD2      LEU  61   0.088  -9.936   0.979
  493   3HD2  LEU  61          3HD2      LEU  61   0.679 -10.761   2.441
  494    H    GLU  62           H        GLU  62   6.609  -9.325   3.138
  495    HA   GLU  62           HA       GLU  62   8.447 -10.478   2.786
  496   1HB   GLU  62          1HB       GLU  62   8.819 -12.289   4.459
  497   2HB   GLU  62          2HB       GLU  62   8.068 -10.873   5.169
  498   1HG   GLU  62          1HG       GLU  62   5.895 -11.920   5.224
  499   2HG   GLU  62          2HG       GLU  62   6.402 -13.210   4.151
  500    H    VAL  63           H        VAL  63   6.241 -11.124   0.886
  501    HA   VAL  63           HA       VAL  63   6.374 -13.949   0.444
  502    HB   VAL  63           HB       VAL  63   5.154 -13.296  -1.666
  503   1HG1  VAL  63          1HG1      VAL  63   4.066 -13.965   0.499
  504   2HG1  VAL  63          2HG1      VAL  63   3.909 -12.236   0.890
  505   3HG1  VAL  63          3HG1      VAL  63   3.073 -12.907  -0.531
  506   1HG2  VAL  63          1HG2      VAL  63   6.127 -10.724  -0.993
  507   2HG2  VAL  63          2HG2      VAL  63   5.055 -11.174  -2.340
  508   3HG2  VAL  63          3HG2      VAL  63   4.361 -10.671  -0.780
  509    H    ASP  64           H        ASP  64   7.052 -14.763  -1.826
  510    HA   ASP  64           HA       ASP  64   9.659 -13.590  -2.325
  511   1HB   ASP  64          1HB       ASP  64   8.554 -16.305  -2.282
  512   2HB   ASP  64          2HB       ASP  64   9.368 -15.999  -3.803
  513    H    ASN  65           H        ASN  65   6.478 -13.546  -3.462
  514    HA   ASN  65           HA       ASN  65   7.175 -12.282  -5.835
  515   1HB   ASN  65          1HB       ASN  65   5.727 -14.221  -7.154
  516   2HB   ASN  65          2HB       ASN  65   7.479 -14.155  -7.150
  517   1HD2  ASN  65          1HD2      ASN  65   4.747 -15.314  -5.188
  518   2HD2  ASN  65          2HD2      ASN  65   5.460 -16.806  -4.673
  519    H    VAL  66           H        VAL  66   5.487 -10.793  -5.906
  520    HA   VAL  66           HA       VAL  66   2.897 -11.661  -4.848
  521    HB   VAL  66           HB       VAL  66   4.481  -9.495  -4.245
  522   1HG1  VAL  66          1HG1      VAL  66   2.183  -8.406  -5.892
  523   2HG1  VAL  66          2HG1      VAL  66   3.510  -7.507  -5.118
  524   3HG1  VAL  66          3HG1      VAL  66   3.842  -8.555  -6.518
  525   1HG2  VAL  66          1HG2      VAL  66   2.061 -10.627  -3.418
  526   2HG2  VAL  66          2HG2      VAL  66   2.972  -9.331  -2.604
  527   3HG2  VAL  66          3HG2      VAL  66   1.671  -8.922  -3.748
  528    HA   PRO  67           HA       PRO  67   1.234 -11.399  -8.830
  529   1HB   PRO  67          1HB       PRO  67  -1.425 -11.124  -8.260
  530   2HB   PRO  67          2HB       PRO  67  -0.591 -12.665  -8.226
  531   1HG   PRO  67          1HG       PRO  67  -1.480 -10.988  -5.960
  532   2HG   PRO  67          2HG       PRO  67  -1.044 -12.685  -5.964
  533   1HD   PRO  67          1HD       PRO  67   0.558 -10.503  -5.015
  534   2HD   PRO  67          2HD       PRO  67   1.038 -12.185  -5.127
  535    H    ARG  68           H        ARG  68   1.399  -9.894 -10.360
  536    HA   ARG  68           HA       ARG  68   1.447  -7.254  -9.618
  537   1HB   ARG  68          1HB       ARG  68   2.246  -8.553 -11.815
  538   2HB   ARG  68          2HB       ARG  68   0.683  -8.062 -12.438
  539   1HG   ARG  68          1HG       ARG  68   1.608  -5.702 -11.288
  540   2HG   ARG  68          2HG       ARG  68   3.092  -6.420 -11.882
  541   1HD   ARG  68          1HD       ARG  68   1.462  -6.849 -14.050
  542   2HD   ARG  68          2HD       ARG  68   0.738  -5.386 -13.415
  543    HE   ARG  68           HE       ARG  68   3.657  -5.237 -13.562
  544   1HH1  ARG  68          2HH2      ARG  68   0.663  -4.786 -15.355
  545   2HH1  ARG  68          1HH2      ARG  68   1.361  -3.680 -16.491
  546   1HH2  ARG  68          2HH1      ARG  68   4.578  -3.778 -15.061
  547   2HH2  ARG  68          1HH1      ARG  68   3.603  -3.103 -16.322
  548    H    HIS  69           H        HIS  69  -1.212  -9.373 -10.690
  549    HA   HIS  69           HA       HIS  69  -3.052  -7.507 -11.491
  550   1HB   HIS  69          1HB       HIS  69  -2.981 -10.254 -11.008
  551   2HB   HIS  69          2HB       HIS  69  -4.232  -9.673  -9.927
  552    HD1  HIS  69           1HD      HIS  69  -6.505  -9.425 -10.944
  553    HD2  HIS  69           2HD      HIS  69  -3.459  -9.285 -13.825
  554    HE1  HIS  69           1HE      HIS  69  -7.670  -9.309 -13.211
  555    H    LEU  70           H        LEU  70  -2.202  -8.631  -8.171
  556    HA   LEU  70           HA       LEU  70  -4.223  -7.038  -6.953
  557   1HB   LEU  70          1HB       LEU  70  -3.739  -8.808  -5.638
  558   2HB   LEU  70          2HB       LEU  70  -2.051  -8.856  -6.106
  559    HG   LEU  70           HG       LEU  70  -1.841  -6.674  -4.685
  560   1HD1  LEU  70          1HD1      LEU  70  -4.388  -7.856  -3.544
  561   2HD1  LEU  70          2HD1      LEU  70  -3.404  -6.583  -2.783
  562   3HD1  LEU  70          3HD1      LEU  70  -4.209  -6.274  -4.340
  563   1HD2  LEU  70          1HD2      LEU  70  -2.227  -9.396  -3.407
  564   2HD2  LEU  70          2HD2      LEU  70  -0.733  -8.772  -4.147
  565   3HD2  LEU  70          3HD2      LEU  70  -1.382  -8.011  -2.674
  566    H    SER  71           H        SER  71  -0.644  -6.760  -7.419
  567    HA   SER  71           HA       SER  71  -0.336  -4.419  -6.034
  568   1HB   SER  71          1HB       SER  71   1.246  -6.101  -7.672
  569   2HB   SER  71          2HB       SER  71   1.371  -4.516  -8.409
  570    HG   SER  71           HG       SER  71   2.188  -3.646  -6.489
  571    H    LEU  72           H        LEU  72  -1.840  -5.062  -9.141
  572    HA   LEU  72           HA       LEU  72  -1.536  -2.415 -10.162
  573   1HB   LEU  72          1HB       LEU  72  -1.740  -3.972 -11.824
  574   2HB   LEU  72          2HB       LEU  72  -2.937  -4.918 -10.963
  575    HG   LEU  72           HG       LEU  72  -4.670  -3.290 -11.470
  576   1HD1  LEU  72          1HD1      LEU  72  -2.890  -1.708 -13.271
  577   2HD1  LEU  72          2HD1      LEU  72  -4.371  -1.230 -12.407
  578   3HD1  LEU  72          3HD1      LEU  72  -2.834  -1.381 -11.522
  579   1HD2  LEU  72          1HD2      LEU  72  -3.709  -5.096 -13.174
  580   2HD2  LEU  72          2HD2      LEU  72  -5.046  -3.999 -13.598
  581   3HD2  LEU  72          3HD2      LEU  72  -3.389  -3.634 -14.138
  582    H    ALA  73           H        ALA  73  -4.191  -4.306  -8.582
  583    HA   ALA  73           HA       ALA  73  -5.958  -2.077  -8.589
  584   1HB   ALA  73          1HB       ALA  73  -7.099  -4.086  -8.544
  585   2HB   ALA  73          2HB       ALA  73  -5.899  -4.869  -7.488
  586   3HB   ALA  73          3HB       ALA  73  -7.070  -3.717  -6.803
  587    H    LEU  74           H        LEU  74  -3.482  -3.415  -6.400
  588    HA   LEU  74           HA       LEU  74  -4.225  -2.191  -4.050
  589   1HB   LEU  74          1HB       LEU  74  -1.803  -3.350  -5.221
  590   2HB   LEU  74          2HB       LEU  74  -1.474  -2.108  -4.028
  591    HG   LEU  74           HG       LEU  74  -3.308  -4.455  -3.494
  592   1HD1  LEU  74          1HD1      LEU  74  -0.863  -5.027  -4.111
  593   2HD1  LEU  74          2HD1      LEU  74  -0.460  -4.314  -2.531
  594   3HD1  LEU  74          3HD1      LEU  74  -1.557  -5.713  -2.622
  595   1HD2  LEU  74          1HD2      LEU  74  -3.382  -3.792  -1.302
  596   2HD2  LEU  74          2HD2      LEU  74  -1.824  -2.936  -1.386
  597   3HD2  LEU  74          3HD2      LEU  74  -3.278  -2.212  -2.114
  598    H    PHE  75           H        PHE  75  -2.151  -0.908  -6.734
  599    HA   PHE  75           HA       PHE  75  -1.879   1.618  -5.465
  600   1HB   PHE  75          1HB       PHE  75  -0.286   0.532  -7.132
  601   2HB   PHE  75          2HB       PHE  75  -1.526   0.648  -8.365
  602    HD1  PHE  75           1HD      PHE  75  -2.160   2.850  -9.282
  603    HD2  PHE  75           2HD      PHE  75   1.020   2.446  -6.502
  604    HE1  PHE  75           1HE      PHE  75  -1.321   5.131  -9.910
  605    HE2  PHE  75           2HE      PHE  75   1.859   4.726  -7.130
  606    HZ   PHE  75           HZ       PHE  75   0.679   6.042  -8.827
  607    H    GLN  76           H        GLN  76  -3.970   0.243  -8.061
  608    HA   GLN  76           HA       GLN  76  -5.063   2.670  -8.837
  609   1HB   GLN  76          1HB       GLN  76  -5.537  -0.185  -9.312
  610   2HB   GLN  76          2HB       GLN  76  -7.043   0.708  -9.266
  611   1HG   GLN  76          1HG       GLN  76  -5.449   2.400 -10.780
  612   2HG   GLN  76          2HG       GLN  76  -4.832   0.829 -11.252
  613   1HE2  GLN  76          1HE2      GLN  76  -6.314  -0.777 -12.026
  614   2HE2  GLN  76          2HE2      GLN  76  -7.766  -0.321 -12.853
  615    H    SER  77           H        SER  77  -5.581   0.635  -6.025
  616    HA   SER  77           HA       SER  77  -8.190   1.550  -5.483
  617   1HB   SER  77          1HB       SER  77  -8.000   0.326  -3.439
  618   2HB   SER  77          2HB       SER  77  -7.098  -0.596  -4.626
  619    HG   SER  77           HG       SER  77  -6.037  -0.219  -2.472
  620    H    PHE  78           H        PHE  78  -4.862   2.579  -4.661
  621    HA   PHE  78           HA       PHE  78  -5.844   4.566  -2.805
  622   1HB   PHE  78          1HB       PHE  78  -3.155   3.615  -3.922
  623   2HB   PHE  78          2HB       PHE  78  -3.232   5.067  -2.944
  624    HD1  PHE  78           1HD      PHE  78  -4.664   4.686  -0.671
  625    HD2  PHE  78           2HD      PHE  78  -2.583   1.679  -2.824
  626    HE1  PHE  78           1HE      PHE  78  -4.524   3.292   1.412
  627    HE2  PHE  78           2HE      PHE  78  -2.444   0.285  -0.742
  628    HZ   PHE  78           HZ       PHE  78  -3.416   1.108   1.351
  629    H    GLU  79           H        GLU  79  -3.258   5.030  -5.259
  630    HA   GLU  79           HA       GLU  79  -2.833   6.750  -6.538
  631   1HB   GLU  79          1HB       GLU  79  -4.705   5.348  -7.746
  632   2HB   GLU  79          2HB       GLU  79  -5.729   6.734  -7.428
  633   1HG   GLU  79          1HG       GLU  79  -3.944   8.197  -8.535
  634   2HG   GLU  79          2HG       GLU  79  -3.111   6.726  -8.998
  635    H    THR  80           H        THR  80  -2.455   8.326  -4.855
  636    HA   THR  80           HA       THR  80  -4.234   9.775  -3.444
  637    HB   THR  80           HB       THR  80  -1.980  10.234  -2.978
  638    HG1  THR  80           1HG      THR  80  -1.689  12.483  -3.867
  639   1HG2  THR  80          1HG2      THR  80  -0.692  11.264  -5.216
  640   2HG2  THR  80          2HG2      THR  80  -0.516   9.589  -4.640
  641   3HG2  THR  80          3HG2      THR  80  -1.682   9.969  -5.930
  642    H    GLY  81           H        GLY  81  -2.803  11.561  -6.196
  643   1HA   GLY  81          1HA       GLY  81  -3.814  12.677  -7.899
  644   2HA   GLY  81          2HA       GLY  81  -5.358  11.976  -7.457
  645    H    HIS  82           H        HIS  82  -4.466  14.844  -8.083
  646    HA   HIS  82           HA       HIS  82  -5.918  16.017  -5.888
  647   1HB   HIS  82          1HB       HIS  82  -3.054  16.158  -6.019
  648   2HB   HIS  82          2HB       HIS  82  -3.704  17.758  -6.322
  649    HD1  HIS  82           1HD      HIS  82  -5.106  18.885  -4.388
  650    HD2  HIS  82           2HD      HIS  82  -3.369  15.198  -3.396
  651    HE1  HIS  82           1HE      HIS  82  -5.241  18.692  -1.847
  652    H    CYS  83           H        CYS  83  -7.042  17.900  -6.511
  653    HA   CYS  83           HA       CYS  83  -7.972  19.345  -7.877
  654   1HB   CYS  83          1HB       CYS  83  -5.240  19.585  -8.480
  655   2HB   CYS  83          2HB       CYS  83  -6.030  19.490 -10.041
  656    HG   CYS  83           HG       CYS  83  -5.620  22.011  -9.120
  657    H    LEU  84           H        LEU  84  -9.555  19.108  -9.491
  658    HA   LEU  84           HA       LEU  84  -9.328  16.649 -11.072
  659   1HB   LEU  84          1HB       LEU  84 -11.658  18.149  -9.913
  660   2HB   LEU  84          2HB       LEU  84 -11.875  17.053 -11.263
  661    HG   LEU  84           HG       LEU  84 -12.386  16.026  -9.077
  662   1HD1  LEU  84          1HD1      LEU  84 -11.469  14.771 -11.128
  663   2HD1  LEU  84          2HD1      LEU  84  -9.956  14.643 -10.198
  664   3HD1  LEU  84          3HD1      LEU  84 -11.458  13.939  -9.554
  665   1HD2  LEU  84          1HD2      LEU  84  -9.461  15.969  -8.407
  666   2HD2  LEU  84          2HD2      LEU  84 -10.457  17.371  -7.948
  667   3HD2  LEU  84          3HD2      LEU  84 -10.877  15.747  -7.353
  668    H    ASN  85           H        ASN  85  -7.940  19.132 -11.762
  669    HA   ASN  85           HA       ASN  85  -8.821  19.281 -14.416
  670   1HB   ASN  85          1HB       ASN  85  -9.202  21.854 -14.323
  671   2HB   ASN  85          2HB       ASN  85 -10.508  20.843 -13.737
  672   1HD2  ASN  85          1HD2      ASN  85 -11.256  22.600 -12.513
  673   2HD2  ASN  85          2HD2      ASN  85 -10.537  23.048 -11.002
  674    H    GLU  86           H        GLU  86  -6.517  18.700 -14.597
  675    HA   GLU  86           HA       GLU  86  -4.843  20.831 -15.015
  676   1HB   GLU  86          1HB       GLU  86  -4.995  20.229 -12.249
  677   2HB   GLU  86          2HB       GLU  86  -3.473  19.543 -12.779
  678   1HG   GLU  86          1HG       GLU  86  -2.789  21.705 -13.759
  679   2HG   GLU  86          2HG       GLU  86  -4.350  22.406 -13.383
  680    H    THR  87           H        THR  87  -3.133  20.132 -16.306
  681    HA   THR  87           HA       THR  87  -2.990  17.242 -16.703
  682    HB   THR  87           HB       THR  87  -1.684  18.074 -18.779
  683    HG1  THR  87           1HG      THR  87  -1.591  20.329 -18.949
  684   1HG2  THR  87          1HG2      THR  87  -4.560  18.892 -18.201
  685   2HG2  THR  87          2HG2      THR  87  -3.791  19.310 -19.751
  686   3HG2  THR  87          3HG2      THR  87  -3.974  17.603 -19.279
  687    H    ASN  88           H        ASN  88  -1.956  17.239 -14.419
  688    HA   ASN  88           HA       ASN  88   0.858  17.055 -14.926
  689   1HB   ASN  88          1HB       ASN  88   0.356  19.425 -13.990
  690   2HB   ASN  88          2HB       ASN  88  -0.123  18.637 -12.500
  691   1HD2  ASN  88          1HD2      ASN  88   1.536  19.687 -11.397
  692   2HD2  ASN  88          2HD2      ASN  88   3.191  19.185 -11.494
  693    H    VAL  89           H        VAL  89  -0.582  14.848 -14.693
  694    HA   VAL  89           HA       VAL  89  -0.544  14.115 -11.846
  695    HB   VAL  89           HB       VAL  89  -2.207  12.922 -14.071
  696   1HG1  VAL  89          1HG1      VAL  89  -1.790  12.288 -11.198
  697   2HG1  VAL  89          2HG1      VAL  89  -3.473  12.254 -11.777
  698   3HG1  VAL  89          3HG1      VAL  89  -2.242  11.231 -12.556
  699   1HG2  VAL  89          1HG2      VAL  89  -4.101  14.133 -13.211
  700   2HG2  VAL  89          2HG2      VAL  89  -3.132  14.801 -11.875
  701   3HG2  VAL  89          3HG2      VAL  89  -2.802  15.301 -13.551
  702    H    THR  90           H        THR  90   1.833  14.183 -13.431
  703    HA   THR  90           HA       THR  90   2.259  11.416 -14.247
  704    HB   THR  90           HB       THR  90   2.993  13.414 -15.646
  705    HG1  THR  90           1HG      THR  90   4.885  12.224 -16.104
  706   1HG2  THR  90          1HG2      THR  90   3.997  15.096 -14.408
  707   2HG2  THR  90          2HG2      THR  90   4.457  13.982 -13.098
  708   3HG2  THR  90          3HG2      THR  90   5.444  14.073 -14.576
  709    H    LYS  91           H        LYS  91   2.386  13.256 -11.401
  710    HA   LYS  91           HA       LYS  91   4.763  12.094 -10.332
  711   1HB   LYS  91          1HB       LYS  91   2.530  13.802  -9.258
  712   2HB   LYS  91          2HB       LYS  91   3.667  13.046  -8.160
  713   1HG   LYS  91          1HG       LYS  91   5.228  14.169 -10.281
  714   2HG   LYS  91          2HG       LYS  91   4.045  15.387  -9.844
  715   1HD   LYS  91          1HD       LYS  91   5.921  13.960  -7.899
  716   2HD   LYS  91          2HD       LYS  91   6.119  15.601  -8.483
  717   1HE   LYS  91          1HE       LYS  91   3.462  15.509  -7.494
  718   2HE   LYS  91          2HE       LYS  91   4.401  14.599  -6.326
  719   1HZ   LYS  91          1HZ       LYS  91   4.305  17.329  -6.628
  720   2HZ   LYS  91          2HZ       LYS  91   5.239  16.479  -5.592
  721   3HZ   LYS  91          3HZ       LYS  91   5.816  16.889  -7.064
  722    H    ASP  92           H        ASP  92   4.367   9.821 -10.858
  723    HA   ASP  92           HA       ASP  92   2.123   8.535  -9.764
  724   1HB   ASP  92          1HB       ASP  92   4.796   7.564 -10.852
  725   2HB   ASP  92          2HB       ASP  92   3.602   6.441 -10.233
  726    H    VAL  93           H        VAL  93   2.185   9.166  -7.464
  727    HA   VAL  93           HA       VAL  93   4.070   7.547  -5.946
  728    HB   VAL  93           HB       VAL  93   4.360   9.533  -4.389
  729   1HG1  VAL  93          1HG1      VAL  93   6.025   8.566  -6.127
  730   2HG1  VAL  93          2HG1      VAL  93   5.648  10.027  -7.072
  731   3HG1  VAL  93          3HG1      VAL  93   6.345  10.177  -5.441
  732   1HG2  VAL  93          1HG2      VAL  93   2.584  10.957  -5.293
  733   2HG2  VAL  93          2HG2      VAL  93   4.164  11.771  -5.398
  734   3HG2  VAL  93          3HG2      VAL  93   3.436  11.050  -6.854
  735    H    VAL  94           H        VAL  94   3.357   7.565  -3.528
  736    HA   VAL  94           HA       VAL  94   0.531   8.110  -3.206
  737    HB   VAL  94           HB       VAL  94   1.708   5.332  -3.004
  738   1HG1  VAL  94          1HG1      VAL  94  -1.053   6.351  -2.255
  739   2HG1  VAL  94          2HG1      VAL  94  -0.589   4.636  -2.358
  740   3HG1  VAL  94          3HG1      VAL  94   0.181   5.695  -1.153
  741   1HG2  VAL  94          1HG2      VAL  94   0.033   4.759  -4.725
  742   2HG2  VAL  94          2HG2      VAL  94  -0.449   6.470  -4.815
  743   3HG2  VAL  94          3HG2      VAL  94   1.192   5.981  -5.302
  744    H    CYS  95           H        CYS  95  -0.110   8.109  -0.939
  745    HA   CYS  95           HA       CYS  95   2.039   8.961   0.711
  746   1HB   CYS  95          1HB       CYS  95  -0.239   9.980   0.759
  747   2HB   CYS  95          2HB       CYS  95  -0.870   8.496   1.446
  748    HG   CYS  95           HG       CYS  95  -0.637  10.164   3.394
  749    H    LEU  96           H        LEU  96   3.095   7.789   2.333
  750    HA   LEU  96           HA       LEU  96   2.654   4.948   2.317
  751   1HB   LEU  96          1HB       LEU  96   4.646   6.742   3.703
  752   2HB   LEU  96          2HB       LEU  96   4.600   5.003   3.920
  753    HG   LEU  96           HG       LEU  96   4.722   5.947   1.108
  754   1HD1  LEU  96          1HD1      LEU  96   7.415   5.895   2.036
  755   2HD1  LEU  96          2HD1      LEU  96   6.524   7.226   1.260
  756   3HD1  LEU  96          3HD1      LEU  96   6.506   7.058   3.032
  757   1HD2  LEU  96          1HD2      LEU  96   4.754   3.539   1.926
  758   2HD2  LEU  96          2HD2      LEU  96   6.023   4.013   0.772
  759   3HD2  LEU  96          3HD2      LEU  96   6.405   3.865   2.504
  760    H    ASN  97           H        ASN  97   2.291   7.718   4.601
  761    HA   ASN  97           HA       ASN  97   1.586   6.208   6.789
  762   1HB   ASN  97          1HB       ASN  97   0.696   9.020   5.958
  763   2HB   ASN  97          2HB       ASN  97   0.436   8.356   7.559
  764   1HD2  ASN  97          1HD2      ASN  97   2.652   9.760   5.350
  765   2HD2  ASN  97          2HD2      ASN  97   4.045   9.848   6.376
  766    H    ASP  98           H        ASP  98  -0.232   7.378   3.935
  767    HA   ASP  98           HA       ASP  98  -2.782   6.959   4.974
  768   1HB   ASP  98          1HB       ASP  98  -2.226   8.319   2.931
  769   2HB   ASP  98          2HB       ASP  98  -1.814   6.845   2.077
  770    H    VAL  99           H        VAL  99  -0.434   4.964   3.084
  771    HA   VAL  99           HA       VAL  99  -2.221   2.786   2.722
  772    HB   VAL  99           HB       VAL  99   0.784   3.041   2.496
  773   1HG1  VAL  99          1HG1      VAL  99   0.770   0.794   2.448
  774   2HG1  VAL  99          2HG1      VAL  99  -0.999   0.715   2.270
  775   3HG1  VAL  99          3HG1      VAL  99   0.030   0.972   0.840
  776   1HG2  VAL  99          1HG2      VAL  99  -0.970   4.350   0.976
  777   2HG2  VAL  99          2HG2      VAL  99   0.518   3.643   0.302
  778   3HG2  VAL  99          3HG2      VAL  99  -1.032   2.783   0.134
  779    H    SER 100           H        SER 100  -0.034   3.892   5.270
  780    HA   SER 100           HA       SER 100   0.211   1.381   6.507
  781   1HB   SER 100          1HB       SER 100   1.897   2.823   7.182
  782   2HB   SER 100          2HB       SER 100   0.851   4.229   7.187
  783    HG   SER 100           HG       SER 100   1.588   2.688   9.287
  784    H    CYS 101           H        CYS 101  -2.219   3.939   6.465
  785    HA   CYS 101           HA       CYS 101  -3.437   3.189   8.922
  786   1HB   CYS 101          1HB       CYS 101  -3.529   5.466   7.613
  787   2HB   CYS 101          2HB       CYS 101  -4.868   4.720   6.763
  788    HG   CYS 101           HG       CYS 101  -5.626   3.771   9.423
  789    H    TYR 102           H        TYR 102  -4.066   2.689   5.384
  790    HA   TYR 102           HA       TYR 102  -6.402   1.194   5.685
  791   1HB   TYR 102          1HB       TYR 102  -5.080   2.316   3.643
  792   2HB   TYR 102          2HB       TYR 102  -4.215   0.793   3.574
  793    HD1  TYR 102           1HD      TYR 102  -4.985  -0.761   2.042
  794    HD2  TYR 102           2HD      TYR 102  -7.784   1.959   3.794
  795    HE1  TYR 102           1HE      TYR 102  -6.846  -1.746   0.616
  796    HE2  TYR 102           2HE      TYR 102  -9.635   0.965   2.362
  797    HH   TYR 102           HH       TYR 102  -8.996  -1.034  -0.276
  798    H    PHE 103           H        PHE 103  -2.966   0.109   5.194
  799    HA   PHE 103           HA       PHE 103  -3.517  -2.602   5.300
  800   1HB   PHE 103          1HB       PHE 103  -1.196  -0.712   5.767
  801   2HB   PHE 103          2HB       PHE 103  -0.971  -2.358   6.327
  802    HD1  PHE 103           1HD      PHE 103  -2.383  -3.888   4.224
  803    HD2  PHE 103           2HD      PHE 103   0.196  -0.532   3.914
  804    HE1  PHE 103           1HE      PHE 103  -1.746  -4.591   1.900
  805    HE2  PHE 103           2HE      PHE 103   0.832  -1.236   1.590
  806    HZ   PHE 103           HZ       PHE 103  -0.146  -3.257   0.611
  807    H    SER 104           H        SER 104  -3.048  -0.183   7.889
  808    HA   SER 104           HA       SER 104  -2.543  -1.938   9.948
  809   1HB   SER 104          1HB       SER 104  -2.203   0.408  10.304
  810   2HB   SER 104          2HB       SER 104  -3.846   0.804   9.838
  811    HG   SER 104           HG       SER 104  -3.010   0.486  12.295
  812    H    LEU 105           H        LEU 105  -5.600  -0.859   8.408
  813    HA   LEU 105           HA       LEU 105  -7.278  -2.028  10.376
  814   1HB   LEU 105          1HB       LEU 105  -7.571  -0.673   7.764
  815   2HB   LEU 105          2HB       LEU 105  -8.851  -1.791   8.191
  816    HG   LEU 105           HG       LEU 105  -9.397   0.499   8.838
  817   1HD1  LEU 105          1HD1      LEU 105 -10.273   0.034  10.958
  818   2HD1  LEU 105          2HD1      LEU 105 -10.108  -1.562  10.187
  819   3HD1  LEU 105          3HD1      LEU 105  -8.912  -1.027  11.393
  820   1HD2  LEU 105          1HD2      LEU 105  -8.069   1.387  10.906
  821   2HD2  LEU 105          2HD2      LEU 105  -6.770   0.345  10.278
  822   3HD2  LEU 105          3HD2      LEU 105  -7.441   1.642   9.261
  823    H    LEU 106           H        LEU 106  -6.196  -3.005   7.055
  824    HA   LEU 106           HA       LEU 106  -7.573  -5.357   6.872
  825   1HB   LEU 106          1HB       LEU 106  -5.263  -4.111   5.635
  826   2HB   LEU 106          2HB       LEU 106  -5.082  -5.852   5.717
  827    HG   LEU 106           HG       LEU 106  -7.539  -5.843   4.733
  828   1HD1  LEU 106          1HD1      LEU 106  -6.616  -3.046   4.378
  829   2HD1  LEU 106          2HD1      LEU 106  -7.378  -3.819   2.967
  830   3HD1  LEU 106          3HD1      LEU 106  -8.261  -3.713   4.508
  831   1HD2  LEU 106          1HD2      LEU 106  -6.038  -5.285   2.430
  832   2HD2  LEU 106          2HD2      LEU 106  -4.881  -5.954   3.606
  833   3HD2  LEU 106          3HD2      LEU 106  -6.343  -6.873   3.173
  834    H    GLU 107           H        GLU 107  -4.105  -5.105   7.942
  835    HA   GLU 107           HA       GLU 107  -3.912  -7.660   8.835
  836   1HB   GLU 107          1HB       GLU 107  -2.326  -5.324   8.877
  837   2HB   GLU 107          2HB       GLU 107  -2.426  -5.812  10.557
  838   1HG   GLU 107          1HG       GLU 107  -2.005  -8.148   8.847
  839   2HG   GLU 107          2HG       GLU 107  -0.776  -6.939   8.536
  840    H    GLY 108           H        GLY 108  -5.175  -4.749  10.531
  841   1HA   GLY 108          1HA       GLY 108  -5.358  -5.707  13.112
  842   2HA   GLY 108          2HA       GLY 108  -6.442  -4.543  12.376
  843    H    GLY 109           H        GLY 109  -8.222  -5.496  10.896
  844   1HA   GLY 109          1HA       GLY 109  -9.016  -8.112  10.846
  845   2HA   GLY 109          2HA       GLY 109  -9.608  -7.517  12.384
  846    H    ARG 110           H        ARG 110  -9.579  -6.805   8.839
  847    HA   ARG 110           HA       ARG 110 -12.104  -5.422   9.269
  848   1HB   ARG 110          1HB       ARG 110  -9.836  -4.464   8.007
  849   2HB   ARG 110          2HB       ARG 110 -10.717  -5.112   6.638
  850   1HG   ARG 110          1HG       ARG 110 -12.558  -3.656   8.360
  851   2HG   ARG 110          2HG       ARG 110 -11.177  -2.639   8.000
  852   1HD   ARG 110          1HD       ARG 110 -11.648  -2.552   5.722
  853   2HD   ARG 110          2HD       ARG 110 -12.329  -4.167   5.686
  854    HE   ARG 110           HE       ARG 110 -14.162  -2.801   7.218
  855   1HH1  ARG 110          2HH2      ARG 110 -12.709  -2.141   4.082
  856   2HH1  ARG 110          1HH2      ARG 110 -14.083  -1.271   3.486
  857   1HH2  ARG 110          2HH1      ARG 110 -15.975  -1.653   6.432
  858   2HH2  ARG 110          1HH1      ARG 110 -15.953  -0.991   4.831
  859    HA   PRO 111           HA       PRO 111 -13.365  -9.097   7.052
  860   1HB   PRO 111          1HB       PRO 111 -15.891  -9.238   8.086
  861   2HB   PRO 111          2HB       PRO 111 -14.509 -10.021   8.824
  862   1HG   PRO 111          1HG       PRO 111 -15.925  -7.571   9.678
  863   2HG   PRO 111          2HG       PRO 111 -14.844  -8.593  10.604
  864   1HD   PRO 111          1HD       PRO 111 -14.225  -6.042   9.448
  865   2HD   PRO 111          2HD       PRO 111 -13.113  -7.116  10.274
  866    H    GLU 112           H        GLU 112 -15.327  -9.662   5.617
  867    HA   GLU 112           HA       GLU 112 -16.902  -7.580   4.742
  868   1HB   GLU 112          1HB       GLU 112 -14.598  -6.740   3.957
  869   2HB   GLU 112          2HB       GLU 112 -14.594  -8.072   2.819
  870   1HG   GLU 112          1HG       GLU 112 -15.478  -6.180   1.624
  871   2HG   GLU 112          2HG       GLU 112 -16.844  -7.228   1.949
  872    H    ASP 113           H        ASP 113 -15.079 -10.568   3.980
  873    HA   ASP 113           HA       ASP 113 -17.548 -11.674   2.990
  874   1HB   ASP 113          1HB       ASP 113 -15.255 -10.994   1.308
  875   2HB   ASP 113          2HB       ASP 113 -15.516 -12.726   1.288
  876    H    LYS 114           H        LYS 114 -17.670 -13.279   4.603
  877    HA   LYS 114           HA       LYS 114 -15.262 -14.594   5.480
  878   1HB   LYS 114          1HB       LYS 114 -17.923 -14.130   6.500
  879   2HB   LYS 114          2HB       LYS 114 -17.554 -15.841   6.574
  880   1HG   LYS 114          1HG       LYS 114 -15.286 -14.118   7.406
  881   2HG   LYS 114          2HG       LYS 114 -16.707 -13.925   8.413
  882   1HD   LYS 114          1HD       LYS 114 -16.794 -16.349   8.848
  883   2HD   LYS 114          2HD       LYS 114 -15.485 -16.637   7.719
  884   1HE   LYS 114          1HE       LYS 114 -14.109 -16.478   9.533
  885   2HE   LYS 114          2HE       LYS 114 -14.348 -14.747   9.402
  886   1HZ   LYS 114          1HZ       LYS 114 -15.377 -14.811  11.328
  887   2HZ   LYS 114          2HZ       LYS 114 -16.523 -15.818  10.746
  888   3HZ   LYS 114          3HZ       LYS 114 -15.176 -16.427  11.439
  889    H    LEU 115           H        LEU 115 -16.915 -14.806   2.687
  890    HA   LEU 115           HA       LEU 115 -17.749 -17.387   2.371
  891   1HB   LEU 115          1HB       LEU 115 -16.195 -15.967   0.235
  892   2HB   LEU 115          2HB       LEU 115 -17.577 -17.032   0.076
  893    HG   LEU 115           HG       LEU 115 -17.525 -14.153   0.976
  894   1HD1  LEU 115          1HD1      LEU 115 -17.729 -14.145  -1.313
  895   2HD1  LEU 115          2HD1      LEU 115 -18.637 -15.675  -1.353
  896   3HD1  LEU 115          3HD1      LEU 115 -19.438 -14.179  -0.818
  897   1HD2  LEU 115          1HD2      LEU 115 -20.028 -15.827   1.057
  898   2HD2  LEU 115          2HD2      LEU 115 -18.959 -15.682   2.474
  899   3HD2  LEU 115          3HD2      LEU 115 -19.713 -14.229   1.776
  900    H    GLU 116           H        GLU 116 -16.514 -19.074   0.896
  901    HA   GLU 116           HA       GLU 116 -13.742 -19.200   1.729
  902   1HB   GLU 116          1HB       GLU 116 -15.586 -21.605   2.000
  903   2HB   GLU 116          2HB       GLU 116 -13.932 -21.462   2.560
  904   1HG   GLU 116          1HG       GLU 116 -16.050 -19.545   3.585
  905   2HG   GLU 116          2HG       GLU 116 -15.912 -21.149   4.277
  906    H    TRP 117           H        TRP 117 -12.381 -20.399   0.280
  907    HA   TRP 117           HA       TRP 117 -13.735 -21.425  -2.109
  908   1HB   TRP 117          1HB       TRP 117 -11.527 -19.382  -1.989
  909   2HB   TRP 117          2HB       TRP 117 -11.759 -20.404  -3.394
  910    HD1  TRP 117           HD       TRP 117 -13.653 -17.653  -1.412
  911    HE1  TRP 117           1HE      TRP 117 -15.432 -16.448  -2.944
  912    HE3  TRP 117           3HE      TRP 117 -13.050 -20.720  -5.423
  913    HZ2  TRP 117           2HZ      TRP 117 -16.366 -16.902  -5.602
  914    HZ3  TRP 117           3HZ      TRP 117 -14.434 -20.270  -7.447
  915    HH2  TRP 117           HH       TRP 117 -16.047 -18.438  -7.577
  916    H    SER 118           H        SER 118 -10.312 -21.119  -2.303
  917    HA   SER 118           HA       SER 118  -8.644 -22.493  -2.090
  918   1HB   SER 118          1HB       SER 118  -9.503 -22.614   0.346
  919   2HB   SER 118          2HB       SER 118 -10.224 -24.152  -0.086
  920    HG   SER 118           HG       SER 118  -7.448 -23.674  -0.651
  Start of MODEL    9
    1   1H    MET   1           H        MET   1 -14.838  -5.181  17.430
    2    HA   MET   1           HA       MET   1 -15.455  -6.559  15.828
    3   1HB   MET   1          1HB       MET   1 -18.054  -5.609  17.114
    4   2HB   MET   1          2HB       MET   1 -18.097  -6.854  15.882
    5   1HG   MET   1          1HG       MET   1 -16.962  -8.421  17.218
    6   2HG   MET   1          2HG       MET   1 -16.136  -7.191  18.153
    7   1HE   MET   1          1HE       MET   1 -18.872  -5.839  20.524
    8   2HE   MET   1          2HE       MET   1 -17.117  -6.033  20.300
    9   3HE   MET   1          3HE       MET   1 -18.083  -5.185  19.068
   10    H    ALA   2           H        ALA   2 -14.736  -4.279  14.513
   11    HA   ALA   2           HA       ALA   2 -16.927  -3.801  12.615
   12   1HB   ALA   2          1HB       ALA   2 -15.008  -1.895  12.100
   13   2HB   ALA   2          2HB       ALA   2 -16.412  -1.661  13.169
   14   3HB   ALA   2          3HB       ALA   2 -14.836  -2.118  13.858
   15    H    LYS   3           H        LYS   3 -16.333  -6.023  11.759
   16    HA   LYS   3           HA       LYS   3 -13.787  -6.391  10.590
   17   1HB   LYS   3          1HB       LYS   3 -15.350  -8.200  11.345
   18   2HB   LYS   3          2HB       LYS   3 -16.385  -7.829   9.982
   19   1HG   LYS   3          1HG       LYS   3 -15.112  -9.207   8.710
   20   2HG   LYS   3          2HG       LYS   3 -13.796  -8.060   8.859
   21   1HD   LYS   3          1HD       LYS   3 -13.580  -9.335  11.278
   22   2HD   LYS   3          2HD       LYS   3 -14.244 -10.638  10.312
   23   1HE   LYS   3          1HE       LYS   3 -12.405 -10.079   8.566
   24   2HE   LYS   3          2HE       LYS   3 -11.673  -9.081   9.807
   25   1HZ   LYS   3          1HZ       LYS   3 -10.870 -11.394   9.724
   26   2HZ   LYS   3          2HZ       LYS   3 -11.438 -10.958  11.191
   27   3HZ   LYS   3          3HZ       LYS   3 -12.338 -11.911  10.217
   28    H    GLU   4           H        GLU   4 -15.909  -7.300   8.170
   29    HA   GLU   4           HA       GLU   4 -16.437  -4.934   6.868
   30   1HB   GLU   4          1HB       GLU   4 -13.705  -5.335   6.846
   31   2HB   GLU   4          2HB       GLU   4 -14.170  -6.105   5.342
   32   1HG   GLU   4          1HG       GLU   4 -14.267  -4.047   4.395
   33   2HG   GLU   4          2HG       GLU   4 -15.673  -3.712   5.387
   34    H    ARG   5           H        ARG   5 -16.219  -5.659   4.165
   35    HA   ARG   5           HA       ARG   5 -16.703  -8.309   3.642
   36   1HB   ARG   5          1HB       ARG   5 -19.155  -8.358   3.317
   37   2HB   ARG   5          2HB       ARG   5 -18.782  -7.985   4.988
   38   1HG   ARG   5          1HG       ARG   5 -18.845  -5.456   3.776
   39   2HG   ARG   5          2HG       ARG   5 -20.126  -6.320   2.950
   40   1HD   ARG   5          1HD       ARG   5 -20.962  -7.046   5.291
   41   2HD   ARG   5          2HD       ARG   5 -19.837  -5.878   5.954
   42    HE   ARG   5           HE       ARG   5 -21.555  -4.750   3.869
   43   1HH1  ARG   5          2HH2      ARG   5 -21.300  -5.478   7.302
   44   2HH1  ARG   5          1HH2      ARG   5 -22.464  -4.284   7.772
   45   1HH2  ARG   5          2HH1      ARG   5 -23.091  -3.175   4.488
   46   2HH2  ARG   5          1HH1      ARG   5 -23.489  -2.966   6.161
   47    H    GLY   6           H        GLY   6 -15.300  -6.030   2.550
   48   1HA   GLY   6          1HA       GLY   6 -16.125  -6.200  -0.178
   49   2HA   GLY   6          2HA       GLY   6 -16.519  -4.639   0.514
   50    H    LEU   7           H        LEU   7 -15.002  -3.214  -0.256
   51    HA   LEU   7           HA       LEU   7 -13.046  -2.267  -0.638
   52   1HB   LEU   7          1HB       LEU   7 -12.785  -3.589   1.874
   53   2HB   LEU   7          2HB       LEU   7 -11.256  -3.726   1.029
   54    HG   LEU   7           HG       LEU   7 -11.979  -1.053   0.670
   55   1HD1  LEU   7          1HD1      LEU   7 -13.669  -0.908   2.245
   56   2HD1  LEU   7          2HD1      LEU   7 -12.883  -2.057   3.354
   57   3HD1  LEU   7          3HD1      LEU   7 -12.236  -0.409   3.175
   58   1HD2  LEU   7          1HD2      LEU   7  -9.722  -1.769   0.989
   59   2HD2  LEU   7          2HD2      LEU   7 -10.122  -0.629   2.297
   60   3HD2  LEU   7          3HD2      LEU   7 -10.083  -2.379   2.622
   61    H    ILE   8           H        ILE   8 -11.903  -2.474  -2.485
   62    HA   ILE   8           HA       ILE   8 -11.134  -3.513  -4.307
   63    HB   ILE   8           HB       ILE   8  -9.079  -4.873  -3.817
   64   1HG1  ILE   8          1HG1      ILE   8  -9.814  -4.259  -0.939
   65   2HG1  ILE   8          2HG1      ILE   8  -9.816  -5.846  -1.682
   66   1HG2  ILE   8          1HG2      ILE   8  -7.890  -2.970  -3.629
   67   2HG2  ILE   8          2HG2      ILE   8  -9.484  -2.198  -3.808
   68   3HG2  ILE   8          3HG2      ILE   8  -8.780  -2.422  -2.188
   69   1HD1  ILE   8          1HD1      ILE   8  -7.264  -4.517  -2.175
   70   2HD1  ILE   8          2HD1      ILE   8  -7.629  -4.557  -0.433
   71   3HD1  ILE   8          3HD1      ILE   8  -7.584  -6.071  -1.368
   72    H    SER   9           H        SER   9 -13.530  -4.770  -3.069
   73    HA   SER   9           HA       SER   9 -14.756  -6.550  -3.265
   74   1HB   SER   9          1HB       SER   9 -13.089  -6.522  -5.669
   75   2HB   SER   9          2HB       SER   9 -13.547  -8.163  -5.257
   76    HG   SER   9           HG       SER   9 -15.605  -7.758  -5.759
   77    HA   PRO  10           HA       PRO  10 -12.976  -9.956  -1.212
   78   1HB   PRO  10          1HB       PRO  10 -14.381 -12.144  -2.050
   79   2HB   PRO  10          2HB       PRO  10 -14.998 -11.003  -0.872
   80   1HG   PRO  10          1HG       PRO  10 -15.743 -11.316  -3.715
   81   2HG   PRO  10          2HG       PRO  10 -16.618 -10.500  -2.434
   82   1HD   PRO  10          1HD       PRO  10 -15.078  -9.267  -4.516
   83   2HD   PRO  10          2HD       PRO  10 -15.856  -8.459  -3.169
   84    H    SER  11           H        SER  11 -12.477  -9.613  -4.435
   85    HA   SER  11           HA       SER  11 -11.071 -12.056  -4.796
   86   1HB   SER  11          1HB       SER  11 -12.014  -9.875  -6.436
   87   2HB   SER  11          2HB       SER  11 -10.303 -10.089  -6.750
   88    HG   SER  11           HG       SER  11 -10.635 -12.138  -7.507
   89    H    ASP  12           H        ASP  12 -10.213  -8.549  -4.406
   90    HA   ASP  12           HA       ASP  12  -7.450  -9.100  -4.418
   91   1HB   ASP  12          1HB       ASP  12  -8.986  -6.850  -4.739
   92   2HB   ASP  12          2HB       ASP  12  -8.475  -6.624  -3.078
   93    H    PHE  13           H        PHE  13 -10.044  -8.604  -1.971
   94    HA   PHE  13           HA       PHE  13  -8.403  -8.357   0.271
   95   1HB   PHE  13          1HB       PHE  13 -11.043  -8.109  -0.278
   96   2HB   PHE  13          2HB       PHE  13 -11.100  -9.780   0.246
   97    HD1  PHE  13           1HD      PHE  13 -10.671  -6.324   1.297
   98    HD2  PHE  13           2HD      PHE  13 -10.592 -10.369   2.578
   99    HE1  PHE  13           1HE      PHE  13 -10.798  -5.569   3.688
  100    HE2  PHE  13           2HE      PHE  13 -10.720  -9.614   4.969
  101    HZ   PHE  13           HZ       PHE  13 -10.821  -7.224   5.495
  102    H    ALA  14           H        ALA  14  -9.677 -11.201  -1.502
  103    HA   ALA  14           HA       ALA  14  -9.119 -13.112   0.457
  104   1HB   ALA  14          1HB       ALA  14 -10.528 -13.812  -1.271
  105   2HB   ALA  14          2HB       ALA  14  -9.495 -13.107  -2.537
  106   3HB   ALA  14          3HB       ALA  14  -8.991 -14.598  -1.706
  107    H    GLN  15           H        GLN  15  -7.198 -12.109  -2.467
  108    HA   GLN  15           HA       GLN  15  -5.032 -13.687  -1.924
  109   1HB   GLN  15          1HB       GLN  15  -5.743 -11.765  -3.835
  110   2HB   GLN  15          2HB       GLN  15  -4.310 -11.080  -3.094
  111   1HG   GLN  15          1HG       GLN  15  -3.499 -12.451  -4.883
  112   2HG   GLN  15          2HG       GLN  15  -3.178 -13.364  -3.422
  113   1HE2  GLN  15          1HE2      GLN  15  -3.544 -15.421  -3.665
  114   2HE2  GLN  15          2HE2      GLN  15  -4.831 -16.169  -4.551
  115    H    LEU  16           H        LEU  16  -5.509 -10.174  -1.097
  116    HA   LEU  16           HA       LEU  16  -3.137  -9.876   0.300
  117   1HB   LEU  16          1HB       LEU  16  -5.283  -8.306  -0.423
  118   2HB   LEU  16          2HB       LEU  16  -5.401  -8.330   1.326
  119    HG   LEU  16           HG       LEU  16  -3.092  -7.508   1.514
  120   1HD1  LEU  16          1HD1      LEU  16  -2.786  -8.460  -1.077
  121   2HD1  LEU  16          2HD1      LEU  16  -2.749  -6.689  -1.260
  122   3HD1  LEU  16          3HD1      LEU  16  -1.613  -7.494  -0.150
  123   1HD2  LEU  16          1HD2      LEU  16  -3.486  -5.227   0.537
  124   2HD2  LEU  16          2HD2      LEU  16  -4.963  -5.875  -0.215
  125   3HD2  LEU  16          3HD2      LEU  16  -4.804  -5.852   1.558
  126    H    GLN  17           H        GLN  17  -6.400 -10.972   1.386
  127    HA   GLN  17           HA       GLN  17  -5.755 -11.083   4.074
  128   1HB   GLN  17          1HB       GLN  17  -8.068 -11.152   3.293
  129   2HB   GLN  17          2HB       GLN  17  -7.785 -12.649   2.427
  130   1HG   GLN  17          1HG       GLN  17  -7.113 -13.658   4.735
  131   2HG   GLN  17          2HG       GLN  17  -7.828 -12.222   5.441
  132   1HE2  GLN  17          1HE2      GLN  17 -10.050 -11.666   4.692
  133   2HE2  GLN  17          2HE2      GLN  17 -11.192 -12.951   4.478
  134    H    LYS  18           H        LYS  18  -6.002 -13.827   1.688
  135    HA   LYS  18           HA       LYS  18  -5.040 -15.810   3.276
  136   1HB   LYS  18          1HB       LYS  18  -5.594 -15.414   0.525
  137   2HB   LYS  18          2HB       LYS  18  -3.988 -16.111   0.607
  138   1HG   LYS  18          1HG       LYS  18  -4.739 -18.107   1.513
  139   2HG   LYS  18          2HG       LYS  18  -6.013 -17.337   2.438
  140   1HD   LYS  18          1HD       LYS  18  -7.540 -17.813   0.831
  141   2HD   LYS  18          2HD       LYS  18  -6.587 -16.978  -0.379
  142   1HE   LYS  18          1HE       LYS  18  -5.401 -19.580   0.340
  143   2HE   LYS  18          2HE       LYS  18  -7.046 -19.754  -0.240
  144   1HZ   LYS  18          1HZ       LYS  18  -5.893 -17.954  -1.921
  145   2HZ   LYS  18          2HZ       LYS  18  -4.727 -19.073  -1.685
  146   3HZ   LYS  18          3HZ       LYS  18  -6.193 -19.527  -2.245
  147    H    TYR  19           H        TYR  19  -3.130 -13.473   1.274
  148    HA   TYR  19           HA       TYR  19  -0.631 -14.540   1.969
  149   1HB   TYR  19          1HB       TYR  19  -1.816 -11.893   0.994
  150   2HB   TYR  19          2HB       TYR  19  -0.102 -11.965   1.353
  151    HD1  TYR  19           1HD      TYR  19  -2.114 -14.713  -0.153
  152    HD2  TYR  19           2HD      TYR  19   0.788 -11.641  -0.825
  153    HE1  TYR  19           1HE      TYR  19  -1.661 -15.639  -2.477
  154    HE2  TYR  19           2HE      TYR  19   1.230 -12.577  -3.147
  155    HH   TYR  19           HH       TYR  19   0.444 -13.932  -4.718
  156    H    MET  20           H        MET  20  -2.430 -11.647   3.244
  157    HA   MET  20           HA       MET  20  -0.567 -10.910   5.090
  158   1HB   MET  20          1HB       MET  20  -3.579 -10.678   4.836
  159   2HB   MET  20          2HB       MET  20  -2.855 -10.173   6.350
  160   1HG   MET  20          1HG       MET  20  -1.326  -8.626   5.104
  161   2HG   MET  20          2HG       MET  20  -2.047  -9.132   3.590
  162   1HE   MET  20          1HE       MET  20  -2.315  -7.754   6.906
  163   2HE   MET  20          2HE       MET  20  -2.780  -6.117   6.384
  164   3HE   MET  20          3HE       MET  20  -3.987  -7.190   7.133
  165    H    GLU  21           H        GLU  21  -3.361 -13.189   5.494
  166    HA   GLU  21           HA       GLU  21  -3.117 -13.671   8.141
  167   1HB   GLU  21          1HB       GLU  21  -4.213 -15.094   5.796
  168   2HB   GLU  21          2HB       GLU  21  -3.751 -16.180   7.091
  169   1HG   GLU  21          1HG       GLU  21  -5.026 -14.177   8.512
  170   2HG   GLU  21          2HG       GLU  21  -5.929 -14.149   7.010
  171    H    TYR  22           H        TYR  22  -1.438 -15.431   5.439
  172    HA   TYR  22           HA       TYR  22   0.040 -17.110   7.138
  173   1HB   TYR  22          1HB       TYR  22  -0.502 -16.744   4.420
  174   2HB   TYR  22          2HB       TYR  22   1.148 -16.157   4.498
  175    HD1  TYR  22           1HD      TYR  22  -0.838 -18.998   3.980
  176    HD2  TYR  22           2HD      TYR  22   2.821 -17.782   5.833
  177    HE1  TYR  22           1HE      TYR  22   0.023 -21.388   3.863
  178    HE2  TYR  22           2HE      TYR  22   3.670 -20.175   5.710
  179    HH   TYR  22           HH       TYR  22   3.256 -22.161   4.327
  180    H    SER  23           H        SER  23   0.419 -13.743   6.168
  181    HA   SER  23           HA       SER  23   3.204 -13.684   6.671
  182   1HB   SER  23          1HB       SER  23   2.913 -11.808   5.449
  183   2HB   SER  23          2HB       SER  23   1.173 -11.904   5.635
  184    HG   SER  23           HG       SER  23   2.159  -9.917   6.507
  185    H    THR  24           H        THR  24   4.298 -12.934   8.547
  186    HA   THR  24           HA       THR  24   2.559 -12.452  10.877
  187    HB   THR  24           HB       THR  24   3.930 -14.732  10.568
  188    HG1  THR  24           1HG      THR  24   2.947 -14.369  12.561
  189   1HG2  THR  24          1HG2      THR  24   6.166 -14.680  11.353
  190   2HG2  THR  24          2HG2      THR  24   6.120 -13.245  10.302
  191   3HG2  THR  24          3HG2      THR  24   5.975 -13.061  12.067
  192    H    LYS  25           H        LYS  25   4.066 -10.710   8.758
  193    HA   LYS  25           HA       LYS  25   5.857  -9.317  10.583
  194   1HB   LYS  25          1HB       LYS  25   5.441  -9.353   7.612
  195   2HB   LYS  25          2HB       LYS  25   6.156  -7.934   8.350
  196   1HG   LYS  25          1HG       LYS  25   7.745  -9.623   9.576
  197   2HG   LYS  25          2HG       LYS  25   7.194 -10.791   8.392
  198   1HD   LYS  25          1HD       LYS  25   9.110  -9.893   7.353
  199   2HD   LYS  25          2HD       LYS  25   7.818  -8.974   6.607
  200   1HE   LYS  25          1HE       LYS  25   8.563  -7.014   7.501
  201   2HE   LYS  25          2HE       LYS  25   8.688  -7.705   9.106
  202   1HZ   LYS  25          1HZ       LYS  25  10.737  -8.862   7.965
  203   2HZ   LYS  25          2HZ       LYS  25  10.698  -7.511   7.049
  204   3HZ   LYS  25          3HZ       LYS  25  10.852  -7.393   8.670
  205    H    LYS  26           H        LYS  26   5.654  -6.703   9.934
  206    HA   LYS  26           HA       LYS  26   2.819  -6.034  10.201
  207   1HB   LYS  26          1HB       LYS  26   5.031  -5.378  12.135
  208   2HB   LYS  26          2HB       LYS  26   3.675  -4.286  11.945
  209   1HG   LYS  26          1HG       LYS  26   2.610  -6.958  12.124
  210   2HG   LYS  26          2HG       LYS  26   3.785  -6.775  13.411
  211   1HD   LYS  26          1HD       LYS  26   2.660  -4.690  14.172
  212   2HD   LYS  26          2HD       LYS  26   1.511  -4.811  12.854
  213   1HE   LYS  26          1HE       LYS  26   0.378  -6.628  13.811
  214   2HE   LYS  26          2HE       LYS  26   1.792  -7.197  14.676
  215   1HZ   LYS  26          1HZ       LYS  26  -0.011  -6.045  15.985
  216   2HZ   LYS  26          2HZ       LYS  26   1.524  -5.573  16.279
  217   3HZ   LYS  26          3HZ       LYS  26   0.545  -4.642  15.361
  218    H    VAL  27           H        VAL  27   2.227  -4.069   9.236
  219    HA   VAL  27           HA       VAL  27   3.897  -3.214   7.148
  220    HB   VAL  27           HB       VAL  27   1.395  -3.190   7.242
  221   1HG1  VAL  27          1HG1      VAL  27   0.239  -1.341   8.295
  222   2HG1  VAL  27          2HG1      VAL  27   1.208  -2.196   9.519
  223   3HG1  VAL  27          3HG1      VAL  27   1.779  -0.646   8.855
  224   1HG2  VAL  27          1HG2      VAL  27   1.428  -1.758   5.515
  225   2HG2  VAL  27          2HG2      VAL  27   1.963  -0.402   6.536
  226   3HG2  VAL  27          3HG2      VAL  27   3.157  -1.547   5.878
  227    H    SER  28           H        SER  28   3.368  -2.127  10.503
  228    HA   SER  28           HA       SER  28   4.557   0.369  10.194
  229   1HB   SER  28          1HB       SER  28   4.753   0.319  12.679
  230   2HB   SER  28          2HB       SER  28   3.161  -0.164  12.129
  231    HG   SER  28           HG       SER  28   4.609  -2.422  12.231
  232    H    ASP  29           H        ASP  29   5.827  -2.908  10.470
  233    HA   ASP  29           HA       ASP  29   8.377  -2.132  11.393
  234   1HB   ASP  29          1HB       ASP  29   7.372  -4.651   9.989
  235   2HB   ASP  29          2HB       ASP  29   8.998  -4.489  10.624
  236    H    VAL  30           H        VAL  30   6.904  -3.101   8.214
  237    HA   VAL  30           HA       VAL  30   9.289  -2.807   6.738
  238    HB   VAL  30           HB       VAL  30   6.382  -2.782   5.902
  239   1HG1  VAL  30          1HG1      VAL  30   7.048  -3.089   3.673
  240   2HG1  VAL  30          2HG1      VAL  30   8.135  -1.814   4.274
  241   3HG1  VAL  30          3HG1      VAL  30   8.722  -3.488   4.128
  242   1HG2  VAL  30          1HG2      VAL  30   8.153  -4.889   6.823
  243   2HG2  VAL  30          2HG2      VAL  30   6.411  -4.944   6.459
  244   3HG2  VAL  30          3HG2      VAL  30   7.601  -5.198   5.160
  245    H    LEU  31           H        LEU  31   6.761  -0.593   7.870
  246    HA   LEU  31           HA       LEU  31   7.142   1.473   6.063
  247   1HB   LEU  31          1HB       LEU  31   5.696   0.978   8.428
  248   2HB   LEU  31          2HB       LEU  31   6.612   2.442   8.723
  249    HG   LEU  31           HG       LEU  31   5.644   3.087   6.313
  250   1HD1  LEU  31          1HD1      LEU  31   3.174   1.775   7.258
  251   2HD1  LEU  31          2HD1      LEU  31   3.790   2.030   5.607
  252   3HD1  LEU  31          3HD1      LEU  31   4.411   0.682   6.591
  253   1HD2  LEU  31          1HD2      LEU  31   3.544   3.533   8.271
  254   2HD2  LEU  31          2HD2      LEU  31   5.161   3.820   8.957
  255   3HD2  LEU  31          3HD2      LEU  31   4.649   4.689   7.490
  256    H    LYS  32           H        LYS  32   8.716   0.908   9.288
  257    HA   LYS  32           HA       LYS  32  10.410   3.107   9.130
  258   1HB   LYS  32          1HB       LYS  32  11.569   2.124  10.974
  259   2HB   LYS  32          2HB       LYS  32   9.860   1.794  11.177
  260   1HG   LYS  32          1HG       LYS  32  10.161  -0.463  11.015
  261   2HG   LYS  32          2HG       LYS  32  11.198  -0.313   9.610
  262   1HD   LYS  32          1HD       LYS  32  13.126   0.272  11.064
  263   2HD   LYS  32          2HD       LYS  32  12.100   0.211  12.483
  264   1HE   LYS  32          1HE       LYS  32  11.598  -2.222  11.949
  265   2HE   LYS  32          2HE       LYS  32  12.748  -2.131  10.630
  266   1HZ   LYS  32          1HZ       LYS  32  13.963  -2.909  12.404
  267   2HZ   LYS  32          2HZ       LYS  32  14.342  -1.321  12.407
  268   3HZ   LYS  32          3HZ       LYS  32  13.273  -1.907  13.493
  269    H    LEU  33           H        LEU  33  10.504  -0.073   7.591
  270    HA   LEU  33           HA       LEU  33  13.263  -0.043   6.990
  271   1HB   LEU  33          1HB       LEU  33  10.897  -1.659   6.368
  272   2HB   LEU  33          2HB       LEU  33  12.072  -1.603   5.069
  273    HG   LEU  33           HG       LEU  33  12.531  -2.543   7.910
  274   1HD1  LEU  33          1HD1      LEU  33  12.200  -4.612   7.167
  275   2HD1  LEU  33          2HD1      LEU  33  11.544  -3.886   5.680
  276   3HD1  LEU  33          3HD1      LEU  33  13.259  -4.356   5.760
  277   1HD2  LEU  33          1HD2      LEU  33  14.587  -1.626   7.548
  278   2HD2  LEU  33          2HD2      LEU  33  14.830  -3.206   6.766
  279   3HD2  LEU  33          3HD2      LEU  33  14.470  -1.770   5.778
  280    H    PHE  34           H        PHE  34  10.312   1.224   5.399
  281    HA   PHE  34           HA       PHE  34  11.771   1.969   3.046
  282   1HB   PHE  34          1HB       PHE  34   9.011   1.866   4.132
  283   2HB   PHE  34          2HB       PHE  34   9.283   3.357   3.251
  284    HD1  PHE  34           1HD      PHE  34   9.898   3.275   0.846
  285    HD2  PHE  34           2HD      PHE  34   8.824  -0.225   2.993
  286    HE1  PHE  34           1HE      PHE  34   9.505   2.067  -1.319
  287    HE2  PHE  34           2HE      PHE  34   8.431  -1.432   0.828
  288    HZ   PHE  34           HZ       PHE  34   8.776  -0.272  -1.302
  289    H    GLU  35           H        GLU  35  11.367   3.258   6.213
  290    HA   GLU  35           HA       GLU  35  11.496   5.986   5.352
  291   1HB   GLU  35          1HB       GLU  35  11.720   4.789   8.150
  292   2HB   GLU  35          2HB       GLU  35  11.520   6.491   7.784
  293   1HG   GLU  35          1HG       GLU  35   9.474   4.941   6.397
  294   2HG   GLU  35          2HG       GLU  35   9.470   4.533   8.101
  295    H    ASP  36           H        ASP  36  13.592   3.743   7.312
  296    HA   ASP  36           HA       ASP  36  15.832   5.404   6.460
  297   1HB   ASP  36          1HB       ASP  36  15.013   4.663   9.055
  298   2HB   ASP  36          2HB       ASP  36  16.344   3.575   8.715
  299    H    GLY  37           H        GLY  37  14.410   2.154   6.882
  300   1HA   GLY  37          1HA       GLY  37  16.550   0.477   6.504
  301   2HA   GLY  37          2HA       GLY  37  14.914   0.165   5.959
  302    H    GLU  38           H        GLU  38  16.475  -1.006   4.285
  303    HA   GLU  38           HA       GLU  38  17.711   0.673   2.396
  304   1HB   GLU  38          1HB       GLU  38  17.242  -2.236   2.773
  305   2HB   GLU  38          2HB       GLU  38  17.353  -1.741   1.096
  306   1HG   GLU  38          1HG       GLU  38  19.414  -0.500   2.839
  307   2HG   GLU  38          2HG       GLU  38  19.520  -2.248   2.764
  308    H    MET  39           H        MET  39  14.438  -0.442   2.937
  309    HA   MET  39           HA       MET  39  13.566  -0.336   0.282
  310   1HB   MET  39          1HB       MET  39  12.363  -0.414   3.041
  311   2HB   MET  39          2HB       MET  39  11.309   0.191   1.779
  312   1HG   MET  39          1HG       MET  39  10.843  -2.060   1.521
  313   2HG   MET  39          2HG       MET  39  12.248  -1.991   0.476
  314   1HE   MET  39          1HE       MET  39  14.846  -4.054   2.068
  315   2HE   MET  39          2HE       MET  39  13.710  -4.147   0.702
  316   3HE   MET  39          3HE       MET  39  14.556  -2.621   1.054
  317    H    ALA  40           H        ALA  40  14.731   2.123   2.280
  318    HA   ALA  40           HA       ALA  40  12.859   4.164   1.551
  319   1HB   ALA  40          1HB       ALA  40  14.507   5.637   2.679
  320   2HB   ALA  40          2HB       ALA  40  14.090   4.223   3.676
  321   3HB   ALA  40          3HB       ALA  40  15.636   4.267   2.796
  322    H    LYS  41           H        LYS  41  15.080   2.399  -0.211
  323    HA   LYS  41           HA       LYS  41  16.262   4.564  -1.669
  324   1HB   LYS  41          1HB       LYS  41  17.395   2.888  -2.890
  325   2HB   LYS  41          2HB       LYS  41  17.336   2.321  -1.234
  326   1HG   LYS  41          1HG       LYS  41  15.467   0.822  -1.738
  327   2HG   LYS  41          2HG       LYS  41  15.287   1.502  -3.343
  328   1HD   LYS  41          1HD       LYS  41  16.551  -0.367  -3.882
  329   2HD   LYS  41          2HD       LYS  41  17.854   0.767  -3.589
  330   1HE   LYS  41          1HE       LYS  41  18.370  -0.154  -1.473
  331   2HE   LYS  41          2HE       LYS  41  16.769  -0.834  -1.261
  332   1HZ   LYS  41          1HZ       LYS  41  18.468  -1.787  -3.430
  333   2HZ   LYS  41          2HZ       LYS  41  18.686  -2.355  -1.915
  334   3HZ   LYS  41          3HZ       LYS  41  17.251  -2.562  -2.666
  335    H    TYR  42           H        TYR  42  13.189   3.048  -1.582
  336    HA   TYR  42           HA       TYR  42  12.676   3.857  -4.363
  337   1HB   TYR  42          1HB       TYR  42  11.350   1.916  -2.369
  338   2HB   TYR  42          2HB       TYR  42  10.659   2.271  -3.940
  339    HD1  TYR  42           1HD      TYR  42  12.969   0.219  -2.122
  340    HD2  TYR  42           2HD      TYR  42  12.067   1.714  -6.028
  341    HE1  TYR  42           1HE      TYR  42  14.362  -1.636  -3.162
  342    HE2  TYR  42           2HE      TYR  42  13.464  -0.146  -7.054
  343    HH   TYR  42           HH       TYR  42  14.143  -2.762  -5.847
  344    H    VAL  43           H        VAL  43  12.830   5.810  -2.230
  345    HA   VAL  43           HA       VAL  43   9.990   6.552  -2.104
  346    HB   VAL  43           HB       VAL  43  12.156   6.875  -0.022
  347   1HG1  VAL  43          1HG1      VAL  43   9.312   7.887   0.214
  348   2HG1  VAL  43          2HG1      VAL  43  10.697   8.208   1.285
  349   3HG1  VAL  43          3HG1      VAL  43  10.654   8.913  -0.349
  350   1HG2  VAL  43          1HG2      VAL  43   9.450   5.581   0.332
  351   2HG2  VAL  43          2HG2      VAL  43  10.849   4.668  -0.280
  352   3HG2  VAL  43          3HG2      VAL  43  10.912   5.416   1.334
  353    H    GLN  44           H        GLN  44   9.502   8.510  -2.990
  354    HA   GLN  44           HA       GLN  44  11.800  10.207  -3.595
  355   1HB   GLN  44          1HB       GLN  44   9.288   9.672  -5.233
  356   2HB   GLN  44          2HB       GLN  44  10.380  10.999  -5.578
  357   1HG   GLN  44          1HG       GLN  44  12.167   8.904  -5.377
  358   2HG   GLN  44          2HG       GLN  44  10.759   8.071  -6.005
  359   1HE2  GLN  44          1HE2      GLN  44   9.809   8.755  -7.967
  360   2HE2  GLN  44          2HE2      GLN  44  10.716   9.607  -9.172
  361    H    GLY  45           H        GLY  45  11.754  12.215  -2.670
  362   1HA   GLY  45          1HA       GLY  45  11.009  13.961  -1.464
  363   2HA   GLY  45          2HA       GLY  45   9.612  13.926  -2.521
  364    H    ASP  46           H        ASP  46  10.743  11.498  -0.073
  365    HA   ASP  46           HA       ASP  46   9.830  10.716   1.733
  366   1HB   ASP  46          1HB       ASP  46   9.289  13.400   1.958
  367   2HB   ASP  46          2HB       ASP  46   7.657  12.762   1.974
  368    H    ALA  47           H        ALA  47   8.643  10.486  -1.143
  369    HA   ALA  47           HA       ALA  47   6.047   9.383  -0.315
  370   1HB   ALA  47          1HB       ALA  47   6.549  10.442  -3.094
  371   2HB   ALA  47          2HB       ALA  47   5.012  10.253  -2.217
  372   3HB   ALA  47          3HB       ALA  47   6.129  11.568  -1.782
  373    H    ILE  48           H        ILE  48   5.301   7.754  -2.186
  374    HA   ILE  48           HA       ILE  48   7.635   6.296  -3.160
  375    HB   ILE  48           HB       ILE  48   7.163   5.277  -1.047
  376   1HG1  ILE  48          1HG1      ILE  48   7.371   3.941  -3.410
  377   2HG1  ILE  48          2HG1      ILE  48   7.423   3.191  -1.827
  378   1HG2  ILE  48          1HG2      ILE  48   4.931   4.203  -0.624
  379   2HG2  ILE  48          2HG2      ILE  48   4.934   5.983  -0.590
  380   3HG2  ILE  48          3HG2      ILE  48   4.299   5.122  -2.012
  381   1HD1  ILE  48          1HD1      ILE  48   5.083   2.601  -1.914
  382   2HD1  ILE  48          2HD1      ILE  48   4.814   3.633  -3.339
  383   3HD1  ILE  48          3HD1      ILE  48   5.781   2.146  -3.486
  384    H    GLY  49           H        GLY  49   7.200   4.988  -5.030
  385   1HA   GLY  49          1HA       GLY  49   4.777   5.874  -6.445
  386   2HA   GLY  49          2HA       GLY  49   6.262   5.291  -7.171
  387    H    TYR  50           H        TYR  50   4.289   4.026  -8.278
  388    HA   TYR  50           HA       TYR  50   3.173   1.885  -6.803
  389   1HB   TYR  50          1HB       TYR  50   2.169   2.850  -8.862
  390   2HB   TYR  50          2HB       TYR  50   3.648   2.580  -9.763
  391    HD1  TYR  50           1HD      TYR  50   3.488   0.905 -11.346
  392    HD2  TYR  50           2HD      TYR  50   1.349   0.461  -7.667
  393    HE1  TYR  50           1HE      TYR  50   2.593  -1.343 -12.129
  394    HE2  TYR  50           2HE      TYR  50   0.462  -1.785  -8.462
  395    HH   TYR  50           HH       TYR  50   1.755  -3.524 -10.750
  396    H    GLU  51           H        GLU  51   6.177   2.355  -8.654
  397    HA   GLU  51           HA       GLU  51   6.711  -0.347  -9.062
  398   1HB   GLU  51          1HB       GLU  51   7.837   2.001  -9.892
  399   2HB   GLU  51          2HB       GLU  51   9.016   1.520  -8.688
  400   1HG   GLU  51          1HG       GLU  51   8.884  -0.846  -9.867
  401   2HG   GLU  51          2HG       GLU  51   8.178   0.043 -11.202
  402    H    GLY  52           H        GLY  52   7.945   1.989  -6.559
  403   1HA   GLY  52          1HA       GLY  52   9.494   0.231  -5.094
  404   2HA   GLY  52          2HA       GLY  52   8.691   1.656  -4.466
  405    H    PHE  53           H        PHE  53   5.936   0.821  -5.017
  406    HA   PHE  53           HA       PHE  53   5.377  -0.506  -2.663
  407   1HB   PHE  53          1HB       PHE  53   3.826   0.906  -4.081
  408   2HB   PHE  53          2HB       PHE  53   3.860  -0.317  -5.335
  409    HD1  PHE  53           1HD      PHE  53   3.269  -0.338  -1.639
  410    HD2  PHE  53           2HD      PHE  53   1.896  -1.493  -5.484
  411    HE1  PHE  53           1HE      PHE  53   1.286  -1.467  -0.592
  412    HE2  PHE  53           2HE      PHE  53  -0.087  -2.621  -4.437
  413    HZ   PHE  53           HZ       PHE  53  -0.368  -2.595  -2.004
  414    H    GLN  54           H        GLN  54   6.293  -1.751  -5.840
  415    HA   GLN  54           HA       GLN  54   5.167  -4.283  -5.552
  416   1HB   GLN  54          1HB       GLN  54   7.702  -3.678  -7.116
  417   2HB   GLN  54          2HB       GLN  54   6.484  -4.889  -7.466
  418   1HG   GLN  54          1HG       GLN  54   5.227  -2.265  -7.323
  419   2HG   GLN  54          2HG       GLN  54   6.591  -2.198  -8.421
  420   1HE2  GLN  54          1HE2      GLN  54   5.408  -2.029 -10.261
  421   2HE2  GLN  54          2HE2      GLN  54   4.437  -3.301 -10.926
  422    H    GLN  55           H        GLN  55   8.380  -2.894  -4.680
  423    HA   GLN  55           HA       GLN  55   9.384  -5.392  -3.825
  424   1HB   GLN  55          1HB       GLN  55  10.440  -2.844  -4.381
  425   2HB   GLN  55          2HB       GLN  55  10.705  -3.041  -2.660
  426   1HG   GLN  55          1HG       GLN  55  11.448  -5.535  -3.579
  427   2HG   GLN  55          2HG       GLN  55  11.900  -4.538  -4.948
  428   1HE2  GLN  55          1HE2      GLN  55  11.968  -4.345  -1.387
  429   2HE2  GLN  55          2HE2      GLN  55  13.598  -3.779  -1.230
  430    H    PHE  56           H        PHE  56   7.327  -2.929  -2.447
  431    HA   PHE  56           HA       PHE  56   7.974  -3.382   0.267
  432   1HB   PHE  56          1HB       PHE  56   6.841  -1.336  -0.489
  433   2HB   PHE  56          2HB       PHE  56   5.607  -2.256  -1.326
  434    HD1  PHE  56           1HD      PHE  56   6.828  -1.239   2.002
  435    HD2  PHE  56           2HD      PHE  56   3.666  -3.035  -0.186
  436    HE1  PHE  56           1HE      PHE  56   5.345  -1.090   4.022
  437    HE2  PHE  56           2HE      PHE  56   2.183  -2.886   1.834
  438    HZ   PHE  56           HZ       PHE  56   3.041  -1.915   3.914
  439    H    LEU  57           H        LEU  57   5.413  -4.634  -1.965
  440    HA   LEU  57           HA       LEU  57   4.043  -6.104  -0.032
  441   1HB   LEU  57          1HB       LEU  57   4.252  -6.172  -3.017
  442   2HB   LEU  57          2HB       LEU  57   3.405  -7.459  -2.182
  443    HG   LEU  57           HG       LEU  57   2.686  -4.608  -1.577
  444   1HD1  LEU  57          1HD1      LEU  57   1.341  -4.319  -3.445
  445   2HD1  LEU  57          2HD1      LEU  57   2.811  -5.057  -4.126
  446   3HD1  LEU  57          3HD1      LEU  57   1.358  -6.050  -3.858
  447   1HD2  LEU  57          1HD2      LEU  57   0.619  -5.474  -0.913
  448   2HD2  LEU  57          2HD2      LEU  57   0.854  -6.990  -1.816
  449   3HD2  LEU  57          3HD2      LEU  57   1.800  -6.678  -0.340
  450    H    LYS  58           H        LYS  58   7.133  -6.593  -1.607
  451    HA   LYS  58           HA       LYS  58   7.235  -9.397  -1.348
  452   1HB   LYS  58          1HB       LYS  58   8.769  -8.611  -2.861
  453   2HB   LYS  58          2HB       LYS  58   9.160  -7.188  -1.916
  454   1HG   LYS  58          1HG       LYS  58  10.472  -8.503  -0.332
  455   2HG   LYS  58          2HG       LYS  58   9.917 -10.009  -1.035
  456   1HD   LYS  58          1HD       LYS  58  10.971  -8.978  -3.274
  457   2HD   LYS  58          2HD       LYS  58  11.898  -8.014  -2.142
  458   1HE   LYS  58          1HE       LYS  58  11.712 -11.051  -1.920
  459   2HE   LYS  58          2HE       LYS  58  12.948 -10.257  -2.875
  460   1HZ   LYS  58          1HZ       LYS  58  13.769  -9.196  -0.960
  461   2HZ   LYS  58          2HZ       LYS  58  12.496  -9.645  -0.042
  462   3HZ   LYS  58          3HZ       LYS  58  13.569 -10.765  -0.553
  463    H    ILE  59           H        ILE  59   8.762  -6.758   0.638
  464    HA   ILE  59           HA       ILE  59   9.420  -8.607   2.699
  465    HB   ILE  59           HB       ILE  59   9.433  -5.587   2.669
  466   1HG1  ILE  59          1HG1      ILE  59  12.015  -6.234   2.437
  467   2HG1  ILE  59          2HG1      ILE  59  11.341  -7.646   1.648
  468   1HG2  ILE  59          1HG2      ILE  59  11.203  -7.221   4.434
  469   2HG2  ILE  59          2HG2      ILE  59  10.546  -5.583   4.663
  470   3HG2  ILE  59          3HG2      ILE  59   9.500  -7.003   4.904
  471   1HD1  ILE  59          1HD1      ILE  59  10.079  -5.090   0.810
  472   2HD1  ILE  59          2HD1      ILE  59  11.805  -5.233   0.398
  473   3HD1  ILE  59          3HD1      ILE  59  10.648  -6.456  -0.179
  474    H    TYR  60           H        TYR  60   6.932  -6.014   2.255
  475    HA   TYR  60           HA       TYR  60   5.749  -6.076   4.698
  476   1HB   TYR  60          1HB       TYR  60   5.160  -4.616   2.738
  477   2HB   TYR  60          2HB       TYR  60   4.596  -6.012   1.841
  478    HD1  TYR  60           1HD      TYR  60   3.879  -5.332   5.429
  479    HD2  TYR  60           2HD      TYR  60   2.353  -5.339   1.433
  480    HE1  TYR  60           1HE      TYR  60   1.527  -4.959   6.319
  481    HE2  TYR  60           2HE      TYR  60   0.006  -4.966   2.336
  482    HH   TYR  60           HH       TYR  60  -0.717  -3.779   5.033
  483    H    LEU  61           H        LEU  61   4.402  -7.931   1.877
  484    HA   LEU  61           HA       LEU  61   2.984  -9.640   3.678
  485   1HB   LEU  61          1HB       LEU  61   3.126  -9.150   0.769
  486   2HB   LEU  61          2HB       LEU  61   2.727 -10.791   1.235
  487    HG   LEU  61           HG       LEU  61   1.236  -8.315   2.147
  488   1HD1  LEU  61          1HD1      LEU  61   0.149  -8.354   0.217
  489   2HD1  LEU  61          2HD1      LEU  61   1.130  -9.734  -0.333
  490   3HD1  LEU  61          3HD1      LEU  61  -0.386 -10.018   0.556
  491   1HD2  LEU  61          1HD2      LEU  61  -0.466 -10.361   2.591
  492   2HD2  LEU  61          2HD2      LEU  61   1.087 -11.175   2.902
  493   3HD2  LEU  61          3HD2      LEU  61   0.649  -9.712   3.817
  494    H    GLU  62           H        GLU  62   6.205  -9.432   2.891
  495    HA   GLU  62           HA       GLU  62   7.903 -10.782   2.985
  496   1HB   GLU  62          1HB       GLU  62   6.203 -11.575   5.064
  497   2HB   GLU  62          2HB       GLU  62   6.624 -13.092   4.295
  498   1HG   GLU  62          1HG       GLU  62   9.096 -12.019   4.342
  499   2HG   GLU  62          2HG       GLU  62   8.418 -11.093   5.666
  500    H    VAL  63           H        VAL  63   5.665 -11.132   0.842
  501    HA   VAL  63           HA       VAL  63   5.857 -13.886   0.105
  502    HB   VAL  63           HB       VAL  63   4.790 -12.921  -2.027
  503   1HG1  VAL  63          1HG1      VAL  63   3.452 -12.700   0.689
  504   2HG1  VAL  63          2HG1      VAL  63   2.587 -12.659  -0.866
  505   3HG1  VAL  63          3HG1      VAL  63   3.488 -14.117  -0.388
  506   1HG2  VAL  63          1HG2      VAL  63   4.167 -10.522  -0.321
  507   2HG2  VAL  63          2HG2      VAL  63   5.639 -10.547  -1.322
  508   3HG2  VAL  63          3HG2      VAL  63   4.040 -10.726  -2.085
  509    H    ASP  64           H        ASP  64   7.171 -14.844  -1.452
  510    HA   ASP  64           HA       ASP  64   9.602 -13.512  -1.917
  511   1HB   ASP  64          1HB       ASP  64   8.428 -16.180  -2.346
  512   2HB   ASP  64          2HB       ASP  64   9.463 -15.712  -3.681
  513    H    ASN  65           H        ASN  65   6.517 -13.433  -3.408
  514    HA   ASN  65           HA       ASN  65   7.403 -11.804  -5.477
  515   1HB   ASN  65          1HB       ASN  65   6.255 -13.641  -7.204
  516   2HB   ASN  65          2HB       ASN  65   7.982 -13.425  -7.007
  517   1HD2  ASN  65          1HD2      ASN  65   5.173 -15.295  -6.085
  518   2HD2  ASN  65          2HD2      ASN  65   5.995 -16.702  -5.496
  519    H    VAL  66           H        VAL  66   5.635 -10.409  -5.495
  520    HA   VAL  66           HA       VAL  66   3.013 -11.547  -4.888
  521    HB   VAL  66           HB       VAL  66   4.376  -9.330  -3.955
  522   1HG1  VAL  66          1HG1      VAL  66   2.192  -8.385  -5.842
  523   2HG1  VAL  66          2HG1      VAL  66   3.094  -7.376  -4.686
  524   3HG1  VAL  66          3HG1      VAL  66   3.939  -8.128  -6.060
  525   1HG2  VAL  66          1HG2      VAL  66   1.436  -9.179  -3.726
  526   2HG2  VAL  66          2HG2      VAL  66   2.138 -10.760  -3.306
  527   3HG2  VAL  66          3HG2      VAL  66   2.685  -9.291  -2.463
  528    HA   PRO  67           HA       PRO  67   1.763 -11.014  -8.992
  529   1HB   PRO  67          1HB       PRO  67  -0.954 -10.974  -8.699
  530   2HB   PRO  67          2HB       PRO  67  -0.013 -12.452  -8.709
  531   1HG   PRO  67          1HG       PRO  67  -1.260 -11.065  -6.416
  532   2HG   PRO  67          2HG       PRO  67  -0.696 -12.721  -6.523
  533   1HD   PRO  67          1HD       PRO  67   0.626 -10.540  -5.211
  534   2HD   PRO  67          2HD       PRO  67   1.243 -12.167  -5.419
  535    H    ARG  68           H        ARG  68   1.530  -9.476 -10.543
  536    HA   ARG  68           HA       ARG  68   1.517  -6.870  -9.558
  537   1HB   ARG  68          1HB       ARG  68   1.287  -6.298 -12.077
  538   2HB   ARG  68          2HB       ARG  68   2.687  -7.243 -11.611
  539   1HG   ARG  68          1HG       ARG  68   2.002  -9.062 -12.809
  540   2HG   ARG  68          2HG       ARG  68   0.363  -8.956 -12.199
  541   1HD   ARG  68          1HD       ARG  68  -0.379  -7.780 -14.028
  542   2HD   ARG  68          2HD       ARG  68   1.047  -6.762 -14.076
  543    HE   ARG  68           HE       ARG  68   1.575  -9.527 -14.894
  544   1HH1  ARG  68          2HH2      ARG  68   0.529  -6.348 -15.981
  545   2HH1  ARG  68          1HH2      ARG  68   0.964  -6.629 -17.634
  546   1HH2  ARG  68          2HH1      ARG  68   2.150  -9.898 -17.075
  547   2HH2  ARG  68          1HH1      ARG  68   1.893  -8.662 -18.260
  548    H    HIS  69           H        HIS  69  -0.984  -9.090 -10.747
  549    HA   HIS  69           HA       HIS  69  -2.928  -7.268 -11.471
  550   1HB   HIS  69          1HB       HIS  69  -2.681 -10.026 -11.285
  551   2HB   HIS  69          2HB       HIS  69  -3.951  -9.665 -10.133
  552    HD1  HIS  69           1HD      HIS  69  -6.162  -8.549 -11.077
  553    HD2  HIS  69           2HD      HIS  69  -3.371  -9.710 -13.985
  554    HE1  HIS  69           1HE      HIS  69  -7.399  -8.516 -13.309
  555    H    LEU  70           H        LEU  70  -2.028  -8.616  -8.254
  556    HA   LEU  70           HA       LEU  70  -4.184  -7.308  -6.931
  557   1HB   LEU  70          1HB       LEU  70  -3.518  -9.203  -5.844
  558   2HB   LEU  70          2HB       LEU  70  -1.815  -8.940  -6.165
  559    HG   LEU  70           HG       LEU  70  -2.096  -6.914  -4.514
  560   1HD1  LEU  70          1HD1      LEU  70  -4.649  -7.400  -4.472
  561   2HD1  LEU  70          2HD1      LEU  70  -4.212  -8.677  -3.312
  562   3HD1  LEU  70          3HD1      LEU  70  -3.810  -6.980  -2.959
  563   1HD2  LEU  70          1HD2      LEU  70  -1.372  -8.303  -2.690
  564   2HD2  LEU  70          2HD2      LEU  70  -2.071  -9.751  -3.454
  565   3HD2  LEU  70          3HD2      LEU  70  -0.678  -8.933  -4.203
  566    H    SER  71           H        SER  71  -0.698  -6.636  -7.531
  567    HA   SER  71           HA       SER  71  -0.458  -4.487  -5.856
  568   1HB   SER  71          1HB       SER  71   1.094  -5.762  -7.842
  569   2HB   SER  71          2HB       SER  71   0.990  -4.096  -8.376
  570    HG   SER  71           HG       SER  71   2.794  -4.692  -6.839
  571    H    LEU  72           H        LEU  72  -2.036  -4.810  -9.021
  572    HA   LEU  72           HA       LEU  72  -2.145  -2.021  -9.558
  573   1HB   LEU  72          1HB       LEU  72  -2.260  -3.296 -11.453
  574   2HB   LEU  72          2HB       LEU  72  -3.283  -4.516 -10.721
  575    HG   LEU  72           HG       LEU  72  -5.194  -2.914 -10.797
  576   1HD1  LEU  72          1HD1      LEU  72  -3.687  -0.868 -10.841
  577   2HD1  LEU  72          2HD1      LEU  72  -3.469  -1.189 -12.578
  578   3HD1  LEU  72          3HD1      LEU  72  -5.093  -0.850 -11.932
  579   1HD2  LEU  72          1HD2      LEU  72  -4.278  -3.049 -13.615
  580   2HD2  LEU  72          2HD2      LEU  72  -4.308  -4.582 -12.711
  581   3HD2  LEU  72          3HD2      LEU  72  -5.791  -3.609 -12.863
  582    H    ALA  73           H        ALA  73  -4.422  -4.465  -8.170
  583    HA   ALA  73           HA       ALA  73  -6.493  -2.572  -7.787
  584   1HB   ALA  73          1HB       ALA  73  -7.086  -4.583  -6.067
  585   2HB   ALA  73          2HB       ALA  73  -7.366  -4.686  -7.822
  586   3HB   ALA  73          3HB       ALA  73  -5.907  -5.416  -7.109
  587    H    LEU  74           H        LEU  74  -3.713  -3.754  -5.863
  588    HA   LEU  74           HA       LEU  74  -4.461  -2.837  -3.382
  589   1HB   LEU  74          1HB       LEU  74  -1.949  -3.496  -4.776
  590   2HB   LEU  74          2HB       LEU  74  -1.772  -2.420  -3.404
  591    HG   LEU  74           HG       LEU  74  -3.311  -5.003  -3.163
  592   1HD1  LEU  74          1HD1      LEU  74  -0.375  -4.798  -2.513
  593   2HD1  LEU  74          2HD1      LEU  74  -1.398  -6.247  -2.662
  594   3HD1  LEU  74          3HD1      LEU  74  -0.947  -5.323  -4.115
  595   1HD2  LEU  74          1HD2      LEU  74  -2.475  -2.862  -1.371
  596   2HD2  LEU  74          2HD2      LEU  74  -3.678  -4.154  -1.137
  597   3HD2  LEU  74          3HD2      LEU  74  -1.958  -4.467  -0.801
  598    H    PHE  75           H        PHE  75  -2.686  -1.073  -6.009
  599    HA   PHE  75           HA       PHE  75  -2.492   1.324  -4.601
  600   1HB   PHE  75          1HB       PHE  75  -1.522   0.288  -6.921
  601   2HB   PHE  75          2HB       PHE  75  -2.882   1.147  -7.616
  602    HD1  PHE  75           1HD      PHE  75  -1.974   2.948  -8.758
  603    HD2  PHE  75           2HD      PHE  75  -0.619   2.131  -4.820
  604    HE1  PHE  75           1HE      PHE  75  -0.625   5.065  -8.782
  605    HE2  PHE  75           2HE      PHE  75   0.730   4.247  -4.845
  606    HZ   PHE  75           HZ       PHE  75   0.711   5.689  -6.826
  607    H    GLN  76           H        GLN  76  -5.023   0.001  -6.796
  608    HA   GLN  76           HA       GLN  76  -6.457   2.281  -7.182
  609   1HB   GLN  76          1HB       GLN  76  -7.134  -0.650  -7.091
  610   2HB   GLN  76          2HB       GLN  76  -8.462   0.491  -7.161
  611   1HG   GLN  76          1HG       GLN  76  -6.950   1.577  -9.114
  612   2HG   GLN  76          2HG       GLN  76  -6.314  -0.053  -9.204
  613   1HE2  GLN  76          1HE2      GLN  76  -7.789  -1.821  -9.505
  614   2HE2  GLN  76          2HE2      GLN  76  -9.267  -1.601 -10.380
  615    H    SER  77           H        SER  77  -6.022   0.394  -4.258
  616    HA   SER  77           HA       SER  77  -8.383   1.068  -2.971
  617   1HB   SER  77          1HB       SER  77  -6.520  -0.657  -2.347
  618   2HB   SER  77          2HB       SER  77  -5.728   0.687  -1.550
  619    HG   SER  77           HG       SER  77  -8.446  -0.166  -1.016
  620    H    PHE  78           H        PHE  78  -5.067   2.557  -2.844
  621    HA   PHE  78           HA       PHE  78  -6.372   5.063  -2.077
  622   1HB   PHE  78          1HB       PHE  78  -4.584   3.332  -0.556
  623   2HB   PHE  78          2HB       PHE  78  -3.696   4.791  -0.951
  624    HD1  PHE  78           1HD      PHE  78  -4.235   6.884   0.079
  625    HD2  PHE  78           2HD      PHE  78  -6.650   3.471   0.804
  626    HE1  PHE  78           1HE      PHE  78  -5.356   8.081   1.979
  627    HE2  PHE  78           2HE      PHE  78  -7.771   4.667   2.704
  628    HZ   PHE  78           HZ       PHE  78  -7.110   6.958   3.269
  629    H    GLU  79           H        GLU  79  -5.403   6.958  -2.913
  630    HA   GLU  79           HA       GLU  79  -2.889   6.836  -4.175
  631   1HB   GLU  79          1HB       GLU  79  -4.073   5.707  -5.967
  632   2HB   GLU  79          2HB       GLU  79  -5.376   6.878  -5.931
  633   1HG   GLU  79          1HG       GLU  79  -3.986   8.622  -6.833
  634   2HG   GLU  79          2HG       GLU  79  -2.512   7.731  -6.505
  635    H    THR  80           H        THR  80  -2.171   8.755  -3.334
  636    HA   THR  80           HA       THR  80  -3.724  10.866  -2.529
  637    HB   THR  80           HB       THR  80  -1.102  10.208  -2.379
  638    HG1  THR  80           1HG      THR  80  -2.222  12.921  -2.494
  639   1HG2  THR  80          1HG2      THR  80  -0.618  10.879  -4.763
  640   2HG2  THR  80          2HG2      THR  80  -1.239  12.507  -4.401
  641   3HG2  THR  80          3HG2      THR  80   0.230  11.915  -3.590
  642    H    GLY  81           H        GLY  81  -2.935   9.884  -5.794
  643   1HA   GLY  81          1HA       GLY  81  -3.023  12.220  -7.216
  644   2HA   GLY  81          2HA       GLY  81  -3.664  10.685  -7.767
  645    H    HIS  82           H        HIS  82  -5.941  10.087  -6.973
  646    HA   HIS  82           HA       HIS  82  -8.082  10.610  -7.178
  647   1HB   HIS  82          1HB       HIS  82  -7.508  10.934  -4.738
  648   2HB   HIS  82          2HB       HIS  82  -7.450  12.659  -5.040
  649    HD1  HIS  82           1HD      HIS  82  -9.498  11.681  -3.035
  650    HD2  HIS  82           2HD      HIS  82 -10.316  12.007  -7.137
  651    HE1  HIS  82           1HE      HIS  82 -12.034  11.866  -3.246
  652    H    CYS  83           H        CYS  83  -6.575  11.834  -9.211
  653    HA   CYS  83           HA       CYS  83  -8.364  13.916  -9.917
  654   1HB   CYS  83          1HB       CYS  83  -6.392  14.922  -8.391
  655   2HB   CYS  83          2HB       CYS  83  -5.557  14.934  -9.932
  656    HG   CYS  83           HG       CYS  83  -6.425  17.121 -10.355
  657    H    LEU  84           H        LEU  84  -8.554  13.828 -12.155
  658    HA   LEU  84           HA       LEU  84  -6.320  12.601 -13.607
  659   1HB   LEU  84          1HB       LEU  84  -9.238  11.895 -13.673
  660   2HB   LEU  84          2HB       LEU  84  -8.214  11.614 -15.066
  661    HG   LEU  84           HG       LEU  84  -8.473   9.601 -13.705
  662   1HD1  LEU  84          1HD1      LEU  84  -6.372  10.063 -14.998
  663   2HD1  LEU  84          2HD1      LEU  84  -5.629  10.607 -13.474
  664   3HD1  LEU  84          3HD1      LEU  84  -6.188   8.925 -13.641
  665   1HD2  LEU  84          1HD2      LEU  84  -6.812  10.632 -11.473
  666   2HD2  LEU  84          2HD2      LEU  84  -8.504  11.179 -11.531
  667   3HD2  LEU  84          3HD2      LEU  84  -8.133   9.439 -11.476
  668    H    ASN  85           H        ASN  85  -6.588  15.367 -13.232
  669    HA   ASN  85           HA       ASN  85  -6.641  16.187 -15.887
  670   1HB   ASN  85          1HB       ASN  85  -8.572  17.900 -15.558
  671   2HB   ASN  85          2HB       ASN  85  -9.038  16.236 -15.851
  672   1HD2  ASN  85          1HD2      ASN  85 -10.993  16.407 -14.842
  673   2HD2  ASN  85          2HD2      ASN  85 -11.194  16.552 -13.128
  674    H    GLU  86           H        GLU  86  -4.542  16.671 -14.568
  675    HA   GLU  86           HA       GLU  86  -4.795  19.360 -13.527
  676   1HB   GLU  86          1HB       GLU  86  -4.573  17.276 -11.762
  677   2HB   GLU  86          2HB       GLU  86  -2.877  17.615 -12.048
  678   1HG   GLU  86          1HG       GLU  86  -3.039  19.833 -11.223
  679   2HG   GLU  86          2HG       GLU  86  -4.772  19.909 -11.474
  680    H    THR  87           H        THR  87  -1.878  19.169 -12.640
  681    HA   THR  87           HA       THR  87  -0.532  18.688 -15.180
  682    HB   THR  87           HB       THR  87  -0.822  21.386 -13.780
  683    HG1  THR  87           1HG      THR  87  -2.039  21.586 -15.615
  684   1HG2  THR  87          1HG2      THR  87   1.374  20.328 -15.576
  685   2HG2  THR  87          2HG2      THR  87   0.783  21.986 -15.844
  686   3HG2  THR  87          3HG2      THR  87   1.477  21.533 -14.269
  687    H    ASN  88           H        ASN  88  -0.449  17.077 -12.913
  688    HA   ASN  88           HA       ASN  88   2.330  17.334 -12.343
  689   1HB   ASN  88          1HB       ASN  88   0.923  18.682 -10.541
  690   2HB   ASN  88          2HB       ASN  88   0.485  17.098  -9.933
  691   1HD2  ASN  88          1HD2      ASN  88   1.554  17.457  -8.004
  692   2HD2  ASN  88          2HD2      ASN  88   3.278  17.407  -7.849
  693    H    VAL  89           H        VAL  89   1.033  15.408 -13.861
  694    HA   VAL  89           HA       VAL  89   0.745  13.132 -12.024
  695    HB   VAL  89           HB       VAL  89  -0.379  13.411 -14.813
  696   1HG1  VAL  89          1HG1      VAL  89  -0.543  11.177 -14.506
  697   2HG1  VAL  89          2HG1      VAL  89  -0.374  11.299 -12.738
  698   3HG1  VAL  89          3HG1      VAL  89  -1.949  11.613 -13.506
  699   1HG2  VAL  89          1HG2      VAL  89  -1.411  15.127 -13.456
  700   2HG2  VAL  89          2HG2      VAL  89  -2.574  13.801 -13.695
  701   3HG2  VAL  89          3HG2      VAL  89  -1.716  13.964 -12.144
  702    H    THR  90           H        THR  90   3.311  14.138 -12.763
  703    HA   THR  90           HA       THR  90   4.172  12.128 -14.736
  704    HB   THR  90           HB       THR  90   4.585  14.483 -15.407
  705    HG1  THR  90           1HG      THR  90   6.927  14.125 -15.581
  706   1HG2  THR  90          1HG2      THR  90   5.220  14.814 -12.607
  707   2HG2  THR  90          2HG2      THR  90   6.704  15.111 -13.545
  708   3HG2  THR  90          3HG2      THR  90   5.233  16.055 -13.883
  709    H    LYS  91           H        LYS  91   4.005  12.828 -11.415
  710    HA   LYS  91           HA       LYS  91   6.244  10.983 -10.960
  711   1HB   LYS  91          1HB       LYS  91   5.484  13.195  -9.048
  712   2HB   LYS  91          2HB       LYS  91   6.919  12.190  -9.034
  713   1HG   LYS  91          1HG       LYS  91   7.998  13.673 -10.363
  714   2HG   LYS  91          2HG       LYS  91   6.794  13.452 -11.617
  715   1HD   LYS  91          1HD       LYS  91   6.971  15.840 -10.898
  716   2HD   LYS  91          2HD       LYS  91   5.364  15.193 -10.636
  717   1HE   LYS  91          1HE       LYS  91   5.522  15.797  -8.456
  718   2HE   LYS  91          2HE       LYS  91   6.786  14.602  -8.249
  719   1HZ   LYS  91          1HZ       LYS  91   7.031  17.450  -8.688
  720   2HZ   LYS  91          2HZ       LYS  91   7.896  16.470  -7.709
  721   3HZ   LYS  91          3HZ       LYS  91   8.202  16.498  -9.313
  722    H    ASP  92           H        ASP  92   4.577   9.297 -11.175
  723    HA   ASP  92           HA       ASP  92   2.311   9.269  -9.612
  724   1HB   ASP  92          1HB       ASP  92   2.652   6.663  -9.880
  725   2HB   ASP  92          2HB       ASP  92   2.318   7.644 -11.293
  726    H    VAL  93           H        VAL  93   2.925   9.946  -7.426
  727    HA   VAL  93           HA       VAL  93   4.351   7.848  -5.948
  728    HB   VAL  93           HB       VAL  93   5.342   9.592  -4.555
  729   1HG1  VAL  93          1HG1      VAL  93   7.098   9.433  -5.917
  730   2HG1  VAL  93          2HG1      VAL  93   6.022   8.975  -7.258
  731   3HG1  VAL  93          3HG1      VAL  93   6.406  10.689  -6.971
  732   1HG2  VAL  93          1HG2      VAL  93   3.569  11.310  -4.932
  733   2HG2  VAL  93          2HG2      VAL  93   5.224  11.939  -5.119
  734   3HG2  VAL  93          3HG2      VAL  93   4.238  11.588  -6.558
  735    H    VAL  94           H        VAL  94   3.899   8.356  -3.417
  736    HA   VAL  94           HA       VAL  94   1.323   9.458  -2.902
  737    HB   VAL  94           HB       VAL  94   0.576   7.411  -3.911
  738   1HG1  VAL  94          1HG1      VAL  94   2.530   6.064  -2.028
  739   2HG1  VAL  94          2HG1      VAL  94   1.213   5.194  -2.849
  740   3HG1  VAL  94          3HG1      VAL  94   2.484   5.992  -3.805
  741   1HG2  VAL  94          1HG2      VAL  94   0.327   6.860  -0.959
  742   2HG2  VAL  94          2HG2      VAL  94  -0.404   8.316  -1.676
  743   3HG2  VAL  94          3HG2      VAL  94  -0.892   6.702  -2.246
  744    H    CYS  95           H        CYS  95   0.822   9.373  -0.550
  745    HA   CYS  95           HA       CYS  95   3.230   9.680   0.920
  746   1HB   CYS  95          1HB       CYS  95   1.440  11.180   1.418
  747   2HB   CYS  95          2HB       CYS  95   0.303   9.871   1.672
  748    HG   CYS  95           HG       CYS  95   1.595  11.374   3.810
  749    H    LEU  96           H        LEU  96   4.159   8.235   2.403
  750    HA   LEU  96           HA       LEU  96   3.436   5.517   2.164
  751   1HB   LEU  96          1HB       LEU  96   5.467   7.125   3.608
  752   2HB   LEU  96          2HB       LEU  96   5.101   5.546   4.273
  753    HG   LEU  96           HG       LEU  96   5.431   5.080   1.532
  754   1HD1  LEU  96          1HD1      LEU  96   7.480   6.099   0.874
  755   2HD1  LEU  96          2HD1      LEU  96   6.392   7.400   1.413
  756   3HD1  LEU  96          3HD1      LEU  96   7.704   6.839   2.477
  757   1HD2  LEU  96          1HD2      LEU  96   7.733   4.694   3.394
  758   2HD2  LEU  96          2HD2      LEU  96   6.194   3.883   3.769
  759   3HD2  LEU  96          3HD2      LEU  96   7.006   3.576   2.215
  760    H    ASN  97           H        ASN  97   2.932   8.049   4.682
  761    HA   ASN  97           HA       ASN  97   1.891   6.392   6.602
  762   1HB   ASN  97          1HB       ASN  97   2.454   9.007   6.556
  763   2HB   ASN  97          2HB       ASN  97   0.758   9.174   6.146
  764   1HD2  ASN  97          1HD2      ASN  97  -0.592   9.398   7.749
  765   2HD2  ASN  97          2HD2      ASN  97  -0.381   8.873   9.386
  766    H    ASP  98           H        ASP  98   0.498   7.854   3.650
  767    HA   ASP  98           HA       ASP  98  -2.177   7.516   4.300
  768   1HB   ASP  98          1HB       ASP  98  -0.548   8.032   1.867
  769   2HB   ASP  98          2HB       ASP  98  -2.067   7.224   1.535
  770    H    VAL  99           H        VAL  99   0.313   5.442   2.712
  771    HA   VAL  99           HA       VAL  99  -1.531   3.383   2.023
  772    HB   VAL  99           HB       VAL  99   1.485   3.523   2.153
  773   1HG1  VAL  99          1HG1      VAL  99   1.543   1.305   1.934
  774   2HG1  VAL  99          2HG1      VAL  99  -0.235   1.220   1.905
  775   3HG1  VAL  99          3HG1      VAL  99   0.669   1.467   0.391
  776   1HG2  VAL  99          1HG2      VAL  99  -0.322   3.494  -0.281
  777   2HG2  VAL  99          2HG2      VAL  99   0.260   4.988   0.491
  778   3HG2  VAL  99          3HG2      VAL  99   1.423   3.838  -0.212
  779    H    SER 100           H        SER 100   0.503   4.224   4.818
  780    HA   SER 100           HA       SER 100   0.323   1.662   5.980
  781   1HB   SER 100          1HB       SER 100   2.125   3.341   6.479
  782   2HB   SER 100          2HB       SER 100   0.940   4.352   7.282
  783    HG   SER 100           HG       SER 100   1.320   1.610   8.080
  784    H    CYS 101           H        CYS 101  -1.773   4.457   5.746
  785    HA   CYS 101           HA       CYS 101  -3.226   3.959   8.133
  786   1HB   CYS 101          1HB       CYS 101  -3.002   6.140   6.624
  787   2HB   CYS 101          2HB       CYS 101  -4.422   5.476   5.840
  788    HG   CYS 101           HG       CYS 101  -5.031   7.295   7.703
  789    H    TYR 102           H        TYR 102  -3.648   3.298   4.592
  790    HA   TYR 102           HA       TYR 102  -6.144   2.065   4.794
  791   1HB   TYR 102          1HB       TYR 102  -5.333   2.708   2.622
  792   2HB   TYR 102          2HB       TYR 102  -3.719   2.112   2.953
  793    HD1  TYR 102           1HD      TYR 102  -7.090   0.456   3.074
  794    HD2  TYR 102           2HD      TYR 102  -3.160   0.497   1.384
  795    HE1  TYR 102           1HE      TYR 102  -7.610  -1.679   1.795
  796    HE2  TYR 102           2HE      TYR 102  -3.693  -1.638   0.111
  797    HH   TYR 102           HH       TYR 102  -5.970  -2.693  -0.758
  798    H    PHE 103           H        PHE 103  -2.814   0.612   4.613
  799    HA   PHE 103           HA       PHE 103  -3.648  -2.017   4.836
  800   1HB   PHE 103          1HB       PHE 103  -1.166  -0.372   5.496
  801   2HB   PHE 103          2HB       PHE 103  -1.180  -2.065   5.948
  802    HD1  PHE 103           1HD      PHE 103   0.326  -0.203   3.730
  803    HD2  PHE 103           2HD      PHE 103  -2.563  -3.311   3.677
  804    HE1  PHE 103           1HE      PHE 103   1.041  -0.829   1.407
  805    HE2  PHE 103           2HE      PHE 103  -1.847  -3.937   1.354
  806    HZ   PHE 103           HZ       PHE 103  -0.054  -2.688   0.246
  807    H    SER 104           H        SER 104  -3.104   0.503   7.313
  808    HA   SER 104           HA       SER 104  -2.920  -1.153   9.500
  809   1HB   SER 104          1HB       SER 104  -2.396   1.215   9.652
  810   2HB   SER 104          2HB       SER 104  -4.025   1.668   9.194
  811    HG   SER 104           HG       SER 104  -3.236   0.311  11.630
  812    H    LEU 105           H        LEU 105  -5.692  -0.123   7.535
  813    HA   LEU 105           HA       LEU 105  -7.654  -0.859   9.468
  814   1HB   LEU 105          1HB       LEU 105  -7.955  -0.432   6.494
  815   2HB   LEU 105          2HB       LEU 105  -9.236  -0.448   7.690
  816    HG   LEU 105           HG       LEU 105  -7.303   1.690   6.991
  817   1HD1  LEU 105          1HD1      LEU 105  -9.433   2.967   7.951
  818   2HD1  LEU 105          2HD1      LEU 105  -9.388   2.288   6.306
  819   3HD1  LEU 105          3HD1      LEU 105 -10.202   1.397   7.615
  820   1HD2  LEU 105          1HD2      LEU 105  -7.739   2.735   9.306
  821   2HD2  LEU 105          2HD2      LEU 105  -8.065   1.068   9.837
  822   3HD2  LEU 105          3HD2      LEU 105  -6.474   1.491   9.160
  823    H    LEU 106           H        LEU 106  -5.928  -2.433   6.762
  824    HA   LEU 106           HA       LEU 106  -7.586  -4.661   6.534
  825   1HB   LEU 106          1HB       LEU 106  -4.905  -3.832   5.680
  826   2HB   LEU 106          2HB       LEU 106  -5.071  -5.563   5.900
  827    HG   LEU 106           HG       LEU 106  -5.508  -4.593   3.572
  828   1HD1  LEU 106          1HD1      LEU 106  -6.700  -6.445   3.050
  829   2HD1  LEU 106          2HD1      LEU 106  -6.308  -6.875   4.733
  830   3HD1  LEU 106          3HD1      LEU 106  -7.899  -6.179   4.339
  831   1HD2  LEU 106          1HD2      LEU 106  -7.355  -3.020   4.997
  832   2HD2  LEU 106          2HD2      LEU 106  -7.115  -3.101   3.235
  833   3HD2  LEU 106          3HD2      LEU 106  -8.321  -4.151   4.018
  834    H    GLU 107           H        GLU 107  -4.730  -3.988   8.640
  835    HA   GLU 107           HA       GLU 107  -4.476  -6.480   9.711
  836   1HB   GLU 107          1HB       GLU 107  -3.949  -3.703  10.809
  837   2HB   GLU 107          2HB       GLU 107  -3.635  -5.118  11.794
  838   1HG   GLU 107          1HG       GLU 107  -2.046  -6.001  10.182
  839   2HG   GLU 107          2HG       GLU 107  -2.518  -4.824   8.972
  840    H    GLY 108           H        GLY 108  -6.526  -3.718  10.874
  841   1HA   GLY 108          1HA       GLY 108  -8.813  -4.683  11.516
  842   2HA   GLY 108          2HA       GLY 108  -7.890  -5.585  12.702
  843    H    GLY 109           H        GLY 109  -8.287  -2.183  11.480
  844   1HA   GLY 109          1HA       GLY 109  -8.020  -1.276  14.286
  845   2HA   GLY 109          2HA       GLY 109  -7.407  -0.389  12.904
  846    H    ARG 110           H        ARG 110  -8.708   1.147  11.973
  847    HA   ARG 110           HA       ARG 110 -11.535   0.947  12.642
  848   1HB   ARG 110          1HB       ARG 110  -9.752   3.414  12.373
  849   2HB   ARG 110          2HB       ARG 110 -11.500   3.518  12.434
  850   1HG   ARG 110          1HG       ARG 110 -11.301   2.102  14.635
  851   2HG   ARG 110          2HG       ARG 110  -9.604   2.539  14.599
  852   1HD   ARG 110          1HD       ARG 110 -10.018   4.723  15.190
  853   2HD   ARG 110          2HD       ARG 110 -11.427   4.844  14.155
  854    HE   ARG 110           HE       ARG 110 -11.421   4.180  16.977
  855   1HH1  ARG 110          2HH2      ARG 110 -13.134   3.569  13.964
  856   2HH1  ARG 110          1HH2      ARG 110 -14.635   3.199  14.745
  857   1HH2  ARG 110          2HH1      ARG 110 -13.401   3.691  18.007
  858   2HH2  ARG 110          1HH1      ARG 110 -14.788   3.268  17.059
  859    HA   PRO 111           HA       PRO 111 -12.056   1.069   8.302
  860   1HB   PRO 111          1HB       PRO 111 -14.768   1.381   8.181
  861   2HB   PRO 111          2HB       PRO 111 -13.992  -0.171   8.427
  862   1HG   PRO 111          1HG       PRO 111 -15.402   1.529  10.392
  863   2HG   PRO 111          2HG       PRO 111 -15.001  -0.173  10.501
  864   1HD   PRO 111          1HD       PRO 111 -13.661   1.993  11.820
  865   2HD   PRO 111          2HD       PRO 111 -13.192   0.305  11.836
  866    H    GLU 112           H        GLU 112 -12.613   2.394   6.448
  867    HA   GLU 112           HA       GLU 112 -13.343   5.073   7.184
  868   1HB   GLU 112          1HB       GLU 112 -10.687   4.609   7.193
  869   2HB   GLU 112          2HB       GLU 112 -10.881   4.864   5.470
  870   1HG   GLU 112          1HG       GLU 112 -12.266   6.852   7.228
  871   2HG   GLU 112          2HG       GLU 112 -10.515   6.892   7.280
  872    H    ASP 113           H        ASP 113 -12.276   2.753   4.628
  873    HA   ASP 113           HA       ASP 113 -13.529   4.264   2.588
  874   1HB   ASP 113          1HB       ASP 113 -12.201   1.554   2.800
  875   2HB   ASP 113          2HB       ASP 113 -13.164   1.904   1.378
  876    H    LYS 114           H        LYS 114 -15.672   4.270   3.958
  877    HA   LYS 114           HA       LYS 114 -17.101   1.795   4.070
  878   1HB   LYS 114          1HB       LYS 114 -18.881   3.125   5.038
  879   2HB   LYS 114          2HB       LYS 114 -17.352   3.526   5.793
  880   1HG   LYS 114          1HG       LYS 114 -17.152   5.579   4.505
  881   2HG   LYS 114          2HG       LYS 114 -18.485   5.129   3.460
  882   1HD   LYS 114          1HD       LYS 114 -20.096   5.712   5.017
  883   2HD   LYS 114          2HD       LYS 114 -19.120   5.206   6.382
  884   1HE   LYS 114          1HE       LYS 114 -17.672   7.239   6.084
  885   2HE   LYS 114          2HE       LYS 114 -18.679   7.750   4.744
  886   1HZ   LYS 114          1HZ       LYS 114 -20.340   7.194   6.886
  887   2HZ   LYS 114          2HZ       LYS 114 -19.125   8.126   7.455
  888   3HZ   LYS 114          3HZ       LYS 114 -20.035   8.646   6.203
  889    H    LEU 115           H        LEU 115 -19.713   2.685   3.286
  890    HA   LEU 115           HA       LEU 115 -19.709   1.952   0.631
  891   1HB   LEU 115          1HB       LEU 115 -21.872   3.697   1.725
  892   2HB   LEU 115          2HB       LEU 115 -21.983   2.294   0.680
  893    HG   LEU 115           HG       LEU 115 -20.952   1.210   3.001
  894   1HD1  LEU 115          1HD1      LEU 115 -22.537   3.640   3.675
  895   2HD1  LEU 115          2HD1      LEU 115 -22.829   2.168   4.634
  896   3HD1  LEU 115          3HD1      LEU 115 -21.192   2.861   4.544
  897   1HD2  LEU 115          1HD2      LEU 115 -22.740   0.318   1.529
  898   2HD2  LEU 115          2HD2      LEU 115 -23.113   0.177   3.264
  899   3HD2  LEU 115          3HD2      LEU 115 -23.887   1.448   2.287
  900    H    GLU 116           H        GLU 116 -20.396   3.259  -1.296
  901    HA   GLU 116           HA       GLU 116 -19.808   6.055  -1.112
  902   1HB   GLU 116          1HB       GLU 116 -18.240   4.722  -3.271
  903   2HB   GLU 116          2HB       GLU 116 -17.840   6.128  -2.305
  904   1HG   GLU 116          1HG       GLU 116 -17.297   4.698  -0.365
  905   2HG   GLU 116          2HG       GLU 116 -17.821   3.268  -1.232
  906    H    TRP 117           H        TRP 117 -21.037   7.203  -2.593
  907    HA   TRP 117           HA       TRP 117 -22.704   5.593  -4.348
  908   1HB   TRP 117          1HB       TRP 117 -22.834   8.491  -3.502
  909   2HB   TRP 117          2HB       TRP 117 -23.941   7.743  -4.636
  910    HD1  TRP 117           HD       TRP 117 -24.348   4.954  -2.958
  911    HE1  TRP 117           1HE      TRP 117 -25.824   4.892  -0.772
  912    HE3  TRP 117           3HE      TRP 117 -24.045   9.935  -1.982
  913    HZ2  TRP 117           2HZ      TRP 117 -26.680   6.888   1.079
  914    HZ3  TRP 117           3HZ      TRP 117 -25.230  10.797   0.035
  915    HH2  TRP 117           HH       TRP 117 -26.514   9.362   1.540
  916    H    SER 118           H        SER 118 -22.303   8.853  -5.372
  917    HA   SER 118           HA       SER 118 -20.170   8.124  -7.193
  918   1HB   SER 118          1HB       SER 118 -22.385   7.681  -8.318
  919   2HB   SER 118          2HB       SER 118 -22.800   9.370  -8.106
  920    HG   SER 118           HG       SER 118 -21.160   8.178 -10.004
  Start of MODEL   10
    1   1H    MET   1           H        MET   1 -21.137   0.152   8.858
    2    HA   MET   1           HA       MET   1 -21.944   1.892  10.482
    3   1HB   MET   1          1HB       MET   1 -18.978   1.558  11.174
    4   2HB   MET   1          2HB       MET   1 -19.870   3.005  11.601
    5   1HG   MET   1          1HG       MET   1 -21.499   0.822  12.454
    6   2HG   MET   1          2HG       MET   1 -19.864   0.401  12.923
    7   1HE   MET   1          1HE       MET   1 -18.718   3.007  15.334
    8   2HE   MET   1          2HE       MET   1 -18.322   1.724  14.165
    9   3HE   MET   1          3HE       MET   1 -18.486   3.409  13.615
   10    H    ALA   2           H        ALA   2 -22.271   2.299   8.091
   11    HA   ALA   2           HA       ALA   2 -21.784   3.291   6.141
   12   1HB   ALA   2          1HB       ALA   2 -20.600   5.685   7.293
   13   2HB   ALA   2          2HB       ALA   2 -22.211   5.456   6.571
   14   3HB   ALA   2          3HB       ALA   2 -21.951   5.103   8.296
   15    H    LYS   3           H        LYS   3 -19.765   1.438   6.768
   16    HA   LYS   3           HA       LYS   3 -17.235   2.794   6.442
   17   1HB   LYS   3          1HB       LYS   3 -17.629   0.765   7.920
   18   2HB   LYS   3          2HB       LYS   3 -17.786  -0.183   6.455
   19   1HG   LYS   3          1HG       LYS   3 -15.514  -0.430   6.674
   20   2HG   LYS   3          2HG       LYS   3 -15.463   1.130   5.877
   21   1HD   LYS   3          1HD       LYS   3 -15.464   2.256   8.131
   22   2HD   LYS   3          2HD       LYS   3 -15.450   0.681   8.900
   23   1HE   LYS   3          1HE       LYS   3 -13.170   0.937   8.850
   24   2HE   LYS   3          2HE       LYS   3 -13.323   0.383   7.194
   25   1HZ   LYS   3          1HZ       LYS   3 -13.303   2.578   6.428
   26   2HZ   LYS   3          2HZ       LYS   3 -13.520   3.218   7.915
   27   3HZ   LYS   3          3HZ       LYS   3 -12.101   2.506   7.532
   28    H    GLU   4           H        GLU   4 -16.852  -0.010   4.755
   29    HA   GLU   4           HA       GLU   4 -16.496  -0.465   2.662
   30   1HB   GLU   4          1HB       GLU   4 -18.807   1.238   1.735
   31   2HB   GLU   4          2HB       GLU   4 -18.322  -0.355   1.190
   32   1HG   GLU   4          1HG       GLU   4 -19.955  -1.172   2.545
   33   2HG   GLU   4          2HG       GLU   4 -18.890  -0.799   3.886
   34    H    ARG   5           H        ARG   5 -14.713   0.340   1.649
   35    HA   ARG   5           HA       ARG   5 -14.849   2.630   0.119
   36   1HB   ARG   5          1HB       ARG   5 -14.593   3.426   2.709
   37   2HB   ARG   5          2HB       ARG   5 -12.898   3.159   2.354
   38   1HG   ARG   5          1HG       ARG   5 -13.064   5.358   1.640
   39   2HG   ARG   5          2HG       ARG   5 -13.487   4.559   0.138
   40   1HD   ARG   5          1HD       ARG   5 -15.672   5.221   2.135
   41   2HD   ARG   5          2HD       ARG   5 -15.041   6.487   1.100
   42    HE   ARG   5           HE       ARG   5 -16.699   4.221   0.272
   43   1HH1  ARG   5          2HH2      ARG   5 -14.374   6.629  -0.813
   44   2HH1  ARG   5          1HH2      ARG   5 -14.883   6.561  -2.467
   45   1HH2  ARG   5          2HH1      ARG   5 -17.372   4.131  -1.910
   46   2HH2  ARG   5          1HH1      ARG   5 -16.600   5.131  -3.095
   47    H    GLY   6           H        GLY   6 -13.042   2.688  -1.311
   48   1HA   GLY   6          1HA       GLY   6 -11.207   1.923  -2.357
   49   2HA   GLY   6          2HA       GLY   6 -10.503   1.670  -0.772
   50    H    LEU   7           H        LEU   7 -13.522   0.008  -1.235
   51    HA   LEU   7           HA       LEU   7 -12.550  -2.479  -0.733
   52   1HB   LEU   7          1HB       LEU   7 -14.988  -1.483  -2.167
   53   2HB   LEU   7          2HB       LEU   7 -14.677  -3.203  -2.045
   54    HG   LEU   7           HG       LEU   7 -14.673  -1.489   0.429
   55   1HD1  LEU   7          1HD1      LEU   7 -17.159  -2.389   0.565
   56   2HD1  LEU   7          2HD1      LEU   7 -16.763  -0.846  -0.228
   57   3HD1  LEU   7          3HD1      LEU   7 -17.033  -2.306  -1.209
   58   1HD2  LEU   7          1HD2      LEU   7 -14.098  -4.138   0.011
   59   2HD2  LEU   7          2HD2      LEU   7 -14.607  -3.419   1.558
   60   3HD2  LEU   7          3HD2      LEU   7 -15.809  -4.195   0.498
   61    H    ILE   8           H        ILE   8 -11.518  -4.095  -1.838
   62    HA   ILE   8           HA       ILE   8 -11.051  -3.567  -4.692
   63    HB   ILE   8           HB       ILE   8  -8.923  -4.928  -4.246
   64   1HG1  ILE   8          1HG1      ILE   8  -9.626  -4.123  -1.409
   65   2HG1  ILE   8          2HG1      ILE   8  -9.456  -5.754  -2.029
   66   1HG2  ILE   8          1HG2      ILE   8  -9.541  -2.095  -3.818
   67   2HG2  ILE   8          2HG2      ILE   8  -8.041  -2.628  -3.022
   68   3HG2  ILE   8          3HG2      ILE   8  -8.252  -2.863  -4.774
   69   1HD1  ILE   8          1HD1      ILE   8  -7.269  -5.652  -1.444
   70   2HD1  ILE   8          2HD1      ILE   8  -7.044  -4.475  -2.759
   71   3HD1  ILE   8          3HD1      ILE   8  -7.387  -3.909  -1.107
   72    H    SER   9           H        SER   9 -13.383  -4.903  -3.703
   73    HA   SER   9           HA       SER   9 -14.527  -6.740  -3.906
   74   1HB   SER   9          1HB       SER   9 -12.755  -6.646  -6.224
   75   2HB   SER   9          2HB       SER   9 -13.140  -8.308  -5.826
   76    HG   SER   9           HG       SER   9 -14.728  -7.443  -7.261
   77    HA   PRO  10           HA       PRO  10 -12.738 -10.079  -1.753
   78   1HB   PRO  10          1HB       PRO  10 -14.005 -12.322  -2.669
   79   2HB   PRO  10          2HB       PRO  10 -14.734 -11.207  -1.530
   80   1HG   PRO  10          1HG       PRO  10 -15.299 -11.546  -4.412
   81   2HG   PRO  10          2HG       PRO  10 -16.279 -10.767  -3.186
   82   1HD   PRO  10          1HD       PRO  10 -14.670  -9.472  -5.176
   83   2HD   PRO  10          2HD       PRO  10 -15.557  -8.697  -3.878
   84    H    SER  11           H        SER  11 -12.048  -9.697  -4.928
   85    HA   SER  11           HA       SER  11 -10.540 -12.088  -5.218
   86   1HB   SER  11          1HB       SER  11 -10.922  -9.569  -6.854
   87   2HB   SER  11          2HB       SER  11  -9.642 -10.689  -7.274
   88    HG   SER  11           HG       SER  11 -12.143 -11.900  -6.809
   89    H    ASP  12           H        ASP  12  -9.806  -8.550  -4.812
   90    HA   ASP  12           HA       ASP  12  -7.037  -9.050  -4.592
   91   1HB   ASP  12          1HB       ASP  12  -8.679  -6.821  -5.008
   92   2HB   ASP  12          2HB       ASP  12  -8.055  -6.539  -3.395
   93    H    PHE  13           H        PHE  13  -9.824  -8.464  -2.381
   94    HA   PHE  13           HA       PHE  13  -8.353  -8.146  -0.028
   95   1HB   PHE  13          1HB       PHE  13 -10.916  -7.820  -0.744
   96   2HB   PHE  13          2HB       PHE  13 -11.084  -9.500  -0.275
   97    HD1  PHE  13           1HD      PHE  13 -11.691  -9.967   1.901
   98    HD2  PHE  13           2HD      PHE  13  -9.729  -6.294   1.082
   99    HE1  PHE  13           1HE      PHE  13 -11.999  -9.269   4.293
  100    HE2  PHE  13           2HE      PHE  13 -10.037  -5.596   3.473
  101    HZ   PHE  13           HZ       PHE  13 -11.168  -7.092   5.050
  102    H    ALA  14           H        ALA  14  -9.637 -11.044  -1.731
  103    HA   ALA  14           HA       ALA  14  -9.184 -12.861   0.347
  104   1HB   ALA  14          1HB       ALA  14 -10.613 -13.511  -1.429
  105   2HB   ALA  14          2HB       ALA  14  -9.413 -13.073  -2.669
  106   3HB   ALA  14          3HB       ALA  14  -9.151 -14.504  -1.642
  107    H    GLN  15           H        GLN  15  -7.180 -12.048  -2.579
  108    HA   GLN  15           HA       GLN  15  -5.084 -13.678  -1.975
  109   1HB   GLN  15          1HB       GLN  15  -5.680 -11.758  -3.913
  110   2HB   GLN  15          2HB       GLN  15  -4.259 -11.091  -3.135
  111   1HG   GLN  15          1HG       GLN  15  -3.431 -12.496  -4.897
  112   2HG   GLN  15          2HG       GLN  15  -3.146 -13.384  -3.413
  113   1HE2  GLN  15          1HE2      GLN  15  -3.039 -15.033  -5.255
  114   2HE2  GLN  15          2HE2      GLN  15  -4.484 -15.929  -5.583
  115    H    LEU  16           H        LEU  16  -5.456 -10.152  -1.154
  116    HA   LEU  16           HA       LEU  16  -3.098  -9.965   0.307
  117   1HB   LEU  16          1HB       LEU  16  -5.310  -8.332  -0.389
  118   2HB   LEU  16          2HB       LEU  16  -5.110  -8.215   1.348
  119    HG   LEU  16           HG       LEU  16  -2.997  -7.638  -0.746
  120   1HD1  LEU  16          1HD1      LEU  16  -3.340  -5.391  -0.408
  121   2HD1  LEU  16          2HD1      LEU  16  -4.999  -6.016  -0.249
  122   3HD1  LEU  16          3HD1      LEU  16  -4.052  -5.624   1.206
  123   1HD2  LEU  16          1HD2      LEU  16  -2.522  -6.896   2.082
  124   2HD2  LEU  16          2HD2      LEU  16  -2.431  -8.632   1.699
  125   3HD2  LEU  16          3HD2      LEU  16  -1.394  -7.473   0.832
  126    H    GLN  17           H        GLN  17  -6.492 -10.667   1.369
  127    HA   GLN  17           HA       GLN  17  -5.950 -10.826   4.044
  128   1HB   GLN  17          1HB       GLN  17  -8.229 -10.795   3.179
  129   2HB   GLN  17          2HB       GLN  17  -7.992 -12.317   2.344
  130   1HG   GLN  17          1HG       GLN  17  -7.289 -12.803   5.070
  131   2HG   GLN  17          2HG       GLN  17  -8.762 -11.855   5.116
  132   1HE2  GLN  17          1HE2      GLN  17 -10.505 -12.537   3.591
  133   2HE2  GLN  17          2HE2      GLN  17 -10.803 -14.232   3.391
  134    H    LYS  18           H        LYS  18  -5.721 -13.358   1.478
  135    HA   LYS  18           HA       LYS  18  -5.037 -15.424   3.284
  136   1HB   LYS  18          1HB       LYS  18  -6.043 -15.617   0.942
  137   2HB   LYS  18          2HB       LYS  18  -4.430 -15.330   0.323
  138   1HG   LYS  18          1HG       LYS  18  -3.559 -17.296   1.523
  139   2HG   LYS  18          2HG       LYS  18  -5.098 -17.538   2.325
  140   1HD   LYS  18          1HD       LYS  18  -5.705 -17.436  -0.456
  141   2HD   LYS  18          2HD       LYS  18  -4.253 -18.410  -0.333
  142   1HE   LYS  18          1HE       LYS  18  -5.292 -20.038   1.037
  143   2HE   LYS  18          2HE       LYS  18  -6.534 -18.933   1.589
  144   1HZ   LYS  18          1HZ       LYS  18  -7.110 -18.938  -0.938
  145   2HZ   LYS  18          2HZ       LYS  18  -6.380 -20.398  -0.902
  146   3HZ   LYS  18          3HZ       LYS  18  -7.671 -20.107   0.054
  147    H    TYR  19           H        TYR  19  -3.057 -13.534   0.888
  148    HA   TYR  19           HA       TYR  19  -0.606 -14.520   1.536
  149   1HB   TYR  19          1HB       TYR  19  -1.807 -11.863   0.663
  150   2HB   TYR  19          2HB       TYR  19  -0.097 -11.869   1.047
  151    HD1  TYR  19           1HD      TYR  19  -2.369 -14.233  -0.799
  152    HD2  TYR  19           2HD      TYR  19   1.213 -11.893  -0.860
  153    HE1  TYR  19           1HE      TYR  19  -1.841 -15.088  -3.135
  154    HE2  TYR  19           2HE      TYR  19   1.728 -12.756  -3.195
  155    HH   TYR  19           HH       TYR  19   0.911 -15.153  -4.448
  156    H    MET  20           H        MET  20  -2.629 -12.240   3.382
  157    HA   MET  20           HA       MET  20  -0.483 -11.440   5.055
  158   1HB   MET  20          1HB       MET  20  -2.464  -9.989   4.625
  159   2HB   MET  20          2HB       MET  20  -3.534 -11.204   5.296
  160   1HG   MET  20          1HG       MET  20  -3.300 -10.002   7.239
  161   2HG   MET  20          2HG       MET  20  -1.799 -10.893   7.403
  162   1HE   MET  20          1HE       MET  20  -2.348  -7.771   4.653
  163   2HE   MET  20          2HE       MET  20  -3.584  -8.014   5.911
  164   3HE   MET  20          3HE       MET  20  -2.475  -6.625   6.009
  165    H    GLU  21           H        GLU  21  -3.139 -13.854   5.175
  166    HA   GLU  21           HA       GLU  21  -3.243 -14.520   7.736
  167   1HB   GLU  21          1HB       GLU  21  -4.027 -16.649   7.060
  168   2HB   GLU  21          2HB       GLU  21  -4.361 -15.621   5.680
  169   1HG   GLU  21          1HG       GLU  21  -3.249 -17.202   4.467
  170   2HG   GLU  21          2HG       GLU  21  -1.793 -16.456   5.094
  171    H    TYR  22           H        TYR  22  -0.513 -15.107   5.520
  172    HA   TYR  22           HA       TYR  22   0.851 -16.770   7.455
  173   1HB   TYR  22          1HB       TYR  22   0.799 -16.288   4.640
  174   2HB   TYR  22          2HB       TYR  22   2.329 -15.601   5.148
  175    HD1  TYR  22           1HD      TYR  22   0.370 -18.708   4.852
  176    HD2  TYR  22           2HD      TYR  22   4.141 -17.014   5.954
  177    HE1  TYR  22           1HE      TYR  22   1.422 -21.022   4.839
  178    HE2  TYR  22           2HE      TYR  22   5.180 -19.334   5.937
  179    HH   TYR  22           HH       TYR  22   4.374 -21.656   4.513
  180    H    SER  23           H        SER  23   0.932 -13.412   6.185
  181    HA   SER  23           HA       SER  23   3.357 -12.814   7.502
  182   1HB   SER  23          1HB       SER  23   1.995 -11.656   5.460
  183   2HB   SER  23          2HB       SER  23   1.435 -10.630   6.766
  184    HG   SER  23           HG       SER  23   3.302  -9.651   6.034
  185    H    THR  24           H        THR  24   3.649 -12.274   9.640
  186    HA   THR  24           HA       THR  24   1.283 -11.327  11.114
  187    HB   THR  24           HB       THR  24   2.123 -13.840  11.412
  188    HG1  THR  24           1HG      THR  24   1.596 -13.404  13.771
  189   1HG2  THR  24          1HG2      THR  24   4.537 -12.773  11.971
  190   2HG2  THR  24          2HG2      THR  24   3.793 -12.546  13.572
  191   3HG2  THR  24          3HG2      THR  24   3.926 -14.179  12.875
  192    H    LYS  25           H        LYS  25   3.782 -10.095   9.718
  193    HA   LYS  25           HA       LYS  25   5.124  -8.971  12.024
  194   1HB   LYS  25          1HB       LYS  25   5.588  -9.067   9.081
  195   2HB   LYS  25          2HB       LYS  25   6.211  -7.672   9.938
  196   1HG   LYS  25          1HG       LYS  25   6.917  -9.798  11.620
  197   2HG   LYS  25          2HG       LYS  25   7.118 -10.485  10.021
  198   1HD   LYS  25          1HD       LYS  25   8.194  -7.729  10.262
  199   2HD   LYS  25          2HD       LYS  25   8.979  -8.878  11.327
  200   1HE   LYS  25          1HE       LYS  25  10.207  -8.922   9.249
  201   2HE   LYS  25          2HE       LYS  25   9.296 -10.418   9.319
  202   1HZ   LYS  25          1HZ       LYS  25   8.468  -9.813   7.383
  203   2HZ   LYS  25          2HZ       LYS  25   7.622  -8.635   8.134
  204   3HZ   LYS  25          3HZ       LYS  25   9.077  -8.301   7.473
  205    H    LYS  26           H        LYS  26   5.571  -6.385  11.554
  206    HA   LYS  26           HA       LYS  26   2.860  -5.273  11.491
  207   1HB   LYS  26          1HB       LYS  26   5.385  -4.275  12.841
  208   2HB   LYS  26          2HB       LYS  26   3.865  -3.406  12.808
  209   1HG   LYS  26          1HG       LYS  26   3.333  -6.125  13.645
  210   2HG   LYS  26          2HG       LYS  26   4.667  -5.510  14.599
  211   1HD   LYS  26          1HD       LYS  26   3.365  -3.575  15.321
  212   2HD   LYS  26          2HD       LYS  26   2.079  -3.947  14.190
  213   1HE   LYS  26          1HE       LYS  26   2.117  -6.304  15.540
  214   2HE   LYS  26          2HE       LYS  26   2.753  -5.271  16.805
  215   1HZ   LYS  26          1HZ       LYS  26   0.649  -3.910  15.707
  216   2HZ   LYS  26          2HZ       LYS  26   0.125  -5.450  15.851
  217   3HZ   LYS  26          3HZ       LYS  26   0.686  -4.652  17.161
  218    H    VAL  27           H        VAL  27   2.349  -3.544  10.136
  219    HA   VAL  27           HA       VAL  27   3.960  -3.333   7.809
  220    HB   VAL  27           HB       VAL  27   1.462  -3.241   7.940
  221   1HG1  VAL  27          1HG1      VAL  27   0.302  -1.337   8.682
  222   2HG1  VAL  27          2HG1      VAL  27   1.529  -1.616   9.941
  223   3HG1  VAL  27          3HG1      VAL  27   1.776  -0.340   8.725
  224   1HG2  VAL  27          1HG2      VAL  27   2.368  -2.616   5.871
  225   2HG2  VAL  27          2HG2      VAL  27   1.305  -1.253   6.296
  226   3HG2  VAL  27          3HG2      VAL  27   3.065  -1.112   6.520
  227    H    SER  28           H        SER  28   3.817  -1.695  10.901
  228    HA   SER  28           HA       SER  28   4.857   0.752  10.015
  229   1HB   SER  28          1HB       SER  28   5.283   1.172  12.421
  230   2HB   SER  28          2HB       SER  28   3.672   0.534  12.158
  231    HG   SER  28           HG       SER  28   5.138  -0.419  13.943
  232    H    ASP  29           H        ASP  29   6.215  -2.422  10.671
  233    HA   ASP  29           HA       ASP  29   8.818  -1.543  11.248
  234   1HB   ASP  29          1HB       ASP  29   7.383  -4.064  10.881
  235   2HB   ASP  29          2HB       ASP  29   8.935  -4.137  10.071
  236    H    VAL  30           H        VAL  30   7.059  -2.752   8.315
  237    HA   VAL  30           HA       VAL  30   9.329  -2.614   6.622
  238    HB   VAL  30           HB       VAL  30   6.356  -2.796   6.118
  239   1HG1  VAL  30          1HG1      VAL  30   6.951  -2.026   4.056
  240   2HG1  VAL  30          2HG1      VAL  30   8.649  -2.532   4.231
  241   3HG1  VAL  30          3HG1      VAL  30   7.398  -3.734   3.829
  242   1HG2  VAL  30          1HG2      VAL  30   8.318  -4.692   6.967
  243   2HG2  VAL  30          2HG2      VAL  30   6.597  -4.959   6.598
  244   3HG2  VAL  30          3HG2      VAL  30   7.818  -5.114   5.311
  245    H    LEU  31           H        LEU  31   6.908  -0.326   7.794
  246    HA   LEU  31           HA       LEU  31   7.052   1.551   5.749
  247   1HB   LEU  31          1HB       LEU  31   5.839   1.273   8.270
  248   2HB   LEU  31          2HB       LEU  31   6.762   2.760   8.353
  249    HG   LEU  31           HG       LEU  31   5.560   3.152   5.975
  250   1HD1  LEU  31          1HD1      LEU  31   3.446   1.649   7.528
  251   2HD1  LEU  31          2HD1      LEU  31   3.343   2.322   5.884
  252   3HD1  LEU  31          3HD1      LEU  31   4.392   0.921   6.208
  253   1HD2  LEU  31          1HD2      LEU  31   5.574   4.501   8.182
  254   2HD2  LEU  31          2HD2      LEU  31   4.233   4.737   7.035
  255   3HD2  LEU  31          3HD2      LEU  31   3.999   3.727   8.482
  256    H    LYS  32           H        LYS  32   8.916   1.374   8.865
  257    HA   LYS  32           HA       LYS  32  10.553   3.547   8.292
  258   1HB   LYS  32          1HB       LYS  32  11.635   3.016  10.239
  259   2HB   LYS  32          2HB       LYS  32  10.121   2.169  10.486
  260   1HG   LYS  32          1HG       LYS  32  11.391   0.158   9.275
  261   2HG   LYS  32          2HG       LYS  32  12.830   1.034   9.759
  262   1HD   LYS  32          1HD       LYS  32  11.981   1.051  12.138
  263   2HD   LYS  32          2HD       LYS  32  10.603   0.096  11.628
  264   1HE   LYS  32          1HE       LYS  32  11.830  -1.842  11.481
  265   2HE   LYS  32          2HE       LYS  32  13.209  -1.035  10.761
  266   1HZ   LYS  32          1HZ       LYS  32  13.292  -1.929  13.177
  267   2HZ   LYS  32          2HZ       LYS  32  14.062  -0.543  12.785
  268   3HZ   LYS  32          3HZ       LYS  32  12.619  -0.488  13.548
  269    H    LEU  33           H        LEU  33  10.699   0.113   7.329
  270    HA   LEU  33           HA       LEU  33  13.333   0.034   6.485
  271   1HB   LEU  33          1HB       LEU  33  10.841  -1.472   5.956
  272   2HB   LEU  33          2HB       LEU  33  12.105  -1.637   4.754
  273    HG   LEU  33           HG       LEU  33  12.508  -2.146   7.713
  274   1HD1  LEU  33          1HD1      LEU  33  11.844  -4.066   5.470
  275   2HD1  LEU  33          2HD1      LEU  33  12.517  -4.568   7.040
  276   3HD1  LEU  33          3HD1      LEU  33  10.929  -3.766   6.968
  277   1HD2  LEU  33          1HD2      LEU  33  14.559  -1.546   6.541
  278   2HD2  LEU  33          2HD2      LEU  33  14.572  -3.265   7.003
  279   3HD2  LEU  33          3HD2      LEU  33  14.245  -2.799   5.317
  280    H    PHE  34           H        PHE  34  10.348   1.167   4.807
  281    HA   PHE  34           HA       PHE  34  11.837   1.780   2.431
  282   1HB   PHE  34          1HB       PHE  34   9.014   1.945   3.526
  283   2HB   PHE  34          2HB       PHE  34   9.391   3.016   2.191
  284    HD1  PHE  34           1HD      PHE  34   9.518   2.201  -0.026
  285    HD2  PHE  34           2HD      PHE  34   9.272  -0.539   3.205
  286    HE1  PHE  34           1HE      PHE  34   9.107   0.328  -1.646
  287    HE2  PHE  34           2HE      PHE  34   8.861  -2.412   1.586
  288    HZ   PHE  34           HZ       PHE  34   8.783  -1.957  -0.820
  289    H    GLU  35           H        GLU  35  11.294   3.290   5.479
  290    HA   GLU  35           HA       GLU  35  11.351   5.947   4.411
  291   1HB   GLU  35          1HB       GLU  35  11.524   4.980   7.300
  292   2HB   GLU  35          2HB       GLU  35  11.275   6.640   6.794
  293   1HG   GLU  35          1HG       GLU  35   9.337   4.887   5.482
  294   2HG   GLU  35          2HG       GLU  35   9.285   4.652   7.218
  295    H    ASP  36           H        ASP  36  13.458   3.949   6.610
  296    HA   ASP  36           HA       ASP  36  15.658   5.650   5.740
  297   1HB   ASP  36          1HB       ASP  36  15.112   5.639   8.207
  298   2HB   ASP  36          2HB       ASP  36  15.425   3.915   8.244
  299    H    GLY  37           H        GLY  37  14.361   2.355   6.215
  300   1HA   GLY  37          1HA       GLY  37  16.679   0.839   5.850
  301   2HA   GLY  37          2HA       GLY  37  15.036   0.330   5.515
  302    H    GLU  38           H        GLU  38  17.347  -0.420   3.942
  303    HA   GLU  38           HA       GLU  38  17.908   1.084   1.791
  304   1HB   GLU  38          1HB       GLU  38  18.824  -0.840   0.892
  305   2HB   GLU  38          2HB       GLU  38  18.599  -1.385   2.543
  306   1HG   GLU  38          1HG       GLU  38  16.296  -2.271   1.828
  307   2HG   GLU  38          2HG       GLU  38  16.750  -1.914   0.174
  308    H    MET  39           H        MET  39  14.868  -0.540   2.562
  309    HA   MET  39           HA       MET  39  13.797  -0.766   0.049
  310   1HB   MET  39          1HB       MET  39  12.801  -0.507   2.870
  311   2HB   MET  39          2HB       MET  39  11.614  -0.131   1.637
  312   1HG   MET  39          1HG       MET  39  13.242  -2.717   1.769
  313   2HG   MET  39          2HG       MET  39  11.574  -2.553   2.281
  314   1HE   MET  39          1HE       MET  39  13.661  -2.230  -1.536
  315   2HE   MET  39          2HE       MET  39  14.055  -3.131  -0.052
  316   3HE   MET  39          3HE       MET  39  13.145  -3.924  -1.360
  317    H    ALA  40           H        ALA  40  14.665   2.087   1.796
  318    HA   ALA  40           HA       ALA  40  12.667   3.790   0.656
  319   1HB   ALA  40          1HB       ALA  40  13.834   4.142   2.868
  320   2HB   ALA  40          2HB       ALA  40  15.320   4.509   1.960
  321   3HB   ALA  40          3HB       ALA  40  13.887   5.549   1.779
  322    H    LYS  41           H        LYS  41  15.201   2.080  -0.685
  323    HA   LYS  41           HA       LYS  41  16.526   4.001  -2.214
  324   1HB   LYS  41          1HB       LYS  41  17.379   2.160  -3.462
  325   2HB   LYS  41          2HB       LYS  41  17.261   1.649  -1.791
  326   1HG   LYS  41          1HG       LYS  41  15.507   0.174  -2.209
  327   2HG   LYS  41          2HG       LYS  41  14.858   1.139  -3.520
  328   1HD   LYS  41          1HD       LYS  41  15.791  -0.473  -4.857
  329   2HD   LYS  41          2HD       LYS  41  17.270   0.436  -4.615
  330   1HE   LYS  41          1HE       LYS  41  17.296  -1.129  -2.356
  331   2HE   LYS  41          2HE       LYS  41  16.447  -2.197  -3.456
  332   1HZ   LYS  41          1HZ       LYS  41  18.997  -0.891  -4.106
  333   2HZ   LYS  41          2HZ       LYS  41  18.872  -2.411  -3.522
  334   3HZ   LYS  41          3HZ       LYS  41  18.238  -2.042  -4.981
  335    H    TYR  42           H        TYR  42  13.320   2.552  -2.456
  336    HA   TYR  42           HA       TYR  42  13.009   3.793  -5.103
  337   1HB   TYR  42          1HB       TYR  42  11.779   1.482  -3.523
  338   2HB   TYR  42          2HB       TYR  42  10.830   2.217  -4.800
  339    HD1  TYR  42           1HD      TYR  42  14.332   2.336  -5.525
  340    HD2  TYR  42           2HD      TYR  42  10.906  -0.223  -5.662
  341    HE1  TYR  42           1HE      TYR  42  15.494   0.861  -7.239
  342    HE2  TYR  42           2HE      TYR  42  12.080  -1.690  -7.376
  343    HH   TYR  42           HH       TYR  42  14.183  -0.984  -9.210
  344    H    VAL  43           H        VAL  43  12.993   5.280  -2.527
  345    HA   VAL  43           HA       VAL  43  10.195   6.171  -2.638
  346    HB   VAL  43           HB       VAL  43  12.031   5.923  -0.250
  347   1HG1  VAL  43          1HG1      VAL  43  10.708   7.281   0.987
  348   2HG1  VAL  43          2HG1      VAL  43  10.297   7.984  -0.596
  349   3HG1  VAL  43          3HG1      VAL  43   9.221   6.777   0.149
  350   1HG2  VAL  43          1HG2      VAL  43  10.684   3.904  -1.221
  351   2HG2  VAL  43          2HG2      VAL  43  10.653   4.223   0.530
  352   3HG2  VAL  43          3HG2      VAL  43   9.282   4.721  -0.490
  353    H    GLN  44           H        GLN  44   9.919   8.301  -3.132
  354    HA   GLN  44           HA       GLN  44  12.373   9.860  -3.259
  355   1HB   GLN  44          1HB       GLN  44  11.053  11.309  -4.867
  356   2HB   GLN  44          2HB       GLN  44  11.339   9.673  -5.426
  357   1HG   GLN  44          1HG       GLN  44   9.113   9.226  -5.515
  358   2HG   GLN  44          2HG       GLN  44   8.873   9.769  -3.866
  359   1HE2  GLN  44          1HE2      GLN  44   7.430  11.290  -3.704
  360   2HE2  GLN  44          2HE2      GLN  44   7.144  12.597  -4.804
  361    H    GLY  45           H        GLY  45  12.605  11.719  -2.035
  362   1HA   GLY  45          1HA       GLY  45  12.168  13.238  -0.439
  363   2HA   GLY  45          2HA       GLY  45  10.579  13.391  -1.162
  364    H    ASP  46           H        ASP  46   8.764  12.440  -0.182
  365    HA   ASP  46           HA       ASP  46   9.342  10.801   2.148
  366   1HB   ASP  46          1HB       ASP  46   7.464  11.996   3.344
  367   2HB   ASP  46          2HB       ASP  46   8.871  12.998   3.052
  368    H    ALA  47           H        ALA  47   8.315  10.519  -0.785
  369    HA   ALA  47           HA       ALA  47   5.856   9.083  -0.084
  370   1HB   ALA  47          1HB       ALA  47   4.616  10.173  -1.644
  371   2HB   ALA  47          2HB       ALA  47   5.847  11.449  -1.479
  372   3HB   ALA  47          3HB       ALA  47   5.968  10.260  -2.799
  373    H    ILE  48           H        ILE  48   5.305   7.491  -1.986
  374    HA   ILE  48           HA       ILE  48   7.805   6.483  -3.134
  375    HB   ILE  48           HB       ILE  48   7.461   5.170  -1.183
  376   1HG1  ILE  48          1HG1      ILE  48   6.530   3.668  -3.648
  377   2HG1  ILE  48          2HG1      ILE  48   8.193   3.973  -3.189
  378   1HG2  ILE  48          1HG2      ILE  48   5.478   4.785  -0.270
  379   2HG2  ILE  48          2HG2      ILE  48   4.721   5.669  -1.617
  380   3HG2  ILE  48          3HG2      ILE  48   4.933   3.904  -1.718
  381   1HD1  ILE  48          1HD1      ILE  48   6.527   1.804  -2.368
  382   2HD1  ILE  48          2HD1      ILE  48   8.193   2.154  -1.845
  383   3HD1  ILE  48          3HD1      ILE  48   6.816   2.805  -0.924
  384    H    GLY  49           H        GLY  49   7.447   5.080  -5.050
  385   1HA   GLY  49          1HA       GLY  49   5.202   6.119  -6.603
  386   2HA   GLY  49          2HA       GLY  49   6.617   5.277  -7.202
  387    H    TYR  50           H        TYR  50   4.612   4.223  -8.399
  388    HA   TYR  50           HA       TYR  50   3.154   2.313  -6.837
  389   1HB   TYR  50          1HB       TYR  50   2.105   3.291  -8.803
  390   2HB   TYR  50          2HB       TYR  50   3.563   3.118  -9.760
  391    HD1  TYR  50           1HD      TYR  50   3.783   1.316 -11.240
  392    HD2  TYR  50           2HD      TYR  50   0.923   1.073  -8.067
  393    HE1  TYR  50           1HE      TYR  50   2.882  -0.856 -12.207
  394    HE2  TYR  50           2HE      TYR  50   0.032  -1.098  -9.045
  395    HH   TYR  50           HH       TYR  50  -0.014  -2.334 -10.929
  396    H    GLU  51           H        GLU  51   6.186   2.408  -8.645
  397    HA   GLU  51           HA       GLU  51   6.303  -0.371  -9.088
  398   1HB   GLU  51          1HB       GLU  51   7.727   1.873  -9.946
  399   2HB   GLU  51          2HB       GLU  51   8.893   1.039  -8.937
  400   1HG   GLU  51          1HG       GLU  51   9.252  -0.008 -11.002
  401   2HG   GLU  51          2HG       GLU  51   8.124  -1.120 -10.252
  402    H    GLY  52           H        GLY  52   7.247   1.837  -6.456
  403   1HA   GLY  52          1HA       GLY  52   9.007   0.126  -5.082
  404   2HA   GLY  52          2HA       GLY  52   8.110   1.475  -4.412
  405    H    PHE  53           H        PHE  53   5.419   0.576  -4.977
  406    HA   PHE  53           HA       PHE  53   4.899  -0.909  -2.725
  407   1HB   PHE  53          1HB       PHE  53   3.531  -0.231  -5.353
  408   2HB   PHE  53          2HB       PHE  53   2.746  -1.421  -4.334
  409    HD1  PHE  53           1HD      PHE  53   2.141   1.631  -5.214
  410    HD2  PHE  53           2HD      PHE  53   3.325  -0.322  -1.637
  411    HE1  PHE  53           1HE      PHE  53   1.101   3.474  -3.863
  412    HE2  PHE  53           2HE      PHE  53   2.285   1.520  -0.287
  413    HZ   PHE  53           HZ       PHE  53   1.185   3.396  -1.415
  414    H    GLN  54           H        GLN  54   5.863  -1.956  -5.969
  415    HA   GLN  54           HA       GLN  54   4.861  -4.517  -5.902
  416   1HB   GLN  54          1HB       GLN  54   7.512  -3.709  -7.161
  417   2HB   GLN  54          2HB       GLN  54   6.442  -4.999  -7.675
  418   1HG   GLN  54          1HG       GLN  54   4.964  -2.489  -7.575
  419   2HG   GLN  54          2HG       GLN  54   6.418  -2.273  -8.528
  420   1HE2  GLN  54          1HE2      GLN  54   5.249  -2.064 -10.420
  421   2HE2  GLN  54          2HE2      GLN  54   4.510  -3.402 -11.235
  422    H    GLN  55           H        GLN  55   8.242  -3.417  -5.102
  423    HA   GLN  55           HA       GLN  55   8.982  -5.896  -4.087
  424   1HB   GLN  55          1HB       GLN  55  10.936  -4.645  -3.139
  425   2HB   GLN  55          2HB       GLN  55  10.651  -4.289  -4.831
  426   1HG   GLN  55          1HG       GLN  55   9.545  -2.177  -4.275
  427   2HG   GLN  55          2HG       GLN  55   9.559  -2.560  -2.565
  428   1HE2  GLN  55          1HE2      GLN  55  10.584  -0.341  -2.727
  429   2HE2  GLN  55          2HE2      GLN  55  12.312  -0.266  -2.811
  430    H    PHE  56           H        PHE  56   7.233  -3.151  -2.713
  431    HA   PHE  56           HA       PHE  56   7.729  -3.562  -0.022
  432   1HB   PHE  56          1HB       PHE  56   6.439  -1.704  -1.359
  433   2HB   PHE  56          2HB       PHE  56   5.067  -2.795  -1.351
  434    HD1  PHE  56           1HD      PHE  56   4.151  -3.540   0.916
  435    HD2  PHE  56           2HD      PHE  56   6.855  -0.300   0.471
  436    HE1  PHE  56           1HE      PHE  56   3.463  -2.657   3.162
  437    HE2  PHE  56           2HE      PHE  56   6.167   0.583   2.717
  438    HZ   PHE  56           HZ       PHE  56   4.478  -0.606   4.036
  439    H    LEU  57           H        LEU  57   5.076  -4.891  -2.120
  440    HA   LEU  57           HA       LEU  57   3.783  -6.318  -0.143
  441   1HB   LEU  57          1HB       LEU  57   4.045  -6.704  -3.117
  442   2HB   LEU  57          2HB       LEU  57   3.068  -7.770  -2.127
  443    HG   LEU  57           HG       LEU  57   2.552  -4.859  -1.814
  444   1HD1  LEU  57          1HD1      LEU  57   1.088  -5.939  -4.102
  445   2HD1  LEU  57          2HD1      LEU  57   1.891  -4.365  -3.886
  446   3HD1  LEU  57          3HD1      LEU  57   2.836  -5.783  -4.399
  447   1HD2  LEU  57          1HD2      LEU  57   1.351  -7.040  -0.833
  448   2HD2  LEU  57          2HD2      LEU  57   0.484  -5.522  -1.164
  449   3HD2  LEU  57          3HD2      LEU  57   0.415  -6.860  -2.336
  450    H    LYS  58           H        LYS  58   6.903  -6.826  -1.633
  451    HA   LYS  58           HA       LYS  58   7.057  -9.612  -1.236
  452   1HB   LYS  58          1HB       LYS  58   8.495  -7.953  -2.683
  453   2HB   LYS  58          2HB       LYS  58   9.460  -7.807  -1.227
  454   1HG   LYS  58          1HG       LYS  58   9.945 -10.173  -1.184
  455   2HG   LYS  58          2HG       LYS  58   8.702 -10.527  -2.368
  456   1HD   LYS  58          1HD       LYS  58  10.013  -9.107  -4.044
  457   2HD   LYS  58          2HD       LYS  58  11.298  -8.996  -2.857
  458   1HE   LYS  58          1HE       LYS  58  10.202 -11.705  -3.698
  459   2HE   LYS  58          2HE       LYS  58  11.415 -10.895  -4.669
  460   1HZ   LYS  58          1HZ       LYS  58  12.625 -10.679  -2.438
  461   2HZ   LYS  58          2HZ       LYS  58  11.646 -11.887  -1.941
  462   3HZ   LYS  58          3HZ       LYS  58  12.649 -12.119  -3.208
  463    H    ILE  59           H        ILE  59   8.454  -6.835   0.655
  464    HA   ILE  59           HA       ILE  59   9.094  -8.581   2.822
  465    HB   ILE  59           HB       ILE  59   9.097  -5.565   2.680
  466   1HG1  ILE  59          1HG1      ILE  59  11.628  -7.083   2.411
  467   2HG1  ILE  59          2HG1      ILE  59  10.540  -7.187   1.041
  468   1HG2  ILE  59          1HG2      ILE  59  11.087  -6.763   4.396
  469   2HG2  ILE  59          2HG2      ILE  59   9.838  -5.551   4.772
  470   3HG2  ILE  59          3HG2      ILE  59   9.453  -7.286   4.868
  471   1HD1  ILE  59          1HD1      ILE  59  10.664  -4.902   0.576
  472   2HD1  ILE  59          2HD1      ILE  59  11.019  -4.472   2.266
  473   3HD1  ILE  59          3HD1      ILE  59  12.290  -5.186   1.244
  474    H    TYR  60           H        TYR  60   6.616  -6.025   2.168
  475    HA   TYR  60           HA       TYR  60   5.381  -5.964   4.596
  476   1HB   TYR  60          1HB       TYR  60   4.804  -4.542   2.647
  477   2HB   TYR  60          2HB       TYR  60   4.386  -5.947   1.686
  478    HD1  TYR  60           1HD      TYR  60   2.138  -5.582   1.115
  479    HD2  TYR  60           2HD      TYR  60   3.356  -5.159   5.195
  480    HE1  TYR  60           1HE      TYR  60  -0.292  -5.337   1.823
  481    HE2  TYR  60           2HE      TYR  60   0.923  -4.916   5.889
  482    HH   TYR  60           HH       TYR  60  -1.171  -4.219   4.889
  483    H    LEU  61           H        LEU  61   3.981  -7.853   1.832
  484    HA   LEU  61           HA       LEU  61   2.486  -9.466   3.611
  485   1HB   LEU  61          1HB       LEU  61   2.885  -9.198   0.697
  486   2HB   LEU  61          2HB       LEU  61   2.410 -10.792   1.249
  487    HG   LEU  61           HG       LEU  61   0.907  -8.218   1.800
  488   1HD1  LEU  61          1HD1      LEU  61   0.940  -9.944  -0.493
  489   2HD1  LEU  61          2HD1      LEU  61  -0.650 -10.041   0.301
  490   3HD1  LEU  61          3HD1      LEU  61  -0.004  -8.463  -0.206
  491   1HD2  LEU  61          1HD2      LEU  61   0.286  -9.476   3.603
  492   2HD2  LEU  61          2HD2      LEU  61  -0.894 -10.057   2.405
  493   3HD2  LEU  61          3HD2      LEU  61   0.556 -11.024   2.766
  494    H    GLU  62           H        GLU  62   5.785  -9.401   2.844
  495    HA   GLU  62           HA       GLU  62   7.440 -10.754   3.213
  496   1HB   GLU  62          1HB       GLU  62   6.061 -11.077   5.404
  497   2HB   GLU  62          2HB       GLU  62   5.625 -12.643   4.748
  498   1HG   GLU  62          1HG       GLU  62   8.490 -12.250   4.443
  499   2HG   GLU  62          2HG       GLU  62   8.042 -11.921   6.105
  500    H    VAL  63           H        VAL  63   5.802 -11.110   0.817
  501    HA   VAL  63           HA       VAL  63   5.883 -14.000   0.414
  502    HB   VAL  63           HB       VAL  63   4.806 -13.227  -1.813
  503   1HG1  VAL  63          1HG1      VAL  63   2.658 -13.488  -0.882
  504   2HG1  VAL  63          2HG1      VAL  63   3.736 -14.372   0.223
  505   3HG1  VAL  63          3HG1      VAL  63   3.141 -12.754   0.666
  506   1HG2  VAL  63          1HG2      VAL  63   3.992 -11.102  -2.036
  507   2HG2  VAL  63          2HG2      VAL  63   3.824 -10.859  -0.280
  508   3HG2  VAL  63          3HG2      VAL  63   5.427 -10.744  -1.046
  509    H    ASP  64           H        ASP  64   6.838 -14.790  -1.691
  510    HA   ASP  64           HA       ASP  64   9.343 -13.399  -2.056
  511   1HB   ASP  64          1HB       ASP  64   9.371 -15.838  -1.567
  512   2HB   ASP  64          2HB       ASP  64   8.376 -16.147  -2.977
  513    H    ASN  65           H        ASN  65   6.223 -13.800  -3.476
  514    HA   ASN  65           HA       ASN  65   7.026 -12.347  -5.767
  515   1HB   ASN  65          1HB       ASN  65   5.532 -14.587  -6.851
  516   2HB   ASN  65          2HB       ASN  65   7.126 -14.025  -7.315
  517   1HD2  ASN  65          1HD2      ASN  65   8.974 -14.783  -6.175
  518   2HD2  ASN  65          2HD2      ASN  65   8.978 -16.325  -5.387
  519    H    VAL  66           H        VAL  66   5.369 -10.819  -5.534
  520    HA   VAL  66           HA       VAL  66   2.725 -11.776  -4.766
  521    HB   VAL  66           HB       VAL  66   4.249  -9.646  -3.964
  522   1HG1  VAL  66          1HG1      VAL  66   3.686  -8.647  -6.284
  523   2HG1  VAL  66          2HG1      VAL  66   2.057  -8.390  -5.615
  524   3HG1  VAL  66          3HG1      VAL  66   3.467  -7.623  -4.845
  525   1HG2  VAL  66          1HG2      VAL  66   1.488  -8.980  -3.558
  526   2HG2  VAL  66          2HG2      VAL  66   1.675 -10.747  -3.460
  527   3HG2  VAL  66          3HG2      VAL  66   2.650  -9.690  -2.412
  528    HA   PRO  67           HA       PRO  67   1.227 -11.321  -8.794
  529   1HB   PRO  67          1HB       PRO  67  -1.452 -11.042  -8.328
  530   2HB   PRO  67          2HB       PRO  67  -0.634 -12.592  -8.321
  531   1HG   PRO  67          1HG       PRO  67  -1.606 -10.999  -6.028
  532   2HG   PRO  67          2HG       PRO  67  -1.184 -12.699  -6.084
  533   1HD   PRO  67          1HD       PRO  67   0.394 -10.574  -4.978
  534   2HD   PRO  67          2HD       PRO  67   0.864 -12.255  -5.139
  535    H    ARG  68           H        ARG  68   1.341  -9.785 -10.308
  536    HA   ARG  68           HA       ARG  68   1.476  -7.173  -9.477
  537   1HB   ARG  68          1HB       ARG  68   2.022  -8.548 -11.811
  538   2HB   ARG  68          2HB       ARG  68   0.614  -7.629 -12.304
  539   1HG   ARG  68          1HG       ARG  68   2.517  -5.986 -10.761
  540   2HG   ARG  68          2HG       ARG  68   3.260  -6.683 -12.187
  541   1HD   ARG  68          1HD       ARG  68   0.730  -5.801 -13.092
  542   2HD   ARG  68          2HD       ARG  68   1.258  -4.537 -11.998
  543    HE   ARG  68           HE       ARG  68   3.013  -3.997 -13.473
  544   1HH1  ARG  68          2HH2      ARG  68   1.554  -7.056 -14.419
  545   2HH1  ARG  68          1HH2      ARG  68   2.392  -7.135 -15.933
  546   1HH2  ARG  68          2HH1      ARG  68   4.119  -4.100 -15.470
  547   2HH2  ARG  68          1HH1      ARG  68   3.861  -5.442 -16.535
  548    H    HIS  69           H        HIS  69  -1.249  -9.170 -10.655
  549    HA   HIS  69           HA       HIS  69  -3.044  -7.207 -11.310
  550   1HB   HIS  69          1HB       HIS  69  -3.056  -9.935 -11.179
  551   2HB   HIS  69          2HB       HIS  69  -4.143  -9.542  -9.862
  552    HD1  HIS  69           1HD      HIS  69  -6.259 -10.364 -11.088
  553    HD2  HIS  69           2HD      HIS  69  -4.178  -7.359 -13.145
  554    HE1  HIS  69           1HE      HIS  69  -7.795  -9.594 -12.974
  555    H    LEU  70           H        LEU  70  -2.079  -8.480  -8.097
  556    HA   LEU  70           HA       LEU  70  -4.110  -7.027  -6.722
  557   1HB   LEU  70          1HB       LEU  70  -3.470  -8.914  -5.600
  558   2HB   LEU  70          2HB       LEU  70  -1.775  -8.731  -6.004
  559    HG   LEU  70           HG       LEU  70  -1.950  -6.615  -4.421
  560   1HD1  LEU  70          1HD1      LEU  70  -4.546  -7.634  -4.171
  561   2HD1  LEU  70          2HD1      LEU  70  -3.716  -8.084  -2.662
  562   3HD1  LEU  70          3HD1      LEU  70  -3.771  -6.380  -3.174
  563   1HD2  LEU  70          1HD2      LEU  70  -1.796  -9.460  -3.388
  564   2HD2  LEU  70          2HD2      LEU  70  -0.457  -8.516  -4.084
  565   3HD2  LEU  70          3HD2      LEU  70  -1.201  -8.007  -2.549
  566    H    SER  71           H        SER  71  -0.584  -6.584  -7.380
  567    HA   SER  71           HA       SER  71  -0.263  -4.326  -5.861
  568   1HB   SER  71          1HB       SER  71   1.804  -4.078  -6.955
  569   2HB   SER  71          2HB       SER  71   1.472  -5.788  -7.146
  570    HG   SER  71           HG       SER  71   1.970  -4.033  -9.084
  571    H    LEU  72           H        LEU  72  -1.762  -4.819  -9.042
  572    HA   LEU  72           HA       LEU  72  -1.679  -2.100  -9.835
  573   1HB   LEU  72          1HB       LEU  72  -1.879  -3.560 -11.590
  574   2HB   LEU  72          2HB       LEU  72  -3.017  -4.600 -10.756
  575    HG   LEU  72           HG       LEU  72  -4.778  -2.867 -11.040
  576   1HD1  LEU  72          1HD1      LEU  72  -4.237  -1.120 -12.868
  577   2HD1  LEU  72          2HD1      LEU  72  -3.696  -0.816 -11.200
  578   3HD1  LEU  72          3HD1      LEU  72  -2.538  -1.404 -12.418
  579   1HD2  LEU  72          1HD2      LEU  72  -4.956  -3.137 -13.570
  580   2HD2  LEU  72          2HD2      LEU  72  -3.412  -4.018 -13.473
  581   3HD2  LEU  72          3HD2      LEU  72  -4.839  -4.625 -12.599
  582    H    ALA  73           H        ALA  73  -4.184  -4.218  -8.297
  583    HA   ALA  73           HA       ALA  73  -6.067  -2.111  -8.096
  584   1HB   ALA  73          1HB       ALA  73  -5.793  -4.952  -7.300
  585   2HB   ALA  73          2HB       ALA  73  -6.820  -3.972  -6.225
  586   3HB   ALA  73          3HB       ALA  73  -7.195  -4.079  -7.962
  587    H    LEU  74           H        LEU  74  -3.395  -3.354  -6.087
  588    HA   LEU  74           HA       LEU  74  -4.101  -2.237  -3.665
  589   1HB   LEU  74          1HB       LEU  74  -1.648  -3.203  -4.977
  590   2HB   LEU  74          2HB       LEU  74  -1.382  -2.045  -3.688
  591    HG   LEU  74           HG       LEU  74  -3.081  -4.520  -3.323
  592   1HD1  LEU  74          1HD1      LEU  74  -0.736  -5.071  -4.053
  593   2HD1  LEU  74          2HD1      LEU  74  -0.162  -4.267  -2.573
  594   3HD1  LEU  74          3HD1      LEU  74  -1.208  -5.703  -2.458
  595   1HD2  LEU  74          1HD2      LEU  74  -2.052  -3.942  -0.893
  596   2HD2  LEU  74          2HD2      LEU  74  -2.156  -2.307  -1.589
  597   3HD2  LEU  74          3HD2      LEU  74  -3.613  -3.326  -1.488
  598    H    PHE  75           H        PHE  75  -2.438  -0.787  -6.515
  599    HA   PHE  75           HA       PHE  75  -1.925   1.671  -5.239
  600   1HB   PHE  75          1HB       PHE  75  -1.059   0.454  -7.474
  601   2HB   PHE  75          2HB       PHE  75  -2.433   1.242  -8.223
  602    HD1  PHE  75           1HD      PHE  75  -1.698   3.009  -9.502
  603    HD2  PHE  75           2HD      PHE  75   0.059   2.399  -5.687
  604    HE1  PHE  75           1HE      PHE  75  -0.340   5.100  -9.792
  605    HE2  PHE  75           2HE      PHE  75   1.417   4.489  -5.978
  606    HZ   PHE  75           HZ       PHE  75   1.201   5.815  -8.027
  607    H    GLN  76           H        GLN  76  -4.531   0.534  -7.492
  608    HA   GLN  76           HA       GLN  76  -5.805   2.938  -7.751
  609   1HB   GLN  76          1HB       GLN  76  -6.830   0.077  -7.812
  610   2HB   GLN  76          2HB       GLN  76  -7.884   1.436  -8.151
  611   1HG   GLN  76          1HG       GLN  76  -5.812   2.101  -9.785
  612   2HG   GLN  76          2HG       GLN  76  -5.584   0.364  -9.760
  613   1HE2  GLN  76          1HE2      GLN  76  -7.031  -0.987 -10.713
  614   2HE2  GLN  76          2HE2      GLN  76  -8.350  -0.467 -11.708
  615    H    SER  77           H        SER  77  -6.222   0.357  -5.252
  616    HA   SER  77           HA       SER  77  -8.388   1.260  -3.966
  617   1HB   SER  77          1HB       SER  77  -7.295  -0.770  -3.261
  618   2HB   SER  77          2HB       SER  77  -5.813   0.077  -2.863
  619    HG   SER  77           HG       SER  77  -6.593   0.585  -0.929
  620    H    PHE  78           H        PHE  78  -4.964   2.210  -3.147
  621    HA   PHE  78           HA       PHE  78  -6.076   4.724  -2.112
  622   1HB   PHE  78          1HB       PHE  78  -4.253   2.631  -1.037
  623   2HB   PHE  78          2HB       PHE  78  -3.525   4.224  -0.957
  624    HD1  PHE  78           1HD      PHE  78  -3.675   5.082   1.169
  625    HD2  PHE  78           2HD      PHE  78  -7.000   2.957  -0.392
  626    HE1  PHE  78           1HE      PHE  78  -4.969   5.569   3.263
  627    HE2  PHE  78           2HE      PHE  78  -8.294   3.444   1.702
  628    HZ   PHE  78           HZ       PHE  78  -7.264   4.744   3.505
  629    H    GLU  79           H        GLU  79  -5.321   6.562  -3.067
  630    HA   GLU  79           HA       GLU  79  -2.660   6.585  -4.102
  631   1HB   GLU  79          1HB       GLU  79  -3.955   5.603  -5.996
  632   2HB   GLU  79          2HB       GLU  79  -5.022   6.994  -5.991
  633   1HG   GLU  79          1HG       GLU  79  -3.568   8.154  -7.284
  634   2HG   GLU  79          2HG       GLU  79  -2.313   7.979  -6.073
  635    H    THR  80           H        THR  80  -1.801   8.585  -3.687
  636    HA   THR  80           HA       THR  80  -3.682  10.688  -2.925
  637    HB   THR  80           HB       THR  80  -1.501   9.715  -1.639
  638    HG1  THR  80           1HG      THR  80  -3.023  11.455  -1.010
  639   1HG2  THR  80          1HG2      THR  80   0.073  10.452  -3.492
  640   2HG2  THR  80          2HG2      THR  80  -0.479  12.124  -3.232
  641   3HG2  THR  80          3HG2      THR  80   0.392  11.263  -1.940
  642    H    GLY  81           H        GLY  81  -1.586   9.709  -5.538
  643   1HA   GLY  81          1HA       GLY  81  -1.160  12.354  -6.577
  644   2HA   GLY  81          2HA       GLY  81  -0.807  10.824  -7.355
  645    H    HIS  82           H        HIS  82  -3.369  13.227  -6.651
  646    HA   HIS  82           HA       HIS  82  -5.101  11.888  -8.571
  647   1HB   HIS  82          1HB       HIS  82  -5.548  13.248  -6.131
  648   2HB   HIS  82          2HB       HIS  82  -6.231  14.267  -7.383
  649    HD1  HIS  82           1HD      HIS  82  -6.993  11.358  -5.336
  650    HD2  HIS  82           2HD      HIS  82  -8.133  12.745  -9.127
  651    HE1  HIS  82           1HE      HIS  82  -9.125  10.098  -5.947
  652    H    CYS  83           H        CYS  83  -6.537  13.923  -9.693
  653    HA   CYS  83           HA       CYS  83  -4.484  15.622 -10.909
  654   1HB   CYS  83          1HB       CYS  83  -6.797  14.504 -12.497
  655   2HB   CYS  83          2HB       CYS  83  -5.333  15.267 -13.084
  656    HG   CYS  83           HG       CYS  83  -4.569  13.057 -13.670
  657    H    LEU  84           H        LEU  84  -5.094  17.420  -9.584
  658    HA   LEU  84           HA       LEU  84  -7.907  18.195  -9.696
  659   1HB   LEU  84          1HB       LEU  84  -5.741  18.447  -7.768
  660   2HB   LEU  84          2HB       LEU  84  -6.537  19.979  -8.066
  661    HG   LEU  84           HG       LEU  84  -7.441  18.657  -6.140
  662   1HD1  LEU  84          1HD1      LEU  84  -9.774  19.140  -6.609
  663   2HD1  LEU  84          2HD1      LEU  84  -8.734  20.436  -7.246
  664   3HD1  LEU  84          3HD1      LEU  84  -9.431  19.229  -8.353
  665   1HD2  LEU  84          1HD2      LEU  84  -8.789  16.715  -6.483
  666   2HD2  LEU  84          2HD2      LEU  84  -8.632  16.845  -8.252
  667   3HD2  LEU  84          3HD2      LEU  84  -7.214  16.428  -7.260
  668    H    ASN  85           H        ASN  85  -6.593  18.343 -12.157
  669    HA   ASN  85           HA       ASN  85  -6.444  19.745 -13.817
  670   1HB   ASN  85          1HB       ASN  85  -7.828  21.338 -11.874
  671   2HB   ASN  85          2HB       ASN  85  -6.577  22.371 -12.537
  672   1HD2  ASN  85          1HD2      ASN  85  -6.329  22.257 -14.964
  673   2HD2  ASN  85          2HD2      ASN  85  -7.774  22.269 -15.919
  674    H    GLU  86           H        GLU  86  -4.175  19.340 -14.127
  675    HA   GLU  86           HA       GLU  86  -1.995  19.549 -13.807
  676   1HB   GLU  86          1HB       GLU  86  -2.480  22.525 -14.140
  677   2HB   GLU  86          2HB       GLU  86  -1.170  21.560 -14.791
  678   1HG   GLU  86          1HG       GLU  86  -4.090  21.160 -15.588
  679   2HG   GLU  86          2HG       GLU  86  -2.994  22.209 -16.466
  680    H    THR  87           H        THR  87  -1.608  18.964 -11.616
  681    HA   THR  87           HA       THR  87  -1.269  21.272  -9.814
  682    HB   THR  87           HB       THR  87  -2.218  18.414  -9.257
  683    HG1  THR  87           1HG      THR  87  -3.315  21.094  -8.787
  684   1HG2  THR  87          1HG2      THR  87  -1.071  18.923  -7.246
  685   2HG2  THR  87          2HG2      THR  87  -1.320  20.675  -7.439
  686   3HG2  THR  87          3HG2      THR  87  -2.673  19.633  -6.936
  687    H    ASN  88           H        ASN  88   0.646  20.203 -11.790
  688    HA   ASN  88           HA       ASN  88   2.763  19.754 -11.897
  689   1HB   ASN  88          1HB       ASN  88   3.056  21.428 -10.079
  690   2HB   ASN  88          2HB       ASN  88   2.735  20.205  -8.866
  691   1HD2  ASN  88          1HD2      ASN  88   4.722  20.561  -7.896
  692   2HD2  ASN  88          2HD2      ASN  88   6.216  19.982  -8.555
  693    H    VAL  89           H        VAL  89   0.973  17.550 -11.734
  694    HA   VAL  89           HA       VAL  89   2.271  15.662  -9.918
  695    HB   VAL  89           HB       VAL  89  -0.078  14.895 -11.556
  696   1HG1  VAL  89          1HG1      VAL  89   1.080  13.487  -9.774
  697   2HG1  VAL  89          2HG1      VAL  89   0.384  14.606  -8.577
  698   3HG1  VAL  89          3HG1      VAL  89  -0.687  13.651  -9.630
  699   1HG2  VAL  89          1HG2      VAL  89  -0.116  17.148  -9.572
  700   2HG2  VAL  89          2HG2      VAL  89  -1.010  16.957 -11.099
  701   3HG2  VAL  89          3HG2      VAL  89  -1.504  16.037  -9.658
  702    H    THR  90           H        THR  90   4.195  15.103 -10.933
  703    HA   THR  90           HA       THR  90   3.863  13.870 -13.587
  704    HB   THR  90           HB       THR  90   5.060  16.126 -13.588
  705    HG1  THR  90           1HG      THR  90   5.714  14.747 -15.249
  706   1HG2  THR  90          1HG2      THR  90   7.457  14.686 -12.457
  707   2HG2  THR  90          2HG2      THR  90   7.104  16.430 -12.490
  708   3HG2  THR  90          3HG2      THR  90   6.300  15.382 -11.298
  709    H    LYS  91           H        LYS  91   4.331  13.309 -10.344
  710    HA   LYS  91           HA       LYS  91   5.767  10.841 -10.985
  711   1HB   LYS  91          1HB       LYS  91   6.937  11.100  -8.744
  712   2HB   LYS  91          2HB       LYS  91   7.501  12.120 -10.052
  713   1HG   LYS  91          1HG       LYS  91   5.308  13.403  -8.575
  714   2HG   LYS  91          2HG       LYS  91   6.626  12.972  -7.503
  715   1HD   LYS  91          1HD       LYS  91   7.581  14.156 -10.036
  716   2HD   LYS  91          2HD       LYS  91   6.518  15.236  -9.156
  717   1HE   LYS  91          1HE       LYS  91   8.025  15.546  -7.446
  718   2HE   LYS  91          2HE       LYS  91   8.514  13.863  -7.432
  719   1HZ   LYS  91          1HZ       LYS  91   9.289  15.486  -9.708
  720   2HZ   LYS  91          2HZ       LYS  91  10.091  15.704  -8.301
  721   3HZ   LYS  91          3HZ       LYS  91  10.074  14.234  -9.013
  722    H    ASP  92           H        ASP  92   3.840   9.644 -10.983
  723    HA   ASP  92           HA       ASP  92   1.827   9.971  -9.148
  724   1HB   ASP  92          1HB       ASP  92   1.169   7.637  -9.791
  725   2HB   ASP  92          2HB       ASP  92   1.521   8.651 -11.176
  726    H    VAL  93           H        VAL  93   2.696  10.142  -6.976
  727    HA   VAL  93           HA       VAL  93   3.894   7.653  -5.969
  728    HB   VAL  93           HB       VAL  93   4.892   9.204  -4.218
  729   1HG1  VAL  93          1HG1      VAL  93   6.824   9.722  -5.598
  730   2HG1  VAL  93          2HG1      VAL  93   6.174   8.129  -6.052
  731   3HG1  VAL  93          3HG1      VAL  93   5.852   9.547  -7.079
  732   1HG2  VAL  93          1HG2      VAL  93   4.763  11.456  -4.370
  733   2HG2  VAL  93          2HG2      VAL  93   4.838  11.448  -6.148
  734   3HG2  VAL  93          3HG2      VAL  93   3.297  11.117  -5.320
  735    H    VAL  94           H        VAL  94   3.520   7.514  -3.449
  736    HA   VAL  94           HA       VAL  94   0.882   8.564  -2.775
  737    HB   VAL  94           HB       VAL  94   1.686   5.650  -2.685
  738   1HG1  VAL  94          1HG1      VAL  94   0.397   5.742  -0.798
  739   2HG1  VAL  94          2HG1      VAL  94  -0.502   7.178  -1.343
  740   3HG1  VAL  94          3HG1      VAL  94  -0.898   5.575  -2.008
  741   1HG2  VAL  94          1HG2      VAL  94  -0.399   7.142  -4.309
  742   2HG2  VAL  94          2HG2      VAL  94   1.038   6.285  -4.916
  743   3HG2  VAL  94          3HG2      VAL  94  -0.302   5.369  -4.185
  744    H    CYS  95           H        CYS  95   0.485   8.598  -0.445
  745    HA   CYS  95           HA       CYS  95   2.883   9.164   0.962
  746   1HB   CYS  95          1HB       CYS  95  -0.023   9.470   1.428
  747   2HB   CYS  95          2HB       CYS  95   0.926   9.199   2.877
  748    HG   CYS  95           HG       CYS  95   0.383  11.807   1.510
  749    H    LEU  96           H        LEU  96   3.926   7.884   2.529
  750    HA   LEU  96           HA       LEU  96   3.366   5.100   2.440
  751   1HB   LEU  96          1HB       LEU  96   5.421   6.895   3.551
  752   2HB   LEU  96          2HB       LEU  96   5.154   5.427   4.470
  753    HG   LEU  96           HG       LEU  96   5.313   4.678   1.726
  754   1HD1  LEU  96          1HD1      LEU  96   7.346   6.736   2.557
  755   2HD1  LEU  96          2HD1      LEU  96   7.759   5.448   1.400
  756   3HD1  LEU  96          3HD1      LEU  96   6.443   6.587   1.030
  757   1HD2  LEU  96          1HD2      LEU  96   7.499   3.615   2.622
  758   2HD2  LEU  96          2HD2      LEU  96   6.970   4.248   4.199
  759   3HD2  LEU  96          3HD2      LEU  96   5.939   3.102   3.309
  760    H    ASN  97           H        ASN  97   3.187   7.629   5.042
  761    HA   ASN  97           HA       ASN  97   2.213   6.010   6.994
  762   1HB   ASN  97          1HB       ASN  97   2.717   8.725   6.711
  763   2HB   ASN  97          2HB       ASN  97   0.970   8.728   6.856
  764   1HD2  ASN  97          1HD2      ASN  97   1.424   9.890   8.835
  765   2HD2  ASN  97          2HD2      ASN  97   1.750   9.026  10.300
  766    H    ASP  98           H        ASP  98   0.626   7.499   4.164
  767    HA   ASP  98           HA       ASP  98  -1.996   7.264   5.033
  768   1HB   ASP  98          1HB       ASP  98  -0.548   7.829   2.544
  769   2HB   ASP  98          2HB       ASP  98  -1.982   6.874   2.222
  770    H    VAL  99           H        VAL  99   0.239   5.106   3.172
  771    HA   VAL  99           HA       VAL  99  -1.687   3.109   2.654
  772    HB   VAL  99           HB       VAL  99   1.332   3.157   2.667
  773   1HG1  VAL  99          1HG1      VAL  99   0.655   1.028   1.078
  774   2HG1  VAL  99          2HG1      VAL  99   1.211   0.909   2.764
  775   3HG1  VAL  99          3HG1      VAL  99  -0.530   0.885   2.398
  776   1HG2  VAL  99          1HG2      VAL  99  -0.554   4.223   0.890
  777   2HG2  VAL  99          2HG2      VAL  99   1.184   3.975   0.593
  778   3HG2  VAL  99          3HG2      VAL  99   0.011   2.724   0.115
  779    H    SER 100           H        SER 100   0.474   3.877   5.376
  780    HA   SER 100           HA       SER 100   0.335   1.371   6.582
  781   1HB   SER 100          1HB       SER 100   2.013   3.148   7.126
  782   2HB   SER 100          2HB       SER 100   0.747   4.109   7.864
  783    HG   SER 100           HG       SER 100   0.393   2.338   9.390
  784    H    CYS 101           H        CYS 101  -1.916   4.052   6.315
  785    HA   CYS 101           HA       CYS 101  -3.409   3.394   8.647
  786   1HB   CYS 101          1HB       CYS 101  -3.245   5.673   7.392
  787   2HB   CYS 101          2HB       CYS 101  -4.477   5.012   6.335
  788    HG   CYS 101           HG       CYS 101  -5.121   4.245   9.335
  789    H    TYR 102           H        TYR 102  -3.784   2.978   5.055
  790    HA   TYR 102           HA       TYR 102  -6.196   1.585   5.153
  791   1HB   TYR 102          1HB       TYR 102  -5.078   2.630   3.142
  792   2HB   TYR 102          2HB       TYR 102  -3.745   1.502   3.285
  793    HD1  TYR 102           1HD      TYR 102  -3.745   0.036   1.490
  794    HD2  TYR 102           2HD      TYR 102  -7.477   1.053   3.318
  795    HE1  TYR 102           1HE      TYR 102  -4.953  -1.579  -0.059
  796    HE2  TYR 102           2HE      TYR 102  -8.672  -0.565   1.763
  797    HH   TYR 102           HH       TYR 102  -8.136  -1.496  -0.620
  798    H    PHE 103           H        PHE 103  -2.791   0.335   4.873
  799    HA   PHE 103           HA       PHE 103  -3.476  -2.345   4.894
  800   1HB   PHE 103          1HB       PHE 103  -1.088  -0.634   5.728
  801   2HB   PHE 103          2HB       PHE 103  -1.015  -2.365   5.987
  802    HD1  PHE 103           1HD      PHE 103  -2.756  -0.900   3.101
  803    HD2  PHE 103           2HD      PHE 103   0.824  -2.711   4.482
  804    HE1  PHE 103           1HE      PHE 103  -2.005  -1.224   0.729
  805    HE2  PHE 103           2HE      PHE 103   1.576  -3.035   2.109
  806    HZ   PHE 103           HZ       PHE 103   0.152  -2.288   0.261
  807    H    SER 104           H        SER 104  -3.102   0.009   7.555
  808    HA   SER 104           HA       SER 104  -2.815  -1.786   9.617
  809   1HB   SER 104          1HB       SER 104  -2.436   0.527  10.064
  810   2HB   SER 104          2HB       SER 104  -4.001   1.000   9.433
  811    HG   SER 104           HG       SER 104  -5.020  -0.015  11.255
  812    H    LEU 105           H        LEU 105  -5.689  -0.675   7.804
  813    HA   LEU 105           HA       LEU 105  -7.566  -1.772   9.636
  814   1HB   LEU 105          1HB       LEU 105  -7.564  -0.186   7.248
  815   2HB   LEU 105          2HB       LEU 105  -8.690  -1.514   7.050
  816    HG   LEU 105           HG       LEU 105  -8.919  -0.146   9.648
  817   1HD1  LEU 105          1HD1      LEU 105  -8.759   1.445   7.215
  818   2HD1  LEU 105          2HD1      LEU 105 -10.330   1.620   8.034
  819   3HD1  LEU 105          3HD1      LEU 105  -8.822   1.955   8.919
  820   1HD2  LEU 105          1HD2      LEU 105 -11.359  -0.137   8.865
  821   2HD2  LEU 105          2HD2      LEU 105 -10.789  -1.109   7.488
  822   3HD2  LEU 105          3HD2      LEU 105 -10.584  -1.714   9.149
  823    H    LEU 106           H        LEU 106  -5.810  -2.910   6.734
  824    HA   LEU 106           HA       LEU 106  -7.329  -5.190   6.260
  825   1HB   LEU 106          1HB       LEU 106  -4.726  -4.100   5.490
  826   2HB   LEU 106          2HB       LEU 106  -4.751  -5.852   5.539
  827    HG   LEU 106           HG       LEU 106  -5.288  -4.700   3.318
  828   1HD1  LEU 106          1HD1      LEU 106  -7.563  -6.414   3.507
  829   2HD1  LEU 106          2HD1      LEU 106  -5.966  -6.743   2.794
  830   3HD1  LEU 106          3HD1      LEU 106  -6.260  -7.090   4.515
  831   1HD2  LEU 106          1HD2      LEU 106  -7.048  -3.220   4.730
  832   2HD2  LEU 106          2HD2      LEU 106  -7.183  -3.524   2.981
  833   3HD2  LEU 106          3HD2      LEU 106  -8.130  -4.500   4.130
  834    H    GLU 107           H        GLU 107  -4.374  -4.703   8.304
  835    HA   GLU 107           HA       GLU 107  -4.472  -7.381   9.203
  836   1HB   GLU 107          1HB       GLU 107  -2.693  -5.094   9.423
  837   2HB   GLU 107          2HB       GLU 107  -2.930  -5.797  11.010
  838   1HG   GLU 107          1HG       GLU 107  -2.609  -8.064   9.434
  839   2HG   GLU 107          2HG       GLU 107  -1.547  -6.923   8.634
  840    H    GLY 108           H        GLY 108  -5.709  -4.227  10.325
  841   1HA   GLY 108          1HA       GLY 108  -7.641  -4.134  11.678
  842   2HA   GLY 108          2HA       GLY 108  -7.186  -5.644  12.442
  843    H    GLY 109           H        GLY 109  -6.488  -2.144  12.220
  844   1HA   GLY 109          1HA       GLY 109  -5.671  -2.086  14.973
  845   2HA   GLY 109          2HA       GLY 109  -4.335  -1.837  13.866
  846    H    ARG 110           H        ARG 110  -7.827  -0.848  13.677
  847    HA   ARG 110           HA       ARG 110  -6.853   1.831  13.154
  848   1HB   ARG 110          1HB       ARG 110  -8.377   0.826  11.457
  849   2HB   ARG 110          2HB       ARG 110  -9.601   0.567  12.684
  850   1HG   ARG 110          1HG       ARG 110  -9.489   3.131  13.108
  851   2HG   ARG 110          2HG       ARG 110  -8.575   3.228  11.616
  852   1HD   ARG 110          1HD       ARG 110 -10.439   2.934  10.327
  853   2HD   ARG 110          2HD       ARG 110 -10.998   1.583  11.293
  854    HE   ARG 110           HE       ARG 110 -12.326   3.049  12.566
  855   1HH1  ARG 110          2HH2      ARG 110 -10.051   4.897  10.619
  856   2HH1  ARG 110          1HH2      ARG 110 -10.791   6.422  10.971
  857   1HH2  ARG 110          2HH1      ARG 110 -13.304   5.061  13.031
  858   2HH2  ARG 110          1HH1      ARG 110 -12.654   6.517  12.352
  859    HA   PRO 111           HA       PRO 111  -8.376   2.866  17.141
  860   1HB   PRO 111          1HB       PRO 111  -7.732   5.522  17.123
  861   2HB   PRO 111          2HB       PRO 111  -6.592   4.262  17.551
  862   1HG   PRO 111          1HG       PRO 111  -6.763   5.836  15.055
  863   2HG   PRO 111          2HG       PRO 111  -5.417   4.900  15.672
  864   1HD   PRO 111          1HD       PRO 111  -7.207   4.145  13.562
  865   2HD   PRO 111          2HD       PRO 111  -5.934   3.163  14.258
  866    H    GLU 112           H        GLU 112 -10.030   4.098  18.267
  867    HA   GLU 112           HA       GLU 112 -12.257   4.291  16.566
  868   1HB   GLU 112          1HB       GLU 112 -11.687   4.647  19.479
  869   2HB   GLU 112          2HB       GLU 112 -13.102   5.486  18.874
  870   1HG   GLU 112          1HG       GLU 112 -14.210   3.513  19.098
  871   2HG   GLU 112          2HG       GLU 112 -13.341   2.976  17.674
  872    H    ASP 113           H        ASP 113  -9.691   6.457  17.396
  873    HA   ASP 113           HA       ASP 113  -9.413   8.624  17.249
  874   1HB   ASP 113          1HB       ASP 113  -9.437   7.892  14.857
  875   2HB   ASP 113          2HB       ASP 113 -11.159   8.206  14.776
  876    H    LYS 114           H        LYS 114 -11.648   7.979  18.961
  877    HA   LYS 114           HA       LYS 114 -14.040   9.179  18.391
  878   1HB   LYS 114          1HB       LYS 114 -14.479   9.087  20.711
  879   2HB   LYS 114          2HB       LYS 114 -13.432   7.725  20.362
  880   1HG   LYS 114          1HG       LYS 114 -11.477   8.907  21.225
  881   2HG   LYS 114          2HG       LYS 114 -12.373  10.407  21.359
  882   1HD   LYS 114          1HD       LYS 114 -13.952   9.147  22.986
  883   2HD   LYS 114          2HD       LYS 114 -12.749   7.872  23.005
  884   1HE   LYS 114          1HE       LYS 114 -11.029   9.451  23.825
  885   2HE   LYS 114          2HE       LYS 114 -12.154  10.788  23.700
  886   1HZ   LYS 114          1HZ       LYS 114 -11.989   9.870  25.935
  887   2HZ   LYS 114          2HZ       LYS 114 -13.514   9.775  25.357
  888   3HZ   LYS 114          3HZ       LYS 114 -12.577   8.438  25.413
  889    H    LEU 115           H        LEU 115 -14.796  11.236  19.855
  890    HA   LEU 115           HA       LEU 115 -13.148  13.395  18.812
  891   1HB   LEU 115          1HB       LEU 115 -15.995  12.991  19.470
  892   2HB   LEU 115          2HB       LEU 115 -15.358  14.574  19.868
  893    HG   LEU 115           HG       LEU 115 -14.742  13.529  17.146
  894   1HD1  LEU 115          1HD1      LEU 115 -16.858  13.032  16.654
  895   2HD1  LEU 115          2HD1      LEU 115 -17.469  13.743  18.168
  896   3HD1  LEU 115          3HD1      LEU 115 -17.177  14.781  16.752
  897   1HD2  LEU 115          1HD2      LEU 115 -14.097  15.636  16.909
  898   2HD2  LEU 115          2HD2      LEU 115 -15.778  16.169  17.148
  899   3HD2  LEU 115          3HD2      LEU 115 -14.683  16.027  18.544
  900    H    GLU 116           H        GLU 116 -13.327  15.474  20.396
  901    HA   GLU 116           HA       GLU 116 -12.888  14.591  23.112
  902   1HB   GLU 116          1HB       GLU 116 -10.853  16.549  22.260
  903   2HB   GLU 116          2HB       GLU 116 -10.670  15.096  23.222
  904   1HG   GLU 116          1HG       GLU 116  -9.446  14.633  21.234
  905   2HG   GLU 116          2HG       GLU 116 -10.955  13.768  21.018
  906    H    TRP 117           H        TRP 117 -13.830  15.997  24.552
  907    HA   TRP 117           HA       TRP 117 -14.908  18.457  23.437
  908   1HB   TRP 117          1HB       TRP 117 -15.419  17.000  26.034
  909   2HB   TRP 117          2HB       TRP 117 -16.160  18.526  25.596
  910    HD1  TRP 117           HD       TRP 117 -16.391  14.787  24.829
  911    HE1  TRP 117           1HE      TRP 117 -18.514  14.219  23.368
  912    HE3  TRP 117           3HE      TRP 117 -17.631  19.612  23.812
  913    HZ2  TRP 117           2HZ      TRP 117 -20.431  15.816  21.983
  914    HZ3  TRP 117           3HZ      TRP 117 -19.643  20.021  22.398
  915    HH2  TRP 117           HH       TRP 117 -21.024  18.218  21.494
  916    H    SER 118           H        SER 118 -14.457  18.521  26.847
  917    HA   SER 118           HA       SER 118 -11.957  19.977  26.525
  918   1HB   SER 118          1HB       SER 118 -13.650  21.692  26.684
  919   2HB   SER 118          2HB       SER 118 -14.462  20.871  28.002
  920    HG   SER 118           HG       SER 118 -11.728  21.603  28.376
  Start of MODEL   11
    1   1H    MET   1           H        MET   1  -7.203  10.717   8.044
    2    HA   MET   1           HA       MET   1  -6.601   7.945   7.932
    3   1HB   MET   1          1HB       MET   1  -9.030   7.373   8.731
    4   2HB   MET   1          2HB       MET   1  -7.853   7.757   9.972
    5   1HG   MET   1          1HG       MET   1  -8.673  10.107  10.053
    6   2HG   MET   1          2HG       MET   1  -9.812   9.772   8.765
    7   1HE   MET   1          1HE       MET   1  -9.010   7.845  12.470
    8   2HE   MET   1          2HE       MET   1  -8.705   9.573  12.168
    9   3HE   MET   1          3HE       MET   1 -10.110   9.074  13.139
   10    H    ALA   2           H        ALA   2  -6.456   9.485   5.802
   11    HA   ALA   2           HA       ALA   2  -9.043   9.752   4.534
   12   1HB   ALA   2          1HB       ALA   2  -7.986  11.321   3.306
   13   2HB   ALA   2          2HB       ALA   2  -6.605  11.110   4.409
   14   3HB   ALA   2          3HB       ALA   2  -6.668  10.205   2.878
   15    H    LYS   3           H        LYS   3  -9.460   7.354   4.741
   16    HA   LYS   3           HA       LYS   3  -7.847   5.703   2.998
   17   1HB   LYS   3          1HB       LYS   3  -9.322   3.887   3.817
   18   2HB   LYS   3          2HB       LYS   3  -8.504   4.750   5.103
   19   1HG   LYS   3          1HG       LYS   3 -11.195   5.810   4.308
   20   2HG   LYS   3          2HG       LYS   3 -11.186   4.251   5.107
   21   1HD   LYS   3          1HD       LYS   3  -9.366   5.921   6.562
   22   2HD   LYS   3          2HD       LYS   3 -10.798   6.887   6.265
   23   1HE   LYS   3          1HE       LYS   3 -11.767   4.311   7.000
   24   2HE   LYS   3          2HE       LYS   3 -10.445   4.641   8.103
   25   1HZ   LYS   3          1HZ       LYS   3 -12.652   5.506   8.778
   26   2HZ   LYS   3          2HZ       LYS   3 -11.467   6.629   8.767
   27   3HZ   LYS   3          3HZ       LYS   3 -12.567   6.592   7.561
   28    H    GLU   4           H        GLU   4 -10.871   4.415   2.758
   29    HA   GLU   4           HA       GLU   4 -12.236   6.020   1.029
   30   1HB   GLU   4          1HB       GLU   4  -9.897   5.321  -0.244
   31   2HB   GLU   4          2HB       GLU   4 -10.954   4.031  -0.780
   32   1HG   GLU   4          1HG       GLU   4 -11.666   5.508  -2.365
   33   2HG   GLU   4          2HG       GLU   4 -12.607   6.232  -1.076
   34    H    ARG   5           H        ARG   5 -14.056   4.842  -0.033
   35    HA   ARG   5           HA       ARG   5 -14.240   2.090   0.852
   36   1HB   ARG   5          1HB       ARG   5 -15.950   4.388   1.692
   37   2HB   ARG   5          2HB       ARG   5 -16.848   2.971   1.186
   38   1HG   ARG   5          1HG       ARG   5 -15.941   1.611   2.893
   39   2HG   ARG   5          2HG       ARG   5 -14.517   2.615   3.082
   40   1HD   ARG   5          1HD       ARG   5 -15.811   4.376   4.183
   41   2HD   ARG   5          2HD       ARG   5 -17.324   3.576   3.805
   42    HE   ARG   5           HE       ARG   5 -15.912   1.658   5.239
   43   1HH1  ARG   5          2HH2      ARG   5 -16.865   4.989   5.852
   44   2HH1  ARG   5          1HH2      ARG   5 -16.961   4.781   7.569
   45   1HH2  ARG   5          2HH1      ARG   5 -16.038   1.382   7.504
   46   2HH2  ARG   5          1HH1      ARG   5 -16.488   2.715   8.515
   47    H    GLY   6           H        GLY   6 -14.450   0.989  -1.081
   48   1HA   GLY   6          1HA       GLY   6 -16.331   0.539  -2.693
   49   2HA   GLY   6          2HA       GLY   6 -16.141   2.214  -3.173
   50    H    LEU   7           H        LEU   7 -13.054   1.529  -2.374
   51    HA   LEU   7           HA       LEU   7 -12.409   0.815  -5.123
   52   1HB   LEU   7          1HB       LEU   7 -10.921   2.126  -2.868
   53   2HB   LEU   7          2HB       LEU   7 -10.060   1.448  -4.236
   54    HG   LEU   7           HG       LEU   7 -10.568   3.937  -4.300
   55   1HD1  LEU   7          1HD1      LEU   7 -10.068   2.258  -6.270
   56   2HD1  LEU   7          2HD1      LEU   7 -11.740   2.653  -6.735
   57   3HD1  LEU   7          3HD1      LEU   7 -10.527   3.948  -6.590
   58   1HD2  LEU   7          1HD2      LEU   7 -12.991   3.505  -3.507
   59   2HD2  LEU   7          2HD2      LEU   7 -12.699   4.754  -4.741
   60   3HD2  LEU   7          3HD2      LEU   7 -13.325   3.158  -5.221
   61    H    ILE   8           H        ILE   8 -10.200  -0.550  -5.205
   62    HA   ILE   8           HA       ILE   8  -9.628  -2.720  -5.168
   63    HB   ILE   8           HB       ILE   8  -8.171  -1.690  -3.566
   64   1HG1  ILE   8          1HG1      ILE   8  -9.029  -4.322  -2.353
   65   2HG1  ILE   8          2HG1      ILE   8  -8.244  -4.231  -3.917
   66   1HG2  ILE   8          1HG2      ILE   8  -9.916  -0.739  -2.094
   67   2HG2  ILE   8          2HG2      ILE   8 -10.212  -2.364  -1.430
   68   3HG2  ILE   8          3HG2      ILE   8  -8.631  -1.581  -1.196
   69   1HD1  ILE   8          1HD1      ILE   8  -6.595  -4.613  -2.099
   70   2HD1  ILE   8          2HD1      ILE   8  -6.307  -3.053  -2.906
   71   3HD1  ILE   8          3HD1      ILE   8  -7.109  -3.098  -1.317
   72    H    SER   9           H        SER   9 -11.508  -3.815  -5.857
   73    HA   SER   9           HA       SER   9 -13.727  -4.293  -4.417
   74   1HB   SER   9          1HB       SER   9 -12.489  -5.339  -6.787
   75   2HB   SER   9          2HB       SER   9 -13.071  -6.709  -5.863
   76    HG   SER   9           HG       SER   9 -14.502  -4.887  -7.332
   77    HA   PRO  10           HA       PRO  10 -12.805  -7.360  -1.457
   78   1HB   PRO  10          1HB       PRO  10 -14.765  -9.253  -1.661
   79   2HB   PRO  10          2HB       PRO  10 -15.006  -7.705  -0.876
   80   1HG   PRO  10          1HG       PRO  10 -15.958  -8.608  -3.525
   81   2HG   PRO  10          2HG       PRO  10 -16.526  -7.264  -2.553
   82   1HD   PRO  10          1HD       PRO  10 -14.837  -7.117  -4.867
   83   2HD   PRO  10          2HD       PRO  10 -15.310  -5.787  -3.828
   84    H    SER  11           H        SER  11 -12.448  -8.112  -4.640
   85    HA   SER  11           HA       SER  11 -11.767 -10.828  -4.300
   86   1HB   SER  11          1HB       SER  11 -11.931  -8.879  -6.475
   87   2HB   SER  11          2HB       SER  11 -10.481  -9.852  -6.628
   88    HG   SER  11           HG       SER  11 -12.819 -11.295  -5.975
   89    H    ASP  12           H        ASP  12 -10.009  -7.691  -4.365
   90    HA   ASP  12           HA       ASP  12  -7.467  -8.896  -4.359
   91   1HB   ASP  12          1HB       ASP  12  -8.562  -6.277  -4.570
   92   2HB   ASP  12          2HB       ASP  12  -7.539  -6.232  -3.148
   93    H    PHE  13           H        PHE  13  -9.577  -7.253  -1.889
   94    HA   PHE  13           HA       PHE  13  -7.912  -7.426   0.277
   95   1HB   PHE  13          1HB       PHE  13 -10.790  -7.154  -0.388
   96   2HB   PHE  13          2HB       PHE  13 -10.581  -7.980   1.143
   97    HD1  PHE  13           1HD      PHE  13 -10.876  -6.563   2.926
   98    HD2  PHE  13           2HD      PHE  13  -8.874  -5.091  -0.514
   99    HE1  PHE  13           1HE      PHE  13 -10.533  -4.356   4.070
  100    HE2  PHE  13           2HE      PHE  13  -8.531  -2.884   0.630
  101    HZ   PHE  13           HZ       PHE  13  -9.364  -2.542   2.909
  102    H    ALA  14           H        ALA  14 -10.127  -9.912  -1.103
  103    HA   ALA  14           HA       ALA  14  -9.922 -11.736   0.997
  104   1HB   ALA  14          1HB       ALA  14 -10.537 -13.377  -0.900
  105   2HB   ALA  14          2HB       ALA  14 -11.658 -12.029  -0.590
  106   3HB   ALA  14          3HB       ALA  14 -10.530 -11.951  -1.966
  107    H    GLN  15           H        GLN  15  -7.912 -11.172  -1.944
  108    HA   GLN  15           HA       GLN  15  -6.291 -13.416  -1.466
  109   1HB   GLN  15          1HB       GLN  15  -6.320 -12.664  -3.702
  110   2HB   GLN  15          2HB       GLN  15  -6.125 -10.982  -3.251
  111   1HG   GLN  15          1HG       GLN  15  -4.008 -11.734  -4.163
  112   2HG   GLN  15          2HG       GLN  15  -3.786 -11.520  -2.437
  113   1HE2  GLN  15          1HE2      GLN  15  -3.120 -13.471  -4.948
  114   2HE2  GLN  15          2HE2      GLN  15  -2.918 -15.003  -4.165
  115    H    LEU  16           H        LEU  16  -5.835  -9.848  -0.951
  116    HA   LEU  16           HA       LEU  16  -3.307  -9.951   0.120
  117   1HB   LEU  16          1HB       LEU  16  -5.305  -8.053  -0.304
  118   2HB   LEU  16          2HB       LEU  16  -5.004  -7.989   1.422
  119    HG   LEU  16           HG       LEU  16  -3.009  -7.551  -0.810
  120   1HD1  LEU  16          1HD1      LEU  16  -4.760  -5.797   0.424
  121   2HD1  LEU  16          2HD1      LEU  16  -3.224  -5.530   1.283
  122   3HD1  LEU  16          3HD1      LEU  16  -3.294  -5.365  -0.488
  123   1HD2  LEU  16          1HD2      LEU  16  -1.897  -6.978   1.767
  124   2HD2  LEU  16          2HD2      LEU  16  -2.481  -8.660   1.743
  125   3HD2  LEU  16          3HD2      LEU  16  -1.321  -8.104   0.514
  126    H    GLN  17           H        GLN  17  -6.507 -10.394   1.733
  127    HA   GLN  17           HA       GLN  17  -5.565 -10.518   4.301
  128   1HB   GLN  17          1HB       GLN  17  -7.974 -10.411   3.583
  129   2HB   GLN  17          2HB       GLN  17  -7.889 -12.096   3.111
  130   1HG   GLN  17          1HG       GLN  17  -7.030 -12.494   5.577
  131   2HG   GLN  17          2HG       GLN  17  -7.704 -10.909   5.898
  132   1HE2  GLN  17          1HE2      GLN  17  -9.957 -10.533   5.188
  133   2HE2  GLN  17          2HE2      GLN  17 -11.113 -11.811   5.363
  134    H    LYS  18           H        LYS  18  -6.385 -13.342   2.147
  135    HA   LYS  18           HA       LYS  18  -5.424 -15.321   3.752
  136   1HB   LYS  18          1HB       LYS  18  -6.713 -15.551   1.610
  137   2HB   LYS  18          2HB       LYS  18  -5.230 -15.248   0.728
  138   1HG   LYS  18          1HG       LYS  18  -4.529 -17.236   2.616
  139   2HG   LYS  18          2HG       LYS  18  -6.125 -17.704   2.066
  140   1HD   LYS  18          1HD       LYS  18  -4.924 -17.008  -0.328
  141   2HD   LYS  18          2HD       LYS  18  -3.552 -17.630   0.567
  142   1HE   LYS  18          1HE       LYS  18  -4.937 -19.704   1.108
  143   2HE   LYS  18          2HE       LYS  18  -6.181 -19.091   0.036
  144   1HZ   LYS  18          1HZ       LYS  18  -4.240 -20.630  -0.789
  145   2HZ   LYS  18          2HZ       LYS  18  -4.929 -19.515  -1.762
  146   3HZ   LYS  18          3HZ       LYS  18  -3.504 -19.193  -1.033
  147    H    TYR  19           H        TYR  19  -3.584 -13.470   1.228
  148    HA   TYR  19           HA       TYR  19  -1.147 -14.721   1.649
  149   1HB   TYR  19          1HB       TYR  19  -2.308 -12.163   0.563
  150   2HB   TYR  19          2HB       TYR  19  -0.612 -12.044   0.991
  151    HD1  TYR  19           1HD      TYR  19  -2.508 -14.913  -0.502
  152    HD2  TYR  19           2HD      TYR  19   0.556 -11.973  -1.029
  153    HE1  TYR  19           1HE      TYR  19  -1.867 -15.969  -2.724
  154    HE2  TYR  19           2HE      TYR  19   1.186 -13.039  -3.249
  155    HH   TYR  19           HH       TYR  19  -0.795 -15.453  -4.716
  156    H    MET  20           H        MET  20  -2.633 -11.856   3.271
  157    HA   MET  20           HA       MET  20  -0.375 -11.152   4.706
  158   1HB   MET  20          1HB       MET  20  -3.349 -10.689   4.862
  159   2HB   MET  20          2HB       MET  20  -2.450 -10.343   6.326
  160   1HG   MET  20          1HG       MET  20  -0.910  -8.849   5.012
  161   2HG   MET  20          2HG       MET  20  -1.842  -9.178   3.564
  162   1HE   MET  20          1HE       MET  20  -3.090  -6.650   7.177
  163   2HE   MET  20          2HE       MET  20  -2.362  -8.267   7.328
  164   3HE   MET  20          3HE       MET  20  -1.431  -6.936   6.600
  165    H    GLU  21           H        GLU  21  -3.122 -13.365   5.496
  166    HA   GLU  21           HA       GLU  21  -2.678 -13.837   8.085
  167   1HB   GLU  21          1HB       GLU  21  -3.927 -15.230   5.874
  168   2HB   GLU  21          2HB       GLU  21  -3.128 -16.406   6.899
  169   1HG   GLU  21          1HG       GLU  21  -4.321 -14.744   8.780
  170   2HG   GLU  21          2HG       GLU  21  -5.488 -14.694   7.473
  171    H    TYR  22           H        TYR  22  -1.019 -15.547   5.338
  172    HA   TYR  22           HA       TYR  22   0.596 -17.188   6.851
  173   1HB   TYR  22          1HB       TYR  22   0.174 -16.333   4.161
  174   2HB   TYR  22          2HB       TYR  22   1.850 -15.919   4.464
  175    HD1  TYR  22           1HD      TYR  22   3.480 -17.523   4.044
  176    HD2  TYR  22           2HD      TYR  22  -0.509 -18.806   4.911
  177    HE1  TYR  22           1HE      TYR  22   4.149 -19.933   3.593
  178    HE2  TYR  22           2HE      TYR  22   0.175 -21.212   4.456
  179    HH   TYR  22           HH       TYR  22   1.985 -22.570   4.310
  180    H    SER  23           H        SER  23   1.046 -13.746   5.893
  181    HA   SER  23           HA       SER  23   3.687 -13.676   6.891
  182   1HB   SER  23          1HB       SER  23   1.944 -11.969   5.387
  183   2HB   SER  23          2HB       SER  23   2.470 -11.049   6.783
  184    HG   SER  23           HG       SER  23   4.627 -11.293   6.186
  185    H    THR  24           H        THR  24   4.427 -13.063   8.939
  186    HA   THR  24           HA       THR  24   2.330 -12.358  10.887
  187    HB   THR  24           HB       THR  24   3.613 -14.712  10.892
  188    HG1  THR  24           1HG      THR  24   3.209 -14.561  13.192
  189   1HG2  THR  24          1HG2      THR  24   5.841 -13.092  11.144
  190   2HG2  THR  24          2HG2      THR  24   5.396 -13.336  12.851
  191   3HG2  THR  24          3HG2      THR  24   5.734 -14.740  11.810
  192    H    LYS  25           H        LYS  25   4.153 -10.690   9.054
  193    HA   LYS  25           HA       LYS  25   5.716  -9.352  11.126
  194   1HB   LYS  25          1HB       LYS  25   5.816  -9.456   8.130
  195   2HB   LYS  25          2HB       LYS  25   6.452  -8.043   8.949
  196   1HG   LYS  25          1HG       LYS  25   7.870  -9.564  10.389
  197   2HG   LYS  25          2HG       LYS  25   7.283 -10.937   9.472
  198   1HD   LYS  25          1HD       LYS  25   8.682 -10.509   7.722
  199   2HD   LYS  25          2HD       LYS  25   8.277  -8.804   7.704
  200   1HE   LYS  25          1HE       LYS  25  10.555  -8.757   8.302
  201   2HE   LYS  25          2HE       LYS  25   9.769  -8.645   9.864
  202   1HZ   LYS  25          1HZ       LYS  25  10.153 -10.902  10.253
  203   2HZ   LYS  25          2HZ       LYS  25  10.561 -11.218   8.703
  204   3HZ   LYS  25          3HZ       LYS  25  11.562 -10.339   9.649
  205    H    LYS  26           H        LYS  26   5.659  -6.883  11.069
  206    HA   LYS  26           HA       LYS  26   2.851  -6.087  10.798
  207   1HB   LYS  26          1HB       LYS  26   5.061  -4.970  12.549
  208   2HB   LYS  26          2HB       LYS  26   3.440  -4.314  12.439
  209   1HG   LYS  26          1HG       LYS  26   3.415  -7.223  12.915
  210   2HG   LYS  26          2HG       LYS  26   4.294  -6.366  14.165
  211   1HD   LYS  26          1HD       LYS  26   2.407  -5.059  14.785
  212   2HD   LYS  26          2HD       LYS  26   1.591  -5.333  13.259
  213   1HE   LYS  26          1HE       LYS  26   2.181  -7.794  14.858
  214   2HE   LYS  26          2HE       LYS  26   1.009  -6.700  15.565
  215   1HZ   LYS  26          1HZ       LYS  26   0.866  -7.714  12.811
  216   2HZ   LYS  26          2HZ       LYS  26   0.023  -8.325  14.070
  217   3HZ   LYS  26          3HZ       LYS  26  -0.259  -6.799  13.561
  218    H    VAL  27           H        VAL  27   2.307  -4.122   9.738
  219    HA   VAL  27           HA       VAL  27   3.990  -3.525   7.548
  220    HB   VAL  27           HB       VAL  27   1.456  -3.463   7.702
  221   1HG1  VAL  27          1HG1      VAL  27   0.350  -1.898   8.882
  222   2HG1  VAL  27          2HG1      VAL  27   1.880  -1.708   9.773
  223   3HG1  VAL  27          3HG1      VAL  27   1.490  -0.609   8.428
  224   1HG2  VAL  27          1HG2      VAL  27   3.245  -1.504   6.353
  225   2HG2  VAL  27          2HG2      VAL  27   2.112  -2.692   5.665
  226   3HG2  VAL  27          3HG2      VAL  27   1.500  -1.154   6.318
  227    H    SER  28           H        SER  28   3.727  -2.362  10.844
  228    HA   SER  28           HA       SER  28   4.718   0.204  10.410
  229   1HB   SER  28          1HB       SER  28   3.570  -0.695  12.502
  230   2HB   SER  28          2HB       SER  28   5.068  -1.510  12.907
  231    HG   SER  28           HG       SER  28   4.697   0.689  13.879
  232    H    ASP  29           H        ASP  29   6.223  -3.008  10.738
  233    HA   ASP  29           HA       ASP  29   8.802  -2.059  11.269
  234   1HB   ASP  29          1HB       ASP  29   7.580  -4.652  10.323
  235   2HB   ASP  29          2HB       ASP  29   9.314  -4.461  10.161
  236    H    VAL  30           H        VAL  30   6.932  -2.977   8.316
  237    HA   VAL  30           HA       VAL  30   9.150  -2.648   6.557
  238    HB   VAL  30           HB       VAL  30   6.171  -2.950   6.181
  239   1HG1  VAL  30          1HG1      VAL  30   7.135  -1.605   4.329
  240   2HG1  VAL  30          2HG1      VAL  30   8.294  -2.917   4.009
  241   3HG1  VAL  30          3HG1      VAL  30   6.549  -3.198   3.794
  242   1HG2  VAL  30          1HG2      VAL  30   8.232  -4.790   6.749
  243   2HG2  VAL  30          2HG2      VAL  30   6.557  -5.146   6.265
  244   3HG2  VAL  30          3HG2      VAL  30   7.832  -5.018   5.029
  245    H    LEU  31           H        LEU  31   6.746  -0.564   8.060
  246    HA   LEU  31           HA       LEU  31   6.775   1.496   6.157
  247   1HB   LEU  31          1HB       LEU  31   5.558   0.925   8.638
  248   2HB   LEU  31          2HB       LEU  31   6.385   2.457   8.839
  249    HG   LEU  31           HG       LEU  31   5.168   2.941   6.481
  250   1HD1  LEU  31          1HD1      LEU  31   2.980   2.003   6.358
  251   2HD1  LEU  31          2HD1      LEU  31   4.132   0.655   6.514
  252   3HD1  LEU  31          3HD1      LEU  31   3.177   1.176   7.923
  253   1HD2  LEU  31          1HD2      LEU  31   3.180   3.693   8.185
  254   2HD2  LEU  31          2HD2      LEU  31   4.540   3.471   9.312
  255   3HD2  LEU  31          3HD2      LEU  31   4.699   4.586   7.934
  256    H    LYS  32           H        LYS  32   8.617   1.064   9.259
  257    HA   LYS  32           HA       LYS  32  10.148   3.363   8.972
  258   1HB   LYS  32          1HB       LYS  32  11.500   2.474  10.724
  259   2HB   LYS  32          2HB       LYS  32   9.842   2.011  11.050
  260   1HG   LYS  32          1HG       LYS  32  10.207  -0.252  10.409
  261   2HG   LYS  32          2HG       LYS  32  11.648   0.138   9.490
  262   1HD   LYS  32          1HD       LYS  32  12.673  -0.709  11.385
  263   2HD   LYS  32          2HD       LYS  32  12.537   0.963  11.891
  264   1HE   LYS  32          1HE       LYS  32  10.203   0.275  12.864
  265   2HE   LYS  32          2HE       LYS  32  10.756  -1.377  12.670
  266   1HZ   LYS  32          1HZ       LYS  32  12.802  -0.534  13.918
  267   2HZ   LYS  32          2HZ       LYS  32  11.851   0.707  14.389
  268   3HZ   LYS  32          3HZ       LYS  32  11.439  -0.827  14.768
  269    H    LEU  33           H        LEU  33  10.391   0.144   7.494
  270    HA   LEU  33           HA       LEU  33  13.055   0.282   6.693
  271   1HB   LEU  33          1HB       LEU  33  10.630  -1.247   5.918
  272   2HB   LEU  33          2HB       LEU  33  11.953  -1.223   4.768
  273    HG   LEU  33           HG       LEU  33  12.277  -2.045   7.664
  274   1HD1  LEU  33          1HD1      LEU  33  10.883  -3.723   6.950
  275   2HD1  LEU  33          2HD1      LEU  33  11.435  -3.621   5.261
  276   3HD1  LEU  33          3HD1      LEU  33  12.469  -4.387   6.491
  277   1HD2  LEU  33          1HD2      LEU  33  14.145  -3.095   5.669
  278   2HD2  LEU  33          2HD2      LEU  33  14.190  -1.322   5.820
  279   3HD2  LEU  33          3HD2      LEU  33  14.451  -2.345   7.254
  280    H    PHE  34           H        PHE  34  10.008   1.440   5.138
  281    HA   PHE  34           HA       PHE  34  11.469   2.451   2.885
  282   1HB   PHE  34          1HB       PHE  34   8.631   2.322   3.958
  283   2HB   PHE  34          2HB       PHE  34   8.961   3.546   2.748
  284    HD1  PHE  34           1HD      PHE  34   9.191   2.972   0.458
  285    HD2  PHE  34           2HD      PHE  34   8.989  -0.092   3.387
  286    HE1  PHE  34           1HE      PHE  34   8.898   1.259  -1.354
  287    HE2  PHE  34           2HE      PHE  34   8.696  -1.805   1.575
  288    HZ   PHE  34           HZ       PHE  34   8.653  -1.108  -0.774
  289    H    GLU  35           H        GLU  35  10.817   3.516   6.095
  290    HA   GLU  35           HA       GLU  35  10.691   6.286   5.390
  291   1HB   GLU  35          1HB       GLU  35  10.979   4.967   8.126
  292   2HB   GLU  35          2HB       GLU  35  10.592   6.652   7.840
  293   1HG   GLU  35          1HG       GLU  35   8.775   4.944   6.321
  294   2HG   GLU  35          2HG       GLU  35   8.775   4.464   8.006
  295    H    ASP  36           H        ASP  36  12.964   4.165   7.287
  296    HA   ASP  36           HA       ASP  36  15.033   6.106   6.612
  297   1HB   ASP  36          1HB       ASP  36  14.972   4.105   8.920
  298   2HB   ASP  36          2HB       ASP  36  16.229   5.292   8.632
  299    H    GLY  37           H        GLY  37  13.963   2.700   6.756
  300   1HA   GLY  37          1HA       GLY  37  16.320   1.333   6.285
  301   2HA   GLY  37          2HA       GLY  37  14.723   0.831   5.768
  302    H    GLU  38           H        GLU  38  16.628   0.044   4.078
  303    HA   GLU  38           HA       GLU  38  17.453   1.954   2.226
  304   1HB   GLU  38          1HB       GLU  38  18.512   0.191   1.195
  305   2HB   GLU  38          2HB       GLU  38  18.171  -0.592   2.725
  306   1HG   GLU  38          1HG       GLU  38  15.865  -1.235   1.558
  307   2HG   GLU  38          2HG       GLU  38  16.743  -0.914   0.075
  308    H    MET  39           H        MET  39  14.405   0.346   2.771
  309    HA   MET  39           HA       MET  39  13.465   0.358   0.146
  310   1HB   MET  39          1HB       MET  39  12.032   0.512   2.855
  311   2HB   MET  39          2HB       MET  39  11.195   0.224   1.342
  312   1HG   MET  39          1HG       MET  39  13.496  -1.544   2.287
  313   2HG   MET  39          2HG       MET  39  11.830  -1.867   2.724
  314   1HE   MET  39          1HE       MET  39  14.344  -1.399  -0.285
  315   2HE   MET  39          2HE       MET  39  14.460  -2.936   0.606
  316   3HE   MET  39          3HE       MET  39  13.923  -2.929  -1.091
  317    H    ALA  40           H        ALA  40  14.305   2.948   2.164
  318    HA   ALA  40           HA       ALA  40  12.176   4.720   1.440
  319   1HB   ALA  40          1HB       ALA  40  13.345   4.971   3.565
  320   2HB   ALA  40          2HB       ALA  40  14.904   5.146   2.724
  321   3HB   ALA  40          3HB       ALA  40  13.655   6.403   2.554
  322    H    LYS  41           H        LYS  41  14.606   3.279  -0.333
  323    HA   LYS  41           HA       LYS  41  15.465   5.605  -1.782
  324   1HB   LYS  41          1HB       LYS  41  16.874   4.136  -2.968
  325   2HB   LYS  41          2HB       LYS  41  16.869   3.549  -1.317
  326   1HG   LYS  41          1HG       LYS  41  15.221   1.805  -1.891
  327   2HG   LYS  41          2HG       LYS  41  15.059   2.443  -3.515
  328   1HD   LYS  41          1HD       LYS  41  17.761   1.541  -2.448
  329   2HD   LYS  41          2HD       LYS  41  16.638   0.392  -3.147
  330   1HE   LYS  41          1HE       LYS  41  16.590   1.684  -5.267
  331   2HE   LYS  41          2HE       LYS  41  17.639   2.903  -4.573
  332   1HZ   LYS  41          1HZ       LYS  41  19.197   0.952  -4.170
  333   2HZ   LYS  41          2HZ       LYS  41  18.290   0.144  -5.261
  334   3HZ   LYS  41          3HZ       LYS  41  19.060   1.516  -5.696
  335    H    TYR  42           H        TYR  42  12.659   3.659  -1.690
  336    HA   TYR  42           HA       TYR  42  12.071   4.262  -4.505
  337   1HB   TYR  42          1HB       TYR  42  11.304   2.198  -2.405
  338   2HB   TYR  42          2HB       TYR  42  10.094   2.579  -3.614
  339    HD1  TYR  42           1HD      TYR  42  10.634   2.204  -6.062
  340    HD2  TYR  42           2HD      TYR  42  13.151   0.778  -2.909
  341    HE1  TYR  42           1HE      TYR  42  11.738   0.574  -7.671
  342    HE2  TYR  42           2HE      TYR  42  14.247  -0.846  -4.529
  343    HH   TYR  42           HH       TYR  42  14.398  -1.513  -6.579
  344    H    VAL  43           H        VAL  43  11.923   6.032  -1.931
  345    HA   VAL  43           HA       VAL  43   9.085   6.723  -2.268
  346    HB   VAL  43           HB       VAL  43  10.856   6.915   0.175
  347   1HG1  VAL  43          1HG1      VAL  43   9.387   8.296   1.193
  348   2HG1  VAL  43          2HG1      VAL  43   8.925   8.732  -0.470
  349   3HG1  VAL  43          3HG1      VAL  43   7.974   7.527   0.432
  350   1HG2  VAL  43          1HG2      VAL  43  10.096   4.674  -0.073
  351   2HG2  VAL  43          2HG2      VAL  43   9.042   5.428   1.147
  352   3HG2  VAL  43          3HG2      VAL  43   8.456   5.202  -0.519
  353    H    GLN  44           H        GLN  44   8.676   8.740  -3.047
  354    HA   GLN  44           HA       GLN  44  10.930  10.592  -2.982
  355   1HB   GLN  44          1HB       GLN  44   9.855  11.489  -5.187
  356   2HB   GLN  44          2HB       GLN  44  10.820  10.027  -5.260
  357   1HG   GLN  44          1HG       GLN  44   7.824   9.855  -4.794
  358   2HG   GLN  44          2HG       GLN  44   8.451  10.064  -6.416
  359   1HE2  GLN  44          1HE2      GLN  44   9.653   8.464  -7.397
  360   2HE2  GLN  44          2HE2      GLN  44   9.722   6.832  -6.820
  361    H    GLY  45           H        GLY  45  10.502  12.537  -2.009
  362   1HA   GLY  45          1HA       GLY  45   9.358  14.149  -0.940
  363   2HA   GLY  45          2HA       GLY  45   8.195  14.032  -2.246
  364    H    ASP  46           H        ASP  46   8.961  11.301  -0.059
  365    HA   ASP  46           HA       ASP  46   7.867  10.443   1.642
  366   1HB   ASP  46          1HB       ASP  46   6.918  13.033   1.810
  367   2HB   ASP  46          2HB       ASP  46   5.429  12.159   1.511
  368    H    ALA  47           H        ALA  47   6.935  10.871  -1.538
  369    HA   ALA  47           HA       ALA  47   4.552   9.175  -1.288
  370   1HB   ALA  47          1HB       ALA  47   4.663  11.520  -2.523
  371   2HB   ALA  47          2HB       ALA  47   5.379  10.552  -3.833
  372   3HB   ALA  47          3HB       ALA  47   3.750  10.165  -3.229
  373    H    ILE  48           H        ILE  48   4.623   7.086  -2.003
  374    HA   ILE  48           HA       ILE  48   7.172   6.202  -3.093
  375    HB   ILE  48           HB       ILE  48   6.325   5.062  -1.141
  376   1HG1  ILE  48          1HG1      ILE  48   6.286   3.416  -3.683
  377   2HG1  ILE  48          2HG1      ILE  48   7.664   3.751  -2.653
  378   1HG2  ILE  48          1HG2      ILE  48   4.111   3.613  -2.275
  379   2HG2  ILE  48          2HG2      ILE  48   4.180   4.610  -0.802
  380   3HG2  ILE  48          3HG2      ILE  48   3.808   5.364  -2.371
  381   1HD1  ILE  48          1HD1      ILE  48   6.991   1.578  -1.991
  382   2HD1  ILE  48          2HD1      ILE  48   6.269   2.627  -0.748
  383   3HD1  ILE  48          3HD1      ILE  48   5.262   1.991  -2.071
  384    H    GLY  49           H        GLY  49   7.298   4.883  -5.020
  385   1HA   GLY  49          1HA       GLY  49   5.316   5.706  -7.000
  386   2HA   GLY  49          2HA       GLY  49   6.887   4.987  -7.294
  387    H    TYR  50           H        TYR  50   4.632   4.031  -8.656
  388    HA   TYR  50           HA       TYR  50   3.294   1.934  -7.402
  389   1HB   TYR  50          1HB       TYR  50   2.707   3.031  -9.588
  390   2HB   TYR  50          2HB       TYR  50   4.221   2.494 -10.287
  391    HD1  TYR  50           1HD      TYR  50   4.595  -0.012 -10.617
  392    HD2  TYR  50           2HD      TYR  50   0.775   1.657  -9.653
  393    HE1  TYR  50           1HE      TYR  50   3.453  -2.127 -11.447
  394    HE2  TYR  50           2HE      TYR  50  -0.353  -0.464 -10.485
  395    HH   TYR  50           HH       TYR  50   0.209  -2.275 -12.125
  396    H    GLU  51           H        GLU  51   6.462   2.089  -9.093
  397    HA   GLU  51           HA       GLU  51   6.786  -0.688  -9.201
  398   1HB   GLU  51          1HB       GLU  51   8.057   1.415 -10.349
  399   2HB   GLU  51          2HB       GLU  51   9.195   1.093  -9.056
  400   1HG   GLU  51          1HG       GLU  51   9.868  -0.916  -9.957
  401   2HG   GLU  51          2HG       GLU  51   8.252  -1.344 -10.482
  402    H    GLY  52           H        GLY  52   7.893   1.868  -6.891
  403   1HA   GLY  52          1HA       GLY  52   9.480   0.300  -5.242
  404   2HA   GLY  52          2HA       GLY  52   8.604   1.741  -4.764
  405    H    PHE  53           H        PHE  53   5.903   0.769  -5.320
  406    HA   PHE  53           HA       PHE  53   5.309  -0.383  -2.886
  407   1HB   PHE  53          1HB       PHE  53   3.991   0.721  -5.063
  408   2HB   PHE  53          2HB       PHE  53   3.589  -0.968  -5.299
  409    HD1  PHE  53           1HD      PHE  53   2.451  -2.207  -3.387
  410    HD2  PHE  53           2HD      PHE  53   2.838   2.018  -3.479
  411    HE1  PHE  53           1HE      PHE  53   0.597  -2.001  -1.708
  412    HE2  PHE  53           2HE      PHE  53   0.984   2.224  -1.799
  413    HZ   PHE  53           HZ       PHE  53  -0.114   0.212  -0.934
  414    H    GLN  54           H        GLN  54   6.335  -1.854  -5.939
  415    HA   GLN  54           HA       GLN  54   5.293  -4.381  -5.518
  416   1HB   GLN  54          1HB       GLN  54   7.922  -3.789  -6.930
  417   2HB   GLN  54          2HB       GLN  54   6.809  -5.103  -7.254
  418   1HG   GLN  54          1HG       GLN  54   5.396  -2.561  -7.445
  419   2HG   GLN  54          2HG       GLN  54   6.833  -2.508  -8.447
  420   1HE2  GLN  54          1HE2      GLN  54   5.871  -2.624 -10.394
  421   2HE2  GLN  54          2HE2      GLN  54   4.995  -3.993 -10.994
  422    H    GLN  55           H        GLN  55   8.672  -3.158  -4.917
  423    HA   GLN  55           HA       GLN  55   9.559  -5.448  -3.694
  424   1HB   GLN  55          1HB       GLN  55  11.377  -4.028  -2.795
  425   2HB   GLN  55          2HB       GLN  55  11.052  -3.652  -4.475
  426   1HG   GLN  55          1HG       GLN  55  10.032  -1.590  -3.967
  427   2HG   GLN  55          2HG       GLN  55   9.583  -2.087  -2.348
  428   1HE2  GLN  55          1HE2      GLN  55  10.477  -0.122  -1.604
  429   2HE2  GLN  55          2HE2      GLN  55  12.181   0.074  -1.364
  430    H    PHE  56           H        PHE  56   7.399  -2.939  -2.542
  431    HA   PHE  56           HA       PHE  56   7.870  -3.220   0.210
  432   1HB   PHE  56          1HB       PHE  56   6.505  -1.502  -1.341
  433   2HB   PHE  56          2HB       PHE  56   5.178  -2.623  -1.109
  434    HD1  PHE  56           1HD      PHE  56   6.539   0.311   0.068
  435    HD2  PHE  56           2HD      PHE  56   4.917  -3.336   1.508
  436    HE1  PHE  56           1HE      PHE  56   5.982   1.420   2.250
  437    HE2  PHE  56           2HE      PHE  56   4.360  -2.227   3.690
  438    HZ   PHE  56           HZ       PHE  56   4.899   0.138   4.035
  439    H    LEU  57           H        LEU  57   5.394  -4.692  -2.003
  440    HA   LEU  57           HA       LEU  57   4.178  -6.210   0.018
  441   1HB   LEU  57          1HB       LEU  57   4.231  -6.427  -2.987
  442   2HB   LEU  57          2HB       LEU  57   3.303  -7.516  -1.976
  443    HG   LEU  57           HG       LEU  57   2.855  -4.625  -1.486
  444   1HD1  LEU  57          1HD1      LEU  57   3.110  -5.049  -4.059
  445   2HD1  LEU  57          2HD1      LEU  57   1.495  -5.779  -3.895
  446   3HD1  LEU  57          3HD1      LEU  57   1.756  -4.080  -3.432
  447   1HD2  LEU  57          1HD2      LEU  57   1.669  -6.772  -0.519
  448   2HD2  LEU  57          2HD2      LEU  57   0.753  -5.285  -0.861
  449   3HD2  LEU  57          3HD2      LEU  57   0.709  -6.641  -2.013
  450    H    LYS  58           H        LYS  58   7.181  -6.539  -1.742
  451    HA   LYS  58           HA       LYS  58   7.408  -9.347  -1.533
  452   1HB   LYS  58          1HB       LYS  58   8.681  -8.151  -3.181
  453   2HB   LYS  58          2HB       LYS  58   9.428  -7.134  -1.966
  454   1HG   LYS  58          1HG       LYS  58  10.969  -8.729  -1.391
  455   2HG   LYS  58          2HG       LYS  58   9.788 -10.024  -1.426
  456   1HD   LYS  58          1HD       LYS  58   9.972 -10.268  -3.823
  457   2HD   LYS  58          2HD       LYS  58  10.836  -8.752  -3.988
  458   1HE   LYS  58          1HE       LYS  58  12.092 -10.797  -2.185
  459   2HE   LYS  58          2HE       LYS  58  12.082 -11.179  -3.895
  460   1HZ   LYS  58          1HZ       LYS  58  13.145  -8.714  -2.699
  461   2HZ   LYS  58          2HZ       LYS  58  14.025  -9.940  -3.323
  462   3HZ   LYS  58          3HZ       LYS  58  13.095  -9.021  -4.302
  463    H    ILE  59           H        ILE  59   8.941  -6.646   0.363
  464    HA   ILE  59           HA       ILE  59   9.872  -8.459   2.342
  465    HB   ILE  59           HB       ILE  59   9.677  -5.448   2.255
  466   1HG1  ILE  59          1HG1      ILE  59  12.168  -7.127   1.978
  467   2HG1  ILE  59          2HG1      ILE  59  11.162  -6.764   0.591
  468   1HG2  ILE  59          1HG2      ILE  59  11.021  -7.261   4.274
  469   2HG2  ILE  59          2HG2      ILE  59  11.326  -5.514   4.124
  470   3HG2  ILE  59          3HG2      ILE  59   9.704  -6.099   4.563
  471   1HD1  ILE  59          1HD1      ILE  59  11.434  -4.282   1.904
  472   2HD1  ILE  59          2HD1      ILE  59  13.044  -5.032   2.011
  473   3HD1  ILE  59          3HD1      ILE  59  12.276  -4.797   0.423
  474    H    TYR  60           H        TYR  60   7.160  -6.070   2.128
  475    HA   TYR  60           HA       TYR  60   6.160  -6.226   4.635
  476   1HB   TYR  60          1HB       TYR  60   5.281  -4.866   2.715
  477   2HB   TYR  60          2HB       TYR  60   4.801  -6.325   1.871
  478    HD1  TYR  60           1HD      TYR  60   2.477  -6.179   1.660
  479    HD2  TYR  60           2HD      TYR  60   4.276  -5.382   5.459
  480    HE1  TYR  60           1HE      TYR  60   0.174  -6.034   2.728
  481    HE2  TYR  60           2HE      TYR  60   1.967  -5.239   6.514
  482    HH   TYR  60           HH       TYR  60  -0.952  -5.635   4.524
  483    H    LEU  61           H        LEU  61   4.840  -8.275   1.935
  484    HA   LEU  61           HA       LEU  61   3.707 -10.072   3.849
  485   1HB   LEU  61          1HB       LEU  61   3.803  -9.925   0.849
  486   2HB   LEU  61          2HB       LEU  61   3.179 -11.343   1.668
  487    HG   LEU  61           HG       LEU  61   2.058  -8.712   2.503
  488   1HD1  LEU  61          1HD1      LEU  61   1.062  -9.990  -0.041
  489   2HD1  LEU  61          2HD1      LEU  61   0.673  -8.392   0.641
  490   3HD1  LEU  61          3HD1      LEU  61   2.286  -8.697  -0.048
  491   1HD2  LEU  61          1HD2      LEU  61   0.966 -11.502   2.091
  492   2HD2  LEU  61          2HD2      LEU  61   1.221 -10.631   3.623
  493   3HD2  LEU  61          3HD2      LEU  61  -0.048 -10.096   2.495
  494    H    GLU  62           H        GLU  62   6.809  -9.627   2.458
  495    HA   GLU  62           HA       GLU  62   8.654 -10.764   2.684
  496   1HB   GLU  62          1HB       GLU  62   6.980 -11.993   4.680
  497   2HB   GLU  62          2HB       GLU  62   7.903 -13.264   3.902
  498   1HG   GLU  62          1HG       GLU  62   9.506 -10.837   4.495
  499   2HG   GLU  62          2HG       GLU  62   8.843 -11.599   5.927
  500    H    VAL  63           H        VAL  63   6.108 -11.503   0.800
  501    HA   VAL  63           HA       VAL  63   6.592 -14.096  -0.114
  502    HB   VAL  63           HB       VAL  63   5.452 -13.140  -2.213
  503   1HG1  VAL  63          1HG1      VAL  63   3.918 -14.291  -1.013
  504   2HG1  VAL  63          2HG1      VAL  63   4.390 -13.530   0.525
  505   3HG1  VAL  63          3HG1      VAL  63   3.313 -12.669  -0.600
  506   1HG2  VAL  63          1HG2      VAL  63   4.322 -10.888  -0.800
  507   2HG2  VAL  63          2HG2      VAL  63   6.088 -10.705  -0.931
  508   3HG2  VAL  63          3HG2      VAL  63   5.106 -10.944  -2.397
  509    H    ASP  64           H        ASP  64   7.533 -14.730  -2.246
  510    HA   ASP  64           HA       ASP  64  10.078 -13.447  -2.494
  511   1HB   ASP  64          1HB       ASP  64   9.343 -16.040  -2.643
  512   2HB   ASP  64          2HB       ASP  64   9.157 -15.647  -4.341
  513    H    ASN  65           H        ASN  65   6.924 -13.249  -3.882
  514    HA   ASN  65           HA       ASN  65   7.710 -11.328  -5.727
  515   1HB   ASN  65          1HB       ASN  65   6.594 -12.956  -7.670
  516   2HB   ASN  65          2HB       ASN  65   8.317 -12.706  -7.469
  517   1HD2  ASN  65          1HD2      ASN  65   5.627 -14.654  -6.199
  518   2HD2  ASN  65          2HD2      ASN  65   6.495 -16.141  -6.017
  519    H    VAL  66           H        VAL  66   5.890 -10.010  -5.571
  520    HA   VAL  66           HA       VAL  66   3.361 -11.233  -4.871
  521    HB   VAL  66           HB       VAL  66   4.687  -8.858  -4.252
  522   1HG1  VAL  66          1HG1      VAL  66   2.221  -8.263  -5.924
  523   2HG1  VAL  66          2HG1      VAL  66   3.120  -7.087  -4.935
  524   3HG1  VAL  66          3HG1      VAL  66   3.901  -7.848  -6.342
  525   1HG2  VAL  66          1HG2      VAL  66   3.379  -9.436  -2.520
  526   2HG2  VAL  66          2HG2      VAL  66   2.114  -8.482  -3.330
  527   3HG2  VAL  66          3HG2      VAL  66   2.189 -10.245  -3.568
  528    HA   PRO  67           HA       PRO  67   1.788 -11.042  -8.893
  529   1HB   PRO  67          1HB       PRO  67  -0.900 -11.053  -8.402
  530   2HB   PRO  67          2HB       PRO  67   0.086 -12.501  -8.371
  531   1HG   PRO  67          1HG       PRO  67  -1.038 -10.975  -6.103
  532   2HG   PRO  67          2HG       PRO  67  -0.429 -12.618  -6.126
  533   1HD   PRO  67          1HD       PRO  67   0.912 -10.306  -5.085
  534   2HD   PRO  67          2HD       PRO  67   1.565 -11.927  -5.214
  535    H    ARG  68           H        ARG  68   1.591  -9.578 -10.484
  536    HA   ARG  68           HA       ARG  68   1.517  -6.933  -9.726
  537   1HB   ARG  68          1HB       ARG  68   1.772  -8.461 -12.162
  538   2HB   ARG  68          2HB       ARG  68   0.584  -7.207 -12.456
  539   1HG   ARG  68          1HG       ARG  68   2.598  -5.860 -11.035
  540   2HG   ARG  68          2HG       ARG  68   3.498  -6.967 -12.052
  541   1HD   ARG  68          1HD       ARG  68   1.734  -6.069 -13.911
  542   2HD   ARG  68          2HD       ARG  68   1.717  -4.676 -12.848
  543    HE   ARG  68           HE       ARG  68   4.440  -5.480 -13.310
  544   1HH1  ARG  68          2HH2      ARG  68   1.728  -3.943 -14.944
  545   2HH1  ARG  68          1HH2      ARG  68   2.730  -3.032 -16.024
  546   1HH2  ARG  68          2HH1      ARG  68   5.762  -4.278 -14.735
  547   2HH2  ARG  68          1HH1      ARG  68   5.040  -3.224 -15.905
  548    H    HIS  69           H        HIS  69  -1.042  -9.252 -10.604
  549    HA   HIS  69           HA       HIS  69  -3.071  -7.533 -11.272
  550   1HB   HIS  69          1HB       HIS  69  -2.851 -10.289 -10.204
  551   2HB   HIS  69          2HB       HIS  69  -4.403  -9.511  -9.964
  552    HD1  HIS  69           1HD      HIS  69  -6.009  -9.704 -11.872
  553    HD2  HIS  69           2HD      HIS  69  -2.026 -10.166 -13.105
  554    HE1  HIS  69           1HE      HIS  69  -6.093 -10.293 -14.353
  555    H    LEU  70           H        LEU  70  -2.055  -8.708  -7.999
  556    HA   LEU  70           HA       LEU  70  -4.034  -7.118  -6.699
  557   1HB   LEU  70          1HB       LEU  70  -3.524  -9.023  -5.534
  558   2HB   LEU  70          2HB       LEU  70  -1.810  -8.930  -5.888
  559    HG   LEU  70           HG       LEU  70  -1.951  -6.767  -4.348
  560   1HD1  LEU  70          1HD1      LEU  70  -3.819  -6.453  -3.197
  561   2HD1  LEU  70          2HD1      LEU  70  -4.578  -7.770  -4.121
  562   3HD1  LEU  70          3HD1      LEU  70  -3.767  -8.120  -2.576
  563   1HD2  LEU  70          1HD2      LEU  70  -1.026  -9.369  -4.067
  564   2HD2  LEU  70          2HD2      LEU  70  -0.668  -7.990  -3.001
  565   3HD2  LEU  70          3HD2      LEU  70  -2.002  -9.099  -2.603
  566    H    SER  71           H        SER  71  -0.472  -6.896  -7.273
  567    HA   SER  71           HA       SER  71  -0.057  -4.627  -5.796
  568   1HB   SER  71          1HB       SER  71   1.362  -6.186  -7.804
  569   2HB   SER  71          2HB       SER  71   1.646  -4.478  -8.076
  570    HG   SER  71           HG       SER  71   2.980  -4.497  -6.414
  571    H    LEU  72           H        LEU  72  -1.661  -5.100  -8.892
  572    HA   LEU  72           HA       LEU  72  -1.353  -2.406  -9.781
  573   1HB   LEU  72          1HB       LEU  72  -1.631  -3.817 -11.539
  574   2HB   LEU  72          2HB       LEU  72  -2.742  -4.868 -10.685
  575    HG   LEU  72           HG       LEU  72  -4.507  -3.095 -10.914
  576   1HD1  LEU  72          1HD1      LEU  72  -2.419  -1.788 -12.676
  577   2HD1  LEU  72          2HD1      LEU  72  -4.145  -1.355 -12.656
  578   3HD1  LEU  72          3HD1      LEU  72  -3.154  -1.129 -11.195
  579   1HD2  LEU  72          1HD2      LEU  72  -3.342  -4.741 -13.056
  580   2HD2  LEU  72          2HD2      LEU  72  -5.018  -4.626 -12.468
  581   3HD2  LEU  72          3HD2      LEU  72  -4.396  -3.425 -13.625
  582    H    ALA  73           H        ALA  73  -3.991  -4.351  -8.237
  583    HA   ALA  73           HA       ALA  73  -5.742  -2.120  -8.091
  584   1HB   ALA  73          1HB       ALA  73  -6.206  -4.700  -8.089
  585   2HB   ALA  73          2HB       ALA  73  -5.915  -4.573  -6.338
  586   3HB   ALA  73          3HB       ALA  73  -7.224  -3.632  -7.093
  587    H    LEU  74           H        LEU  74  -3.086  -3.400  -6.145
  588    HA   LEU  74           HA       LEU  74  -3.796  -2.288  -3.688
  589   1HB   LEU  74          1HB       LEU  74  -1.392  -3.410  -4.968
  590   2HB   LEU  74          2HB       LEU  74  -1.071  -2.267  -3.679
  591    HG   LEU  74           HG       LEU  74  -2.909  -4.646  -3.342
  592   1HD1  LEU  74          1HD1      LEU  74  -1.104  -5.886  -2.376
  593   2HD1  LEU  74          2HD1      LEU  74  -0.598  -5.342  -3.994
  594   3HD1  LEU  74          3HD1      LEU  74   0.008  -4.506  -2.544
  595   1HD2  LEU  74          1HD2      LEU  74  -3.418  -3.609  -1.441
  596   2HD2  LEU  74          2HD2      LEU  74  -1.761  -3.968  -0.901
  597   3HD2  LEU  74          3HD2      LEU  74  -2.129  -2.403  -1.664
  598    H    PHE  75           H        PHE  75  -2.103  -0.948  -6.562
  599    HA   PHE  75           HA       PHE  75  -1.393   1.470  -5.296
  600   1HB   PHE  75          1HB       PHE  75  -0.445   0.380  -7.430
  601   2HB   PHE  75          2HB       PHE  75  -1.945   0.779  -8.244
  602    HD1  PHE  75           1HD      PHE  75   1.018   2.259  -6.593
  603    HD2  PHE  75           2HD      PHE  75  -2.299   2.930  -9.154
  604    HE1  PHE  75           1HE      PHE  75   1.951   4.505  -7.214
  605    HE2  PHE  75           2HE      PHE  75  -1.365   5.176  -9.774
  606    HZ   PHE  75           HZ       PHE  75   0.748   5.936  -8.797
  607    H    GLN  76           H        GLN  76  -4.213   0.388  -7.262
  608    HA   GLN  76           HA       GLN  76  -5.336   2.832  -7.709
  609   1HB   GLN  76          1HB       GLN  76  -6.594   0.099  -7.258
  610   2HB   GLN  76          2HB       GLN  76  -7.542   1.494  -7.735
  611   1HG   GLN  76          1HG       GLN  76  -6.091   1.789  -9.755
  612   2HG   GLN  76          2HG       GLN  76  -5.146   0.392  -9.279
  613   1HE2  GLN  76          1HE2      GLN  76  -6.487   0.647 -11.715
  614   2HE2  GLN  76          2HE2      GLN  76  -7.737  -0.547 -11.824
  615    H    SER  77           H        SER  77  -4.913   1.117  -4.708
  616    HA   SER  77           HA       SER  77  -7.125   2.165  -3.355
  617   1HB   SER  77          1HB       SER  77  -4.444   1.114  -2.354
  618   2HB   SER  77          2HB       SER  77  -5.775   1.526  -1.291
  619    HG   SER  77           HG       SER  77  -5.369  -0.778  -2.683
  620    H    PHE  78           H        PHE  78  -6.946   4.451  -4.211
  621    HA   PHE  78           HA       PHE  78  -6.503   6.590  -3.924
  622   1HB   PHE  78          1HB       PHE  78  -6.926   5.793  -1.484
  623   2HB   PHE  78          2HB       PHE  78  -5.187   5.676  -1.298
  624    HD1  PHE  78           1HD      PHE  78  -4.115   7.463  -0.322
  625    HD2  PHE  78           2HD      PHE  78  -7.720   8.178  -2.444
  626    HE1  PHE  78           1HE      PHE  78  -4.023   9.883   0.337
  627    HE2  PHE  78           2HE      PHE  78  -7.628  10.598  -1.785
  628    HZ   PHE  78           HZ       PHE  78  -5.780  11.422  -0.402
  629    H    GLU  79           H        GLU  79  -4.686   8.279  -3.609
  630    HA   GLU  79           HA       GLU  79  -2.082   7.066  -3.993
  631   1HB   GLU  79          1HB       GLU  79  -3.368   9.071  -5.896
  632   2HB   GLU  79          2HB       GLU  79  -1.659   8.683  -5.910
  633   1HG   GLU  79          1HG       GLU  79  -2.473   7.186  -7.519
  634   2HG   GLU  79          2HG       GLU  79  -2.477   6.176  -6.087
  635    H    THR  80           H        THR  80  -0.551   9.336  -4.457
  636    HA   THR  80           HA       THR  80  -0.284  10.443  -1.948
  637    HB   THR  80           HB       THR  80   1.312  10.368  -4.016
  638    HG1  THR  80           1HG      THR  80   2.386  11.848  -2.741
  639   1HG2  THR  80          1HG2      THR  80   0.042  13.116  -4.453
  640   2HG2  THR  80          2HG2      THR  80   1.355  12.370  -5.395
  641   3HG2  THR  80          3HG2      THR  80  -0.299  11.722  -5.506
  642    H    GLY  81           H        GLY  81  -2.402  11.422  -4.635
  643   1HA   GLY  81          1HA       GLY  81  -3.855  13.139  -2.807
  644   2HA   GLY  81          2HA       GLY  81  -3.044  13.978  -4.115
  645    H    HIS  82           H        HIS  82  -5.608  14.380  -4.334
  646    HA   HIS  82           HA       HIS  82  -6.776  12.219  -5.892
  647   1HB   HIS  82          1HB       HIS  82  -7.824  14.539  -4.344
  648   2HB   HIS  82          2HB       HIS  82  -8.739  14.053  -5.757
  649    HD1  HIS  82           1HD      HIS  82  -9.471  13.701  -2.580
  650    HD2  HIS  82           2HD      HIS  82  -8.310  10.729  -5.303
  651    HE1  HIS  82           1HE      HIS  82 -10.358  11.495  -1.653
  652    H    CYS  83           H        CYS  83  -7.491  15.690  -6.333
  653    HA   CYS  83           HA       CYS  83  -7.326  17.024  -8.066
  654   1HB   CYS  83          1HB       CYS  83  -4.842  15.388  -8.461
  655   2HB   CYS  83          2HB       CYS  83  -5.344  16.474  -9.742
  656    HG   CYS  83           HG       CYS  83  -4.805  18.571  -8.737
  657    H    LEU  84           H        LEU  84  -9.238  14.962  -8.149
  658    HA   LEU  84           HA       LEU  84  -9.047  13.682 -10.731
  659   1HB   LEU  84          1HB       LEU  84 -10.728  13.464  -8.309
  660   2HB   LEU  84          2HB       LEU  84 -11.538  13.128  -9.826
  661    HG   LEU  84           HG       LEU  84 -10.585  11.134  -8.625
  662   1HD1  LEU  84          1HD1      LEU  84  -9.297  10.397 -10.869
  663   2HD1  LEU  84          2HD1      LEU  84 -11.069  10.504 -10.741
  664   3HD1  LEU  84          3HD1      LEU  84 -10.147  11.839 -11.473
  665   1HD2  LEU  84          1HD2      LEU  84  -8.472  11.066  -7.959
  666   2HD2  LEU  84          2HD2      LEU  84  -7.899  11.347  -9.621
  667   3HD2  LEU  84          3HD2      LEU  84  -8.254  12.728  -8.556
  668    H    ASN  85           H        ASN  85  -8.816  16.346 -11.198
  669    HA   ASN  85           HA       ASN  85 -10.842  16.817 -12.964
  670   1HB   ASN  85          1HB       ASN  85 -11.351  17.881 -10.206
  671   2HB   ASN  85          2HB       ASN  85 -11.600  19.034 -11.503
  672   1HD2  ASN  85          1HD2      ASN  85 -12.732  17.976 -13.492
  673   2HD2  ASN  85          2HD2      ASN  85 -14.180  17.091 -13.147
  674    H    GLU  86           H        GLU  86  -7.974  16.946 -12.779
  675    HA   GLU  86           HA       GLU  86  -7.609  19.766 -13.350
  676   1HB   GLU  86          1HB       GLU  86  -6.702  18.764 -10.980
  677   2HB   GLU  86          2HB       GLU  86  -5.321  18.396 -11.994
  678   1HG   GLU  86          1HG       GLU  86  -4.779  20.619 -12.314
  679   2HG   GLU  86          2HG       GLU  86  -6.453  21.136 -12.356
  680    H    THR  87           H        THR  87  -4.614  19.158 -13.633
  681    HA   THR  87           HA       THR  87  -4.602  17.225 -15.804
  682    HB   THR  87           HB       THR  87  -4.166  20.231 -16.115
  683    HG1  THR  87           1HG      THR  87  -5.544  18.099 -17.592
  684   1HG2  THR  87          1HG2      THR  87  -2.931  17.937 -17.605
  685   2HG2  THR  87          2HG2      THR  87  -3.713  19.183 -18.607
  686   3HG2  THR  87          3HG2      THR  87  -2.397  19.631 -17.496
  687    H    ASN  88           H        ASN  88  -3.526  16.946 -13.248
  688    HA   ASN  88           HA       ASN  88  -0.718  17.030 -13.970
  689   1HB   ASN  88          1HB       ASN  88  -1.337  18.920 -12.328
  690   2HB   ASN  88          2HB       ASN  88  -1.751  17.678 -11.163
  691   1HD2  ASN  88          1HD2      ASN  88  -0.154  18.429  -9.766
  692   2HD2  ASN  88          2HD2      ASN  88   1.529  18.093  -9.996
  693    H    VAL  89           H        VAL  89  -1.662  14.709 -14.473
  694    HA   VAL  89           HA       VAL  89  -1.682  13.130 -11.994
  695    HB   VAL  89           HB       VAL  89  -2.981  12.598 -14.673
  696   1HG1  VAL  89          1HG1      VAL  89  -2.358  10.842 -12.384
  697   2HG1  VAL  89          2HG1      VAL  89  -4.052  10.781 -12.926
  698   3HG1  VAL  89          3HG1      VAL  89  -2.737  10.437 -14.076
  699   1HG2  VAL  89          1HG2      VAL  89  -3.870  14.216 -12.605
  700   2HG2  VAL  89          2HG2      VAL  89  -4.880  13.476 -13.869
  701   3HG2  VAL  89          3HG2      VAL  89  -4.689  12.666 -12.296
  702    H    THR  90           H        THR  90   0.753  14.070 -13.162
  703    HA   THR  90           HA       THR  90   1.758  11.741 -14.623
  704    HB   THR  90           HB       THR  90   2.129  14.069 -15.516
  705    HG1  THR  90           1HG      THR  90   3.962  12.998 -16.137
  706   1HG2  THR  90          1HG2      THR  90   3.633  14.336 -12.868
  707   2HG2  THR  90          2HG2      THR  90   4.009  15.345 -14.286
  708   3HG2  THR  90          3HG2      THR  90   2.400  15.437 -13.530
  709    H    LYS  91           H        LYS  91   1.440  12.893 -11.433
  710    HA   LYS  91           HA       LYS  91   3.890  11.529 -10.606
  711   1HB   LYS  91          1HB       LYS  91   2.442  13.856  -9.680
  712   2HB   LYS  91          2HB       LYS  91   2.595  12.689  -8.382
  713   1HG   LYS  91          1HG       LYS  91   4.598  13.942  -8.220
  714   2HG   LYS  91          2HG       LYS  91   5.099  12.497  -9.076
  715   1HD   LYS  91          1HD       LYS  91   4.128  14.798 -10.751
  716   2HD   LYS  91          2HD       LYS  91   5.679  14.995  -9.960
  717   1HE   LYS  91          1HE       LYS  91   6.149  12.553 -10.937
  718   2HE   LYS  91          2HE       LYS  91   4.864  12.968 -12.054
  719   1HZ   LYS  91          1HZ       LYS  91   7.404  14.367 -11.658
  720   2HZ   LYS  91          2HZ       LYS  91   6.824  13.697 -13.029
  721   3HZ   LYS  91          3HZ       LYS  91   6.156  15.067 -12.443
  722    H    ASP  92           H        ASP  92   3.197   9.363 -10.999
  723    HA   ASP  92           HA       ASP  92   0.783   8.513  -9.733
  724   1HB   ASP  92          1HB       ASP  92   2.894   6.653 -10.858
  725   2HB   ASP  92          2HB       ASP  92   1.157   6.428 -10.820
  726    H    VAL  93           H        VAL  93   1.542   9.126  -7.479
  727    HA   VAL  93           HA       VAL  93   3.168   6.966  -6.359
  728    HB   VAL  93           HB       VAL  93   4.153   8.725  -4.822
  729   1HG1  VAL  93          1HG1      VAL  93   5.908   9.368  -6.463
  730   2HG1  VAL  93          2HG1      VAL  93   5.494   7.638  -6.525
  731   3HG1  VAL  93          3HG1      VAL  93   4.874   8.747  -7.772
  732   1HG2  VAL  93          1HG2      VAL  93   3.812  10.791  -6.917
  733   2HG2  VAL  93          2HG2      VAL  93   2.360  10.428  -5.954
  734   3HG2  VAL  93          3HG2      VAL  93   3.859  10.945  -5.144
  735    H    VAL  94           H        VAL  94   2.810   6.758  -3.948
  736    HA   VAL  94           HA       VAL  94   0.188   7.820  -3.181
  737    HB   VAL  94           HB       VAL  94   1.147   4.962  -2.943
  738   1HG1  VAL  94          1HG1      VAL  94  -0.968   4.473  -1.850
  739   2HG1  VAL  94          2HG1      VAL  94  -0.095   5.724  -0.934
  740   3HG1  VAL  94          3HG1      VAL  94  -1.463   6.178  -1.978
  741   1HG2  VAL  94          1HG2      VAL  94   0.176   4.670  -4.929
  742   2HG2  VAL  94          2HG2      VAL  94  -1.381   5.108  -4.187
  743   3HG2  VAL  94          3HG2      VAL  94  -0.379   6.361  -4.957
  744    H    CYS  95           H        CYS  95  -0.086   8.132  -0.893
  745    HA   CYS  95           HA       CYS  95   2.374   8.766   0.385
  746   1HB   CYS  95          1HB       CYS  95  -0.518   9.193   0.928
  747   2HB   CYS  95          2HB       CYS  95   0.524   9.127   2.335
  748    HG   CYS  95           HG       CYS  95   2.391  10.705   0.873
  749    H    LEU  96           H        LEU  96   3.567   6.897   0.887
  750    HA   LEU  96           HA       LEU  96   2.585   4.454   1.589
  751   1HB   LEU  96          1HB       LEU  96   4.753   3.981   2.469
  752   2HB   LEU  96          2HB       LEU  96   4.908   4.958   1.022
  753    HG   LEU  96           HG       LEU  96   5.202   5.937   3.875
  754   1HD1  LEU  96          1HD1      LEU  96   7.051   4.700   2.053
  755   2HD1  LEU  96          2HD1      LEU  96   7.549   6.378   2.372
  756   3HD1  LEU  96          3HD1      LEU  96   7.305   5.250   3.727
  757   1HD2  LEU  96          1HD2      LEU  96   6.002   8.053   2.794
  758   2HD2  LEU  96          2HD2      LEU  96   5.383   7.427   1.247
  759   3HD2  LEU  96          3HD2      LEU  96   4.263   7.723   2.598
  760    H    ASN  97           H        ASN  97   2.568   7.438   3.429
  761    HA   ASN  97           HA       ASN  97   2.365   6.205   5.950
  762   1HB   ASN  97          1HB       ASN  97   1.408   8.562   6.566
  763   2HB   ASN  97          2HB       ASN  97   3.061   8.488   5.988
  764   1HD2  ASN  97          1HD2      ASN  97   0.046   9.876   5.608
  765   2HD2  ASN  97          2HD2      ASN  97   0.242  10.637   4.064
  766    H    ASP  98           H        ASP  98   0.059   7.673   3.557
  767    HA   ASP  98           HA       ASP  98  -2.215   7.301   5.094
  768   1HB   ASP  98          1HB       ASP  98  -1.524   8.210   2.451
  769   2HB   ASP  98          2HB       ASP  98  -2.812   7.036   2.269
  770    H    VAL  99           H        VAL  99  -0.248   5.179   3.051
  771    HA   VAL  99           HA       VAL  99  -2.271   3.210   2.637
  772    HB   VAL  99           HB       VAL  99   0.732   3.231   2.300
  773   1HG1  VAL  99          1HG1      VAL  99   0.740   1.081   1.553
  774   2HG1  VAL  99          2HG1      VAL  99  -0.642   0.944   2.666
  775   3HG1  VAL  99          3HG1      VAL  99  -0.922   1.173   0.924
  776   1HG2  VAL  99          1HG2      VAL  99   0.263   3.451  -0.067
  777   2HG2  VAL  99          2HG2      VAL  99  -1.488   3.331   0.230
  778   3HG2  VAL  99          3HG2      VAL  99  -0.580   4.744   0.820
  779    H    SER 100           H        SER 100   0.163   3.967   5.109
  780    HA   SER 100           HA       SER 100   0.329   1.477   6.272
  781   1HB   SER 100          1HB       SER 100   1.756   3.533   6.745
  782   2HB   SER 100          2HB       SER 100   0.438   4.161   7.714
  783    HG   SER 100           HG       SER 100   1.030   1.551   8.426
  784    H    CYS 101           H        CYS 101  -2.132   4.051   6.471
  785    HA   CYS 101           HA       CYS 101  -3.417   3.011   8.764
  786   1HB   CYS 101          1HB       CYS 101  -3.561   5.394   7.901
  787   2HB   CYS 101          2HB       CYS 101  -4.634   4.806   6.645
  788    HG   CYS 101           HG       CYS 101  -6.130   3.436   8.563
  789    H    TYR 102           H        TYR 102  -4.140   2.978   5.194
  790    HA   TYR 102           HA       TYR 102  -6.387   1.404   5.262
  791   1HB   TYR 102          1HB       TYR 102  -4.770   2.632   3.407
  792   2HB   TYR 102          2HB       TYR 102  -4.209   0.987   3.182
  793    HD1  TYR 102           1HD      TYR 102  -6.257   3.290   1.763
  794    HD2  TYR 102           2HD      TYR 102  -6.458  -0.726   3.222
  795    HE1  TYR 102           1HE      TYR 102  -8.227   2.823   0.225
  796    HE2  TYR 102           2HE      TYR 102  -8.427  -1.180   1.680
  797    HH   TYR 102           HH       TYR 102  -9.877  -0.314   0.314
  798    H    PHE 103           H        PHE 103  -2.923   0.445   5.387
  799    HA   PHE 103           HA       PHE 103  -3.494  -2.321   5.090
  800   1HB   PHE 103          1HB       PHE 103  -1.214  -0.449   5.679
  801   2HB   PHE 103          2HB       PHE 103  -1.008  -2.058   6.342
  802    HD1  PHE 103           1HD      PHE 103   0.274  -0.334   3.900
  803    HD2  PHE 103           2HD      PHE 103  -2.240  -3.734   4.251
  804    HE1  PHE 103           1HE      PHE 103   1.069  -1.152   1.664
  805    HE2  PHE 103           2HE      PHE 103  -1.445  -4.553   2.016
  806    HZ   PHE 103           HZ       PHE 103   0.200  -3.252   0.749
  807    H    SER 104           H        SER 104  -3.269  -0.028   7.804
  808    HA   SER 104           HA       SER 104  -2.887  -1.930   9.796
  809   1HB   SER 104          1HB       SER 104  -2.485   0.457  10.174
  810   2HB   SER 104          2HB       SER 104  -4.168   0.835   9.867
  811    HG   SER 104           HG       SER 104  -3.494   0.676  12.187
  812    H    LEU 105           H        LEU 105  -5.729  -0.808   7.988
  813    HA   LEU 105           HA       LEU 105  -7.630  -1.857   9.835
  814   1HB   LEU 105          1HB       LEU 105  -7.617  -0.189   7.556
  815   2HB   LEU 105          2HB       LEU 105  -8.644  -1.553   7.165
  816    HG   LEU 105           HG       LEU 105  -9.950   0.278   8.078
  817   1HD1  LEU 105          1HD1      LEU 105  -9.867  -2.386   9.219
  818   2HD1  LEU 105          2HD1      LEU 105 -10.515  -1.201  10.379
  819   3HD1  LEU 105          3HD1      LEU 105 -11.262  -1.375   8.773
  820   1HD2  LEU 105          1HD2      LEU 105  -8.993   0.120  10.839
  821   2HD2  LEU 105          2HD2      LEU 105  -7.780   0.767   9.708
  822   3HD2  LEU 105          3HD2      LEU 105  -9.381   1.535   9.832
  823    H    LEU 106           H        LEU 106  -5.896  -3.012   6.924
  824    HA   LEU 106           HA       LEU 106  -7.378  -5.202   6.282
  825   1HB   LEU 106          1HB       LEU 106  -4.564  -4.375   6.037
  826   2HB   LEU 106          2HB       LEU 106  -4.825  -6.105   5.948
  827    HG   LEU 106           HG       LEU 106  -4.789  -4.985   3.739
  828   1HD1  LEU 106          1HD1      LEU 106  -6.149  -6.552   2.908
  829   2HD1  LEU 106          2HD1      LEU 106  -6.427  -7.013   4.605
  830   3HD1  LEU 106          3HD1      LEU 106  -7.568  -5.923   3.781
  831   1HD2  LEU 106          1HD2      LEU 106  -5.835  -3.058   3.418
  832   2HD2  LEU 106          2HD2      LEU 106  -7.398  -3.886   3.620
  833   3HD2  LEU 106          3HD2      LEU 106  -6.584  -3.164   5.029
  834    H    GLU 107           H        GLU 107  -4.779  -4.975   8.802
  835    HA   GLU 107           HA       GLU 107  -4.944  -7.596   9.601
  836   1HB   GLU 107          1HB       GLU 107  -3.666  -5.169  10.480
  837   2HB   GLU 107          2HB       GLU 107  -4.368  -5.942  11.887
  838   1HG   GLU 107          1HG       GLU 107  -3.231  -8.087  10.470
  839   2HG   GLU 107          2HG       GLU 107  -2.076  -6.791  10.235
  840    H    GLY 108           H        GLY 108  -6.592  -4.667  10.987
  841   1HA   GLY 108          1HA       GLY 108  -8.315  -6.412  12.586
  842   2HA   GLY 108          2HA       GLY 108  -8.145  -4.673  12.718
  843    H    GLY 109           H        GLY 109  -8.681  -6.627   9.722
  844   1HA   GLY 109          1HA       GLY 109 -10.889  -4.908   8.989
  845   2HA   GLY 109          2HA       GLY 109 -10.170  -6.197   8.045
  846    H    ARG 110           H        ARG 110 -11.614  -6.161  11.382
  847    HA   ARG 110           HA       ARG 110 -12.774  -8.633  11.077
  848   1HB   ARG 110          1HB       ARG 110 -14.258  -7.796  13.059
  849   2HB   ARG 110          2HB       ARG 110 -12.524  -7.850  13.308
  850   1HG   ARG 110          1HG       ARG 110 -12.291  -5.523  13.236
  851   2HG   ARG 110          2HG       ARG 110 -13.674  -5.304  12.183
  852   1HD   ARG 110          1HD       ARG 110 -15.222  -5.416  13.953
  853   2HD   ARG 110          2HD       ARG 110 -14.167  -6.386  14.960
  854    HE   ARG 110           HE       ARG 110 -14.232  -3.482  14.820
  855   1HH1  ARG 110          2HH2      ARG 110 -12.127  -6.230  15.452
  856   2HH1  ARG 110          1HH2      ARG 110 -11.032  -5.326  16.443
  857   1HH2  ARG 110          2HH1      ARG 110 -12.788  -2.289  16.128
  858   2HH2  ARG 110          1HH1      ARG 110 -11.410  -3.069  16.830
  859    HA   PRO 111           HA       PRO 111 -16.236  -7.490   8.628
  860   1HB   PRO 111          1HB       PRO 111 -17.402  -9.954   8.435
  861   2HB   PRO 111          2HB       PRO 111 -16.102  -9.425   7.387
  862   1HG   PRO 111          1HG       PRO 111 -16.001 -11.321   9.653
  863   2HG   PRO 111          2HG       PRO 111 -14.848 -11.103   8.352
  864   1HD   PRO 111          1HD       PRO 111 -14.583 -10.174  11.052
  865   2HD   PRO 111          2HD       PRO 111 -13.486  -9.858   9.723
  866    H    GLU 112           H        GLU 112 -18.576  -7.275   8.654
  867    HA   GLU 112           HA       GLU 112 -19.415  -7.420  11.441
  868   1HB   GLU 112          1HB       GLU 112 -19.822  -5.430   9.265
  869   2HB   GLU 112          2HB       GLU 112 -21.250  -5.761  10.226
  870   1HG   GLU 112          1HG       GLU 112 -19.716  -5.436  12.308
  871   2HG   GLU 112          2HG       GLU 112 -18.547  -4.752  11.196
  872    H    ASP 113           H        ASP 113 -19.828  -8.770   8.302
  873    HA   ASP 113           HA       ASP 113 -21.885 -10.440   9.267
  874   1HB   ASP 113          1HB       ASP 113 -23.079  -8.280   8.460
  875   2HB   ASP 113          2HB       ASP 113 -22.580  -8.731   6.841
  876    H    LYS 114           H        LYS 114 -20.565 -12.204   8.604
  877    HA   LYS 114           HA       LYS 114 -19.304 -12.163   6.029
  878   1HB   LYS 114          1HB       LYS 114 -19.380 -14.044   8.371
  879   2HB   LYS 114          2HB       LYS 114 -18.799 -14.619   6.822
  880   1HG   LYS 114          1HG       LYS 114 -17.548 -12.099   7.158
  881   2HG   LYS 114          2HG       LYS 114 -17.487 -12.836   8.747
  882   1HD   LYS 114          1HD       LYS 114 -15.725 -14.074   8.039
  883   2HD   LYS 114          2HD       LYS 114 -16.820 -14.940   6.978
  884   1HE   LYS 114          1HE       LYS 114 -15.763 -14.057   5.178
  885   2HE   LYS 114          2HE       LYS 114 -16.257 -12.452   5.679
  886   1HZ   LYS 114          1HZ       LYS 114 -14.010 -13.610   7.075
  887   2HZ   LYS 114          2HZ       LYS 114 -13.755 -13.162   5.526
  888   3HZ   LYS 114          3HZ       LYS 114 -14.268 -12.063   6.619
  889    H    LEU 115           H        LEU 115 -19.621 -14.058   4.482
  890    HA   LEU 115           HA       LEU 115 -22.492 -14.371   4.111
  891   1HB   LEU 115          1HB       LEU 115 -20.093 -14.328   2.376
  892   2HB   LEU 115          2HB       LEU 115 -21.373 -15.423   1.893
  893    HG   LEU 115           HG       LEU 115 -21.520 -13.229   0.787
  894   1HD1  LEU 115          1HD1      LEU 115 -23.970 -12.951   2.275
  895   2HD1  LEU 115          2HD1      LEU 115 -23.705 -13.574   0.629
  896   3HD1  LEU 115          3HD1      LEU 115 -23.596 -14.673   2.025
  897   1HD2  LEU 115          1HD2      LEU 115 -22.359 -11.286   2.203
  898   2HD2  LEU 115          2HD2      LEU 115 -21.783 -12.204   3.615
  899   3HD2  LEU 115          3HD2      LEU 115 -20.635 -11.706   2.349
  900    H    GLU 116           H        GLU 116 -22.972 -16.652   2.920
  901    HA   GLU 116           HA       GLU 116 -21.515 -18.728   4.306
  902   1HB   GLU 116          1HB       GLU 116 -24.425 -19.198   4.388
  903   2HB   GLU 116          2HB       GLU 116 -23.221 -19.431   5.640
  904   1HG   GLU 116          1HG       GLU 116 -24.603 -17.688   6.486
  905   2HG   GLU 116          2HG       GLU 116 -23.184 -16.852   5.886
  906    H    TRP 117           H        TRP 117 -21.140 -20.453   2.957
  907    HA   TRP 117           HA       TRP 117 -22.933 -20.736   0.648
  908   1HB   TRP 117          1HB       TRP 117 -19.916 -20.700   0.661
  909   2HB   TRP 117          2HB       TRP 117 -20.853 -21.410  -0.639
  910    HD1  TRP 117           HD       TRP 117 -20.176 -17.947   0.963
  911    HE1  TRP 117           1HE      TRP 117 -20.737 -15.999  -0.728
  912    HE3  TRP 117           3HE      TRP 117 -22.197 -20.933  -2.622
  913    HZ2  TRP 117           2HZ      TRP 117 -21.936 -15.928  -3.316
  914    HZ3  TRP 117           3HZ      TRP 117 -23.040 -19.844  -4.701
  915    HH2  TRP 117           HH       TRP 117 -22.933 -17.432  -5.078
  916    H    SER 118           H        SER 118 -20.191 -22.780   0.609
  917    HA   SER 118           HA       SER 118 -21.747 -25.032   1.125
  918   1HB   SER 118          1HB       SER 118 -19.236 -24.484   0.002
  919   2HB   SER 118          2HB       SER 118 -18.843 -25.435   1.421
  920    HG   SER 118           HG       SER 118 -19.995 -26.235  -0.963
  Start of MODEL   12
    1   1H    MET   1           H        MET   1  -4.631  13.444   5.159
    2    HA   MET   1           HA       MET   1  -6.024  12.651   3.141
    3   1HB   MET   1          1HB       MET   1  -3.084  12.192   2.428
    4   2HB   MET   1          2HB       MET   1  -4.355  11.230   1.700
    5   1HG   MET   1          1HG       MET   1  -4.204  14.283   1.586
    6   2HG   MET   1          2HG       MET   1  -3.711  13.211   0.290
    7   1HE   MET   1          1HE       MET   1  -5.338  12.330  -1.518
    8   2HE   MET   1          2HE       MET   1  -5.434  11.086  -0.249
    9   3HE   MET   1          3HE       MET   1  -6.919  11.670  -1.037
   10    H    ALA   2           H        ALA   2  -7.028  10.922   4.066
   11    HA   ALA   2           HA       ALA   2  -5.693   8.563   4.719
   12   1HB   ALA   2          1HB       ALA   2  -5.090  10.386   6.619
   13   2HB   ALA   2          2HB       ALA   2  -6.637   9.795   7.272
   14   3HB   ALA   2          3HB       ALA   2  -5.302   8.655   6.977
   15    H    LYS   3           H        LYS   3  -7.877   9.184   3.136
   16    HA   LYS   3           HA       LYS   3 -10.244   8.681   4.738
   17   1HB   LYS   3          1HB       LYS   3 -10.058  10.383   2.811
   18   2HB   LYS   3          2HB       LYS   3 -10.119   8.999   1.737
   19   1HG   LYS   3          1HG       LYS   3 -12.368   8.867   1.978
   20   2HG   LYS   3          2HG       LYS   3 -12.198   8.666   3.710
   21   1HD   LYS   3          1HD       LYS   3 -12.056  11.152   3.984
   22   2HD   LYS   3          2HD       LYS   3 -12.229  11.352   2.252
   23   1HE   LYS   3          1HE       LYS   3 -14.436  11.662   3.088
   24   2HE   LYS   3          2HE       LYS   3 -14.448  10.022   2.469
   25   1HZ   LYS   3          1HZ       LYS   3 -15.326  10.460   4.797
   26   2HZ   LYS   3          2HZ       LYS   3 -14.358   9.163   4.582
   27   3HZ   LYS   3          3HZ       LYS   3 -13.762  10.523   5.261
   28    H    GLU   4           H        GLU   4 -11.023   7.306   1.892
   29    HA   GLU   4           HA       GLU   4  -9.730   4.783   2.341
   30   1HB   GLU   4          1HB       GLU   4 -12.391   5.345   3.365
   31   2HB   GLU   4          2HB       GLU   4 -12.493   4.108   2.128
   32   1HG   GLU   4          1HG       GLU   4 -10.441   3.018   3.377
   33   2HG   GLU   4          2HG       GLU   4 -10.896   4.059   4.710
   34    H    ARG   5           H        ARG   5 -10.130   7.050   0.273
   35    HA   ARG   5           HA       ARG   5 -11.726   6.463  -1.748
   36   1HB   ARG   5          1HB       ARG   5  -8.837   7.401  -1.714
   37   2HB   ARG   5          2HB       ARG   5  -9.656   7.189  -3.249
   38   1HG   ARG   5          1HG       ARG   5 -11.148   8.721  -1.140
   39   2HG   ARG   5          2HG       ARG   5  -9.743   9.511  -1.829
   40   1HD   ARG   5          1HD       ARG   5 -11.119  10.151  -3.532
   41   2HD   ARG   5          2HD       ARG   5 -11.006   8.496  -4.098
   42    HE   ARG   5           HE       ARG   5 -13.251   8.256  -3.541
   43   1HH1  ARG   5          2HH2      ARG   5 -11.840  10.675  -1.410
   44   2HH1  ARG   5          1HH2      ARG   5 -13.326  10.997  -0.581
   45   1HH2  ARG   5          2HH1      ARG   5 -15.212   8.680  -2.447
   46   2HH2  ARG   5          1HH1      ARG   5 -15.257   9.854  -1.174
   47    H    GLY   6           H        GLY   6 -12.090   4.719  -3.095
   48   1HA   GLY   6          1HA       GLY   6 -11.520   2.985  -4.489
   49   2HA   GLY   6          2HA       GLY   6  -9.876   3.007  -3.881
   50    H    LEU   7           H        LEU   7 -12.690   1.203  -3.943
   51    HA   LEU   7           HA       LEU   7 -12.071  -0.033  -1.350
   52   1HB   LEU   7          1HB       LEU   7 -14.622   0.545  -2.760
   53   2HB   LEU   7          2HB       LEU   7 -14.519  -0.970  -1.886
   54    HG   LEU   7           HG       LEU   7 -13.513   1.065  -0.163
   55   1HD1  LEU   7          1HD1      LEU   7 -15.152   2.308  -1.970
   56   2HD1  LEU   7          2HD1      LEU   7 -16.289   1.885  -0.668
   57   3HD1  LEU   7          3HD1      LEU   7 -14.844   2.859  -0.306
   58   1HD2  LEU   7          1HD2      LEU   7 -15.673  -0.953  -0.221
   59   2HD2  LEU   7          2HD2      LEU   7 -14.457  -0.596   1.028
   60   3HD2  LEU   7          3HD2      LEU   7 -15.917   0.412   0.895
   61    H    ILE   8           H        ILE   8 -10.424  -1.416  -2.089
   62    HA   ILE   8           HA       ILE   8 -10.469  -2.847  -4.439
   63    HB   ILE   8           HB       ILE   8  -8.950  -4.429  -3.151
   64   1HG1  ILE   8          1HG1      ILE   8  -9.055  -2.340  -0.977
   65   2HG1  ILE   8          2HG1      ILE   8 -10.081  -3.760  -0.920
   66   1HG2  ILE   8          1HG2      ILE   8  -7.260  -2.428  -2.787
   67   2HG2  ILE   8          2HG2      ILE   8  -7.780  -2.928  -4.414
   68   3HG2  ILE   8          3HG2      ILE   8  -8.528  -1.512  -3.637
   69   1HD1  ILE   8          1HD1      ILE   8  -8.321  -5.196  -0.520
   70   2HD1  ILE   8          2HD1      ILE   8  -7.196  -4.266  -1.537
   71   3HD1  ILE   8          3HD1      ILE   8  -7.569  -3.712   0.112
   72    H    SER   9           H        SER   9 -11.853  -4.334  -5.222
   73    HA   SER   9           HA       SER   9 -14.001  -5.258  -3.875
   74   1HB   SER   9          1HB       SER   9 -12.818  -5.650  -6.418
   75   2HB   SER   9          2HB       SER   9 -13.043  -7.265  -5.776
   76    HG   SER   9           HG       SER   9 -15.191  -5.378  -5.568
   77    HA   PRO  10           HA       PRO  10 -12.746  -8.765  -1.594
   78   1HB   PRO  10          1HB       PRO  10 -14.361 -10.850  -2.309
   79   2HB   PRO  10          2HB       PRO  10 -14.879  -9.558  -1.246
   80   1HG   PRO  10          1HG       PRO  10 -15.578 -10.018  -4.081
   81   2HG   PRO  10          2HG       PRO  10 -16.391  -9.011  -2.900
   82   1HD   PRO  10          1HD       PRO  10 -14.669  -8.124  -5.015
   83   2HD   PRO  10          2HD       PRO  10 -15.389  -7.131  -3.764
   84    H    SER  11           H        SER  11 -12.102  -8.723  -4.801
   85    HA   SER  11           HA       SER  11 -10.983 -11.330  -4.940
   86   1HB   SER  11          1HB       SER  11 -11.523  -9.110  -6.751
   87   2HB   SER  11          2HB       SER  11  -9.894  -9.704  -7.003
   88    HG   SER  11           HG       SER  11 -11.007 -11.090  -8.264
   89    H    ASP  12           H        ASP  12  -9.743  -7.929  -4.702
   90    HA   ASP  12           HA       ASP  12  -7.060  -8.772  -4.593
   91   1HB   ASP  12          1HB       ASP  12  -8.501  -6.322  -4.801
   92   2HB   ASP  12          2HB       ASP  12  -7.549  -6.176  -3.337
   93    H    PHE  13           H        PHE  13  -9.655  -7.906  -2.254
   94    HA   PHE  13           HA       PHE  13  -8.060  -7.745   0.030
   95   1HB   PHE  13          1HB       PHE  13 -10.636  -7.226  -0.607
   96   2HB   PHE  13          2HB       PHE  13 -10.898  -8.863  -0.039
   97    HD1  PHE  13           1HD      PHE  13  -9.584  -5.553   0.994
   98    HD2  PHE  13           2HD      PHE  13 -11.060  -9.325   2.260
   99    HE1  PHE  13           1HE      PHE  13  -9.698  -4.715   3.358
  100    HE2  PHE  13           2HE      PHE  13 -11.175  -8.487   4.623
  101    HZ   PHE  13           HZ       PHE  13 -10.492  -6.192   5.144
  102    H    ALA  14           H        ALA  14  -9.560 -10.503  -1.694
  103    HA   ALA  14           HA       ALA  14  -9.272 -12.382   0.362
  104   1HB   ALA  14          1HB       ALA  14 -10.728 -12.931  -1.408
  105   2HB   ALA  14          2HB       ALA  14  -9.529 -12.501  -2.651
  106   3HB   ALA  14          3HB       ALA  14  -9.317 -13.980  -1.685
  107    H    GLN  15           H        GLN  15  -7.194 -11.693  -2.544
  108    HA   GLN  15           HA       GLN  15  -5.235 -13.481  -1.973
  109   1HB   GLN  15          1HB       GLN  15  -5.657 -11.474  -3.855
  110   2HB   GLN  15          2HB       GLN  15  -4.215 -10.913  -3.032
  111   1HG   GLN  15          1HG       GLN  15  -3.463 -12.319  -4.841
  112   2HG   GLN  15          2HG       GLN  15  -3.208 -13.232  -3.366
  113   1HE2  GLN  15          1HE2      GLN  15  -3.222 -14.694  -5.502
  114   2HE2  GLN  15          2HE2      GLN  15  -4.687 -15.589  -5.736
  115    H    LEU  16           H        LEU  16  -5.333  -9.968  -1.028
  116    HA   LEU  16           HA       LEU  16  -2.985  -9.990   0.439
  117   1HB   LEU  16          1HB       LEU  16  -4.556  -8.079  -0.377
  118   2HB   LEU  16          2HB       LEU  16  -5.342  -8.289   1.176
  119    HG   LEU  16           HG       LEU  16  -3.878  -6.678   1.781
  120   1HD1  LEU  16          1HD1      LEU  16  -3.275  -8.618   3.140
  121   2HD1  LEU  16          2HD1      LEU  16  -2.042  -9.085   1.944
  122   3HD1  LEU  16          3HD1      LEU  16  -1.868  -7.566   2.856
  123   1HD2  LEU  16          1HD2      LEU  16  -3.011  -6.572  -0.614
  124   2HD2  LEU  16          2HD2      LEU  16  -1.904  -6.039   0.674
  125   3HD2  LEU  16          3HD2      LEU  16  -1.697  -7.642  -0.071
  126    H    GLN  17           H        GLN  17  -6.347 -10.886   1.332
  127    HA   GLN  17           HA       GLN  17  -5.925 -11.068   4.047
  128   1HB   GLN  17          1HB       GLN  17  -8.154 -11.123   2.954
  129   2HB   GLN  17          2HB       GLN  17  -7.800 -12.699   2.276
  130   1HG   GLN  17          1HG       GLN  17  -7.957 -13.790   4.349
  131   2HG   GLN  17          2HG       GLN  17  -7.520 -12.359   5.260
  132   1HE2  GLN  17          1HE2      GLN  17 -10.047 -13.977   3.451
  133   2HE2  GLN  17          2HE2      GLN  17 -11.403 -13.120   4.105
  134    H    LYS  18           H        LYS  18  -5.831 -13.702   1.534
  135    HA   LYS  18           HA       LYS  18  -4.970 -15.686   3.294
  136   1HB   LYS  18          1HB       LYS  18  -5.965 -16.301   1.222
  137   2HB   LYS  18          2HB       LYS  18  -4.811 -15.367   0.292
  138   1HG   LYS  18          1HG       LYS  18  -2.970 -16.885   1.246
  139   2HG   LYS  18          2HG       LYS  18  -4.242 -17.889   1.912
  140   1HD   LYS  18          1HD       LYS  18  -5.192 -18.195  -0.392
  141   2HD   LYS  18          2HD       LYS  18  -3.898 -17.214  -1.049
  142   1HE   LYS  18          1HE       LYS  18  -2.280 -18.912   0.118
  143   2HE   LYS  18          2HE       LYS  18  -3.686 -19.945   0.275
  144   1HZ   LYS  18          1HZ       LYS  18  -3.118 -18.780  -2.324
  145   2HZ   LYS  18          2HZ       LYS  18  -2.208 -20.040  -1.823
  146   3HZ   LYS  18          3HZ       LYS  18  -3.827 -20.206  -1.962
  147    H    TYR  19           H        TYR  19  -3.110 -13.548   1.027
  148    HA   TYR  19           HA       TYR  19  -0.600 -14.542   1.639
  149   1HB   TYR  19          1HB       TYR  19  -1.852 -11.902   0.747
  150   2HB   TYR  19          2HB       TYR  19  -0.125 -11.939   1.044
  151    HD1  TYR  19           1HD      TYR  19  -2.426 -14.427  -0.575
  152    HD2  TYR  19           2HD      TYR  19   0.977 -11.869  -1.000
  153    HE1  TYR  19           1HE      TYR  19  -2.036 -15.325  -2.921
  154    HE2  TYR  19           2HE      TYR  19   1.356 -12.775  -3.345
  155    HH   TYR  19           HH       TYR  19   0.860 -14.613  -4.663
  156    H    MET  20           H        MET  20  -2.630 -12.094   3.312
  157    HA   MET  20           HA       MET  20  -0.546 -11.258   5.007
  158   1HB   MET  20          1HB       MET  20  -2.427  -9.770   4.638
  159   2HB   MET  20          2HB       MET  20  -3.592 -11.021   5.019
  160   1HG   MET  20          1HG       MET  20  -2.740 -11.039   7.402
  161   2HG   MET  20          2HG       MET  20  -1.659  -9.720   6.999
  162   1HE   MET  20          1HE       MET  20  -3.678  -7.298   5.388
  163   2HE   MET  20          2HE       MET  20  -3.334  -6.706   7.031
  164   3HE   MET  20          3HE       MET  20  -2.135  -7.705   6.176
  165    H    GLU  21           H        GLU  21  -3.347 -13.526   5.374
  166    HA   GLU  21           HA       GLU  21  -3.218 -14.107   7.964
  167   1HB   GLU  21          1HB       GLU  21  -3.843 -15.710   5.514
  168   2HB   GLU  21          2HB       GLU  21  -3.626 -16.620   6.995
  169   1HG   GLU  21          1HG       GLU  21  -5.218 -14.560   7.901
  170   2HG   GLU  21          2HG       GLU  21  -5.785 -14.698   6.248
  171    H    TYR  22           H        TYR  22  -1.125 -15.588   5.394
  172    HA   TYR  22           HA       TYR  22   0.316 -17.252   7.105
  173   1HB   TYR  22          1HB       TYR  22   0.095 -16.726   4.409
  174   2HB   TYR  22          2HB       TYR  22   1.571 -15.838   4.728
  175    HD1  TYR  22           1HD      TYR  22   0.019 -19.215   4.958
  176    HD2  TYR  22           2HD      TYR  22   3.653 -16.959   4.938
  177    HE1  TYR  22           1HE      TYR  22   1.361 -21.366   4.766
  178    HE2  TYR  22           2HE      TYR  22   4.984 -19.116   4.746
  179    HH   TYR  22           HH       TYR  22   3.607 -22.009   3.870
  180    H    SER  23           H        SER  23   0.632 -13.784   6.307
  181    HA   SER  23           HA       SER  23   3.223 -13.607   7.441
  182   1HB   SER  23          1HB       SER  23   1.494 -11.955   5.876
  183   2HB   SER  23          2HB       SER  23   1.841 -11.055   7.339
  184    HG   SER  23           HG       SER  23   4.037 -11.093   6.902
  185    H    THR  24           H        THR  24   3.795 -12.522   9.457
  186    HA   THR  24           HA       THR  24   1.572 -12.049  11.301
  187    HB   THR  24           HB       THR  24   2.771 -13.447  13.017
  188    HG1  THR  24           1HG      THR  24   4.652 -14.555  12.255
  189   1HG2  THR  24          1HG2      THR  24   1.055 -14.524  11.396
  190   2HG2  THR  24          2HG2      THR  24   2.459 -15.085  10.458
  191   3HG2  THR  24          3HG2      THR  24   2.234 -15.633  12.136
  192    H    LYS  25           H        LYS  25   3.900 -10.640   9.664
  193    HA   LYS  25           HA       LYS  25   5.211  -9.363  11.930
  194   1HB   LYS  25          1HB       LYS  25   5.731  -9.501   8.971
  195   2HB   LYS  25          2HB       LYS  25   6.419  -8.196   9.917
  196   1HG   LYS  25          1HG       LYS  25   6.902 -10.513  11.467
  197   2HG   LYS  25          2HG       LYS  25   7.198 -11.025   9.817
  198   1HD   LYS  25          1HD       LYS  25   8.343  -8.359  10.457
  199   2HD   LYS  25          2HD       LYS  25   9.013  -9.660  11.422
  200   1HE   LYS  25          1HE       LYS  25   9.189 -10.923   9.084
  201   2HE   LYS  25          2HE       LYS  25   9.078  -9.308   8.414
  202   1HZ   LYS  25          1HZ       LYS  25  10.896  -9.354  10.552
  203   2HZ   LYS  25          2HZ       LYS  25  11.301 -10.499   9.460
  204   3HZ   LYS  25          3HZ       LYS  25  11.156  -8.941   8.993
  205    H    LYS  26           H        LYS  26   5.521  -6.832  11.513
  206    HA   LYS  26           HA       LYS  26   2.802  -5.824  11.088
  207   1HB   LYS  26          1HB       LYS  26   5.073  -4.610  12.690
  208   2HB   LYS  26          2HB       LYS  26   3.447  -3.974  12.553
  209   1HG   LYS  26          1HG       LYS  26   3.395  -6.799  13.340
  210   2HG   LYS  26          2HG       LYS  26   4.381  -5.864  14.446
  211   1HD   LYS  26          1HD       LYS  26   2.583  -4.446  15.067
  212   2HD   LYS  26          2HD       LYS  26   1.670  -4.797  13.613
  213   1HE   LYS  26          1HE       LYS  26   0.813  -6.787  14.453
  214   2HE   LYS  26          2HE       LYS  26   2.251  -7.141  15.390
  215   1HZ   LYS  26          1HZ       LYS  26  -0.080  -5.740  16.168
  216   2HZ   LYS  26          2HZ       LYS  26   1.086  -6.406  17.098
  217   3HZ   LYS  26          3HZ       LYS  26   1.270  -4.891  16.518
  218    H    VAL  27           H        VAL  27   2.419  -4.087   9.688
  219    HA   VAL  27           HA       VAL  27   4.318  -3.833   7.585
  220    HB   VAL  27           HB       VAL  27   1.825  -3.851   7.372
  221   1HG1  VAL  27          1HG1      VAL  27   2.087  -1.044   8.500
  222   2HG1  VAL  27          2HG1      VAL  27   0.630  -1.697   7.713
  223   3HG1  VAL  27          3HG1      VAL  27   1.219  -2.415   9.232
  224   1HG2  VAL  27          1HG2      VAL  27   2.683  -3.188   5.377
  225   2HG2  VAL  27          2HG2      VAL  27   1.939  -1.635   5.829
  226   3HG2  VAL  27          3HG2      VAL  27   3.677  -1.903   6.105
  227    H    SER  28           H        SER  28   3.396  -1.973  10.485
  228    HA   SER  28           HA       SER  28   4.473   0.443   9.796
  229   1HB   SER  28          1HB       SER  28   3.303  -0.671  12.050
  230   2HB   SER  28          2HB       SER  28   4.936  -0.373  12.612
  231    HG   SER  28           HG       SER  28   4.412   1.684  12.799
  232    H    ASP  29           H        ASP  29   6.023  -2.610  10.708
  233    HA   ASP  29           HA       ASP  29   8.498  -1.447  11.385
  234   1HB   ASP  29          1HB       ASP  29   7.291  -4.024  11.447
  235   2HB   ASP  29          2HB       ASP  29   8.684  -4.197  10.398
  236    H    VAL  30           H        VAL  30   6.878  -2.677   8.447
  237    HA   VAL  30           HA       VAL  30   9.205  -2.888   6.855
  238    HB   VAL  30           HB       VAL  30   6.250  -2.706   6.296
  239   1HG1  VAL  30          1HG1      VAL  30   6.738  -3.272   3.950
  240   2HG1  VAL  30          2HG1      VAL  30   7.409  -1.685   4.396
  241   3HG1  VAL  30          3HG1      VAL  30   8.480  -3.102   4.272
  242   1HG2  VAL  30          1HG2      VAL  30   6.329  -4.888   6.750
  243   2HG2  VAL  30          2HG2      VAL  30   7.394  -5.107   5.341
  244   3HG2  VAL  30          3HG2      VAL  30   8.096  -4.825   6.952
  245    H    LEU  31           H        LEU  31   6.891  -0.274   7.649
  246    HA   LEU  31           HA       LEU  31   7.769   1.490   5.638
  247   1HB   LEU  31          1HB       LEU  31   6.293   1.851   8.239
  248   2HB   LEU  31          2HB       LEU  31   6.689   3.200   7.192
  249    HG   LEU  31           HG       LEU  31   5.400   1.072   5.690
  250   1HD1  LEU  31          1HD1      LEU  31   3.896   2.164   8.084
  251   2HD1  LEU  31          2HD1      LEU  31   3.155   1.298   6.716
  252   3HD1  LEU  31          3HD1      LEU  31   4.328   0.466   7.766
  253   1HD2  LEU  31          1HD2      LEU  31   4.362   3.855   6.231
  254   2HD2  LEU  31          2HD2      LEU  31   5.716   3.538   5.120
  255   3HD2  LEU  31          3HD2      LEU  31   4.116   2.828   4.798
  256    H    LYS  32           H        LYS  32   8.893   0.694   8.933
  257    HA   LYS  32           HA       LYS  32  10.529   2.908   9.318
  258   1HB   LYS  32          1HB       LYS  32  11.169   1.846  11.213
  259   2HB   LYS  32          2HB       LYS  32   9.780   0.844  10.844
  260   1HG   LYS  32          1HG       LYS  32  11.322  -0.855  11.061
  261   2HG   LYS  32          2HG       LYS  32  11.623  -0.491   9.373
  262   1HD   LYS  32          1HD       LYS  32  13.599   0.734   9.847
  263   2HD   LYS  32          2HD       LYS  32  13.137   1.031  11.511
  264   1HE   LYS  32          1HE       LYS  32  13.243  -1.657  11.654
  265   2HE   LYS  32          2HE       LYS  32  14.316  -1.460  10.283
  266   1HZ   LYS  32          1HZ       LYS  32  15.886  -0.743  11.629
  267   2HZ   LYS  32          2HZ       LYS  32  14.933   0.405  12.292
  268   3HZ   LYS  32          3HZ       LYS  32  14.944  -1.106  12.912
  269    H    LEU  33           H        LEU  33  10.882   0.013   7.306
  270    HA   LEU  33           HA       LEU  33  13.696   0.453   6.910
  271   1HB   LEU  33          1HB       LEU  33  11.747  -1.410   5.546
  272   2HB   LEU  33          2HB       LEU  33  13.485  -1.412   5.322
  273    HG   LEU  33           HG       LEU  33  12.671  -1.648   8.139
  274   1HD1  LEU  33          1HD1      LEU  33  11.069  -3.171   7.938
  275   2HD1  LEU  33          2HD1      LEU  33  11.277  -3.244   6.171
  276   3HD1  LEU  33          3HD1      LEU  33  12.277  -4.269   7.229
  277   1HD2  LEU  33          1HD2      LEU  33  14.582  -2.823   8.314
  278   2HD2  LEU  33          2HD2      LEU  33  14.283  -3.746   6.821
  279   3HD2  LEU  33          3HD2      LEU  33  14.942  -2.095   6.730
  280    H    PHE  34           H        PHE  34  10.599   1.278   5.355
  281    HA   PHE  34           HA       PHE  34  11.890   2.185   2.959
  282   1HB   PHE  34          1HB       PHE  34   9.145   1.956   4.196
  283   2HB   PHE  34          2HB       PHE  34   9.318   3.229   3.004
  284    HD1  PHE  34           1HD      PHE  34   9.149  -0.358   3.549
  285    HD2  PHE  34           2HD      PHE  34   9.859   2.670   0.662
  286    HE1  PHE  34           1HE      PHE  34   8.822  -2.034   1.710
  287    HE2  PHE  34           2HE      PHE  34   9.531   0.994  -1.177
  288    HZ   PHE  34           HZ       PHE  34   9.017  -1.338  -0.631
  289    H    GLU  35           H        GLU  35  11.402   3.430   6.134
  290    HA   GLU  35           HA       GLU  35  11.205   6.151   5.239
  291   1HB   GLU  35          1HB       GLU  35  10.408   6.560   7.324
  292   2HB   GLU  35          2HB       GLU  35  10.343   4.819   7.508
  293   1HG   GLU  35          1HG       GLU  35  12.618   4.799   8.486
  294   2HG   GLU  35          2HG       GLU  35  12.778   6.523   8.214
  295    H    ASP  36           H        ASP  36  13.549   4.018   7.000
  296    HA   ASP  36           HA       ASP  36  15.584   5.983   6.288
  297   1HB   ASP  36          1HB       ASP  36  15.342   5.965   8.703
  298   2HB   ASP  36          2HB       ASP  36  15.302   4.214   8.752
  299    H    GLY  37           H        GLY  37  14.545   2.575   6.650
  300   1HA   GLY  37          1HA       GLY  37  16.911   1.224   6.131
  301   2HA   GLY  37          2HA       GLY  37  15.296   0.656   5.756
  302    H    GLU  38           H        GLU  38  17.429  -0.024   4.079
  303    HA   GLU  38           HA       GLU  38  17.997   1.703   2.052
  304   1HB   GLU  38          1HB       GLU  38  18.928  -0.135   0.977
  305   2HB   GLU  38          2HB       GLU  38  18.820  -0.752   2.614
  306   1HG   GLU  38          1HG       GLU  38  16.621  -1.825   2.056
  307   2HG   GLU  38          2HG       GLU  38  16.750  -1.222   0.415
  308    H    MET  39           H        MET  39  15.018  -0.056   2.748
  309    HA   MET  39           HA       MET  39  13.922  -0.165   0.239
  310   1HB   MET  39          1HB       MET  39  12.631   0.326   2.979
  311   2HB   MET  39          2HB       MET  39  11.713  -0.101   1.548
  312   1HG   MET  39          1HG       MET  39  13.987  -1.811   2.663
  313   2HG   MET  39          2HG       MET  39  12.299  -2.070   3.056
  314   1HE   MET  39          1HE       MET  39  14.601  -3.718  -0.266
  315   2HE   MET  39          2HE       MET  39  14.736  -1.946  -0.370
  316   3HE   MET  39          3HE       MET  39  15.109  -2.779   1.158
  317    H    ALA  40           H        ALA  40  14.718   2.607   2.154
  318    HA   ALA  40           HA       ALA  40  12.669   4.315   1.120
  319   1HB   ALA  40          1HB       ALA  40  15.298   4.925   2.534
  320   2HB   ALA  40          2HB       ALA  40  13.956   6.067   2.278
  321   3HB   ALA  40          3HB       ALA  40  13.731   4.650   3.332
  322    H    LYS  41           H        LYS  41  15.242   2.762  -0.329
  323    HA   LYS  41           HA       LYS  41  16.455   4.848  -1.764
  324   1HB   LYS  41          1HB       LYS  41  17.481   3.128  -3.041
  325   2HB   LYS  41          2HB       LYS  41  17.368   2.540  -1.395
  326   1HG   LYS  41          1HG       LYS  41  15.637   1.016  -1.906
  327   2HG   LYS  41          2HG       LYS  41  15.114   1.919  -3.314
  328   1HD   LYS  41          1HD       LYS  41  16.235  -0.021  -4.173
  329   2HD   LYS  41          2HD       LYS  41  17.346   1.311  -4.418
  330   1HE   LYS  41          1HE       LYS  41  18.010   0.428  -1.846
  331   2HE   LYS  41          2HE       LYS  41  17.619  -1.066  -2.675
  332   1HZ   LYS  41          1HZ       LYS  41  19.792   0.739  -3.129
  333   2HZ   LYS  41          2HZ       LYS  41  19.699  -0.868  -3.401
  334   3HZ   LYS  41          3HZ       LYS  41  19.091   0.182  -4.495
  335    H    TYR  42           H        TYR  42  13.401   3.095  -2.099
  336    HA   TYR  42           HA       TYR  42  13.002   4.358  -4.718
  337   1HB   TYR  42          1HB       TYR  42  11.649   2.096  -3.121
  338   2HB   TYR  42          2HB       TYR  42  11.044   2.647  -4.670
  339    HD1  TYR  42           1HD      TYR  42  13.771   3.060  -6.021
  340    HD2  TYR  42           2HD      TYR  42  12.171  -0.155  -3.694
  341    HE1  TYR  42           1HE      TYR  42  15.319   1.425  -7.202
  342    HE2  TYR  42           2HE      TYR  42  13.725  -1.779  -4.884
  343    HH   TYR  42           HH       TYR  42  16.278  -1.166  -6.232
  344    H    VAL  43           H        VAL  43  12.912   5.939  -2.261
  345    HA   VAL  43           HA       VAL  43  10.060   6.626  -2.337
  346    HB   VAL  43           HB       VAL  43  11.907   6.468   0.048
  347   1HG1  VAL  43          1HG1      VAL  43   9.256   7.170   0.827
  348   2HG1  VAL  43          2HG1      VAL  43  10.759   8.099   1.042
  349   3HG1  VAL  43          3HG1      VAL  43   9.777   8.322  -0.426
  350   1HG2  VAL  43          1HG2      VAL  43   9.463   4.959  -0.856
  351   2HG2  VAL  43          2HG2      VAL  43  11.013   4.340  -0.239
  352   3HG2  VAL  43          3HG2      VAL  43   9.848   5.093   0.877
  353    H    GLN  44           H        GLN  44   9.668   8.723  -2.881
  354    HA   GLN  44           HA       GLN  44  11.986  10.494  -2.766
  355   1HB   GLN  44          1HB       GLN  44  10.629  11.686  -4.714
  356   2HB   GLN  44          2HB       GLN  44  11.675  10.323  -5.059
  357   1HG   GLN  44          1HG       GLN  44   8.761   9.849  -4.361
  358   2HG   GLN  44          2HG       GLN  44   9.200  10.335  -5.986
  359   1HE2  GLN  44          1HE2      GLN  44  10.400   8.993  -7.299
  360   2HE2  GLN  44          2HE2      GLN  44  10.644   7.308  -6.976
  361    H    GLY  45           H        GLY  45  11.748  12.253  -1.450
  362   1HA   GLY  45          1HA       GLY  45  10.787  13.744  -0.069
  363   2HA   GLY  45          2HA       GLY  45   9.541  13.900  -1.292
  364    H    ASP  46           H        ASP  46  10.285  10.857   0.465
  365    HA   ASP  46           HA       ASP  46   9.224   9.793   2.058
  366   1HB   ASP  46          1HB       ASP  46   8.619  12.284   2.851
  367   2HB   ASP  46          2HB       ASP  46   7.016  11.842   2.298
  368    H    ALA  47           H        ALA  47   8.175  10.694  -0.950
  369    HA   ALA  47           HA       ALA  47   5.637   9.230  -0.768
  370   1HB   ALA  47          1HB       ALA  47   6.510  10.812  -3.176
  371   2HB   ALA  47          2HB       ALA  47   4.872  10.513  -2.547
  372   3HB   ALA  47          3HB       ALA  47   5.940  11.679  -1.730
  373    H    ILE  48           H        ILE  48   5.336   7.339  -1.938
  374    HA   ILE  48           HA       ILE  48   7.713   6.413  -3.395
  375    HB   ILE  48           HB       ILE  48   7.356   5.191  -1.339
  376   1HG1  ILE  48          1HG1      ILE  48   6.455   3.305  -3.498
  377   2HG1  ILE  48          2HG1      ILE  48   8.006   4.108  -3.644
  378   1HG2  ILE  48          1HG2      ILE  48   4.930   5.627  -1.115
  379   2HG2  ILE  48          2HG2      ILE  48   4.622   4.450  -2.415
  380   3HG2  ILE  48          3HG2      ILE  48   5.357   3.914  -0.885
  381   1HD1  ILE  48          1HD1      ILE  48   7.721   1.766  -2.337
  382   2HD1  ILE  48          2HD1      ILE  48   8.930   2.977  -1.846
  383   3HD1  ILE  48          3HD1      ILE  48   7.377   2.868  -0.982
  384    H    GLY  49           H        GLY  49   7.328   5.106  -5.321
  385   1HA   GLY  49          1HA       GLY  49   4.975   6.056  -6.757
  386   2HA   GLY  49          2HA       GLY  49   6.390   5.268  -7.424
  387    H    TYR  50           H        TYR  50   4.495   4.086  -8.582
  388    HA   TYR  50           HA       TYR  50   3.017   2.207  -7.031
  389   1HB   TYR  50          1HB       TYR  50   2.121   3.031  -9.142
  390   2HB   TYR  50          2HB       TYR  50   3.655   2.818  -9.962
  391    HD1  TYR  50           1HD      TYR  50   3.072   1.443 -11.785
  392    HD2  TYR  50           2HD      TYR  50   1.859   0.325  -7.838
  393    HE1  TYR  50           1HE      TYR  50   2.287  -0.812 -12.658
  394    HE2  TYR  50           2HE      TYR  50   1.077  -1.927  -8.724
  395    HH   TYR  50           HH       TYR  50   1.598  -3.391 -10.621
  396    H    GLU  51           H        GLU  51   5.694   1.882  -9.476
  397    HA   GLU  51           HA       GLU  51   6.006  -0.799  -9.277
  398   1HB   GLU  51          1HB       GLU  51   7.200   1.053 -10.750
  399   2HB   GLU  51          2HB       GLU  51   8.435   0.988  -9.509
  400   1HG   GLU  51          1HG       GLU  51   9.044  -1.215 -10.018
  401   2HG   GLU  51          2HG       GLU  51   7.453  -1.633 -10.623
  402    H    GLY  52           H        GLY  52   7.515   1.783  -7.238
  403   1HA   GLY  52          1HA       GLY  52   9.186   0.198  -5.697
  404   2HA   GLY  52          2HA       GLY  52   8.447   1.706  -5.196
  405    H    PHE  53           H        PHE  53   5.650   0.851  -5.419
  406    HA   PHE  53           HA       PHE  53   5.277  -0.155  -2.873
  407   1HB   PHE  53          1HB       PHE  53   3.759   1.010  -4.803
  408   2HB   PHE  53          2HB       PHE  53   3.332  -0.650  -5.165
  409    HD1  PHE  53           1HD      PHE  53   1.837  -1.869  -3.768
  410    HD2  PHE  53           2HD      PHE  53   3.211   1.961  -2.563
  411    HE1  PHE  53           1HE      PHE  53   0.106  -1.819  -1.952
  412    HE2  PHE  53           2HE      PHE  53   1.479   2.011  -0.747
  413    HZ   PHE  53           HZ       PHE  53  -0.053   0.120  -0.463
  414    H    GLN  54           H        GLN  54   5.853  -1.806  -5.956
  415    HA   GLN  54           HA       GLN  54   4.732  -4.245  -5.321
  416   1HB   GLN  54          1HB       GLN  54   7.241  -3.858  -7.000
  417   2HB   GLN  54          2HB       GLN  54   6.044  -5.128  -7.153
  418   1HG   GLN  54          1HG       GLN  54   4.737  -2.527  -7.330
  419   2HG   GLN  54          2HG       GLN  54   6.068  -2.594  -8.468
  420   1HE2  GLN  54          1HE2      GLN  54   4.669  -2.609 -10.212
  421   2HE2  GLN  54          2HE2      GLN  54   3.759  -4.004 -10.687
  422    H    GLN  55           H        GLN  55   8.009  -2.881  -4.675
  423    HA   GLN  55           HA       GLN  55   9.068  -5.244  -3.658
  424   1HB   GLN  55          1HB       GLN  55  10.705  -3.685  -4.211
  425   2HB   GLN  55          2HB       GLN  55   9.792  -2.330  -3.577
  426   1HG   GLN  55          1HG       GLN  55  10.254  -3.068  -1.252
  427   2HG   GLN  55          2HG       GLN  55  11.095  -4.485  -1.847
  428   1HE2  GLN  55          1HE2      GLN  55  11.163  -1.040  -1.419
  429   2HE2  GLN  55          2HE2      GLN  55  12.837  -0.769  -1.772
  430    H    PHE  56           H        PHE  56   7.047  -2.671  -2.262
  431    HA   PHE  56           HA       PHE  56   7.541  -3.159   0.427
  432   1HB   PHE  56          1HB       PHE  56   6.208  -1.290  -0.843
  433   2HB   PHE  56          2HB       PHE  56   4.878  -2.429  -0.919
  434    HD1  PHE  56           1HD      PHE  56   6.622  -0.032   1.115
  435    HD2  PHE  56           2HD      PHE  56   3.852  -3.245   1.235
  436    HE1  PHE  56           1HE      PHE  56   5.853   0.715   3.384
  437    HE2  PHE  56           2HE      PHE  56   3.083  -2.498   3.504
  438    HZ   PHE  56           HZ       PHE  56   4.093  -0.527   4.552
  439    H    LEU  57           H        LEU  57   4.971  -4.491  -1.770
  440    HA   LEU  57           HA       LEU  57   3.701  -6.047   0.123
  441   1HB   LEU  57          1HB       LEU  57   4.022  -6.293  -2.859
  442   2HB   LEU  57          2HB       LEU  57   3.071  -7.438  -1.934
  443    HG   LEU  57           HG       LEU  57   2.328  -4.692  -1.305
  444   1HD1  LEU  57          1HD1      LEU  57   1.219  -4.246  -3.508
  445   2HD1  LEU  57          2HD1      LEU  57   2.994  -4.116  -3.524
  446   3HD1  LEU  57          3HD1      LEU  57   2.201  -5.558  -4.203
  447   1HD2  LEU  57          1HD2      LEU  57   0.413  -6.497  -2.648
  448   2HD2  LEU  57          2HD2      LEU  57   1.160  -7.136  -1.164
  449   3HD2  LEU  57          3HD2      LEU  57   0.275  -5.592  -1.122
  450    H    LYS  58           H        LYS  58   6.861  -6.376  -1.330
  451    HA   LYS  58           HA       LYS  58   7.103  -9.174  -1.031
  452   1HB   LYS  58          1HB       LYS  58   8.485  -7.441  -2.434
  453   2HB   LYS  58          2HB       LYS  58   9.436  -7.278  -0.972
  454   1HG   LYS  58          1HG       LYS  58   9.447  -9.938  -1.013
  455   2HG   LYS  58          2HG       LYS  58   9.036  -9.731  -2.704
  456   1HD   LYS  58          1HD       LYS  58  11.066  -8.037  -2.737
  457   2HD   LYS  58          2HD       LYS  58  11.544  -8.832  -1.250
  458   1HE   LYS  58          1HE       LYS  58  10.888 -10.943  -3.041
  459   2HE   LYS  58          2HE       LYS  58  11.781  -9.785  -4.007
  460   1HZ   LYS  58          1HZ       LYS  58  13.193  -9.869  -1.736
  461   2HZ   LYS  58          2HZ       LYS  58  12.694 -11.418  -1.862
  462   3HZ   LYS  58          3HZ       LYS  58  13.539 -10.732  -3.079
  463    H    ILE  59           H        ILE  59   8.397  -6.407   0.944
  464    HA   ILE  59           HA       ILE  59   9.107  -8.187   3.058
  465    HB   ILE  59           HB       ILE  59   8.932  -5.181   3.157
  466   1HG1  ILE  59          1HG1      ILE  59  11.583  -6.062   2.561
  467   2HG1  ILE  59          2HG1      ILE  59  10.509  -6.766   1.369
  468   1HG2  ILE  59          1HG2      ILE  59  10.228  -7.315   4.795
  469   2HG2  ILE  59          2HG2      ILE  59  11.069  -5.757   4.613
  470   3HG2  ILE  59          3HG2      ILE  59   9.426  -5.807   5.296
  471   1HD1  ILE  59          1HD1      ILE  59   9.466  -4.424   1.105
  472   2HD1  ILE  59          2HD1      ILE  59  10.840  -3.821   2.062
  473   3HD1  ILE  59          3HD1      ILE  59  11.127  -4.620   0.497
  474    H    TYR  60           H        TYR  60   6.517  -5.725   2.484
  475    HA   TYR  60           HA       TYR  60   5.274  -5.772   4.896
  476   1HB   TYR  60          1HB       TYR  60   4.605  -4.372   2.964
  477   2HB   TYR  60          2HB       TYR  60   4.280  -5.789   1.986
  478    HD1  TYR  60           1HD      TYR  60   2.027  -5.123   1.407
  479    HD2  TYR  60           2HD      TYR  60   3.181  -5.547   5.505
  480    HE1  TYR  60           1HE      TYR  60  -0.415  -5.043   2.110
  481    HE2  TYR  60           2HE      TYR  60   0.735  -5.466   6.194
  482    HH   TYR  60           HH       TYR  60  -1.352  -4.576   5.315
  483    H    LEU  61           H        LEU  61   4.221  -7.840   2.091
  484    HA   LEU  61           HA       LEU  61   2.781  -9.537   3.901
  485   1HB   LEU  61          1HB       LEU  61   3.003  -9.123   0.994
  486   2HB   LEU  61          2HB       LEU  61   2.728 -10.785   1.477
  487    HG   LEU  61           HG       LEU  61   0.995  -8.446   2.320
  488   1HD1  LEU  61          1HD1      LEU  61  -0.555 -10.011   0.689
  489   2HD1  LEU  61          2HD1      LEU  61   0.257  -8.501   0.209
  490   3HD1  LEU  61          3HD1      LEU  61   1.027 -10.070  -0.126
  491   1HD2  LEU  61          1HD2      LEU  61  -0.605 -10.464   2.765
  492   2HD2  LEU  61          2HD2      LEU  61   0.908 -11.396   2.861
  493   3HD2  LEU  61          3HD2      LEU  61   0.637 -10.024   3.962
  494    H    GLU  62           H        GLU  62   6.029  -9.206   3.033
  495    HA   GLU  62           HA       GLU  62   7.788 -10.438   3.348
  496   1HB   GLU  62          1HB       GLU  62   6.259 -11.129   5.449
  497   2HB   GLU  62          2HB       GLU  62   6.299 -12.697   4.667
  498   1HG   GLU  62          1HG       GLU  62   8.913 -11.227   4.950
  499   2HG   GLU  62          2HG       GLU  62   8.211 -11.906   6.405
  500    H    VAL  63           H        VAL  63   5.532 -11.046   1.187
  501    HA   VAL  63           HA       VAL  63   5.981 -13.757   0.483
  502    HB   VAL  63           HB       VAL  63   4.941 -12.903  -1.707
  503   1HG1  VAL  63          1HG1      VAL  63   3.767 -13.247   0.975
  504   2HG1  VAL  63          2HG1      VAL  63   2.733 -12.359  -0.171
  505   3HG1  VAL  63          3HG1      VAL  63   3.320 -13.989  -0.580
  506   1HG2  VAL  63          1HG2      VAL  63   5.558 -10.422  -0.654
  507   2HG2  VAL  63          2HG2      VAL  63   4.419 -10.738  -1.985
  508   3HG2  VAL  63          3HG2      VAL  63   3.817 -10.576  -0.318
  509    H    ASP  64           H        ASP  64   7.171 -14.565  -1.372
  510    HA   ASP  64           HA       ASP  64   9.609 -13.089  -1.685
  511   1HB   ASP  64          1HB       ASP  64   9.581 -15.567  -1.276
  512   2HB   ASP  64          2HB       ASP  64   8.736 -15.800  -2.793
  513    H    ASN  65           H        ASN  65   6.559 -13.273  -3.183
  514    HA   ASN  65           HA       ASN  65   7.437 -11.798  -5.399
  515   1HB   ASN  65          1HB       ASN  65   6.165 -13.734  -6.912
  516   2HB   ASN  65          2HB       ASN  65   7.906 -13.581  -6.782
  517   1HD2  ASN  65          1HD2      ASN  65   9.051 -14.850  -5.265
  518   2HD2  ASN  65          2HD2      ASN  65   8.436 -16.365  -4.693
  519    H    VAL  66           H        VAL  66   5.718 -10.349  -5.528
  520    HA   VAL  66           HA       VAL  66   3.078 -11.327  -4.734
  521    HB   VAL  66           HB       VAL  66   4.553  -9.095  -4.022
  522   1HG1  VAL  66          1HG1      VAL  66   4.129  -7.973  -6.124
  523   2HG1  VAL  66          2HG1      VAL  66   2.381  -8.281  -5.981
  524   3HG1  VAL  66          3HG1      VAL  66   3.188  -7.178  -4.840
  525   1HG2  VAL  66          1HG2      VAL  66   1.881  -8.479  -3.432
  526   2HG2  VAL  66          2HG2      VAL  66   1.942 -10.257  -3.508
  527   3HG2  VAL  66          3HG2      VAL  66   3.031  -9.374  -2.411
  528    HA   PRO  67           HA       PRO  67   1.731 -11.060  -8.834
  529   1HB   PRO  67          1HB       PRO  67  -0.973 -10.895  -8.474
  530   2HB   PRO  67          2HB       PRO  67  -0.086 -12.404  -8.396
  531   1HG   PRO  67          1HG       PRO  67  -1.217 -10.802  -6.184
  532   2HG   PRO  67          2HG       PRO  67  -0.716 -12.482  -6.179
  533   1HD   PRO  67          1HD       PRO  67   0.721 -10.259  -5.072
  534   2HD   PRO  67          2HD       PRO  67   1.273 -11.919  -5.171
  535    H    ARG  68           H        ARG  68   1.336  -9.670 -10.525
  536    HA   ARG  68           HA       ARG  68   1.534  -6.985  -9.757
  537   1HB   ARG  68          1HB       ARG  68   1.366  -8.535 -12.315
  538   2HB   ARG  68          2HB       ARG  68   0.842  -6.866 -12.421
  539   1HG   ARG  68          1HG       ARG  68   3.151  -6.550 -10.967
  540   2HG   ARG  68          2HG       ARG  68   3.573  -7.971 -11.903
  541   1HD   ARG  68          1HD       ARG  68   2.352  -6.284 -13.797
  542   2HD   ARG  68          2HD       ARG  68   3.264  -5.174 -12.793
  543    HE   ARG  68           HE       ARG  68   5.267  -6.114 -13.587
  544   1HH1  ARG  68          2HH2      ARG  68   2.564  -8.199 -14.441
  545   2HH1  ARG  68          1HH2      ARG  68   3.510  -9.216 -15.476
  546   1HH2  ARG  68          2HH1      ARG  68   6.515  -7.456 -14.952
  547   2HH2  ARG  68          1HH1      ARG  68   5.773  -8.790 -15.768
  548    H    HIS  69           H        HIS  69  -1.125  -9.169 -10.690
  549    HA   HIS  69           HA       HIS  69  -3.034  -7.312 -11.392
  550   1HB   HIS  69          1HB       HIS  69  -3.124 -10.075 -10.212
  551   2HB   HIS  69          2HB       HIS  69  -4.609  -9.164 -10.401
  552    HD1  HIS  69           1HD      HIS  69  -5.374 -10.969 -12.184
  553    HD2  HIS  69           2HD      HIS  69  -2.013  -8.706 -13.268
  554    HE1  HIS  69           1HE      HIS  69  -5.037 -11.344 -14.685
  555    H    LEU  70           H        LEU  70  -2.061  -8.558  -8.146
  556    HA   LEU  70           HA       LEU  70  -4.063  -7.101  -6.776
  557   1HB   LEU  70          1HB       LEU  70  -3.337  -8.920  -5.606
  558   2HB   LEU  70          2HB       LEU  70  -1.661  -8.708  -6.072
  559    HG   LEU  70           HG       LEU  70  -1.846  -6.545  -4.548
  560   1HD1  LEU  70          1HD1      LEU  70  -4.402  -7.501  -4.211
  561   2HD1  LEU  70          2HD1      LEU  70  -3.563  -8.118  -2.767
  562   3HD1  LEU  70          3HD1      LEU  70  -3.558  -6.373  -3.122
  563   1HD2  LEU  70          1HD2      LEU  70  -0.203  -7.964  -3.875
  564   2HD2  LEU  70          2HD2      LEU  70  -1.357  -8.237  -2.548
  565   3HD2  LEU  70          3HD2      LEU  70  -1.264  -9.393  -3.899
  566    H    SER  71           H        SER  71  -0.542  -6.556  -7.426
  567    HA   SER  71           HA       SER  71  -0.354  -4.212  -6.009
  568   1HB   SER  71          1HB       SER  71   1.298  -5.770  -7.691
  569   2HB   SER  71          2HB       SER  71   1.283  -4.186  -8.439
  570    HG   SER  71           HG       SER  71   2.821  -4.868  -6.461
  571    H    LEU  72           H        LEU  72  -1.922  -4.942  -9.057
  572    HA   LEU  72           HA       LEU  72  -1.820  -2.287 -10.093
  573   1HB   LEU  72          1HB       LEU  72  -2.007  -3.874 -11.734
  574   2HB   LEU  72          2HB       LEU  72  -3.127  -4.865 -10.821
  575    HG   LEU  72           HG       LEU  72  -4.918  -3.198 -11.228
  576   1HD1  LEU  72          1HD1      LEU  72  -4.663  -1.339 -12.659
  577   2HD1  LEU  72          2HD1      LEU  72  -3.297  -1.267 -11.520
  578   3HD1  LEU  72          3HD1      LEU  72  -3.042  -1.858 -13.180
  579   1HD2  LEU  72          1HD2      LEU  72  -4.187  -5.198 -12.800
  580   2HD2  LEU  72          2HD2      LEU  72  -5.491  -4.076 -13.257
  581   3HD2  LEU  72          3HD2      LEU  72  -3.859  -3.870 -13.939
  582    H    ALA  73           H        ALA  73  -4.284  -4.313  -8.378
  583    HA   ALA  73           HA       ALA  73  -6.180  -2.195  -8.320
  584   1HB   ALA  73          1HB       ALA  73  -7.359  -4.105  -8.049
  585   2HB   ALA  73          2HB       ALA  73  -5.939  -5.001  -7.459
  586   3HB   ALA  73          3HB       ALA  73  -6.888  -3.997  -6.336
  587    H    LEU  74           H        LEU  74  -3.545  -3.374  -6.216
  588    HA   LEU  74           HA       LEU  74  -4.263  -2.106  -3.870
  589   1HB   LEU  74          1HB       LEU  74  -1.795  -3.177  -5.089
  590   2HB   LEU  74          2HB       LEU  74  -1.553  -1.988  -3.824
  591    HG   LEU  74           HG       LEU  74  -3.312  -4.417  -3.442
  592   1HD1  LEU  74          1HD1      LEU  74  -1.545  -5.705  -2.687
  593   2HD1  LEU  74          2HD1      LEU  74  -0.836  -4.875  -4.093
  594   3HD1  LEU  74          3HD1      LEU  74  -0.480  -4.300  -2.446
  595   1HD2  LEU  74          1HD2      LEU  74  -1.901  -3.262  -1.144
  596   2HD2  LEU  74          2HD2      LEU  74  -3.052  -2.147  -1.920
  597   3HD2  LEU  74          3HD2      LEU  74  -3.607  -3.733  -1.334
  598    H    PHE  75           H        PHE  75  -2.495  -0.866  -6.759
  599    HA   PHE  75           HA       PHE  75  -2.036   1.675  -5.581
  600   1HB   PHE  75          1HB       PHE  75  -0.889   0.341  -7.576
  601   2HB   PHE  75          2HB       PHE  75  -2.206   0.956  -8.555
  602    HD1  PHE  75           1HD      PHE  75  -0.024   2.496  -5.936
  603    HD2  PHE  75           2HD      PHE  75  -1.476   2.655  -9.920
  604    HE1  PHE  75           1HE      PHE  75   1.252   4.624  -6.316
  605    HE2  PHE  75           2HE      PHE  75  -0.200   4.783 -10.300
  606    HZ   PHE  75           HZ       PHE  75   1.149   5.742  -8.493
  607    H    GLN  76           H        GLN  76  -4.398   0.366  -7.999
  608    HA   GLN  76           HA       GLN  76  -5.612   2.742  -8.591
  609   1HB   GLN  76          1HB       GLN  76  -6.446  -0.147  -8.650
  610   2HB   GLN  76          2HB       GLN  76  -7.696   1.058  -8.880
  611   1HG   GLN  76          1HG       GLN  76  -5.676   2.021 -10.530
  612   2HG   GLN  76          2HG       GLN  76  -5.464   0.288 -10.681
  613   1HE2  GLN  76          1HE2      GLN  76  -6.825  -0.881 -11.868
  614   2HE2  GLN  76          2HE2      GLN  76  -8.246  -0.292 -12.664
  615    H    SER  77           H        SER  77  -5.673   0.876  -5.640
  616    HA   SER  77           HA       SER  77  -8.179   1.677  -4.718
  617   1HB   SER  77          1HB       SER  77  -7.007  -0.218  -3.725
  618   2HB   SER  77          2HB       SER  77  -5.655   0.794  -3.258
  619    HG   SER  77           HG       SER  77  -6.691   1.350  -1.473
  620    H    PHE  78           H        PHE  78  -4.890   2.757  -3.570
  621    HA   PHE  78           HA       PHE  78  -6.083   5.406  -3.141
  622   1HB   PHE  78          1HB       PHE  78  -4.976   3.553  -1.311
  623   2HB   PHE  78          2HB       PHE  78  -3.626   4.623  -1.633
  624    HD1  PHE  78           1HD      PHE  78  -6.530   4.139   0.309
  625    HD2  PHE  78           2HD      PHE  78  -4.126   7.181  -1.417
  626    HE1  PHE  78           1HE      PHE  78  -7.455   5.800   1.947
  627    HE2  PHE  78           2HE      PHE  78  -5.051   8.842   0.221
  628    HZ   PHE  78           HZ       PHE  78  -6.705   8.132   1.884
  629    H    GLU  79           H        GLU  79  -4.677   7.256  -3.488
  630    HA   GLU  79           HA       GLU  79  -2.191   6.632  -4.830
  631   1HB   GLU  79          1HB       GLU  79  -4.328   7.048  -6.408
  632   2HB   GLU  79          2HB       GLU  79  -3.938   8.728  -6.100
  633   1HG   GLU  79          1HG       GLU  79  -2.134   8.658  -7.482
  634   2HG   GLU  79          2HG       GLU  79  -1.506   7.219  -6.703
  635    H    THR  80           H        THR  80  -2.025   9.524  -5.736
  636    HA   THR  80           HA       THR  80  -1.081  10.564  -3.209
  637    HB   THR  80           HB       THR  80  -0.207  10.660  -5.841
  638    HG1  THR  80           1HG      THR  80   1.372  11.811  -4.722
  639   1HG2  THR  80          1HG2      THR  80  -1.150  13.472  -5.115
  640   2HG2  THR  80          2HG2      THR  80  -0.392  12.930  -6.632
  641   3HG2  THR  80          3HG2      THR  80  -2.060  12.443  -6.247
  642    H    GLY  81           H        GLY  81  -3.999  10.658  -5.043
  643   1HA   GLY  81          1HA       GLY  81  -5.680  11.799  -3.436
  644   2HA   GLY  81          2HA       GLY  81  -4.780  13.238  -3.871
  645    H    HIS  82           H        HIS  82  -7.183  13.688  -4.612
  646    HA   HIS  82           HA       HIS  82  -8.198  12.416  -6.851
  647   1HB   HIS  82          1HB       HIS  82  -8.685  14.914  -5.361
  648   2HB   HIS  82          2HB       HIS  82  -9.157  14.982  -7.047
  649    HD1  HIS  82           1HD      HIS  82 -11.685  14.910  -6.679
  650    HD2  HIS  82           2HD      HIS  82  -9.658  11.706  -4.883
  651    HE1  HIS  82           1HE      HIS  82 -13.481  13.271  -5.904
  652    H    CYS  83           H        CYS  83  -6.989  15.826  -6.959
  653    HA   CYS  83           HA       CYS  83  -5.891  16.931  -8.503
  654   1HB   CYS  83          1HB       CYS  83  -4.422  14.354  -8.374
  655   2HB   CYS  83          2HB       CYS  83  -4.107  15.332  -9.793
  656    HG   CYS  83           HG       CYS  83  -2.614  16.845  -8.766
  657    H    LEU  84           H        LEU  84  -8.467  15.902  -9.206
  658    HA   LEU  84           HA       LEU  84  -8.250  14.743 -11.833
  659   1HB   LEU  84          1HB       LEU  84 -10.368  15.286  -9.852
  660   2HB   LEU  84          2HB       LEU  84 -10.865  15.417 -11.527
  661    HG   LEU  84           HG       LEU  84 -11.203  13.171 -10.400
  662   1HD1  LEU  84          1HD1      LEU  84 -10.889  13.784 -12.976
  663   2HD1  LEU  84          2HD1      LEU  84  -9.492  12.696 -12.791
  664   3HD1  LEU  84          3HD1      LEU  84 -11.131  12.114 -12.410
  665   1HD2  LEU  84          1HD2      LEU  84  -8.444  13.474  -9.830
  666   2HD2  LEU  84          2HD2      LEU  84  -9.516  12.111  -9.429
  667   3HD2  LEU  84          3HD2      LEU  84  -8.603  12.106 -10.957
  668    H    ASN  85           H        ASN  85  -6.739  16.952 -11.999
  669    HA   ASN  85           HA       ASN  85  -7.811  18.325 -14.065
  670   1HB   ASN  85          1HB       ASN  85  -8.885  19.295 -11.560
  671   2HB   ASN  85          2HB       ASN  85  -7.803  20.529 -12.177
  672   1HD2  ASN  85          1HD2      ASN  85 -10.873  19.819 -12.041
  673   2HD2  ASN  85          2HD2      ASN  85 -11.476  20.356 -13.573
  674    H    GLU  86           H        GLU  86  -5.551  17.967 -14.645
  675    HA   GLU  86           HA       GLU  86  -3.869  20.065 -14.232
  676   1HB   GLU  86          1HB       GLU  86  -3.861  18.319 -11.955
  677   2HB   GLU  86          2HB       GLU  86  -2.330  18.097 -12.779
  678   1HG   GLU  86          1HG       GLU  86  -2.421  20.794 -12.891
  679   2HG   GLU  86          2HG       GLU  86  -3.455  20.579 -11.493
  680    H    THR  87           H        THR  87  -2.206  19.948 -15.756
  681    HA   THR  87           HA       THR  87  -1.866  17.312 -17.032
  682    HB   THR  87           HB       THR  87  -1.521  20.029 -18.375
  683    HG1  THR  87           1HG      THR  87  -3.751  20.058 -18.508
  684   1HG2  THR  87          1HG2      THR  87  -0.947  17.549 -19.346
  685   2HG2  THR  87          2HG2      THR  87  -2.696  17.585 -19.679
  686   3HG2  THR  87          3HG2      THR  87  -1.632  18.832 -20.372
  687    H    ASN  88           H        ASN  88  -0.332  17.500 -14.892
  688    HA   ASN  88           HA       ASN  88   2.242  17.749 -16.088
  689   1HB   ASN  88          1HB       ASN  88   1.887  20.071 -15.250
  690   2HB   ASN  88          2HB       ASN  88   1.472  19.456 -13.662
  691   1HD2  ASN  88          1HD2      ASN  88   3.130  20.632 -12.717
  692   2HD2  ASN  88          2HD2      ASN  88   4.796  20.167 -12.818
  693    H    VAL  89           H        VAL  89   1.011  15.428 -15.319
  694    HA   VAL  89           HA       VAL  89   2.027  14.873 -12.619
  695    HB   VAL  89           HB       VAL  89   0.125  13.053 -14.008
  696   1HG1  VAL  89          1HG1      VAL  89  -0.477  13.795 -11.267
  697   2HG1  VAL  89          2HG1      VAL  89  -0.087  12.200 -11.954
  698   3HG1  VAL  89          3HG1      VAL  89   1.221  13.291 -11.437
  699   1HG2  VAL  89          1HG2      VAL  89  -1.737  14.543 -12.914
  700   2HG2  VAL  89          2HG2      VAL  89  -0.538  15.845 -13.110
  701   3HG2  VAL  89          3HG2      VAL  89  -1.111  14.941 -14.532
  702    H    THR  90           H        THR  90   4.167  14.334 -13.046
  703    HA   THR  90           HA       THR  90   4.509  12.028 -14.848
  704    HB   THR  90           HB       THR  90   5.390  14.253 -15.746
  705    HG1  THR  90           1HG      THR  90   6.324  12.077 -16.189
  706   1HG2  THR  90          1HG2      THR  90   6.224  15.332 -13.706
  707   2HG2  THR  90          2HG2      THR  90   7.225  13.912 -13.318
  708   3HG2  THR  90          3HG2      THR  90   7.629  14.928 -14.722
  709    H    LYS  91           H        LYS  91   4.427  13.052 -11.678
  710    HA   LYS  91           HA       LYS  91   6.429  11.028 -10.949
  711   1HB   LYS  91          1HB       LYS  91   5.767  13.655  -9.597
  712   2HB   LYS  91          2HB       LYS  91   6.664  12.373  -8.809
  713   1HG   LYS  91          1HG       LYS  91   8.569  12.842  -9.972
  714   2HG   LYS  91          2HG       LYS  91   7.717  12.922 -11.501
  715   1HD   LYS  91          1HD       LYS  91   8.664  15.121 -11.039
  716   2HD   LYS  91          2HD       LYS  91   6.920  15.237 -10.913
  717   1HE   LYS  91          1HE       LYS  91   6.958  15.404  -8.556
  718   2HE   LYS  91          2HE       LYS  91   8.515  14.612  -8.419
  719   1HZ   LYS  91          1HZ       LYS  91   8.542  17.044  -8.092
  720   2HZ   LYS  91          2HZ       LYS  91   9.577  16.527  -9.245
  721   3HZ   LYS  91          3HZ       LYS  91   8.173  17.244  -9.670
  722    H    ASP  92           H        ASP  92   4.667   9.452 -11.199
  723    HA   ASP  92           HA       ASP  92   2.340   9.740  -9.664
  724   1HB   ASP  92          1HB       ASP  92   2.212   7.174 -10.113
  725   2HB   ASP  92          2HB       ASP  92   2.144   8.257 -11.489
  726    H    VAL  93           H        VAL  93   2.875  10.074  -7.428
  727    HA   VAL  93           HA       VAL  93   4.164   7.770  -6.146
  728    HB   VAL  93           HB       VAL  93   5.153   9.398  -4.537
  729   1HG1  VAL  93          1HG1      VAL  93   6.359   8.367  -6.528
  730   2HG1  VAL  93          2HG1      VAL  93   6.110   9.919  -7.362
  731   3HG1  VAL  93          3HG1      VAL  93   7.068   9.858  -5.863
  732   1HG2  VAL  93          1HG2      VAL  93   5.208  11.698  -6.259
  733   2HG2  VAL  93          2HG2      VAL  93   3.516  11.248  -5.937
  734   3HG2  VAL  93          3HG2      VAL  93   4.626  11.563  -4.582
  735    H    VAL  94           H        VAL  94   3.478   7.450  -3.873
  736    HA   VAL  94           HA       VAL  94   0.948   8.789  -3.261
  737    HB   VAL  94           HB       VAL  94   0.074   6.864  -4.135
  738   1HG1  VAL  94          1HG1      VAL  94   1.089   4.607  -3.912
  739   2HG1  VAL  94          2HG1      VAL  94   2.152   5.766  -4.745
  740   3HG1  VAL  94          3HG1      VAL  94   2.462   5.336  -3.045
  741   1HG2  VAL  94          1HG2      VAL  94  -0.712   7.069  -1.846
  742   2HG2  VAL  94          2HG2      VAL  94  -0.543   5.348  -2.267
  743   3HG2  VAL  94          3HG2      VAL  94   0.684   6.140  -1.250
  744    H    CYS  95           H        CYS  95   0.446   8.840  -0.969
  745    HA   CYS  95           HA       CYS  95   2.806   9.080   0.586
  746   1HB   CYS  95          1HB       CYS  95   0.621  10.473   0.717
  747   2HB   CYS  95          2HB       CYS  95  -0.003   9.158   1.693
  748    HG   CYS  95           HG       CYS  95   1.123  11.435   2.922
  749    H    LEU  96           H        LEU  96   3.795   7.029   0.833
  750    HA   LEU  96           HA       LEU  96   2.548   4.630   1.179
  751   1HB   LEU  96          1HB       LEU  96   4.617   3.829   2.056
  752   2HB   LEU  96          2HB       LEU  96   4.932   4.962   0.756
  753    HG   LEU  96           HG       LEU  96   5.210   5.508   3.724
  754   1HD1  LEU  96          1HD1      LEU  96   6.929   4.084   2.273
  755   2HD1  LEU  96          2HD1      LEU  96   7.489   5.710   1.814
  756   3HD1  LEU  96          3HD1      LEU  96   7.459   5.229   3.528
  757   1HD2  LEU  96          1HD2      LEU  96   4.458   7.534   2.707
  758   2HD2  LEU  96          2HD2      LEU  96   6.210   7.682   2.985
  759   3HD2  LEU  96          3HD2      LEU  96   5.593   7.346   1.349
  760    H    ASN  97           H        ASN  97   2.694   7.352   3.368
  761    HA   ASN  97           HA       ASN  97   2.393   5.951   5.748
  762   1HB   ASN  97          1HB       ASN  97   2.777   8.571   5.112
  763   2HB   ASN  97          2HB       ASN  97   1.049   8.630   5.395
  764   1HD2  ASN  97          1HD2      ASN  97   0.892   9.635   7.278
  765   2HD2  ASN  97          2HD2      ASN  97   1.603   9.128   8.775
  766    H    ASP  98           H        ASP  98   0.039   7.562   3.485
  767    HA   ASP  98           HA       ASP  98  -2.241   7.063   4.878
  768   1HB   ASP  98          1HB       ASP  98  -1.934   8.416   2.730
  769   2HB   ASP  98          2HB       ASP  98  -1.938   6.904   1.844
  770    H    VAL  99           H        VAL  99  -0.187   4.934   2.899
  771    HA   VAL  99           HA       VAL  99  -2.136   2.881   2.576
  772    HB   VAL  99           HB       VAL  99   0.831   3.131   2.139
  773   1HG1  VAL  99          1HG1      VAL  99   0.420   0.832   2.901
  774   2HG1  VAL  99          2HG1      VAL  99  -0.853   0.646   1.670
  775   3HG1  VAL  99          3HG1      VAL  99   0.841   0.875   1.172
  776   1HG2  VAL  99          1HG2      VAL  99  -1.558   3.555   0.565
  777   2HG2  VAL  99          2HG2      VAL  99   0.140   3.915   0.168
  778   3HG2  VAL  99          3HG2      VAL  99  -0.535   2.306  -0.185
  779    H    SER 100           H        SER 100   0.478   3.670   4.903
  780    HA   SER 100           HA       SER 100   0.550   1.235   6.179
  781   1HB   SER 100          1HB       SER 100   2.174   3.127   6.484
  782   2HB   SER 100          2HB       SER 100   0.961   4.002   7.397
  783    HG   SER 100           HG       SER 100   1.217   1.467   8.422
  784    H    CYS 101           H        CYS 101  -1.828   3.838   6.232
  785    HA   CYS 101           HA       CYS 101  -2.989   3.076   8.717
  786   1HB   CYS 101          1HB       CYS 101  -3.066   5.392   7.606
  787   2HB   CYS 101          2HB       CYS 101  -4.315   4.739   6.565
  788    HG   CYS 101           HG       CYS 101  -4.533   4.024   9.728
  789    H    TYR 102           H        TYR 102  -3.947   2.842   5.209
  790    HA   TYR 102           HA       TYR 102  -6.234   1.349   5.551
  791   1HB   TYR 102          1HB       TYR 102  -4.939   2.480   3.491
  792   2HB   TYR 102          2HB       TYR 102  -4.149   0.922   3.344
  793    HD1  TYR 102           1HD      TYR 102  -6.813   2.848   2.178
  794    HD2  TYR 102           2HD      TYR 102  -5.886  -1.156   3.365
  795    HE1  TYR 102           1HE      TYR 102  -8.766   1.980   0.800
  796    HE2  TYR 102           2HE      TYR 102  -7.842  -2.011   1.983
  797    HH   TYR 102           HH       TYR 102  -9.968  -1.142   1.147
  798    H    PHE 103           H        PHE 103  -2.796   0.285   5.345
  799    HA   PHE 103           HA       PHE 103  -3.464  -2.469   5.267
  800   1HB   PHE 103          1HB       PHE 103  -1.022  -0.712   5.800
  801   2HB   PHE 103          2HB       PHE 103  -0.894  -2.439   6.066
  802    HD1  PHE 103           1HD      PHE 103  -3.096  -1.337   3.405
  803    HD2  PHE 103           2HD      PHE 103   0.884  -2.472   4.343
  804    HE1  PHE 103           1HE      PHE 103  -2.618  -1.678   0.965
  805    HE2  PHE 103           2HE      PHE 103   1.362  -2.813   1.903
  806    HZ   PHE 103           HZ       PHE 103  -0.395  -2.412   0.243
  807    H    SER 104           H        SER 104  -2.668  -0.094   7.842
  808    HA   SER 104           HA       SER 104  -2.226  -1.912   9.861
  809   1HB   SER 104          1HB       SER 104  -1.681   0.466  10.079
  810   2HB   SER 104          2HB       SER 104  -3.371   0.912   9.944
  811    HG   SER 104           HG       SER 104  -3.651  -0.523  11.942
  812    H    LEU 105           H        LEU 105  -5.237  -0.558   8.470
  813    HA   LEU 105           HA       LEU 105  -6.937  -1.493  10.524
  814   1HB   LEU 105          1HB       LEU 105  -7.138  -0.103   7.985
  815   2HB   LEU 105          2HB       LEU 105  -8.426  -1.276   8.175
  816    HG   LEU 105           HG       LEU 105  -9.088   0.949   8.949
  817   1HD1  LEU 105          1HD1      LEU 105  -9.672  -1.392  10.130
  818   2HD1  LEU 105          2HD1      LEU 105  -8.957  -0.535  11.517
  819   3HD1  LEU 105          3HD1      LEU 105 -10.348   0.168  10.657
  820   1HD2  LEU 105          1HD2      LEU 105  -7.315   0.828  11.340
  821   2HD2  LEU 105          2HD2      LEU 105  -6.591   1.341   9.796
  822   3HD2  LEU 105          3HD2      LEU 105  -7.980   2.229  10.466
  823    H    LEU 106           H        LEU 106  -5.855  -2.809   7.342
  824    HA   LEU 106           HA       LEU 106  -7.478  -4.989   7.179
  825   1HB   LEU 106          1HB       LEU 106  -4.848  -4.188   6.169
  826   2HB   LEU 106          2HB       LEU 106  -5.050  -5.925   6.280
  827    HG   LEU 106           HG       LEU 106  -7.242  -5.603   4.985
  828   1HD1  LEU 106          1HD1      LEU 106  -7.004  -3.005   5.433
  829   2HD1  LEU 106          2HD1      LEU 106  -6.077  -3.070   3.915
  830   3HD1  LEU 106          3HD1      LEU 106  -7.764  -3.635   3.952
  831   1HD2  LEU 106          1HD2      LEU 106  -4.519  -5.835   4.136
  832   2HD2  LEU 106          2HD2      LEU 106  -5.991  -6.507   3.395
  833   3HD2  LEU 106          3HD2      LEU 106  -5.422  -4.885   2.932
  834    H    GLU 107           H        GLU 107  -4.158  -4.994   8.671
  835    HA   GLU 107           HA       GLU 107  -4.594  -7.510   9.821
  836   1HB   GLU 107          1HB       GLU 107  -2.448  -7.118  10.958
  837   2HB   GLU 107          2HB       GLU 107  -2.342  -6.627   9.279
  838   1HG   GLU 107          1HG       GLU 107  -2.929  -4.238  10.082
  839   2HG   GLU 107          2HG       GLU 107  -2.669  -4.822  11.714
  840    H    GLY 108           H        GLY 108  -4.777  -4.120  11.050
  841   1HA   GLY 108          1HA       GLY 108  -5.036  -4.389  13.708
  842   2HA   GLY 108          2HA       GLY 108  -6.019  -3.293  12.757
  843    H    GLY 109           H        GLY 109  -7.495  -5.308  11.233
  844   1HA   GLY 109          1HA       GLY 109  -9.353  -6.125  13.342
  845   2HA   GLY 109          2HA       GLY 109  -9.676  -6.009  11.624
  846    H    ARG 110           H        ARG 110  -7.033  -7.681  13.478
  847    HA   ARG 110           HA       ARG 110  -7.506  -9.990  11.846
  848   1HB   ARG 110          1HB       ARG 110  -5.424 -10.859  12.896
  849   2HB   ARG 110          2HB       ARG 110  -5.175  -9.241  12.268
  850   1HG   ARG 110          1HG       ARG 110  -4.512  -8.566  14.326
  851   2HG   ARG 110          2HG       ARG 110  -6.122  -8.893  14.936
  852   1HD   ARG 110          1HD       ARG 110  -5.535 -11.174  15.534
  853   2HD   ARG 110          2HD       ARG 110  -4.022 -11.087  14.653
  854    HE   ARG 110           HE       ARG 110  -3.056  -9.865  16.429
  855   1HH1  ARG 110          2HH2      ARG 110  -6.530 -10.166  16.905
  856   2HH1  ARG 110          1HH2      ARG 110  -6.485  -9.586  18.537
  857   1HH2  ARG 110          2HH1      ARG 110  -2.997  -9.101  18.582
  858   2HH2  ARG 110          1HH1      ARG 110  -4.462  -8.976  19.497
  859    HA   PRO 111           HA       PRO 111  -9.662 -12.121  14.984
  860   1HB   PRO 111          1HB       PRO 111  -9.303 -14.718  14.210
  861   2HB   PRO 111          2HB       PRO 111 -10.492 -13.656  13.481
  862   1HG   PRO 111          1HG       PRO 111  -7.897 -14.558  12.391
  863   2HG   PRO 111          2HG       PRO 111  -9.264 -13.866  11.541
  864   1HD   PRO 111          1HD       PRO 111  -6.820 -12.533  12.233
  865   2HD   PRO 111          2HD       PRO 111  -8.232 -11.812  11.487
  866    H    GLU 112           H        GLU 112  -9.579 -13.516  16.873
  867    HA   GLU 112           HA       GLU 112  -6.829 -13.510  17.785
  868   1HB   GLU 112          1HB       GLU 112  -9.522 -13.480  19.149
  869   2HB   GLU 112          2HB       GLU 112  -8.136 -14.083  20.036
  870   1HG   GLU 112          1HG       GLU 112  -7.202 -12.001  20.250
  871   2HG   GLU 112          2HG       GLU 112  -7.578 -11.553  18.598
  872    H    ASP 113           H        ASP 113  -9.301 -15.614  16.588
  873    HA   ASP 113           HA       ASP 113  -9.623 -17.779  16.641
  874   1HB   ASP 113          1HB       ASP 113  -7.630 -17.529  15.144
  875   2HB   ASP 113          2HB       ASP 113  -6.570 -17.769  16.519
  876    H    LYS 114           H        LYS 114  -9.831 -16.923  19.253
  877    HA   LYS 114           HA       LYS 114  -8.044 -17.830  21.119
  878   1HB   LYS 114          1HB       LYS 114 -11.058 -17.566  21.227
  879   2HB   LYS 114          2HB       LYS 114 -10.076 -17.931  22.631
  880   1HG   LYS 114          1HG       LYS 114  -8.728 -15.833  22.177
  881   2HG   LYS 114          2HG       LYS 114  -9.819 -15.455  20.859
  882   1HD   LYS 114          1HD       LYS 114 -10.969 -16.009  23.605
  883   2HD   LYS 114          2HD       LYS 114 -10.238 -14.449  23.289
  884   1HE   LYS 114          1HE       LYS 114 -11.749 -14.388  21.150
  885   2HE   LYS 114          2HE       LYS 114 -12.630 -15.708  21.894
  886   1HZ   LYS 114          1HZ       LYS 114 -12.454 -13.982  23.903
  887   2HZ   LYS 114          2HZ       LYS 114 -12.537 -12.948  22.641
  888   3HZ   LYS 114          3HZ       LYS 114 -13.719 -14.051  22.872
  889    H    LEU 115           H        LEU 115  -8.884 -19.698  22.808
  890    HA   LEU 115           HA       LEU 115  -8.195 -22.075  21.626
  891   1HB   LEU 115          1HB       LEU 115  -9.998 -22.038  24.008
  892   2HB   LEU 115          2HB       LEU 115  -8.613 -23.056  23.668
  893    HG   LEU 115           HG       LEU 115  -7.458 -20.558  23.821
  894   1HD1  LEU 115          1HD1      LEU 115  -8.581 -19.130  25.102
  895   2HD1  LEU 115          2HD1      LEU 115  -9.998 -20.190  24.912
  896   3HD1  LEU 115          3HD1      LEU 115  -8.926 -20.382  26.319
  897   1HD2  LEU 115          1HD2      LEU 115  -6.374 -22.359  24.818
  898   2HD2  LEU 115          2HD2      LEU 115  -6.847 -21.345  26.202
  899   3HD2  LEU 115          3HD2      LEU 115  -7.790 -22.800  25.802
  900    H    GLU 116           H        GLU 116  -9.505 -24.071  21.288
  901    HA   GLU 116           HA       GLU 116 -12.291 -23.605  20.798
  902   1HB   GLU 116          1HB       GLU 116 -10.956 -24.837  18.443
  903   2HB   GLU 116          2HB       GLU 116 -12.307 -23.723  18.506
  904   1HG   GLU 116          1HG       GLU 116 -10.762 -21.835  18.981
  905   2HG   GLU 116          2HG       GLU 116  -9.397 -22.934  19.002
  906    H    TRP 117           H        TRP 117 -13.463 -25.458  21.229
  907    HA   TRP 117           HA       TRP 117 -12.049 -27.704  22.230
  908   1HB   TRP 117          1HB       TRP 117 -14.984 -27.238  21.678
  909   2HB   TRP 117          2HB       TRP 117 -14.340 -28.667  22.463
  910    HD1  TRP 117           HD       TRP 117 -13.674 -24.861  23.147
  911    HE1  TRP 117           1HE      TRP 117 -13.955 -24.331  25.717
  912    HE3  TRP 117           3HE      TRP 117 -14.965 -29.585  24.517
  913    HZ2  TRP 117           2HZ      TRP 117 -14.670 -25.912  27.984
  914    HZ3  TRP 117           3HZ      TRP 117 -15.438 -30.006  26.928
  915    HH2  TRP 117           HH       TRP 117 -15.308 -28.263  28.636
  916    H    SER 118           H        SER 118 -14.767 -28.748  20.412
  917    HA   SER 118           HA       SER 118 -14.895 -30.259  18.833
  918   1HB   SER 118          1HB       SER 118 -15.094 -28.493  17.313
  919   2HB   SER 118          2HB       SER 118 -13.455 -27.932  17.578
  920    HG   SER 118           HG       SER 118 -14.155 -30.390  16.210
  Start of MODEL   13
    1   1H    MET   1           H        MET   1  -7.086  11.490   1.767
    2    HA   MET   1           HA       MET   1  -7.237   8.904   2.318
    3   1HB   MET   1          1HB       MET   1  -6.980   8.714   4.814
    4   2HB   MET   1          2HB       MET   1  -5.467   9.155   4.048
    5   1HG   MET   1          1HG       MET   1  -5.867  11.555   4.603
    6   2HG   MET   1          2HG       MET   1  -7.408  11.142   5.329
    7   1HE   MET   1          1HE       MET   1  -3.795  10.425   5.098
    8   2HE   MET   1          2HE       MET   1  -3.203  10.275   6.770
    9   3HE   MET   1          3HE       MET   1  -3.912   8.865   5.947
   10    H    ALA   2           H        ALA   2  -9.071   8.428   4.157
   11    HA   ALA   2           HA       ALA   2 -11.200   8.721   4.681
   12   1HB   ALA   2          1HB       ALA   2 -11.550  11.479   5.031
   13   2HB   ALA   2          2HB       ALA   2 -11.059  10.306   6.276
   14   3HB   ALA   2          3HB       ALA   2  -9.823  11.208   5.367
   15    H    LYS   3           H        LYS   3 -10.607   8.524   1.913
   16    HA   LYS   3           HA       LYS   3 -12.618  10.355   0.798
   17   1HB   LYS   3          1HB       LYS   3 -10.160  10.559   0.031
   18   2HB   LYS   3          2HB       LYS   3 -10.421   9.039  -0.801
   19   1HG   LYS   3          1HG       LYS   3 -11.584  10.059  -2.464
   20   2HG   LYS   3          2HG       LYS   3 -12.661  10.834  -1.319
   21   1HD   LYS   3          1HD       LYS   3 -10.749  12.528  -0.884
   22   2HD   LYS   3          2HD       LYS   3  -9.954  11.844  -2.287
   23   1HE   LYS   3          1HE       LYS   3 -11.284  13.024  -3.701
   24   2HE   LYS   3          2HE       LYS   3 -12.735  12.400  -2.942
   25   1HZ   LYS   3          1HZ       LYS   3 -12.334  14.860  -2.810
   26   2HZ   LYS   3          2HZ       LYS   3 -12.723  14.122  -1.406
   27   3HZ   LYS   3          3HZ       LYS   3 -11.174  14.545  -1.704
   28    H    GLU   4           H        GLU   4 -12.026   8.318  -1.644
   29    HA   GLU   4           HA       GLU   4 -12.991   5.876  -0.887
   30   1HB   GLU   4          1HB       GLU   4 -15.036   7.631  -0.485
   31   2HB   GLU   4          2HB       GLU   4 -15.324   7.244  -2.170
   32   1HG   GLU   4          1HG       GLU   4 -16.187   5.222  -1.615
   33   2HG   GLU   4          2HG       GLU   4 -14.724   4.787  -0.753
   34    H    ARG   5           H        ARG   5 -14.893   5.668  -3.273
   35    HA   ARG   5           HA       ARG   5 -14.787   5.193  -5.377
   36   1HB   ARG   5          1HB       ARG   5 -13.168   7.699  -5.214
   37   2HB   ARG   5          2HB       ARG   5 -12.911   6.763  -6.673
   38   1HG   ARG   5          1HG       ARG   5 -14.804   7.710  -7.495
   39   2HG   ARG   5          2HG       ARG   5 -15.702   6.715  -6.367
   40   1HD   ARG   5          1HD       ARG   5 -14.662   8.992  -4.915
   41   2HD   ARG   5          2HD       ARG   5 -15.427   9.584  -6.376
   42    HE   ARG   5           HE       ARG   5 -17.285   7.782  -5.461
   43   1HH1  ARG   5          2HH2      ARG   5 -15.570  10.422  -3.888
   44   2HH1  ARG   5          1HH2      ARG   5 -16.846  10.750  -2.763
   45   1HH2  ARG   5          2HH1      ARG   5 -18.969   8.215  -3.977
   46   2HH2  ARG   5          1HH1      ARG   5 -18.792   9.486  -2.814
   47    H    GLY   6           H        GLY   6 -13.389   4.182  -7.155
   48   1HA   GLY   6          1HA       GLY   6 -11.861   2.645  -7.752
   49   2HA   GLY   6          2HA       GLY   6 -10.687   3.687  -6.973
   50    H    LEU   7           H        LEU   7 -12.576   0.735  -6.735
   51    HA   LEU   7           HA       LEU   7 -11.497   0.265  -4.050
   52   1HB   LEU   7          1HB       LEU   7 -13.700  -1.226  -5.478
   53   2HB   LEU   7          2HB       LEU   7 -13.208  -1.407  -3.805
   54    HG   LEU   7           HG       LEU   7 -15.277  -0.158  -3.951
   55   1HD1  LEU   7          1HD1      LEU   7 -13.186   0.491  -2.388
   56   2HD1  LEU   7          2HD1      LEU   7 -13.431   2.046  -3.219
   57   3HD1  LEU   7          3HD1      LEU   7 -14.767   1.305  -2.306
   58   1HD2  LEU   7          1HD2      LEU   7 -13.985   2.173  -5.301
   59   2HD2  LEU   7          2HD2      LEU   7 -14.522   0.800  -6.298
   60   3HD2  LEU   7          3HD2      LEU   7 -15.690   1.663  -5.268
   61    H    ILE   8           H        ILE   8 -11.505  -2.518  -4.005
   62    HA   ILE   8           HA       ILE   8  -9.752  -3.248  -6.234
   63    HB   ILE   8           HB       ILE   8  -8.183  -4.278  -4.722
   64   1HG1  ILE   8          1HG1      ILE   8  -9.933  -3.204  -2.491
   65   2HG1  ILE   8          2HG1      ILE   8  -9.694  -4.889  -2.906
   66   1HG2  ILE   8          1HG2      ILE   8  -7.043  -2.375  -4.653
   67   2HG2  ILE   8          2HG2      ILE   8  -8.538  -1.522  -5.107
   68   3HG2  ILE   8          3HG2      ILE   8  -8.110  -1.715  -3.390
   69   1HD1  ILE   8          1HD1      ILE   8  -7.087  -4.134  -2.622
   70   2HD1  ILE   8          2HD1      ILE   8  -7.862  -3.003  -1.488
   71   3HD1  ILE   8          3HD1      ILE   8  -8.074  -4.757  -1.278
   72    H    SER   9           H        SER   9 -12.669  -3.694  -5.122
   73    HA   SER   9           HA       SER   9 -14.104  -5.320  -4.975
   74   1HB   SER   9          1HB       SER   9 -12.312  -6.019  -7.145
   75   2HB   SER   9          2HB       SER   9 -12.879  -7.492  -6.383
   76    HG   SER   9           HG       SER   9 -15.080  -6.107  -6.542
   77    HA   PRO  10           HA       PRO  10 -12.985  -8.292  -1.991
   78   1HB   PRO  10          1HB       PRO  10 -14.575 -10.464  -2.463
   79   2HB   PRO  10          2HB       PRO  10 -15.148  -9.012  -1.667
   80   1HG   PRO  10          1HG       PRO  10 -15.655  -9.935  -4.429
   81   2HG   PRO  10          2HG       PRO  10 -16.535  -8.745  -3.491
   82   1HD   PRO  10          1HD       PRO  10 -14.659  -8.225  -5.597
   83   2HD   PRO  10          2HD       PRO  10 -15.451  -7.036  -4.581
   84    H    SER  11           H        SER  11 -12.192  -8.846  -5.141
   85    HA   SER  11           HA       SER  11 -11.065 -11.416  -4.733
   86   1HB   SER  11          1HB       SER  11 -11.624  -9.683  -6.946
   87   2HB   SER  11          2HB       SER  11  -9.906 -10.028  -6.996
   88    HG   SER  11           HG       SER  11 -11.892 -12.103  -6.669
   89    H    ASP  12           H        ASP  12  -9.892  -8.003  -4.885
   90    HA   ASP  12           HA       ASP  12  -7.191  -8.746  -4.615
   91   1HB   ASP  12          1HB       ASP  12  -8.267  -6.534  -5.524
   92   2HB   ASP  12          2HB       ASP  12  -8.375  -6.053  -3.842
   93    H    PHE  13           H        PHE  13  -9.845  -7.598  -2.445
   94    HA   PHE  13           HA       PHE  13  -8.290  -7.260  -0.151
   95   1HB   PHE  13          1HB       PHE  13 -10.816  -6.682  -0.890
   96   2HB   PHE  13          2HB       PHE  13 -11.178  -8.251  -0.199
   97    HD1  PHE  13           1HD      PHE  13 -10.212  -4.812   0.516
   98    HD2  PHE  13           2HD      PHE  13 -10.938  -8.635   2.210
   99    HE1  PHE  13           1HE      PHE  13 -10.348  -3.776   2.798
  100    HE2  PHE  13           2HE      PHE  13 -11.074  -7.598   4.492
  101    HZ   PHE  13           HZ       PHE  13 -10.777  -5.181   4.759
  102    H    ALA  14           H        ALA  14 -10.160 -10.083  -1.425
  103    HA   ALA  14           HA       ALA  14  -9.816 -11.726   0.792
  104   1HB   ALA  14          1HB       ALA  14 -10.227 -13.555  -0.925
  105   2HB   ALA  14          2HB       ALA  14 -11.441 -12.254  -0.895
  106   3HB   ALA  14          3HB       ALA  14 -10.200 -12.285  -2.171
  107    H    GLN  15           H        GLN  15  -7.884 -11.488  -2.278
  108    HA   GLN  15           HA       GLN  15  -6.043 -13.383  -1.680
  109   1HB   GLN  15          1HB       GLN  15  -6.327 -12.033  -3.834
  110   2HB   GLN  15          2HB       GLN  15  -5.405 -10.750  -3.075
  111   1HG   GLN  15          1HG       GLN  15  -4.343 -13.600  -3.260
  112   2HG   GLN  15          2HG       GLN  15  -4.095 -12.436  -4.546
  113   1HE2  GLN  15          1HE2      GLN  15  -1.933 -13.470  -3.410
  114   2HE2  GLN  15          2HE2      GLN  15  -1.110 -12.338  -2.388
  115    H    LEU  16           H        LEU  16  -5.881  -9.835  -0.910
  116    HA   LEU  16           HA       LEU  16  -3.434  -9.955   0.415
  117   1HB   LEU  16          1HB       LEU  16  -4.890  -7.974  -0.461
  118   2HB   LEU  16          2HB       LEU  16  -5.596  -8.011   1.143
  119    HG   LEU  16           HG       LEU  16  -3.452  -7.569   2.173
  120   1HD1  LEU  16          1HD1      LEU  16  -1.901  -8.762   0.860
  121   2HD1  LEU  16          2HD1      LEU  16  -2.349  -7.882  -0.621
  122   3HD1  LEU  16          3HD1      LEU  16  -1.464  -7.046   0.677
  123   1HD2  LEU  16          1HD2      LEU  16  -3.189  -5.500   0.140
  124   2HD2  LEU  16          2HD2      LEU  16  -4.883  -5.777   0.609
  125   3HD2  LEU  16          3HD2      LEU  16  -3.671  -5.377   1.849
  126    H    GLN  17           H        GLN  17  -6.810 -10.496   1.519
  127    HA   GLN  17           HA       GLN  17  -6.199 -10.572   4.224
  128   1HB   GLN  17          1HB       GLN  17  -8.483 -11.072   2.511
  129   2HB   GLN  17          2HB       GLN  17  -8.384 -12.347   3.708
  130   1HG   GLN  17          1HG       GLN  17  -8.060 -10.463   5.465
  131   2HG   GLN  17          2HG       GLN  17  -8.541  -9.345   4.205
  132   1HE2  GLN  17          1HE2      GLN  17  -9.530 -12.447   5.648
  133   2HE2  GLN  17          2HE2      GLN  17 -11.237 -12.152   5.657
  134    H    LYS  18           H        LYS  18  -5.890 -12.955   1.605
  135    HA   LYS  18           HA       LYS  18  -5.481 -15.136   3.439
  136   1HB   LYS  18          1HB       LYS  18  -6.624 -15.508   1.312
  137   2HB   LYS  18          2HB       LYS  18  -5.227 -14.937   0.423
  138   1HG   LYS  18          1HG       LYS  18  -3.968 -16.826   1.867
  139   2HG   LYS  18          2HG       LYS  18  -5.579 -17.508   1.963
  140   1HD   LYS  18          1HD       LYS  18  -5.721 -17.311  -0.584
  141   2HD   LYS  18          2HD       LYS  18  -4.032 -16.845  -0.584
  142   1HE   LYS  18          1HE       LYS  18  -3.846 -19.103   0.930
  143   2HE   LYS  18          2HE       LYS  18  -5.267 -19.521  -0.006
  144   1HZ   LYS  18          1HZ       LYS  18  -2.976 -18.424  -1.411
  145   2HZ   LYS  18          2HZ       LYS  18  -2.903 -19.976  -0.910
  146   3HZ   LYS  18          3HZ       LYS  18  -4.088 -19.502  -1.928
  147    H    TYR  19           H        TYR  19  -3.518 -13.061   1.225
  148    HA   TYR  19           HA       TYR  19  -1.083 -14.360   1.812
  149   1HB   TYR  19          1HB       TYR  19  -2.219 -12.187   0.250
  150   2HB   TYR  19          2HB       TYR  19  -0.879 -11.508   1.151
  151    HD1  TYR  19           1HD      TYR  19   0.878 -11.206  -0.347
  152    HD2  TYR  19           2HD      TYR  19  -1.300 -14.888  -0.423
  153    HE1  TYR  19           1HE      TYR  19   2.501 -12.139  -2.067
  154    HE2  TYR  19           2HE      TYR  19   0.330 -15.808  -2.143
  155    HH   TYR  19           HH       TYR  19   1.980 -15.346  -3.483
  156    H    MET  20           H        MET  20  -2.478 -11.193   2.936
  157    HA   MET  20           HA       MET  20  -0.437 -10.524   4.605
  158   1HB   MET  20          1HB       MET  20  -2.016  -8.961   5.559
  159   2HB   MET  20          2HB       MET  20  -2.567  -9.207   3.914
  160   1HG   MET  20          1HG       MET  20  -4.591  -9.585   4.958
  161   2HG   MET  20          2HG       MET  20  -3.960 -11.213   5.111
  162   1HE   MET  20          1HE       MET  20  -3.863  -7.762   6.451
  163   2HE   MET  20          2HE       MET  20  -4.100  -7.897   8.210
  164   3HE   MET  20          3HE       MET  20  -2.476  -8.106   7.512
  165    H    GLU  21           H        GLU  21  -2.950 -12.975   5.015
  166    HA   GLU  21           HA       GLU  21  -2.870 -13.129   7.787
  167   1HB   GLU  21          1HB       GLU  21  -3.931 -14.722   5.538
  168   2HB   GLU  21          2HB       GLU  21  -3.471 -15.711   6.908
  169   1HG   GLU  21          1HG       GLU  21  -4.895 -13.296   7.783
  170   2HG   GLU  21          2HG       GLU  21  -5.850 -14.206   6.630
  171    H    TYR  22           H        TYR  22  -1.163 -15.073   5.232
  172    HA   TYR  22           HA       TYR  22   0.233 -16.789   6.798
  173   1HB   TYR  22          1HB       TYR  22   0.225 -15.685   4.145
  174   2HB   TYR  22          2HB       TYR  22   1.875 -15.483   4.701
  175    HD1  TYR  22           1HD      TYR  22   3.389 -17.285   4.637
  176    HD2  TYR  22           2HD      TYR  22  -0.805 -18.053   4.289
  177    HE1  TYR  22           1HE      TYR  22   3.874 -19.713   4.058
  178    HE2  TYR  22           2HE      TYR  22  -0.306 -20.478   3.712
  179    HH   TYR  22           HH       TYR  22   2.252 -22.000   4.389
  180    H    SER  23           H        SER  23   1.127 -13.374   5.983
  181    HA   SER  23           HA       SER  23   3.522 -13.551   7.470
  182   1HB   SER  23          1HB       SER  23   2.498 -11.834   5.541
  183   2HB   SER  23          2HB       SER  23   2.414 -10.845   6.985
  184    HG   SER  23           HG       SER  23   4.804 -11.979   7.134
  185    H    THR  24           H        THR  24   3.993 -12.606   9.545
  186    HA   THR  24           HA       THR  24   1.628 -11.735  11.063
  187    HB   THR  24           HB       THR  24   2.545 -13.089  12.975
  188    HG1  THR  24           1HG      THR  24   4.571 -13.936  12.638
  189   1HG2  THR  24          1HG2      THR  24   2.377 -14.821  10.458
  190   2HG2  THR  24          2HG2      THR  24   2.033 -15.319  12.132
  191   3HG2  THR  24          3HG2      THR  24   0.940 -14.190  11.297
  192    H    LYS  25           H        LYS  25   4.225 -10.586   9.620
  193    HA   LYS  25           HA       LYS  25   5.555  -9.366  11.849
  194   1HB   LYS  25          1HB       LYS  25   5.833  -9.304   8.861
  195   2HB   LYS  25          2HB       LYS  25   6.583  -8.040   9.814
  196   1HG   LYS  25          1HG       LYS  25   7.823  -9.706  11.143
  197   2HG   LYS  25          2HG       LYS  25   6.985 -11.021  10.343
  198   1HD   LYS  25          1HD       LYS  25   8.773 -11.033   8.920
  199   2HD   LYS  25          2HD       LYS  25   7.987  -9.662   8.163
  200   1HE   LYS  25          1HE       LYS  25  10.244  -8.959   8.597
  201   2HE   LYS  25          2HE       LYS  25   9.257  -8.148   9.797
  202   1HZ   LYS  25          1HZ       LYS  25   9.945  -9.622  11.426
  203   2HZ   LYS  25          2HZ       LYS  25  10.509 -10.730  10.367
  204   3HZ   LYS  25          3HZ       LYS  25  11.315  -9.327  10.588
  205    H    LYS  26           H        LYS  26   5.908  -6.765  11.380
  206    HA   LYS  26           HA       LYS  26   3.168  -5.726  11.467
  207   1HB   LYS  26          1HB       LYS  26   5.740  -4.779  12.753
  208   2HB   LYS  26          2HB       LYS  26   4.286  -3.803  12.698
  209   1HG   LYS  26          1HG       LYS  26   3.743  -6.558  13.610
  210   2HG   LYS  26          2HG       LYS  26   4.906  -5.739  14.634
  211   1HD   LYS  26          1HD       LYS  26   3.318  -4.365  15.515
  212   2HD   LYS  26          2HD       LYS  26   2.682  -3.955  13.935
  213   1HE   LYS  26          1HE       LYS  26   1.182  -5.800  13.910
  214   2HE   LYS  26          2HE       LYS  26   2.090  -6.683  15.121
  215   1HZ   LYS  26          1HZ       LYS  26  -0.049  -5.381  15.734
  216   2HZ   LYS  26          2HZ       LYS  26   1.202  -5.451  16.782
  217   3HZ   LYS  26          3HZ       LYS  26   0.973  -4.115  15.872
  218    H    VAL  27           H        VAL  27   2.578  -3.914  10.221
  219    HA   VAL  27           HA       VAL  27   4.029  -3.673   7.787
  220    HB   VAL  27           HB       VAL  27   1.562  -3.608   8.015
  221   1HG1  VAL  27          1HG1      VAL  27   1.361  -0.784   8.692
  222   2HG1  VAL  27          2HG1      VAL  27   0.482  -2.182   9.357
  223   3HG1  VAL  27          3HG1      VAL  27   2.069  -1.729  10.023
  224   1HG2  VAL  27          1HG2      VAL  27   1.419  -1.295   6.641
  225   2HG2  VAL  27          2HG2      VAL  27   3.178  -1.559   6.585
  226   3HG2  VAL  27          3HG2      VAL  27   2.071  -2.800   5.950
  227    H    SER  28           H        SER  28   3.916  -1.969  10.885
  228    HA   SER  28           HA       SER  28   4.992   0.432   9.932
  229   1HB   SER  28          1HB       SER  28   5.445   0.898  12.336
  230   2HB   SER  28          2HB       SER  28   3.813   0.317  12.073
  231    HG   SER  28           HG       SER  28   4.220  -1.333  13.365
  232    H    ASP  29           H        ASP  29   6.316  -2.736  10.640
  233    HA   ASP  29           HA       ASP  29   8.923  -1.890  11.230
  234   1HB   ASP  29          1HB       ASP  29   7.497  -4.433  10.655
  235   2HB   ASP  29          2HB       ASP  29   9.176  -4.446  10.153
  236    H    VAL  30           H        VAL  30   7.124  -2.931   8.275
  237    HA   VAL  30           HA       VAL  30   9.432  -2.847   6.600
  238    HB   VAL  30           HB       VAL  30   6.463  -3.025   6.074
  239   1HG1  VAL  30          1HG1      VAL  30   7.704  -1.963   4.176
  240   2HG1  VAL  30          2HG1      VAL  30   8.703  -3.432   4.068
  241   3HG1  VAL  30          3HG1      VAL  30   6.951  -3.523   3.768
  242   1HG2  VAL  30          1HG2      VAL  30   6.710  -5.186   6.557
  243   2HG2  VAL  30          2HG2      VAL  30   7.909  -5.338   5.250
  244   3HG2  VAL  30          3HG2      VAL  30   8.437  -4.930   6.901
  245    H    LEU  31           H        LEU  31   7.037  -0.560   7.803
  246    HA   LEU  31           HA       LEU  31   7.269   1.336   5.744
  247   1HB   LEU  31          1HB       LEU  31   5.786   0.989   8.070
  248   2HB   LEU  31          2HB       LEU  31   6.736   2.427   8.389
  249    HG   LEU  31           HG       LEU  31   5.800   2.911   5.839
  250   1HD1  LEU  31          1HD1      LEU  31   3.568   2.283   5.606
  251   2HD1  LEU  31          2HD1      LEU  31   4.359   0.808   6.212
  252   3HD1  LEU  31          3HD1      LEU  31   3.411   1.829   7.320
  253   1HD2  LEU  31          1HD2      LEU  31   4.864   3.746   8.576
  254   2HD2  LEU  31          2HD2      LEU  31   5.818   4.655   7.379
  255   3HD2  LEU  31          3HD2      LEU  31   4.083   4.367   7.101
  256    H    LYS  32           H        LYS  32   8.929   0.998   8.952
  257    HA   LYS  32           HA       LYS  32  10.532   3.249   8.669
  258   1HB   LYS  32          1HB       LYS  32  11.865   2.275  10.460
  259   2HB   LYS  32          2HB       LYS  32  10.153   2.100  10.793
  260   1HG   LYS  32          1HG       LYS  32  10.191  -0.204  10.552
  261   2HG   LYS  32          2HG       LYS  32  11.407  -0.165   9.292
  262   1HD   LYS  32          1HD       LYS  32  12.374   0.768  11.950
  263   2HD   LYS  32          2HD       LYS  32  11.876  -0.912  11.916
  264   1HE   LYS  32          1HE       LYS  32  14.081  -1.167  11.226
  265   2HE   LYS  32          2HE       LYS  32  13.322  -0.963   9.659
  266   1HZ   LYS  32          1HZ       LYS  32  14.650   0.760   9.410
  267   2HZ   LYS  32          2HZ       LYS  32  13.808   1.563  10.556
  268   3HZ   LYS  32          3HZ       LYS  32  15.151   0.728  10.964
  269    H    LEU  33           H        LEU  33  10.762  -0.026   7.311
  270    HA   LEU  33           HA       LEU  33  13.455  -0.005   6.637
  271   1HB   LEU  33          1HB       LEU  33  11.039  -1.500   5.930
  272   2HB   LEU  33          2HB       LEU  33  12.213  -1.426   4.631
  273    HG   LEU  33           HG       LEU  33  12.700  -2.467   7.435
  274   1HD1  LEU  33          1HD1      LEU  33  11.753  -3.706   4.989
  275   2HD1  LEU  33          2HD1      LEU  33  13.265  -4.454   5.557
  276   3HD1  LEU  33          3HD1      LEU  33  11.856  -4.363   6.640
  277   1HD2  LEU  33          1HD2      LEU  33  14.876  -3.276   6.110
  278   2HD2  LEU  33          2HD2      LEU  33  14.566  -1.762   5.227
  279   3HD2  LEU  33          3HD2      LEU  33  14.800  -1.731   6.992
  280    H    PHE  34           H        PHE  34  10.564   1.353   4.976
  281    HA   PHE  34           HA       PHE  34  12.148   2.203   2.740
  282   1HB   PHE  34          1HB       PHE  34   9.289   2.376   3.767
  283   2HB   PHE  34          2HB       PHE  34   9.761   3.503   2.511
  284    HD1  PHE  34           1HD      PHE  34  10.348   2.693   0.270
  285    HD2  PHE  34           2HD      PHE  34   9.036   0.022   3.295
  286    HE1  PHE  34           1HE      PHE  34   9.914   0.937  -1.469
  287    HE2  PHE  34           2HE      PHE  34   8.602  -1.735   1.556
  288    HZ   PHE  34           HZ       PHE  34   9.046  -1.256  -0.806
  289    H    GLU  35           H        GLU  35  11.558   3.356   5.926
  290    HA   GLU  35           HA       GLU  35  11.716   6.119   5.171
  291   1HB   GLU  35          1HB       GLU  35  10.767   6.472   7.193
  292   2HB   GLU  35          2HB       GLU  35  10.635   4.732   7.349
  293   1HG   GLU  35          1HG       GLU  35  12.822   4.608   8.471
  294   2HG   GLU  35          2HG       GLU  35  13.112   6.312   8.182
  295    H    ASP  36           H        ASP  36  13.696   3.696   7.011
  296    HA   ASP  36           HA       ASP  36  15.972   5.446   6.497
  297   1HB   ASP  36          1HB       ASP  36  15.008   4.153   8.947
  298   2HB   ASP  36          2HB       ASP  36  16.647   3.649   8.589
  299    H    GLY  37           H        GLY  37  14.561   2.156   6.639
  300   1HA   GLY  37          1HA       GLY  37  16.765   0.552   6.238
  301   2HA   GLY  37          2HA       GLY  37  15.146   0.222   5.654
  302    H    GLU  38           H        GLU  38  17.201  -0.708   4.109
  303    HA   GLU  38           HA       GLU  38  18.236   1.083   2.282
  304   1HB   GLU  38          1HB       GLU  38  19.175  -0.778   1.319
  305   2HB   GLU  38          2HB       GLU  38  18.645  -1.535   2.807
  306   1HG   GLU  38          1HG       GLU  38  16.424  -2.062   1.590
  307   2HG   GLU  38          2HG       GLU  38  17.224  -1.568   0.111
  308    H    MET  39           H        MET  39  14.999   0.040   2.753
  309    HA   MET  39           HA       MET  39  14.237   0.157   0.016
  310   1HB   MET  39          1HB       MET  39  12.578   0.235   2.599
  311   2HB   MET  39          2HB       MET  39  11.922  -0.050   0.999
  312   1HG   MET  39          1HG       MET  39  13.890  -1.835   2.506
  313   2HG   MET  39          2HG       MET  39  12.221  -2.207   2.124
  314   1HE   MET  39          1HE       MET  39  11.393  -1.584  -0.172
  315   2HE   MET  39          2HE       MET  39  12.501  -1.049  -1.458
  316   3HE   MET  39          3HE       MET  39  11.914  -2.729  -1.432
  317    H    ALA  40           H        ALA  40  15.386   2.534   1.923
  318    HA   ALA  40           HA       ALA  40  13.306   4.492   1.412
  319   1HB   ALA  40          1HB       ALA  40  16.036   5.009   2.614
  320   2HB   ALA  40          2HB       ALA  40  14.506   5.873   2.898
  321   3HB   ALA  40          3HB       ALA  40  14.741   4.239   3.564
  322    H    LYS  41           H        LYS  41  15.692   2.998  -0.379
  323    HA   LYS  41           HA       LYS  41  16.824   5.313  -1.616
  324   1HB   LYS  41          1HB       LYS  41  18.075   3.802  -2.902
  325   2HB   LYS  41          2HB       LYS  41  17.918   3.031  -1.337
  326   1HG   LYS  41          1HG       LYS  41  16.197   1.532  -2.132
  327   2HG   LYS  41          2HG       LYS  41  15.962   2.458  -3.601
  328   1HD   LYS  41          1HD       LYS  41  17.310   0.771  -4.449
  329   2HD   LYS  41          2HD       LYS  41  18.558   1.909  -3.980
  330   1HE   LYS  41          1HE       LYS  41  19.312  -0.120  -3.025
  331   2HE   LYS  41          2HE       LYS  41  18.546   0.684  -1.669
  332   1HZ   LYS  41          1HZ       LYS  41  17.014  -1.131  -3.369
  333   2HZ   LYS  41          2HZ       LYS  41  17.934  -1.710  -2.151
  334   3HZ   LYS  41          3HZ       LYS  41  16.711  -0.677  -1.830
  335    H    TYR  42           H        TYR  42  13.868   3.491  -1.882
  336    HA   TYR  42           HA       TYR  42  13.348   4.786  -4.474
  337   1HB   TYR  42          1HB       TYR  42  12.357   2.231  -3.071
  338   2HB   TYR  42          2HB       TYR  42  11.583   2.846  -4.518
  339    HD1  TYR  42           1HD      TYR  42  13.302   0.196  -3.758
  340    HD2  TYR  42           2HD      TYR  42  13.964   3.709  -6.108
  341    HE1  TYR  42           1HE      TYR  42  14.971  -1.073  -5.197
  342    HE2  TYR  42           2HE      TYR  42  15.632   2.429  -7.539
  343    HH   TYR  42           HH       TYR  42  16.997   0.557  -7.467
  344    H    VAL  43           H        VAL  43  13.070   6.395  -2.236
  345    HA   VAL  43           HA       VAL  43  10.157   6.596  -2.099
  346    HB   VAL  43           HB       VAL  43  12.083   6.658   0.228
  347   1HG1  VAL  43          1HG1      VAL  43   9.889   8.324  -0.077
  348   2HG1  VAL  43          2HG1      VAL  43   9.240   6.961   0.866
  349   3HG1  VAL  43          3HG1      VAL  43  10.652   7.864   1.464
  350   1HG2  VAL  43          1HG2      VAL  43   9.640   5.044   0.431
  351   2HG2  VAL  43          2HG2      VAL  43  10.719   4.530  -0.888
  352   3HG2  VAL  43          3HG2      VAL  43  11.332   4.616   0.781
  353    H    GLN  44           H        GLN  44   9.440   8.642  -2.512
  354    HA   GLN  44           HA       GLN  44  11.533  10.644  -2.751
  355   1HB   GLN  44          1HB       GLN  44   8.783  10.379  -4.025
  356   2HB   GLN  44          2HB       GLN  44   9.714  11.861  -4.123
  357   1HG   GLN  44          1HG       GLN  44  11.610   9.970  -4.854
  358   2HG   GLN  44          2HG       GLN  44  10.144   9.262  -5.504
  359   1HE2  GLN  44          1HE2      GLN  44  10.231   9.640  -7.599
  360   2HE2  GLN  44          2HE2      GLN  44  10.421  11.182  -8.366
  361    H    GLY  45           H        GLY  45  11.637  11.225  -0.498
  362   1HA   GLY  45          1HA       GLY  45  11.119  12.607   1.208
  363   2HA   GLY  45          2HA       GLY  45   9.788  13.247   0.265
  364    H    ASP  46           H        ASP  46   7.679  12.215   0.347
  365    HA   ASP  46           HA       ASP  46   7.461  10.216   2.445
  366   1HB   ASP  46          1HB       ASP  46   6.169  12.915   2.264
  367   2HB   ASP  46          2HB       ASP  46   5.120  11.603   2.764
  368    H    ALA  47           H        ALA  47   7.400  10.349  -0.635
  369    HA   ALA  47           HA       ALA  47   4.815   9.018  -0.937
  370   1HB   ALA  47          1HB       ALA  47   5.681  10.698  -3.228
  371   2HB   ALA  47          2HB       ALA  47   4.054  10.419  -2.563
  372   3HB   ALA  47          3HB       ALA  47   5.142  11.595  -1.788
  373    H    ILE  48           H        ILE  48   4.992   7.107  -2.044
  374    HA   ILE  48           HA       ILE  48   7.582   6.636  -3.348
  375    HB   ILE  48           HB       ILE  48   7.379   5.322  -1.360
  376   1HG1  ILE  48          1HG1      ILE  48   6.836   3.545  -3.755
  377   2HG1  ILE  48          2HG1      ILE  48   8.376   4.313  -3.425
  378   1HG2  ILE  48          1HG2      ILE  48   5.558   3.722  -1.000
  379   2HG2  ILE  48          2HG2      ILE  48   4.960   5.397  -1.067
  380   3HG2  ILE  48          3HG2      ILE  48   4.742   4.317  -2.465
  381   1HD1  ILE  48          1HD1      ILE  48   6.979   2.122  -1.880
  382   2HD1  ILE  48          2HD1      ILE  48   8.671   2.212  -2.424
  383   3HD1  ILE  48          3HD1      ILE  48   8.129   3.189  -1.039
  384    H    GLY  49           H        GLY  49   7.567   5.363  -5.317
  385   1HA   GLY  49          1HA       GLY  49   5.189   5.902  -6.901
  386   2HA   GLY  49          2HA       GLY  49   6.753   5.352  -7.466
  387    H    TYR  50           H        TYR  50   5.012   3.945  -8.717
  388    HA   TYR  50           HA       TYR  50   3.676   1.894  -7.382
  389   1HB   TYR  50          1HB       TYR  50   3.536   2.821  -9.822
  390   2HB   TYR  50          2HB       TYR  50   4.998   1.917 -10.165
  391    HD1  TYR  50           1HD      TYR  50   4.913  -0.659  -9.713
  392    HD2  TYR  50           2HD      TYR  50   1.442   1.811 -10.109
  393    HE1  TYR  50           1HE      TYR  50   3.510  -2.706 -10.262
  394    HE2  TYR  50           2HE      TYR  50   0.051  -0.245 -10.657
  395    HH   TYR  50           HH       TYR  50   0.241  -2.399 -11.397
  396    H    GLU  51           H        GLU  51   6.827   1.792  -9.204
  397    HA   GLU  51           HA       GLU  51   7.415  -0.802  -8.705
  398   1HB   GLU  51          1HB       GLU  51   8.726   1.430  -9.804
  399   2HB   GLU  51          2HB       GLU  51   9.798   0.908  -8.520
  400   1HG   GLU  51          1HG       GLU  51  10.573  -0.599 -10.054
  401   2HG   GLU  51          2HG       GLU  51   9.142  -1.522  -9.639
  402    H    GLY  52           H        GLY  52   7.655   2.009  -6.533
  403   1HA   GLY  52          1HA       GLY  52   9.252   0.675  -4.555
  404   2HA   GLY  52          2HA       GLY  52   8.434   2.218  -4.413
  405    H    PHE  53           H        PHE  53   5.784   1.041  -5.314
  406    HA   PHE  53           HA       PHE  53   4.919   0.262  -2.714
  407   1HB   PHE  53          1HB       PHE  53   3.794   1.608  -4.747
  408   2HB   PHE  53          2HB       PHE  53   3.377   0.013  -5.343
  409    HD1  PHE  53           1HD      PHE  53   2.669  -1.423  -2.888
  410    HD2  PHE  53           2HD      PHE  53   1.807   2.568  -4.043
  411    HE1  PHE  53           1HE      PHE  53   0.631  -1.439  -1.422
  412    HE2  PHE  53           2HE      PHE  53  -0.231   2.553  -2.577
  413    HZ   PHE  53           HZ       PHE  53  -0.794   0.549  -1.284
  414    H    GLN  54           H        GLN  54   4.911  -1.350  -5.978
  415    HA   GLN  54           HA       GLN  54   3.930  -3.749  -5.082
  416   1HB   GLN  54          1HB       GLN  54   5.093  -4.673  -7.183
  417   2HB   GLN  54          2HB       GLN  54   3.953  -3.365  -7.427
  418   1HG   GLN  54          1HG       GLN  54   5.587  -2.160  -8.431
  419   2HG   GLN  54          2HG       GLN  54   6.454  -2.103  -6.910
  420   1HE2  GLN  54          1HE2      GLN  54   7.066  -2.546  -9.912
  421   2HE2  GLN  54          2HE2      GLN  54   8.198  -3.856  -9.930
  422    H    GLN  55           H        GLN  55   7.166  -2.339  -4.852
  423    HA   GLN  55           HA       GLN  55   8.520  -4.756  -4.434
  424   1HB   GLN  55          1HB       GLN  55   9.110  -1.868  -4.330
  425   2HB   GLN  55          2HB       GLN  55  10.007  -2.776  -3.129
  426   1HG   GLN  55          1HG       GLN  55  10.002  -4.207  -5.680
  427   2HG   GLN  55          2HG       GLN  55  10.578  -2.568  -5.907
  428   1HE2  GLN  55          1HE2      GLN  55  11.776  -2.008  -3.520
  429   2HE2  GLN  55          2HE2      GLN  55  13.164  -3.013  -3.269
  430    H    PHE  56           H        PHE  56   6.757  -2.466  -2.333
  431    HA   PHE  56           HA       PHE  56   7.728  -3.282   0.120
  432   1HB   PHE  56          1HB       PHE  56   6.180  -1.332  -0.467
  433   2HB   PHE  56          2HB       PHE  56   4.888  -2.479  -0.760
  434    HD1  PHE  56           1HD      PHE  56   3.989  -3.824   1.160
  435    HD2  PHE  56           2HD      PHE  56   6.690  -0.601   1.730
  436    HE1  PHE  56           1HE      PHE  56   3.326  -3.695   3.577
  437    HE2  PHE  56           2HE      PHE  56   6.027  -0.473   4.147
  438    HZ   PHE  56           HZ       PHE  56   4.352  -2.021   5.042
  439    H    LEU  57           H        LEU  57   4.978  -4.579  -1.850
  440    HA   LEU  57           HA       LEU  57   4.053  -6.399   0.015
  441   1HB   LEU  57          1HB       LEU  57   4.001  -6.302  -2.991
  442   2HB   LEU  57          2HB       LEU  57   3.283  -7.635  -2.108
  443    HG   LEU  57           HG       LEU  57   2.299  -5.248  -0.920
  444   1HD1  LEU  57          1HD1      LEU  57   1.195  -4.161  -2.833
  445   2HD1  LEU  57          2HD1      LEU  57   2.968  -4.022  -2.907
  446   3HD1  LEU  57          3HD1      LEU  57   2.123  -5.195  -3.946
  447   1HD2  LEU  57          1HD2      LEU  57   0.562  -6.727  -2.807
  448   2HD2  LEU  57          2HD2      LEU  57   1.349  -7.699  -1.540
  449   3HD2  LEU  57          3HD2      LEU  57   0.322  -6.316  -1.092
  450    H    LYS  58           H        LYS  58   7.018  -6.336  -1.831
  451    HA   LYS  58           HA       LYS  58   7.474  -9.130  -1.833
  452   1HB   LYS  58          1HB       LYS  58   8.513  -7.305  -3.320
  453   2HB   LYS  58          2HB       LYS  58   9.589  -6.978  -1.977
  454   1HG   LYS  58          1HG       LYS  58   9.970  -9.614  -2.012
  455   2HG   LYS  58          2HG       LYS  58   9.360  -9.491  -3.650
  456   1HD   LYS  58          1HD       LYS  58  11.108  -7.572  -3.960
  457   2HD   LYS  58          2HD       LYS  58  11.826  -8.155  -2.471
  458   1HE   LYS  58          1HE       LYS  58  11.621 -10.532  -3.756
  459   2HE   LYS  58          2HE       LYS  58  11.685  -9.492  -5.165
  460   1HZ   LYS  58          1HZ       LYS  58  13.744  -8.664  -4.506
  461   2HZ   LYS  58          2HZ       LYS  58  13.629  -9.251  -2.986
  462   3HZ   LYS  58          3HZ       LYS  58  13.856 -10.272  -4.241
  463    H    ILE  59           H        ILE  59   8.884  -6.434   0.162
  464    HA   ILE  59           HA       ILE  59  10.026  -8.289   1.989
  465    HB   ILE  59           HB       ILE  59   9.590  -5.323   2.326
  466   1HG1  ILE  59          1HG1      ILE  59  12.237  -5.853   1.488
  467   2HG1  ILE  59          2HG1      ILE  59  11.199  -6.733   0.384
  468   1HG2  ILE  59          1HG2      ILE  59  11.968  -6.731   3.412
  469   2HG2  ILE  59          2HG2      ILE  59  11.018  -5.382   4.080
  470   3HG2  ILE  59          3HG2      ILE  59  10.408  -7.049   4.209
  471   1HD1  ILE  59          1HD1      ILE  59  11.769  -4.178  -0.062
  472   2HD1  ILE  59          2HD1      ILE  59  10.135  -4.798  -0.395
  473   3HD1  ILE  59          3HD1      ILE  59  10.455  -3.895   1.105
  474    H    TYR  60           H        TYR  60   7.147  -6.098   2.005
  475    HA   TYR  60           HA       TYR  60   6.242  -6.344   4.506
  476   1HB   TYR  60          1HB       TYR  60   5.086  -5.166   2.644
  477   2HB   TYR  60          2HB       TYR  60   4.844  -6.674   1.784
  478    HD1  TYR  60           1HD      TYR  60   4.294  -6.546   5.413
  479    HD2  TYR  60           2HD      TYR  60   2.440  -6.237   1.570
  480    HE1  TYR  60           1HE      TYR  60   2.005  -6.797   6.490
  481    HE2  TYR  60           2HE      TYR  60   0.157  -6.489   2.660
  482    HH   TYR  60           HH       TYR  60  -0.940  -6.752   4.495
  483    H    LEU  61           H        LEU  61   4.936  -8.598   1.980
  484    HA   LEU  61           HA       LEU  61   4.295 -10.488   4.042
  485   1HB   LEU  61          1HB       LEU  61   4.026 -10.722   1.043
  486   2HB   LEU  61          2HB       LEU  61   3.280 -11.755   2.245
  487    HG   LEU  61           HG       LEU  61   2.504  -9.083   2.849
  488   1HD1  LEU  61          1HD1      LEU  61   3.060  -8.366   0.637
  489   2HD1  LEU  61          2HD1      LEU  61   2.249  -9.775  -0.087
  490   3HD1  LEU  61          3HD1      LEU  61   1.290  -8.521   0.734
  491   1HD2  LEU  61          1HD2      LEU  61   0.234  -9.983   2.282
  492   2HD2  LEU  61          2HD2      LEU  61   1.029 -11.479   1.733
  493   3HD2  LEU  61          3HD2      LEU  61   1.166 -10.970   3.433
  494    H    GLU  62           H        GLU  62   7.097  -9.678   2.310
  495    HA   GLU  62           HA       GLU  62   9.063 -10.611   2.226
  496   1HB   GLU  62          1HB       GLU  62   8.205 -11.670   4.512
  497   2HB   GLU  62          2HB       GLU  62   8.174 -13.158   3.587
  498   1HG   GLU  62          1HG       GLU  62  10.622 -12.410   2.846
  499   2HG   GLU  62          2HG       GLU  62  10.547 -11.410   4.283
  500    H    VAL  63           H        VAL  63   6.423 -11.502   0.597
  501    HA   VAL  63           HA       VAL  63   6.905 -14.002  -0.476
  502    HB   VAL  63           HB       VAL  63   5.680 -12.937  -2.495
  503   1HG1  VAL  63          1HG1      VAL  63   3.803 -13.715  -1.534
  504   2HG1  VAL  63          2HG1      VAL  63   4.840 -14.092  -0.138
  505   3HG1  VAL  63          3HG1      VAL  63   3.912 -12.573  -0.174
  506   1HG2  VAL  63          1HG2      VAL  63   5.247 -10.747  -2.503
  507   2HG2  VAL  63          2HG2      VAL  63   4.586 -10.815  -0.851
  508   3HG2  VAL  63          3HG2      VAL  63   6.333 -10.584  -1.102
  509    H    ASP  64           H        ASP  64   7.855 -14.651  -2.539
  510    HA   ASP  64           HA       ASP  64  10.269 -13.152  -2.990
  511   1HB   ASP  64          1HB       ASP  64   9.511 -15.905  -3.065
  512   2HB   ASP  64          2HB       ASP  64   9.920 -15.481  -4.715
  513    H    ASN  65           H        ASN  65   7.077 -13.344  -4.186
  514    HA   ASN  65           HA       ASN  65   7.657 -11.696  -6.359
  515   1HB   ASN  65          1HB       ASN  65   6.405 -13.624  -7.908
  516   2HB   ASN  65          2HB       ASN  65   8.132 -13.324  -7.917
  517   1HD2  ASN  65          1HD2      ASN  65   5.690 -15.002  -5.935
  518   2HD2  ASN  65          2HD2      ASN  65   6.591 -16.457  -5.664
  519    H    VAL  66           H        VAL  66   5.838 -10.377  -6.200
  520    HA   VAL  66           HA       VAL  66   3.353 -11.612  -5.286
  521    HB   VAL  66           HB       VAL  66   4.716  -9.307  -4.567
  522   1HG1  VAL  66          1HG1      VAL  66   3.919  -8.203  -6.636
  523   2HG1  VAL  66          2HG1      VAL  66   2.239  -8.516  -6.138
  524   3HG1  VAL  66          3HG1      VAL  66   3.270  -7.439  -5.165
  525   1HG2  VAL  66          1HG2      VAL  66   3.308  -9.484  -2.841
  526   2HG2  VAL  66          2HG2      VAL  66   1.894  -9.171  -3.875
  527   3HG2  VAL  66          3HG2      VAL  66   2.528 -10.826  -3.711
  528    HA   PRO  67           HA       PRO  67   1.612 -11.206  -9.221
  529   1HB   PRO  67          1HB       PRO  67  -1.054 -11.198  -8.619
  530   2HB   PRO  67          2HB       PRO  67  -0.093 -12.661  -8.695
  531   1HG   PRO  67          1HG       PRO  67  -1.095 -11.223  -6.314
  532   2HG   PRO  67          2HG       PRO  67  -0.516 -12.873  -6.437
  533   1HD   PRO  67          1HD       PRO  67   0.907 -10.632  -5.350
  534   2HD   PRO  67          2HD       PRO  67   1.526 -12.255  -5.580
  535    H    ARG  68           H        ARG  68   1.514  -9.628 -10.691
  536    HA   ARG  68           HA       ARG  68   1.421  -7.035  -9.781
  537   1HB   ARG  68          1HB       ARG  68   1.009  -6.510 -12.288
  538   2HB   ARG  68          2HB       ARG  68   2.451  -7.429 -11.905
  539   1HG   ARG  68          1HG       ARG  68   1.499  -9.483 -12.655
  540   2HG   ARG  68          2HG       ARG  68  -0.140  -8.872 -12.552
  541   1HD   ARG  68          1HD       ARG  68   0.024  -8.466 -14.791
  542   2HD   ARG  68          2HD       ARG  68   1.031  -7.098 -14.360
  543    HE   ARG  68           HE       ARG  68   2.718  -9.377 -14.378
  544   1HH1  ARG  68          2HH2      ARG  68   0.782  -7.533 -16.664
  545   2HH1  ARG  68          1HH2      ARG  68   1.788  -7.916 -18.021
  546   1HH2  ARG  68          2HH1      ARG  68   4.046  -9.883 -16.167
  547   2HH2  ARG  68          1HH1      ARG  68   3.657  -9.262 -17.737
  548    H    HIS  69           H        HIS  69  -1.123  -9.330 -10.601
  549    HA   HIS  69           HA       HIS  69  -3.152  -7.582 -11.303
  550   1HB   HIS  69          1HB       HIS  69  -3.211 -10.028 -11.589
  551   2HB   HIS  69          2HB       HIS  69  -3.321 -10.239  -9.853
  552    HD1  HIS  69           1HD      HIS  69  -5.308  -8.450 -12.610
  553    HD2  HIS  69           2HD      HIS  69  -5.893 -10.433  -8.960
  554    HE1  HIS  69           1HE      HIS  69  -7.832  -8.559 -12.252
  555    H    LEU  70           H        LEU  70  -2.117  -8.832  -8.066
  556    HA   LEU  70           HA       LEU  70  -4.115  -7.303  -6.719
  557   1HB   LEU  70          1HB       LEU  70  -3.599  -9.201  -5.572
  558   2HB   LEU  70          2HB       LEU  70  -1.897  -9.140  -5.985
  559    HG   LEU  70           HG       LEU  70  -1.887  -7.027  -4.406
  560   1HD1  LEU  70          1HD1      LEU  70  -3.627  -6.657  -3.057
  561   2HD1  LEU  70          2HD1      LEU  70  -4.557  -7.663  -4.194
  562   3HD1  LEU  70          3HD1      LEU  70  -3.861  -8.391  -2.727
  563   1HD2  LEU  70          1HD2      LEU  70  -1.818  -9.939  -3.664
  564   2HD2  LEU  70          2HD2      LEU  70  -0.481  -8.776  -3.829
  565   3HD2  LEU  70          3HD2      LEU  70  -1.577  -8.680  -2.430
  566    H    SER  71           H        SER  71  -0.557  -7.022  -7.299
  567    HA   SER  71           HA       SER  71  -0.215  -4.751  -5.773
  568   1HB   SER  71          1HB       SER  71   1.866  -5.467  -6.336
  569   2HB   SER  71          2HB       SER  71   1.291  -6.271  -7.783
  570    HG   SER  71           HG       SER  71   2.163  -4.672  -8.892
  571    H    LEU  72           H        LEU  72  -1.677  -5.263  -8.932
  572    HA   LEU  72           HA       LEU  72  -1.341  -2.589  -9.853
  573   1HB   LEU  72          1HB       LEU  72  -1.556  -4.170 -11.527
  574   2HB   LEU  72          2HB       LEU  72  -2.872  -5.007 -10.728
  575    HG   LEU  72           HG       LEU  72  -4.403  -3.163 -11.261
  576   1HD1  LEU  72          1HD1      LEU  72  -2.038  -1.677 -11.627
  577   2HD1  LEU  72          2HD1      LEU  72  -2.821  -1.768 -13.222
  578   3HD1  LEU  72          3HD1      LEU  72  -3.720  -1.129 -11.825
  579   1HD2  LEU  72          1HD2      LEU  72  -4.737  -3.702 -13.515
  580   2HD2  LEU  72          2HD2      LEU  72  -2.999  -3.943 -13.814
  581   3HD2  LEU  72          3HD2      LEU  72  -3.906  -5.122 -12.836
  582    H    ALA  73           H        ALA  73  -4.036  -4.480  -8.340
  583    HA   ALA  73           HA       ALA  73  -5.770  -2.231  -8.285
  584   1HB   ALA  73          1HB       ALA  73  -7.212  -3.915  -7.939
  585   2HB   ALA  73          2HB       ALA  73  -5.855  -5.052  -7.759
  586   3HB   ALA  73          3HB       ALA  73  -6.494  -4.197  -6.335
  587    H    LEU  74           H        LEU  74  -3.245  -3.577  -6.180
  588    HA   LEU  74           HA       LEU  74  -4.013  -2.324  -3.807
  589   1HB   LEU  74          1HB       LEU  74  -1.609  -3.632  -4.910
  590   2HB   LEU  74          2HB       LEU  74  -1.306  -2.478  -3.627
  591    HG   LEU  74           HG       LEU  74  -3.325  -4.710  -3.345
  592   1HD1  LEU  74          1HD1      LEU  74  -0.858  -5.398  -3.881
  593   2HD1  LEU  74          2HD1      LEU  74  -0.564  -4.916  -2.193
  594   3HD1  LEU  74          3HD1      LEU  74  -1.748  -6.193  -2.561
  595   1HD2  LEU  74          1HD2      LEU  74  -2.199  -4.084  -0.874
  596   2HD2  LEU  74          2HD2      LEU  74  -2.431  -2.511  -1.673
  597   3HD2  LEU  74          3HD2      LEU  74  -3.810  -3.618  -1.471
  598    H    PHE  75           H        PHE  75  -1.882  -1.252  -6.526
  599    HA   PHE  75           HA       PHE  75  -1.342   1.246  -5.277
  600   1HB   PHE  75          1HB       PHE  75   0.157   0.097  -6.931
  601   2HB   PHE  75          2HB       PHE  75  -1.114   0.134  -8.137
  602    HD1  PHE  75           1HD      PHE  75  -1.418   2.024  -9.523
  603    HD2  PHE  75           2HD      PHE  75   1.184   2.275  -6.180
  604    HE1  PHE  75           1HE      PHE  75  -0.564   4.233 -10.353
  605    HE2  PHE  75           2HE      PHE  75   2.038   4.484  -7.011
  606    HZ   PHE  75           HZ       PHE  75   1.154   5.437  -9.088
  607    H    GLN  76           H        GLN  76  -3.614   0.044  -7.805
  608    HA   GLN  76           HA       GLN  76  -4.490   2.454  -8.725
  609   1HB   GLN  76          1HB       GLN  76  -5.289  -0.298  -8.887
  610   2HB   GLN  76          2HB       GLN  76  -6.731   0.638  -8.546
  611   1HG   GLN  76          1HG       GLN  76  -5.738   2.253 -10.442
  612   2HG   GLN  76          2HG       GLN  76  -4.878   0.805 -10.927
  613   1HE2  GLN  76          1HE2      GLN  76  -5.838  -0.411 -12.352
  614   2HE2  GLN  76          2HE2      GLN  76  -7.540  -0.568 -12.632
  615    H    SER  77           H        SER  77  -5.447   0.631  -5.778
  616    HA   SER  77           HA       SER  77  -7.642   2.195  -5.147
  617   1HB   SER  77          1HB       SER  77  -7.277   1.296  -2.811
  618   2HB   SER  77          2HB       SER  77  -7.325   0.066  -4.058
  619    HG   SER  77           HG       SER  77  -5.554  -0.347  -2.662
  620    H    PHE  78           H        PHE  78  -4.165   2.384  -4.119
  621    HA   PHE  78           HA       PHE  78  -4.741   4.994  -2.937
  622   1HB   PHE  78          1HB       PHE  78  -2.600   2.831  -2.748
  623   2HB   PHE  78          2HB       PHE  78  -2.169   4.462  -2.276
  624    HD1  PHE  78           1HD      PHE  78  -3.510   1.408  -1.164
  625    HD2  PHE  78           2HD      PHE  78  -3.794   5.597  -0.549
  626    HE1  PHE  78           1HE      PHE  78  -4.486   1.008   1.114
  627    HE2  PHE  78           2HE      PHE  78  -4.770   5.197   1.729
  628    HZ   PHE  78           HZ       PHE  78  -5.104   2.907   2.533
  629    H    GLU  79           H        GLU  79  -4.570   6.642  -4.400
  630    HA   GLU  79           HA       GLU  79  -2.052   6.985  -5.664
  631   1HB   GLU  79          1HB       GLU  79  -3.687   5.482  -7.182
  632   2HB   GLU  79          2HB       GLU  79  -4.337   7.049  -7.620
  633   1HG   GLU  79          1HG       GLU  79  -1.828   7.739  -8.005
  634   2HG   GLU  79          2HG       GLU  79  -1.505   6.016  -8.003
  635    H    THR  80           H        THR  80  -1.644   9.096  -5.186
  636    HA   THR  80           HA       THR  80  -3.715  10.892  -4.491
  637    HB   THR  80           HB       THR  80  -1.045  10.681  -3.975
  638    HG1  THR  80           1HG      THR  80  -2.311  12.119  -2.773
  639   1HG2  THR  80          1HG2      THR  80   0.270  12.206  -5.173
  640   2HG2  THR  80          2HG2      THR  80  -0.781  11.634  -6.490
  641   3HG2  THR  80          3HG2      THR  80  -1.136  13.176  -5.674
  642    H    GLY  81           H        GLY  81  -2.410   9.871  -7.543
  643   1HA   GLY  81          1HA       GLY  81  -2.621  12.128  -9.110
  644   2HA   GLY  81          2HA       GLY  81  -2.920  10.486  -9.644
  645    H    HIS  82           H        HIS  82  -5.137   9.561  -9.347
  646    HA   HIS  82           HA       HIS  82  -7.340   9.651  -9.351
  647   1HB   HIS  82          1HB       HIS  82  -7.023  11.184  -7.343
  648   2HB   HIS  82          2HB       HIS  82  -7.236  12.533  -8.440
  649    HD1  HIS  82           1HD      HIS  82  -9.136  10.813  -6.082
  650    HD2  HIS  82           2HD      HIS  82  -9.862  11.846 -10.082
  651    HE1  HIS  82           1HE      HIS  82 -11.669  10.760  -6.385
  652    H    CYS  83           H        CYS  83  -7.179   9.358 -11.649
  653    HA   CYS  83           HA       CYS  83  -8.438  11.443 -13.087
  654   1HB   CYS  83          1HB       CYS  83  -5.489  11.196 -13.300
  655   2HB   CYS  83          2HB       CYS  83  -6.348  11.268 -14.826
  656    HG   CYS  83           HG       CYS  83  -6.819  13.586 -14.841
  657    H    LEU  84           H        LEU  84  -9.675  10.415 -14.650
  658    HA   LEU  84           HA       LEU  84  -8.880   7.663 -15.306
  659   1HB   LEU  84          1HB       LEU  84 -11.547   8.915 -14.752
  660   2HB   LEU  84          2HB       LEU  84 -11.438   7.511 -15.796
  661    HG   LEU  84           HG       LEU  84 -11.956   6.689 -13.651
  662   1HD1  LEU  84          1HD1      LEU  84  -9.071   6.158 -13.354
  663   2HD1  LEU  84          2HD1      LEU  84 -10.439   5.037 -13.554
  664   3HD1  LEU  84          3HD1      LEU  84  -9.733   5.842 -14.976
  665   1HD2  LEU  84          1HD2      LEU  84 -11.574   8.480 -12.195
  666   2HD2  LEU  84          2HD2      LEU  84 -10.427   7.227 -11.662
  667   3HD2  LEU  84          3HD2      LEU  84  -9.855   8.600 -12.639
  668    H    ASN  85           H        ASN  85  -7.644   9.689 -16.712
  669    HA   ASN  85           HA       ASN  85  -8.308   9.033 -19.291
  670   1HB   ASN  85          1HB       ASN  85  -9.832  11.319 -18.201
  671   2HB   ASN  85          2HB       ASN  85  -8.892  11.785 -19.605
  672   1HD2  ASN  85          1HD2      ASN  85 -11.822  11.291 -19.030
  673   2HD2  ASN  85          2HD2      ASN  85 -12.375  10.256 -20.304
  674    H    GLU  86           H        GLU  86  -5.988   8.887 -19.401
  675    HA   GLU  86           HA       GLU  86  -4.690  11.452 -19.627
  676   1HB   GLU  86          1HB       GLU  86  -4.421  10.191 -17.243
  677   2HB   GLU  86          2HB       GLU  86  -3.144   9.369 -18.118
  678   1HG   GLU  86          1HG       GLU  86  -2.421  11.796 -18.866
  679   2HG   GLU  86          2HG       GLU  86  -3.415  12.333 -17.526
  680    H    THR  87           H        THR  87  -2.013   9.957 -19.647
  681    HA   THR  87           HA       THR  87  -2.081   7.925 -21.562
  682    HB   THR  87           HB       THR  87  -2.958  10.069 -22.846
  683    HG1  THR  87           1HG      THR  87  -2.377   8.373 -24.180
  684   1HG2  THR  87          1HG2      THR  87  -0.008  10.473 -23.356
  685   2HG2  THR  87          2HG2      THR  87  -1.357  11.608 -23.602
  686   3HG2  THR  87          3HG2      THR  87  -0.732  11.311 -21.962
  687    H    ASN  88           H        ASN  88  -0.817   8.651 -19.040
  688    HA   ASN  88           HA       ASN  88   1.759   7.845 -19.720
  689   1HB   ASN  88          1HB       ASN  88   1.897  10.332 -20.316
  690   2HB   ASN  88          2HB       ASN  88   1.567  10.704 -18.636
  691   1HD2  ASN  88          1HD2      ASN  88   3.509  11.703 -18.296
  692   2HD2  ASN  88          2HD2      ASN  88   5.024  10.869 -18.193
  693    H    VAL  89           H        VAL  89   0.998   6.293 -18.064
  694    HA   VAL  89           HA       VAL  89   0.825   7.442 -15.368
  695    HB   VAL  89           HB       VAL  89   0.012   4.660 -15.702
  696   1HG1  VAL  89          1HG1      VAL  89  -0.852   5.407 -13.760
  697   2HG1  VAL  89          2HG1      VAL  89  -0.811   7.109 -14.280
  698   3HG1  VAL  89          3HG1      VAL  89  -2.159   6.058 -14.778
  699   1HG2  VAL  89          1HG2      VAL  89  -1.341   6.801 -17.360
  700   2HG2  VAL  89          2HG2      VAL  89  -0.731   5.213 -17.884
  701   3HG2  VAL  89          3HG2      VAL  89  -2.172   5.314 -16.844
  702    H    THR  90           H        THR  90   3.172   7.626 -15.235
  703    HA   THR  90           HA       THR  90   4.365   5.040 -14.561
  704    HB   THR  90           HB       THR  90   5.092   5.458 -16.863
  705    HG1  THR  90           1HG      THR  90   7.253   5.292 -16.241
  706   1HG2  THR  90          1HG2      THR  90   6.535   7.980 -16.191
  707   2HG2  THR  90          2HG2      THR  90   5.711   7.520 -17.700
  708   3HG2  THR  90          3HG2      THR  90   4.770   8.159 -16.331
  709    H    LYS  91           H        LYS  91   4.527   8.636 -14.460
  710    HA   LYS  91           HA       LYS  91   6.117   8.383 -12.020
  711   1HB   LYS  91          1HB       LYS  91   6.165  10.170 -14.249
  712   2HB   LYS  91          2HB       LYS  91   5.737  11.102 -12.829
  713   1HG   LYS  91          1HG       LYS  91   8.141  11.090 -12.913
  714   2HG   LYS  91          2HG       LYS  91   7.698  10.001 -11.614
  715   1HD   LYS  91          1HD       LYS  91   7.999   8.817 -14.368
  716   2HD   LYS  91          2HD       LYS  91   9.463   9.303 -13.537
  717   1HE   LYS  91          1HE       LYS  91   8.010   7.948 -11.547
  718   2HE   LYS  91          2HE       LYS  91   7.677   7.017 -12.994
  719   1HZ   LYS  91          1HZ       LYS  91   9.889   6.557 -13.280
  720   2HZ   LYS  91          2HZ       LYS  91  10.414   7.828 -12.398
  721   3HZ   LYS  91          3HZ       LYS  91   9.771   6.526 -11.651
  722    H    ASP  92           H        ASP  92   4.559   7.743 -10.502
  723    HA   ASP  92           HA       ASP  92   2.841   9.896  -9.715
  724   1HB   ASP  92          1HB       ASP  92   1.808   7.716 -11.230
  725   2HB   ASP  92          2HB       ASP  92   1.334   7.392  -9.574
  726    H    VAL  93           H        VAL  93   3.277  10.036  -7.510
  727    HA   VAL  93           HA       VAL  93   3.995   7.545  -6.136
  728    HB   VAL  93           HB       VAL  93   5.002   9.150  -4.464
  729   1HG1  VAL  93          1HG1      VAL  93   6.019   8.802  -7.280
  730   2HG1  VAL  93          2HG1      VAL  93   6.963   9.715  -6.079
  731   3HG1  VAL  93          3HG1      VAL  93   6.554   8.009  -5.778
  732   1HG2  VAL  93          1HG2      VAL  93   4.770  11.167  -6.717
  733   2HG2  VAL  93          2HG2      VAL  93   3.697  11.143  -5.297
  734   3HG2  VAL  93          3HG2      VAL  93   5.443  11.417  -5.088
  735    H    VAL  94           H        VAL  94   3.247   7.377  -3.831
  736    HA   VAL  94           HA       VAL  94   0.795   8.893  -3.348
  737    HB   VAL  94           HB       VAL  94   0.133   6.824  -4.441
  738   1HG1  VAL  94          1HG1      VAL  94   1.350   5.275  -2.143
  739   2HG1  VAL  94          2HG1      VAL  94   0.680   4.656  -3.672
  740   3HG1  VAL  94          3HG1      VAL  94   2.217   5.554  -3.672
  741   1HG2  VAL  94          1HG2      VAL  94  -1.080   7.870  -2.373
  742   2HG2  VAL  94          2HG2      VAL  94  -1.580   6.271  -2.974
  743   3HG2  VAL  94          3HG2      VAL  94  -0.536   6.395  -1.538
  744    H    CYS  95           H        CYS  95   0.084   8.665  -1.011
  745    HA   CYS  95           HA       CYS  95   2.370   9.036   0.624
  746   1HB   CYS  95          1HB       CYS  95  -0.583   9.287   0.951
  747   2HB   CYS  95          2HB       CYS  95   0.352   9.025   2.410
  748    HG   CYS  95           HG       CYS  95   1.493  11.099   0.152
  749    H    LEU  96           H        LEU  96   3.256   7.602   2.154
  750    HA   LEU  96           HA       LEU  96   2.542   4.847   1.812
  751   1HB   LEU  96          1HB       LEU  96   4.724   6.407   3.066
  752   2HB   LEU  96          2HB       LEU  96   4.380   4.847   3.787
  753    HG   LEU  96           HG       LEU  96   4.564   4.743   0.858
  754   1HD1  LEU  96          1HD1      LEU  96   6.981   5.622   2.457
  755   2HD1  LEU  96          2HD1      LEU  96   7.035   4.972   0.801
  756   3HD1  LEU  96          3HD1      LEU  96   6.187   6.501   1.130
  757   1HD2  LEU  96          1HD2      LEU  96   5.990   2.811   1.355
  758   2HD2  LEU  96          2HD2      LEU  96   5.956   3.231   3.085
  759   3HD2  LEU  96          3HD2      LEU  96   4.456   2.750   2.256
  760    H    ASN  97           H        ASN  97   2.195   7.407   4.306
  761    HA   ASN  97           HA       ASN  97   1.373   5.805   6.364
  762   1HB   ASN  97          1HB       ASN  97   0.048   7.948   7.065
  763   2HB   ASN  97          2HB       ASN  97   1.784   8.100   6.880
  764   1HD2  ASN  97          1HD2      ASN  97   2.487   9.723   5.733
  765   2HD2  ASN  97          2HD2      ASN  97   1.636  10.586   4.496
  766    H    ASP  98           H        ASP  98  -0.390   7.234   3.564
  767    HA   ASP  98           HA       ASP  98  -2.952   6.737   4.412
  768   1HB   ASP  98          1HB       ASP  98  -1.824   7.864   2.205
  769   2HB   ASP  98          2HB       ASP  98  -2.286   6.323   1.509
  770    H    VAL  99           H        VAL  99  -0.479   4.691   2.787
  771    HA   VAL  99           HA       VAL  99  -2.274   2.539   2.261
  772    HB   VAL  99           HB       VAL  99   0.717   2.904   2.184
  773   1HG1  VAL  99          1HG1      VAL  99  -0.751   0.414   2.359
  774   2HG1  VAL  99          2HG1      VAL  99   0.073   0.546   0.786
  775   3HG1  VAL  99          3HG1      VAL  99   1.006   0.694   2.295
  776   1HG2  VAL  99          1HG2      VAL  99   0.084   2.315  -0.319
  777   2HG2  VAL  99          2HG2      VAL  99  -1.521   2.892   0.190
  778   3HG2  VAL  99          3HG2      VAL  99  -0.107   3.967   0.317
  779    H    SER 100           H        SER 100   0.252   3.280   4.745
  780    HA   SER 100           HA       SER 100   0.154   0.895   6.061
  781   1HB   SER 100          1HB       SER 100   1.746   2.840   6.444
  782   2HB   SER 100          2HB       SER 100   0.481   3.634   7.361
  783    HG   SER 100           HG       SER 100   0.636   2.138   8.986
  784    H    CYS 101           H        CYS 101  -2.254   3.415   5.820
  785    HA   CYS 101           HA       CYS 101  -3.562   2.891   8.271
  786   1HB   CYS 101          1HB       CYS 101  -3.696   4.980   6.700
  787   2HB   CYS 101          2HB       CYS 101  -4.939   4.071   5.864
  788    HG   CYS 101           HG       CYS 101  -6.156   5.674   7.472
  789    H    TYR 102           H        TYR 102  -3.966   1.865   4.820
  790    HA   TYR 102           HA       TYR 102  -6.284   0.384   5.124
  791   1HB   TYR 102          1HB       TYR 102  -4.512   1.088   3.139
  792   2HB   TYR 102          2HB       TYR 102  -3.963  -0.556   3.400
  793    HD1  TYR 102           1HD      TYR 102  -7.124   1.365   2.776
  794    HD2  TYR 102           2HD      TYR 102  -4.973  -2.290   2.216
  795    HE1  TYR 102           1HE      TYR 102  -8.976   0.499   1.266
  796    HE2  TYR 102           2HE      TYR 102  -6.833  -3.145   0.707
  797    HH   TYR 102           HH       TYR 102  -9.499  -1.048  -0.231
  798    H    PHE 103           H        PHE 103  -2.824  -0.719   5.305
  799    HA   PHE 103           HA       PHE 103  -3.491  -3.369   5.919
  800   1HB   PHE 103          1HB       PHE 103  -1.057  -1.568   6.457
  801   2HB   PHE 103          2HB       PHE 103  -1.021  -3.299   6.726
  802    HD1  PHE 103           1HD      PHE 103   0.363  -1.169   4.670
  803    HD2  PHE 103           2HD      PHE 103  -2.445  -4.337   4.382
  804    HE1  PHE 103           1HE      PHE 103   1.013  -1.527   2.272
  805    HE2  PHE 103           2HE      PHE 103  -1.795  -4.695   1.984
  806    HZ   PHE 103           HZ       PHE 103  -0.074  -3.286   0.958
  807    H    SER 104           H        SER 104  -2.808  -0.469   7.945
  808    HA   SER 104           HA       SER 104  -2.594  -1.790  10.348
  809   1HB   SER 104          1HB       SER 104  -1.969   0.566  10.051
  810   2HB   SER 104          2HB       SER 104  -3.631   1.007   9.716
  811    HG   SER 104           HG       SER 104  -3.991  -0.047  11.990
  812    H    LEU 105           H        LEU 105  -5.450  -0.599   8.512
  813    HA   LEU 105           HA       LEU 105  -7.297  -1.126  10.598
  814   1HB   LEU 105          1HB       LEU 105  -7.280   0.141   8.089
  815   2HB   LEU 105          2HB       LEU 105  -8.448  -1.158   7.952
  816    HG   LEU 105           HG       LEU 105  -8.912   0.154  10.446
  817   1HD1  LEU 105          1HD1      LEU 105  -7.618   1.984   9.022
  818   2HD1  LEU 105          2HD1      LEU 105  -9.229   2.197   8.295
  819   3HD1  LEU 105          3HD1      LEU 105  -9.011   2.396  10.051
  820   1HD2  LEU 105          1HD2      LEU 105 -11.029   0.860   8.961
  821   2HD2  LEU 105          2HD2      LEU 105 -10.363  -0.418   7.917
  822   3HD2  LEU 105          3HD2      LEU 105 -10.795  -0.783   9.605
  823    H    LEU 106           H        LEU 106  -5.941  -2.970   7.844
  824    HA   LEU 106           HA       LEU 106  -7.746  -5.056   7.809
  825   1HB   LEU 106          1HB       LEU 106  -4.998  -4.545   6.913
  826   2HB   LEU 106          2HB       LEU 106  -5.341  -6.236   7.223
  827    HG   LEU 106           HG       LEU 106  -7.417  -5.911   5.729
  828   1HD1  LEU 106          1HD1      LEU 106  -7.203  -3.381   5.800
  829   2HD1  LEU 106          2HD1      LEU 106  -5.848  -3.561   4.659
  830   3HD1  LEU 106          3HD1      LEU 106  -7.478  -4.114   4.202
  831   1HD2  LEU 106          1HD2      LEU 106  -5.708  -7.293   4.924
  832   2HD2  LEU 106          2HD2      LEU 106  -5.955  -6.093   3.633
  833   3HD2  LEU 106          3HD2      LEU 106  -4.569  -5.938   4.739
  834    H    GLU 107           H        GLU 107  -4.504  -5.096   9.460
  835    HA   GLU 107           HA       GLU 107  -4.989  -7.383  10.869
  836   1HB   GLU 107          1HB       GLU 107  -3.053  -5.168  10.940
  837   2HB   GLU 107          2HB       GLU 107  -3.319  -5.855  12.530
  838   1HG   GLU 107          1HG       GLU 107  -3.142  -8.136  10.945
  839   2HG   GLU 107          2HG       GLU 107  -2.014  -7.057  10.150
  840    H    GLY 108           H        GLY 108  -5.774  -3.964  11.663
  841   1HA   GLY 108          1HA       GLY 108  -7.021  -4.846  14.180
  842   2HA   GLY 108          2HA       GLY 108  -6.572  -3.207  13.750
  843    H    GLY 109           H        GLY 109  -8.400  -5.723  11.876
  844   1HA   GLY 109          1HA       GLY 109 -10.963  -4.746  12.297
  845   2HA   GLY 109          2HA       GLY 109 -10.310  -3.847  10.942
  846    H    ARG 110           H        ARG 110  -9.552  -7.255  11.869
  847    HA   ARG 110           HA       ARG 110 -10.361  -8.003   9.206
  848   1HB   ARG 110          1HB       ARG 110  -9.163 -10.127   9.682
  849   2HB   ARG 110          2HB       ARG 110  -8.136  -8.750  10.028
  850   1HG   ARG 110          1HG       ARG 110  -7.862  -9.506  12.145
  851   2HG   ARG 110          2HG       ARG 110  -9.573  -9.265  12.439
  852   1HD   ARG 110          1HD       ARG 110 -10.028 -11.555  11.463
  853   2HD   ARG 110          2HD       ARG 110  -8.302 -11.792  11.278
  854    HE   ARG 110           HE       ARG 110  -8.913 -11.019  13.995
  855   1HH1  ARG 110          2HH2      ARG 110  -9.083 -13.753  11.787
  856   2HH1  ARG 110          1HH2      ARG 110  -9.009 -14.939  13.047
  857   1HH2  ARG 110          2HH1      ARG 110  -8.814 -12.583  15.658
  858   2HH2  ARG 110          1HH1      ARG 110  -8.854 -14.269  15.264
  859    HA   PRO 111           HA       PRO 111 -13.973  -9.938  10.713
  860   1HB   PRO 111          1HB       PRO 111 -14.578 -11.579   8.613
  861   2HB   PRO 111          2HB       PRO 111 -14.965  -9.870   8.636
  862   1HG   PRO 111          1HG       PRO 111 -12.825 -11.266   7.150
  863   2HG   PRO 111          2HG       PRO 111 -13.494  -9.670   6.872
  864   1HD   PRO 111          1HD       PRO 111 -10.983 -10.286   8.114
  865   2HD   PRO 111          2HD       PRO 111 -11.705  -8.698   7.940
  866    H    GLU 112           H        GLU 112 -14.973 -11.891  11.528
  867    HA   GLU 112           HA       GLU 112 -12.829 -13.694  12.238
  868   1HB   GLU 112          1HB       GLU 112 -15.598 -13.150  13.344
  869   2HB   GLU 112          2HB       GLU 112 -14.744 -14.615  13.786
  870   1HG   GLU 112          1HG       GLU 112 -12.742 -13.067  14.397
  871   2HG   GLU 112          2HG       GLU 112 -13.877 -11.737  14.275
  872    H    ASP 113           H        ASP 113 -15.572 -13.427  10.109
  873    HA   ASP 113           HA       ASP 113 -15.346 -16.289   9.596
  874   1HB   ASP 113          1HB       ASP 113 -17.716 -14.535   9.977
  875   2HB   ASP 113          2HB       ASP 113 -17.816 -15.547   8.550
  876    H    LYS 114           H        LYS 114 -13.598 -15.495   8.048
  877    HA   LYS 114           HA       LYS 114 -14.234 -13.700   5.975
  878   1HB   LYS 114          1HB       LYS 114 -12.102 -14.270   5.081
  879   2HB   LYS 114          2HB       LYS 114 -11.942 -14.236   6.825
  880   1HG   LYS 114          1HG       LYS 114 -12.741 -16.906   5.958
  881   2HG   LYS 114          2HG       LYS 114 -11.319 -16.395   5.071
  882   1HD   LYS 114          1HD       LYS 114 -10.043 -16.057   7.074
  883   2HD   LYS 114          2HD       LYS 114 -11.472 -16.055   8.088
  884   1HE   LYS 114          1HE       LYS 114 -10.662 -18.509   6.474
  885   2HE   LYS 114          2HE       LYS 114 -10.024 -18.211   8.079
  886   1HZ   LYS 114          1HZ       LYS 114 -12.352 -18.058   8.833
  887   2HZ   LYS 114          2HZ       LYS 114 -12.850 -18.532   7.352
  888   3HZ   LYS 114          3HZ       LYS 114 -11.947 -19.537   8.270
  889    H    LEU 115           H        LEU 115 -13.853 -14.580   3.551
  890    HA   LEU 115           HA       LEU 115 -16.135 -16.181   3.047
  891   1HB   LEU 115          1HB       LEU 115 -14.077 -14.738   1.467
  892   2HB   LEU 115          2HB       LEU 115 -14.913 -16.051   0.662
  893    HG   LEU 115           HG       LEU 115 -16.944 -14.556   1.904
  894   1HD1  LEU 115          1HD1      LEU 115 -15.102 -12.796   2.146
  895   2HD1  LEU 115          2HD1      LEU 115 -15.192 -12.635   0.375
  896   3HD1  LEU 115          3HD1      LEU 115 -16.626 -12.295   1.374
  897   1HD2  LEU 115          1HD2      LEU 115 -17.008 -15.770  -0.263
  898   2HD2  LEU 115          2HD2      LEU 115 -17.686 -14.126  -0.344
  899   3HD2  LEU 115          3HD2      LEU 115 -16.060 -14.450  -0.991
  900    H    GLU 116           H        GLU 116 -15.733 -18.031   1.214
  901    HA   GLU 116           HA       GLU 116 -13.455 -19.622   1.958
  902   1HB   GLU 116          1HB       GLU 116 -15.968 -21.199   2.006
  903   2HB   GLU 116          2HB       GLU 116 -14.551 -21.323   3.030
  904   1HG   GLU 116          1HG       GLU 116 -15.271 -19.290   4.289
  905   2HG   GLU 116          2HG       GLU 116 -16.677 -19.139   3.253
  906    H    TRP 117           H        TRP 117 -12.665 -20.714   0.182
  907    HA   TRP 117           HA       TRP 117 -14.135 -20.398  -2.282
  908   1HB   TRP 117          1HB       TRP 117 -11.370 -21.363  -1.577
  909   2HB   TRP 117          2HB       TRP 117 -12.026 -21.536  -3.193
  910    HD1  TRP 117           HD       TRP 117 -12.472 -18.371  -0.966
  911    HE1  TRP 117           1HE      TRP 117 -11.433 -16.250  -2.143
  912    HE3  TRP 117           3HE      TRP 117 -10.493 -20.884  -4.919
  913    HZ2  TRP 117           2HZ      TRP 117  -9.934 -15.870  -4.541
  914    HZ3  TRP 117           3HZ      TRP 117  -9.256 -19.562  -6.634
  915    HH2  TRP 117           HH       TRP 117  -8.962 -17.140  -6.491
  916    H    SER 118           H        SER 118 -14.057 -22.583   0.318
  917    HA   SER 118           HA       SER 118 -14.343 -24.934  -1.292
  918   1HB   SER 118          1HB       SER 118 -13.989 -24.290   1.574
  919   2HB   SER 118          2HB       SER 118 -15.095 -25.621   1.301
  920    HG   SER 118           HG       SER 118 -13.080 -26.573   1.395
  Start of MODEL   14
    1   1H    MET   1           H        MET   1  -4.562  15.020   2.101
    2    HA   MET   1           HA       MET   1  -7.004  14.610   1.605
    3   1HB   MET   1          1HB       MET   1  -4.536  13.809   0.224
    4   2HB   MET   1          2HB       MET   1  -5.844  12.730  -0.219
    5   1HG   MET   1          1HG       MET   1  -6.721  15.545  -0.191
    6   2HG   MET   1          2HG       MET   1  -5.370  15.299  -1.279
    7   1HE   MET   1          1HE       MET   1  -6.736  14.166  -4.270
    8   2HE   MET   1          2HE       MET   1  -5.365  14.637  -3.237
    9   3HE   MET   1          3HE       MET   1  -5.784  12.918  -3.432
   10    H    ALA   2           H        ALA   2  -8.678  13.065   1.542
   11    HA   ALA   2           HA       ALA   2  -7.984  10.333   2.283
   12   1HB   ALA   2          1HB       ALA   2  -8.533  11.824   4.337
   13   2HB   ALA   2          2HB       ALA   2 -10.204  11.801   3.726
   14   3HB   ALA   2          3HB       ALA   2  -9.398  10.278   4.170
   15    H    LYS   3           H        LYS   3  -8.547  11.046  -0.276
   16    HA   LYS   3           HA       LYS   3 -11.363  11.031  -0.762
   17   1HB   LYS   3          1HB       LYS   3  -9.665  12.190  -2.194
   18   2HB   LYS   3          2HB       LYS   3  -9.067  10.623  -2.699
   19   1HG   LYS   3          1HG       LYS   3 -10.628  10.736  -4.354
   20   2HG   LYS   3          2HG       LYS   3 -11.797  10.333  -3.113
   21   1HD   LYS   3          1HD       LYS   3 -12.681  12.448  -3.076
   22   2HD   LYS   3          2HD       LYS   3 -11.108  13.214  -3.162
   23   1HE   LYS   3          1HE       LYS   3 -11.948  13.805  -5.253
   24   2HE   LYS   3          2HE       LYS   3 -11.133  12.312  -5.674
   25   1HZ   LYS   3          1HZ       LYS   3 -13.827  11.989  -4.749
   26   2HZ   LYS   3          2HZ       LYS   3 -13.686  12.791  -6.164
   27   3HZ   LYS   3          3HZ       LYS   3 -13.067  11.288  -6.013
   28    H    GLU   4           H        GLU   4 -10.102   8.986  -3.071
   29    HA   GLU   4           HA       GLU   4  -9.754   6.576  -1.992
   30   1HB   GLU   4          1HB       GLU   4 -12.467   7.419  -1.453
   31   2HB   GLU   4          2HB       GLU   4 -12.519   6.063  -2.561
   32   1HG   GLU   4          1HG       GLU   4 -11.590   4.582  -1.030
   33   2HG   GLU   4          2HG       GLU   4 -10.603   5.813  -0.268
   34    H    ARG   5           H        ARG   5 -10.005   4.794  -3.598
   35    HA   ARG   5           HA       ARG   5 -10.649   5.850  -6.230
   36   1HB   ARG   5          1HB       ARG   5  -8.141   4.515  -5.258
   37   2HB   ARG   5          2HB       ARG   5  -8.713   4.003  -6.833
   38   1HG   ARG   5          1HG       ARG   5  -8.841   6.927  -6.554
   39   2HG   ARG   5          2HG       ARG   5  -7.220   6.331  -6.254
   40   1HD   ARG   5          1HD       ARG   5  -8.581   5.100  -8.610
   41   2HD   ARG   5          2HD       ARG   5  -8.258   6.816  -8.766
   42    HE   ARG   5           HE       ARG   5  -5.923   5.464  -7.738
   43   1HH1  ARG   5          2HH2      ARG   5  -7.755   5.951 -10.703
   44   2HH1  ARG   5          1HH2      ARG   5  -6.390   5.696 -11.739
   45   1HH2  ARG   5          2HH1      ARG   5  -4.122   5.128  -9.104
   46   2HH2  ARG   5          1HH1      ARG   5  -4.310   5.224 -10.823
   47    H    GLY   6           H        GLY   6 -10.391   3.582  -7.791
   48   1HA   GLY   6          1HA       GLY   6 -12.633   2.174  -7.632
   49   2HA   GLY   6          2HA       GLY   6 -11.128   1.460  -8.177
   50    H    LEU   7           H        LEU   7 -13.425   1.771  -5.494
   51    HA   LEU   7           HA       LEU   7 -12.150   0.715  -3.383
   52   1HB   LEU   7          1HB       LEU   7 -14.928   0.088  -4.388
   53   2HB   LEU   7          2HB       LEU   7 -14.341  -0.336  -2.792
   54    HG   LEU   7           HG       LEU   7 -13.790   2.383  -2.969
   55   1HD1  LEU   7          1HD1      LEU   7 -15.261   3.478  -4.233
   56   2HD1  LEU   7          2HD1      LEU   7 -15.595   1.915  -5.017
   57   3HD1  LEU   7          3HD1      LEU   7 -16.619   2.473  -3.672
   58   1HD2  LEU   7          1HD2      LEU   7 -15.850   0.692  -1.616
   59   2HD2  LEU   7          2HD2      LEU   7 -14.532   1.670  -0.927
   60   3HD2  LEU   7          3HD2      LEU   7 -16.006   2.463  -1.533
   61    H    ILE   8           H        ILE   8 -10.703  -0.913  -3.262
   62    HA   ILE   8           HA       ILE   8 -10.472  -2.924  -5.152
   63    HB   ILE   8           HB       ILE   8  -8.770  -2.079  -3.500
   64   1HG1  ILE   8          1HG1      ILE   8  -8.971  -5.094  -3.552
   65   2HG1  ILE   8          2HG1      ILE   8  -8.622  -4.160  -4.993
   66   1HG2  ILE   8          1HG2      ILE   8 -10.528  -2.632  -1.568
   67   2HG2  ILE   8          2HG2      ILE   8  -9.634  -4.171  -1.568
   68   3HG2  ILE   8          3HG2      ILE   8  -8.768  -2.639  -1.300
   69   1HD1  ILE   8          1HD1      ILE   8  -6.444  -4.254  -4.348
   70   2HD1  ILE   8          2HD1      ILE   8  -6.878  -3.055  -3.106
   71   3HD1  ILE   8          3HD1      ILE   8  -6.877  -4.789  -2.707
   72    H    SER   9           H        SER   9 -12.117  -4.279  -5.687
   73    HA   SER   9           HA       SER   9 -14.198  -4.960  -4.107
   74   1HB   SER   9          1HB       SER   9 -13.124  -5.759  -6.641
   75   2HB   SER   9          2HB       SER   9 -13.518  -7.230  -5.774
   76    HG   SER   9           HG       SER   9 -15.452  -6.743  -6.675
   77    HA   PRO  10           HA       PRO  10 -12.871  -8.179  -1.477
   78   1HB   PRO  10          1HB       PRO  10 -14.674 -10.218  -1.729
   79   2HB   PRO  10          2HB       PRO  10 -14.996  -8.761  -0.809
   80   1HG   PRO  10          1HG       PRO  10 -16.026  -9.540  -3.468
   81   2HG   PRO  10          2HG       PRO  10 -16.646  -8.330  -2.362
   82   1HD   PRO  10          1HD       PRO  10 -15.116  -7.857  -4.743
   83   2HD   PRO  10          2HD       PRO  10 -15.636  -6.658  -3.575
   84    H    SER  11           H        SER  11 -12.497  -8.552  -4.678
   85    HA   SER  11           HA       SER  11 -11.646 -11.252  -4.650
   86   1HB   SER  11          1HB       SER  11 -12.316  -9.370  -6.607
   87   2HB   SER  11          2HB       SER  11 -10.587  -9.554  -6.821
   88    HG   SER  11           HG       SER  11 -12.428 -11.163  -7.780
   89    H    ASP  12           H        ASP  12 -10.014  -8.010  -4.792
   90    HA   ASP  12           HA       ASP  12  -7.446  -9.156  -4.697
   91   1HB   ASP  12          1HB       ASP  12  -8.627  -6.554  -5.026
   92   2HB   ASP  12          2HB       ASP  12  -7.489  -6.431  -3.699
   93    H    PHE  13           H        PHE  13  -9.798  -7.751  -2.359
   94    HA   PHE  13           HA       PHE  13  -8.149  -7.481  -0.165
   95   1HB   PHE  13          1HB       PHE  13 -10.801  -7.105  -0.823
   96   2HB   PHE  13          2HB       PHE  13 -10.960  -8.571   0.124
   97    HD1  PHE  13           1HD      PHE  13 -11.192  -5.158   0.328
   98    HD2  PHE  13           2HD      PHE  13  -9.445  -8.418   2.409
   99    HE1  PHE  13           1HE      PHE  13 -11.167  -3.799   2.437
  100    HE2  PHE  13           2HE      PHE  13  -9.420  -7.059   4.518
  101    HZ   PHE  13           HZ       PHE  13 -10.281  -4.765   4.507
  102    H    ALA  14           H        ALA  14  -9.766 -10.372  -1.533
  103    HA   ALA  14           HA       ALA  14  -9.377 -12.030   0.701
  104   1HB   ALA  14          1HB       ALA  14 -10.156 -13.736  -0.708
  105   2HB   ALA  14          2HB       ALA  14 -10.882 -12.276  -1.422
  106   3HB   ALA  14          3HB       ALA  14  -9.433 -13.002  -2.160
  107    H    GLN  15           H        GLN  15  -7.497 -11.621  -2.383
  108    HA   GLN  15           HA       GLN  15  -5.548 -13.427  -1.836
  109   1HB   GLN  15          1HB       GLN  15  -6.043 -11.490  -3.790
  110   2HB   GLN  15          2HB       GLN  15  -4.514 -10.973  -3.108
  111   1HG   GLN  15          1HG       GLN  15  -3.902 -12.488  -4.842
  112   2HG   GLN  15          2HG       GLN  15  -3.722 -13.421  -3.369
  113   1HE2  GLN  15          1HE2      GLN  15  -3.876 -15.071  -5.187
  114   2HE2  GLN  15          2HE2      GLN  15  -5.439 -15.744  -5.511
  115    H    LEU  16           H        LEU  16  -5.501  -9.865  -1.090
  116    HA   LEU  16           HA       LEU  16  -3.060  -9.867   0.215
  117   1HB   LEU  16          1HB       LEU  16  -4.814  -7.998  -0.558
  118   2HB   LEU  16          2HB       LEU  16  -5.207  -8.039   1.149
  119    HG   LEU  16           HG       LEU  16  -2.874  -7.533   1.724
  120   1HD1  LEU  16          1HD1      LEU  16  -2.463  -7.623  -1.267
  121   2HD1  LEU  16          2HD1      LEU  16  -1.352  -6.771  -0.167
  122   3HD1  LEU  16          3HD1      LEU  16  -1.604  -8.525   0.005
  123   1HD2  LEU  16          1HD2      LEU  16  -3.960  -5.567  -0.309
  124   2HD2  LEU  16          2HD2      LEU  16  -4.532  -5.722   1.369
  125   3HD2  LEU  16          3HD2      LEU  16  -2.855  -5.222   1.044
  126    H    GLN  17           H        GLN  17  -6.382 -10.576   1.401
  127    HA   GLN  17           HA       GLN  17  -5.805 -10.619   4.075
  128   1HB   GLN  17          1HB       GLN  17  -7.940 -11.529   2.314
  129   2HB   GLN  17          2HB       GLN  17  -7.694 -12.692   3.601
  130   1HG   GLN  17          1HG       GLN  17  -7.553 -10.300   4.996
  131   2HG   GLN  17          2HG       GLN  17  -8.711  -9.899   3.744
  132   1HE2  GLN  17          1HE2      GLN  17 -10.461 -11.506   3.359
  133   2HE2  GLN  17          2HE2      GLN  17 -11.188 -12.279   4.729
  134    H    LYS  18           H        LYS  18  -5.839 -13.414   1.743
  135    HA   LYS  18           HA       LYS  18  -4.935 -15.310   3.548
  136   1HB   LYS  18          1HB       LYS  18  -5.921 -15.536   1.157
  137   2HB   LYS  18          2HB       LYS  18  -4.266 -15.367   0.609
  138   1HG   LYS  18          1HG       LYS  18  -3.552 -17.335   1.802
  139   2HG   LYS  18          2HG       LYS  18  -5.015 -17.380   2.766
  140   1HD   LYS  18          1HD       LYS  18  -5.133 -17.640  -0.263
  141   2HD   LYS  18          2HD       LYS  18  -4.805 -19.034   0.748
  142   1HE   LYS  18          1HE       LYS  18  -7.197 -17.253   1.330
  143   2HE   LYS  18          2HE       LYS  18  -7.297 -18.487   0.090
  144   1HZ   LYS  18          1HZ       LYS  18  -6.556 -20.084   1.788
  145   2HZ   LYS  18          2HZ       LYS  18  -6.650 -18.912   2.922
  146   3HZ   LYS  18          3HZ       LYS  18  -7.997 -19.400   2.138
  147    H    TYR  19           H        TYR  19  -3.017 -13.444   1.084
  148    HA   TYR  19           HA       TYR  19  -0.536 -14.352   1.806
  149   1HB   TYR  19          1HB       TYR  19  -1.698 -11.680   0.840
  150   2HB   TYR  19          2HB       TYR  19   0.036 -11.880   0.995
  151    HD1  TYR  19           1HD      TYR  19  -2.026 -11.479  -1.477
  152    HD2  TYR  19           2HD      TYR  19   0.355 -14.699   0.029
  153    HE1  TYR  19           1HE      TYR  19  -1.932 -12.507  -3.801
  154    HE2  TYR  19           2HE      TYR  19   0.441 -15.715  -2.300
  155    HH   TYR  19           HH       TYR  19  -1.277 -15.507  -4.418
  156    H    MET  20           H        MET  20  -2.440 -11.618   3.213
  157    HA   MET  20           HA       MET  20  -0.411 -10.718   4.869
  158   1HB   MET  20          1HB       MET  20  -3.447 -10.547   4.827
  159   2HB   MET  20          2HB       MET  20  -2.597  -9.925   6.228
  160   1HG   MET  20          1HG       MET  20  -1.258  -8.412   4.787
  161   2HG   MET  20          2HG       MET  20  -2.004  -9.080   3.349
  162   1HE   MET  20          1HE       MET  20  -2.454  -7.732   6.692
  163   2HE   MET  20          2HE       MET  20  -3.259  -6.176   6.375
  164   3HE   MET  20          3HE       MET  20  -4.223  -7.597   6.842
  165    H    GLU  21           H        GLU  21  -3.262 -12.855   5.619
  166    HA   GLU  21           HA       GLU  21  -2.684 -13.301   8.231
  167   1HB   GLU  21          1HB       GLU  21  -4.238 -14.656   6.111
  168   2HB   GLU  21          2HB       GLU  21  -3.705 -15.749   7.373
  169   1HG   GLU  21          1HG       GLU  21  -4.568 -13.595   8.877
  170   2HG   GLU  21          2HG       GLU  21  -5.662 -13.506   7.511
  171    H    TYR  22           H        TYR  22  -1.599 -15.256   5.365
  172    HA   TYR  22           HA       TYR  22  -0.221 -17.229   6.564
  173   1HB   TYR  22          1HB       TYR  22  -0.481 -16.044   4.046
  174   2HB   TYR  22          2HB       TYR  22   1.198 -15.685   4.393
  175    HD1  TYR  22           1HD      TYR  22   2.186 -18.062   5.754
  176    HD2  TYR  22           2HD      TYR  22  -0.550 -17.759   2.479
  177    HE1  TYR  22           1HE      TYR  22   2.838 -20.396   4.984
  178    HE2  TYR  22           2HE      TYR  22   0.111 -20.094   1.720
  179    HH   TYR  22           HH       TYR  22   1.723 -21.662   1.927
  180    H    SER  23           H        SER  23   0.825 -13.803   6.200
  181    HA   SER  23           HA       SER  23   3.304 -14.482   7.520
  182   1HB   SER  23          1HB       SER  23   3.917 -12.987   5.893
  183   2HB   SER  23          2HB       SER  23   2.322 -12.266   5.804
  184    HG   SER  23           HG       SER  23   4.416 -11.721   7.717
  185    H    THR  24           H        THR  24   4.043 -12.847   9.303
  186    HA   THR  24           HA       THR  24   1.799 -11.777  10.828
  187    HB   THR  24           HB       THR  24   3.012 -13.000  12.866
  188    HG1  THR  24           1HG      THR  24   3.927 -15.032  11.980
  189   1HG2  THR  24          1HG2      THR  24   1.744 -15.172  11.360
  190   2HG2  THR  24          2HG2      THR  24   1.178 -14.367  12.844
  191   3HG2  THR  24          3HG2      THR  24   0.774 -13.683  11.251
  192    H    LYS  25           H        LYS  25   3.073  -9.960   9.620
  193    HA   LYS  25           HA       LYS  25   5.075  -9.027  11.548
  194   1HB   LYS  25          1HB       LYS  25   5.396  -9.499   8.665
  195   2HB   LYS  25          2HB       LYS  25   5.854  -7.881   9.158
  196   1HG   LYS  25          1HG       LYS  25   6.793 -10.189  10.860
  197   2HG   LYS  25          2HG       LYS  25   7.573  -9.946   9.310
  198   1HD   LYS  25          1HD       LYS  25   7.389  -7.356  10.488
  199   2HD   LYS  25          2HD       LYS  25   7.892  -8.426  11.781
  200   1HE   LYS  25          1HE       LYS  25   9.279  -8.829   9.157
  201   2HE   LYS  25          2HE       LYS  25   9.624  -7.316   9.971
  202   1HZ   LYS  25          1HZ       LYS  25  11.026  -8.502  11.171
  203   2HZ   LYS  25          2HZ       LYS  25   9.746  -9.166  11.937
  204   3HZ   LYS  25          3HZ       LYS  25  10.428  -9.936  10.669
  205    H    LYS  26           H        LYS  26   5.382  -6.531  11.249
  206    HA   LYS  26           HA       LYS  26   2.679  -5.429  10.980
  207   1HB   LYS  26          1HB       LYS  26   5.060  -4.422  12.567
  208   2HB   LYS  26          2HB       LYS  26   3.504  -3.625  12.463
  209   1HG   LYS  26          1HG       LYS  26   3.421  -6.518  13.226
  210   2HG   LYS  26          2HG       LYS  26   4.154  -5.448  14.404
  211   1HD   LYS  26          1HD       LYS  26   2.115  -3.979  14.315
  212   2HD   LYS  26          2HD       LYS  26   1.380  -5.087  13.173
  213   1HE   LYS  26          1HE       LYS  26   0.645  -6.387  14.879
  214   2HE   LYS  26          2HE       LYS  26   2.295  -6.658  15.404
  215   1HZ   LYS  26          1HZ       LYS  26   0.750  -4.264  16.115
  216   2HZ   LYS  26          2HZ       LYS  26   0.858  -5.588  17.064
  217   3HZ   LYS  26          3HZ       LYS  26   2.196  -4.716  16.725
  218    H    VAL  27           H        VAL  27   2.339  -3.493   9.785
  219    HA   VAL  27           HA       VAL  27   4.062  -3.267   7.534
  220    HB   VAL  27           HB       VAL  27   1.601  -3.039   7.483
  221   1HG1  VAL  27          1HG1      VAL  27   0.609  -0.849   8.181
  222   2HG1  VAL  27          2HG1      VAL  27   1.181  -1.849   9.538
  223   3HG1  VAL  27          3HG1      VAL  27   2.147  -0.459   8.987
  224   1HG2  VAL  27          1HG2      VAL  27   3.459  -1.747   5.967
  225   2HG2  VAL  27          2HG2      VAL  27   1.708  -1.728   5.645
  226   3HG2  VAL  27          3HG2      VAL  27   2.467  -0.377   6.521
  227    H    SER  28           H        SER  28   3.637  -1.586  10.639
  228    HA   SER  28           HA       SER  28   4.975   0.742   9.929
  229   1HB   SER  28          1HB       SER  28   4.993   1.238  12.263
  230   2HB   SER  28          2HB       SER  28   3.537   0.300  12.001
  231    HG   SER  28           HG       SER  28   4.278  -1.020  13.506
  232    H    ASP  29           H        ASP  29   6.058  -2.480  11.056
  233    HA   ASP  29           HA       ASP  29   8.689  -1.670  11.598
  234   1HB   ASP  29          1HB       ASP  29   7.381  -4.363  11.039
  235   2HB   ASP  29          2HB       ASP  29   9.100  -4.232  11.354
  236    H    VAL  30           H        VAL  30   6.864  -2.867   8.759
  237    HA   VAL  30           HA       VAL  30   9.172  -3.414   7.181
  238    HB   VAL  30           HB       VAL  30   6.237  -3.076   6.544
  239   1HG1  VAL  30          1HG1      VAL  30   6.638  -3.253   4.348
  240   2HG1  VAL  30          2HG1      VAL  30   8.337  -2.878   4.724
  241   3HG1  VAL  30          3HG1      VAL  30   7.809  -4.572   4.591
  242   1HG2  VAL  30          1HG2      VAL  30   7.801  -5.652   6.468
  243   2HG2  VAL  30          2HG2      VAL  30   7.140  -5.032   8.001
  244   3HG2  VAL  30          3HG2      VAL  30   6.048  -5.398   6.644
  245    H    LEU  31           H        LEU  31   6.833  -0.686   7.526
  246    HA   LEU  31           HA       LEU  31   7.974   0.827   5.435
  247   1HB   LEU  31          1HB       LEU  31   6.154   1.480   7.744
  248   2HB   LEU  31          2HB       LEU  31   6.697   2.699   6.608
  249    HG   LEU  31           HG       LEU  31   5.021   0.253   5.997
  250   1HD1  LEU  31          1HD1      LEU  31   4.458   3.203   6.174
  251   2HD1  LEU  31          2HD1      LEU  31   3.454   2.134   5.165
  252   3HD1  LEU  31          3HD1      LEU  31   3.590   1.837   6.915
  253   1HD2  LEU  31          1HD2      LEU  31   6.411   2.182   4.151
  254   2HD2  LEU  31          2HD2      LEU  31   6.350   0.404   4.093
  255   3HD2  LEU  31          3HD2      LEU  31   4.909   1.358   3.669
  256    H    LYS  32           H        LYS  32   8.922   0.116   8.716
  257    HA   LYS  32           HA       LYS  32  10.314   2.457   9.313
  258   1HB   LYS  32          1HB       LYS  32  10.153  -0.308  10.329
  259   2HB   LYS  32          2HB       LYS  32  11.693   0.476  10.620
  260   1HG   LYS  32          1HG       LYS  32   9.869   2.499  11.234
  261   2HG   LYS  32          2HG       LYS  32   9.033   1.062  11.786
  262   1HD   LYS  32          1HD       LYS  32  10.358   1.830  13.647
  263   2HD   LYS  32          2HD       LYS  32  11.155   0.394  13.035
  264   1HE   LYS  32          1HE       LYS  32  13.012   1.558  12.346
  265   2HE   LYS  32          2HE       LYS  32  12.068   2.896  11.721
  266   1HZ   LYS  32          1HZ       LYS  32  13.251   3.665  13.575
  267   2HZ   LYS  32          2HZ       LYS  32  11.702   3.534  14.077
  268   3HZ   LYS  32          3HZ       LYS  32  12.802   2.410  14.519
  269    H    LEU  33           H        LEU  33  10.973  -0.202   7.102
  270    HA   LEU  33           HA       LEU  33  13.778   0.431   6.927
  271   1HB   LEU  33          1HB       LEU  33  12.063  -1.415   5.260
  272   2HB   LEU  33          2HB       LEU  33  13.812  -1.317   5.227
  273    HG   LEU  33           HG       LEU  33  12.777  -1.815   7.920
  274   1HD1  LEU  33          1HD1      LEU  33  11.839  -3.947   7.650
  275   2HD1  LEU  33          2HD1      LEU  33  11.049  -2.944   6.410
  276   3HD1  LEU  33          3HD1      LEU  33  12.356  -4.062   5.951
  277   1HD2  LEU  33          1HD2      LEU  33  14.611  -3.187   8.104
  278   2HD2  LEU  33          2HD2      LEU  33  14.568  -3.668   6.391
  279   3HD2  LEU  33          3HD2      LEU  33  15.161  -2.053   6.847
  280    H    PHE  34           H        PHE  34  10.729   1.340   5.400
  281    HA   PHE  34           HA       PHE  34  11.961   2.366   3.040
  282   1HB   PHE  34          1HB       PHE  34   9.254   2.456   4.453
  283   2HB   PHE  34          2HB       PHE  34   9.523   3.511   3.081
  284    HD1  PHE  34           1HD      PHE  34   9.540  -0.054   4.108
  285    HD2  PHE  34           2HD      PHE  34   9.309   2.700   0.888
  286    HE1  PHE  34           1HE      PHE  34   8.937  -1.927   2.550
  287    HE2  PHE  34           2HE      PHE  34   8.706   0.827  -0.671
  288    HZ   PHE  34           HZ       PHE  34   8.527  -1.464   0.179
  289    H    GLU  35           H        GLU  35  11.815   3.411   6.296
  290    HA   GLU  35           HA       GLU  35  11.952   6.196   5.472
  291   1HB   GLU  35          1HB       GLU  35  11.638   6.679   7.924
  292   2HB   GLU  35          2HB       GLU  35  10.299   5.810   7.201
  293   1HG   GLU  35          1HG       GLU  35  11.211   3.657   8.076
  294   2HG   GLU  35          2HG       GLU  35  12.572   4.510   8.777
  295    H    ASP  36           H        ASP  36  13.634   3.644   7.402
  296    HA   ASP  36           HA       ASP  36  15.987   5.362   7.326
  297   1HB   ASP  36          1HB       ASP  36  14.855   3.484   9.349
  298   2HB   ASP  36          2HB       ASP  36  16.589   3.352   9.130
  299    H    GLY  37           H        GLY  37  14.530   2.159   6.695
  300   1HA   GLY  37          1HA       GLY  37  16.899   0.728   6.123
  301   2HA   GLY  37          2HA       GLY  37  15.267   0.315   5.638
  302    H    GLU  38           H        GLU  38  17.298  -0.230   3.857
  303    HA   GLU  38           HA       GLU  38  17.945   1.855   2.156
  304   1HB   GLU  38          1HB       GLU  38  18.926   0.216   0.808
  305   2HB   GLU  38          2HB       GLU  38  18.888  -0.590   2.364
  306   1HG   GLU  38          1HG       GLU  38  16.531  -1.480   1.586
  307   2HG   GLU  38          2HG       GLU  38  17.056  -1.015  -0.019
  308    H    MET  39           H        MET  39  15.006  -0.033   2.557
  309    HA   MET  39           HA       MET  39  13.949   0.129   0.038
  310   1HB   MET  39          1HB       MET  39  12.811   0.070   2.858
  311   2HB   MET  39          2HB       MET  39  11.705   0.268   1.514
  312   1HG   MET  39          1HG       MET  39  13.762  -1.951   1.393
  313   2HG   MET  39          2HG       MET  39  12.342  -2.169   2.396
  314   1HE   MET  39          1HE       MET  39  12.823  -2.736  -1.931
  315   2HE   MET  39          2HE       MET  39  13.101  -1.008  -1.605
  316   3HE   MET  39          3HE       MET  39  14.007  -2.243  -0.697
  317    H    ALA  40           H        ALA  40  14.686   2.685   2.250
  318    HA   ALA  40           HA       ALA  40  12.628   4.475   1.405
  319   1HB   ALA  40          1HB       ALA  40  13.646   5.992   2.887
  320   2HB   ALA  40          2HB       ALA  40  14.000   4.409   3.619
  321   3HB   ALA  40          3HB       ALA  40  15.255   5.258   2.685
  322    H    LYS  41           H        LYS  41  15.199   3.102  -0.223
  323    HA   LYS  41           HA       LYS  41  16.323   5.374  -1.468
  324   1HB   LYS  41          1HB       LYS  41  17.453   3.817  -2.865
  325   2HB   LYS  41          2HB       LYS  41  17.387   3.114  -1.261
  326   1HG   LYS  41          1HG       LYS  41  16.025   1.390  -1.926
  327   2HG   LYS  41          2HG       LYS  41  15.045   2.422  -2.948
  328   1HD   LYS  41          1HD       LYS  41  16.493   2.204  -4.802
  329   2HD   LYS  41          2HD       LYS  41  17.877   1.796  -3.807
  330   1HE   LYS  41          1HE       LYS  41  15.620  -0.132  -3.586
  331   2HE   LYS  41          2HE       LYS  41  16.322  -0.039  -5.188
  332   1HZ   LYS  41          1HZ       LYS  41  18.459  -0.075  -3.535
  333   2HZ   LYS  41          2HZ       LYS  41  17.428  -1.122  -2.821
  334   3HZ   LYS  41          3HZ       LYS  41  17.880  -1.352  -4.373
  335    H    TYR  42           H        TYR  42  13.355   3.528  -1.892
  336    HA   TYR  42           HA       TYR  42  12.872   4.980  -4.404
  337   1HB   TYR  42          1HB       TYR  42  12.110   2.308  -3.156
  338   2HB   TYR  42          2HB       TYR  42  10.955   3.032  -4.257
  339    HD1  TYR  42           1HD      TYR  42  14.464   3.707  -4.930
  340    HD2  TYR  42           2HD      TYR  42  11.245   0.990  -5.680
  341    HE1  TYR  42           1HE      TYR  42  15.735   2.735  -6.906
  342    HE2  TYR  42           2HE      TYR  42  12.527   0.027  -7.653
  343    HH   TYR  42           HH       TYR  42  15.837   1.018  -8.308
  344    H    VAL  43           H        VAL  43  12.607   6.445  -2.021
  345    HA   VAL  43           HA       VAL  43   9.682   6.635  -1.856
  346    HB   VAL  43           HB       VAL  43  11.727   6.856   0.357
  347   1HG1  VAL  43          1HG1      VAL  43   8.745   7.379   0.560
  348   2HG1  VAL  43          2HG1      VAL  43   9.963   7.532   1.848
  349   3HG1  VAL  43          3HG1      VAL  43   9.983   8.655   0.467
  350   1HG2  VAL  43          1HG2      VAL  43   9.291   5.061   0.182
  351   2HG2  VAL  43          2HG2      VAL  43  10.914   4.565  -0.355
  352   3HG2  VAL  43          3HG2      VAL  43  10.632   4.987   1.351
  353    H    GLN  44           H        GLN  44   8.884   8.622  -2.367
  354    HA   GLN  44           HA       GLN  44  10.862  10.765  -2.479
  355   1HB   GLN  44          1HB       GLN  44   8.569  10.072  -4.341
  356   2HB   GLN  44          2HB       GLN  44   9.209  11.703  -4.284
  357   1HG   GLN  44          1HG       GLN  44  11.554  10.600  -4.610
  358   2HG   GLN  44          2HG       GLN  44  10.675   9.149  -5.051
  359   1HE2  GLN  44          1HE2      GLN  44  10.535  12.658  -5.674
  360   2HE2  GLN  44          2HE2      GLN  44  10.294  12.566  -7.386
  361    H    GLY  45           H        GLY  45  10.479  12.454  -1.110
  362   1HA   GLY  45          1HA       GLY  45   9.439  13.672   0.480
  363   2HA   GLY  45          2HA       GLY  45   8.173  13.828  -0.722
  364    H    ASP  46           H        ASP  46   9.395  11.207   1.498
  365    HA   ASP  46           HA       ASP  46   8.363   9.816   2.802
  366   1HB   ASP  46          1HB       ASP  46   6.500  12.207   3.025
  367   2HB   ASP  46          2HB       ASP  46   6.154  10.732   3.906
  368    H    ALA  47           H        ALA  47   7.594  10.075  -0.178
  369    HA   ALA  47           HA       ALA  47   5.051   8.611   0.005
  370   1HB   ALA  47          1HB       ALA  47   5.792  10.233  -2.422
  371   2HB   ALA  47          2HB       ALA  47   4.184   9.775  -1.811
  372   3HB   ALA  47          3HB       ALA  47   5.112  11.057  -0.998
  373    H    ILE  48           H        ILE  48   4.742   7.205  -2.060
  374    HA   ILE  48           HA       ILE  48   7.297   6.312  -3.129
  375    HB   ILE  48           HB       ILE  48   7.050   4.944  -1.185
  376   1HG1  ILE  48          1HG1      ILE  48   6.390   3.519  -3.771
  377   2HG1  ILE  48          2HG1      ILE  48   7.974   3.813  -3.083
  378   1HG2  ILE  48          1HG2      ILE  48   4.405   3.874  -2.131
  379   2HG2  ILE  48          2HG2      ILE  48   5.149   3.800  -0.516
  380   3HG2  ILE  48          3HG2      ILE  48   4.486   5.338  -1.121
  381   1HD1  ILE  48          1HD1      ILE  48   7.654   1.630  -2.366
  382   2HD1  ILE  48          2HD1      ILE  48   6.923   2.490  -0.989
  383   3HD1  ILE  48          3HD1      ILE  48   5.886   1.811  -2.267
  384    H    GLY  49           H        GLY  49   7.076   5.129  -5.141
  385   1HA   GLY  49          1HA       GLY  49   4.683   5.946  -6.585
  386   2HA   GLY  49          2HA       GLY  49   6.172   5.305  -7.251
  387    H    TYR  50           H        TYR  50   4.001   4.216  -8.359
  388    HA   TYR  50           HA       TYR  50   2.872   2.054  -6.937
  389   1HB   TYR  50          1HB       TYR  50   1.681   2.899  -8.846
  390   2HB   TYR  50          2HB       TYR  50   3.149   3.105  -9.780
  391    HD1  TYR  50           1HD      TYR  50   2.664   1.951 -11.774
  392    HD2  TYR  50           2HD      TYR  50   1.994   0.022  -8.015
  393    HE1  TYR  50           1HE      TYR  50   2.204  -0.243 -12.974
  394    HE2  TYR  50           2HE      TYR  50   1.535  -2.166  -9.227
  395    HH   TYR  50           HH       TYR  50   1.462  -3.187 -11.124
  396    H    GLU  51           H        GLU  51   5.819   2.479  -8.888
  397    HA   GLU  51           HA       GLU  51   6.211  -0.250  -9.372
  398   1HB   GLU  51          1HB       GLU  51   7.300   1.941 -10.425
  399   2HB   GLU  51          2HB       GLU  51   8.509   1.698  -9.181
  400   1HG   GLU  51          1HG       GLU  51   8.538  -0.802 -10.047
  401   2HG   GLU  51          2HG       GLU  51   7.772  -0.140 -11.478
  402    H    GLY  52           H        GLY  52   7.681   2.049  -6.967
  403   1HA   GLY  52          1HA       GLY  52   9.297   0.256  -5.622
  404   2HA   GLY  52          2HA       GLY  52   8.570   1.694  -4.934
  405    H    PHE  53           H        PHE  53   5.757   0.756  -5.461
  406    HA   PHE  53           HA       PHE  53   5.339  -0.521  -3.012
  407   1HB   PHE  53          1HB       PHE  53   3.729   0.934  -4.335
  408   2HB   PHE  53          2HB       PHE  53   3.640  -0.305  -5.571
  409    HD1  PHE  53           1HD      PHE  53   2.264  -2.244  -5.284
  410    HD2  PHE  53           2HD      PHE  53   2.710   0.540  -2.112
  411    HE1  PHE  53           1HE      PHE  53   0.341  -3.312  -4.075
  412    HE2  PHE  53           2HE      PHE  53   0.788  -0.528  -0.904
  413    HZ   PHE  53           HZ       PHE  53  -0.374  -2.442  -1.899
  414    H    GLN  54           H        GLN  54   6.028  -1.742  -6.256
  415    HA   GLN  54           HA       GLN  54   4.875  -4.248  -5.964
  416   1HB   GLN  54          1HB       GLN  54   7.382  -3.668  -7.583
  417   2HB   GLN  54          2HB       GLN  54   6.143  -4.862  -7.915
  418   1HG   GLN  54          1HG       GLN  54   4.914  -2.230  -7.711
  419   2HG   GLN  54          2HG       GLN  54   6.253  -2.160  -8.840
  420   1HE2  GLN  54          1HE2      GLN  54   5.045  -1.968 -10.657
  421   2HE2  GLN  54          2HE2      GLN  54   4.043  -3.220 -11.312
  422    H    GLN  55           H        GLN  55   8.164  -2.976  -5.184
  423    HA   GLN  55           HA       GLN  55   9.077  -5.524  -4.354
  424   1HB   GLN  55          1HB       GLN  55  11.062  -4.205  -3.515
  425   2HB   GLN  55          2HB       GLN  55  10.695  -3.947  -5.209
  426   1HG   GLN  55          1HG       GLN  55   9.664  -1.809  -4.771
  427   2HG   GLN  55          2HG       GLN  55   9.585  -2.113  -3.047
  428   1HE2  GLN  55          1HE2      GLN  55  10.631   0.026  -3.050
  429   2HE2  GLN  55          2HE2      GLN  55  12.360   0.119  -3.115
  430    H    PHE  56           H        PHE  56   7.239  -2.918  -2.922
  431    HA   PHE  56           HA       PHE  56   7.980  -3.335  -0.238
  432   1HB   PHE  56          1HB       PHE  56   6.863  -1.282  -0.883
  433   2HB   PHE  56          2HB       PHE  56   5.645  -2.140  -1.806
  434    HD1  PHE  56           1HD      PHE  56   3.544  -2.422  -0.882
  435    HD2  PHE  56           2HD      PHE  56   6.839  -1.768   1.711
  436    HE1  PHE  56           1HE      PHE  56   1.980  -2.311   1.079
  437    HE2  PHE  56           2HE      PHE  56   5.276  -1.657   3.671
  438    HZ   PHE  56           HZ       PHE  56   2.865  -1.930   3.331
  439    H    LEU  57           H        LEU  57   5.432  -4.715  -2.378
  440    HA   LEU  57           HA       LEU  57   4.019  -6.031  -0.356
  441   1HB   LEU  57          1HB       LEU  57   4.278  -6.382  -3.328
  442   2HB   LEU  57          2HB       LEU  57   3.337  -7.507  -2.369
  443    HG   LEU  57           HG       LEU  57   2.716  -4.647  -1.916
  444   1HD1  LEU  57          1HD1      LEU  57   2.763  -5.776  -4.618
  445   2HD1  LEU  57          2HD1      LEU  57   1.174  -5.128  -4.144
  446   3HD1  LEU  57          3HD1      LEU  57   2.616  -4.087  -4.075
  447   1HD2  LEU  57          1HD2      LEU  57   1.558  -7.028  -1.243
  448   2HD2  LEU  57          2HD2      LEU  57   0.730  -5.452  -1.259
  449   3HD2  LEU  57          3HD2      LEU  57   0.593  -6.544  -2.658
  450    H    LYS  58           H        LYS  58   7.132  -6.623  -1.836
  451    HA   LYS  58           HA       LYS  58   7.204  -9.412  -1.351
  452   1HB   LYS  58          1HB       LYS  58   8.606  -8.351  -3.038
  453   2HB   LYS  58          2HB       LYS  58   9.407  -7.382  -1.817
  454   1HG   LYS  58          1HG       LYS  58  10.827  -9.076  -1.297
  455   2HG   LYS  58          2HG       LYS  58   9.499 -10.189  -1.041
  456   1HD   LYS  58          1HD       LYS  58   9.856 -11.201  -3.044
  457   2HD   LYS  58          2HD       LYS  58   9.808  -9.670  -3.895
  458   1HE   LYS  58          1HE       LYS  58  12.284  -9.645  -2.508
  459   2HE   LYS  58          2HE       LYS  58  12.131 -11.281  -3.118
  460   1HZ   LYS  58          1HZ       LYS  58  12.449  -8.834  -4.566
  461   2HZ   LYS  58          2HZ       LYS  58  12.886 -10.353  -4.977
  462   3HZ   LYS  58          3HZ       LYS  58  11.349  -9.852  -5.214
  463    H    ILE  59           H        ILE  59   8.793  -6.607   0.336
  464    HA   ILE  59           HA       ILE  59   9.516  -8.237   2.543
  465    HB   ILE  59           HB       ILE  59   9.421  -5.228   2.299
  466   1HG1  ILE  59          1HG1      ILE  59  12.023  -5.840   1.964
  467   2HG1  ILE  59          2HG1      ILE  59  11.313  -7.268   1.236
  468   1HG2  ILE  59          1HG2      ILE  59  10.408  -5.077   4.300
  469   2HG2  ILE  59          2HG2      ILE  59   9.803  -6.729   4.564
  470   3HG2  ILE  59          3HG2      ILE  59  11.469  -6.473   3.993
  471   1HD1  ILE  59          1HD1      ILE  59   9.873  -4.878   0.371
  472   2HD1  ILE  59          2HD1      ILE  59  11.615  -4.725   0.038
  473   3HD1  ILE  59          3HD1      ILE  59  10.702  -6.108  -0.612
  474    H    TYR  60           H        TYR  60   6.901  -5.833   1.879
  475    HA   TYR  60           HA       TYR  60   5.749  -5.534   4.269
  476   1HB   TYR  60          1HB       TYR  60   4.850  -4.607   2.169
  477   2HB   TYR  60          2HB       TYR  60   4.636  -6.207   1.486
  478    HD1  TYR  60           1HD      TYR  60   3.632  -5.379   4.949
  479    HD2  TYR  60           2HD      TYR  60   2.312  -5.901   0.913
  480    HE1  TYR  60           1HE      TYR  60   1.214  -5.394   5.734
  481    HE2  TYR  60           2HE      TYR  60  -0.102  -5.914   1.712
  482    HH   TYR  60           HH       TYR  60  -1.441  -5.612   3.390
  483    H    LEU  61           H        LEU  61   4.456  -8.105   2.059
  484    HA   LEU  61           HA       LEU  61   3.511  -9.535   4.378
  485   1HB   LEU  61          1HB       LEU  61   3.289 -10.243   1.451
  486   2HB   LEU  61          2HB       LEU  61   2.391 -10.952   2.778
  487    HG   LEU  61           HG       LEU  61   1.897  -8.174   2.920
  488   1HD1  LEU  61          1HD1      LEU  61   1.512  -9.170   0.085
  489   2HD1  LEU  61          2HD1      LEU  61   1.076  -7.573   0.740
  490   3HD1  LEU  61          3HD1      LEU  61   2.788  -8.042   0.603
  491   1HD2  LEU  61          1HD2      LEU  61  -0.362  -9.270   1.795
  492   2HD2  LEU  61          2HD2      LEU  61   0.430 -10.681   2.537
  493   3HD2  LEU  61          3HD2      LEU  61   0.040  -9.256   3.529
  494    H    GLU  62           H        GLU  62   6.467  -9.240   2.861
  495    HA   GLU  62           HA       GLU  62   8.313 -10.380   3.000
  496   1HB   GLU  62          1HB       GLU  62   6.666 -11.694   5.065
  497   2HB   GLU  62          2HB       GLU  62   7.888 -12.761   4.403
  498   1HG   GLU  62          1HG       GLU  62   9.475 -11.716   5.635
  499   2HG   GLU  62          2HG       GLU  62   9.151 -10.216   4.789
  500    H    VAL  63           H        VAL  63   5.688 -11.208   1.291
  501    HA   VAL  63           HA       VAL  63   5.989 -13.844   0.530
  502    HB   VAL  63           HB       VAL  63   5.001 -12.914  -1.675
  503   1HG1  VAL  63          1HG1      VAL  63   3.302 -12.208   0.695
  504   2HG1  VAL  63          2HG1      VAL  63   2.887 -13.117  -0.777
  505   3HG1  VAL  63          3HG1      VAL  63   3.860 -13.886   0.500
  506   1HG2  VAL  63          1HG2      VAL  63   4.817 -10.708  -1.959
  507   2HG2  VAL  63          2HG2      VAL  63   4.014 -10.523  -0.381
  508   3HG2  VAL  63          3HG2      VAL  63   5.790 -10.482  -0.486
  509    H    ASP  64           H        ASP  64   7.009 -14.822  -1.354
  510    HA   ASP  64           HA       ASP  64   9.580 -13.614  -1.792
  511   1HB   ASP  64          1HB       ASP  64   8.335 -16.322  -2.161
  512   2HB   ASP  64          2HB       ASP  64   9.646 -15.919  -3.252
  513    H    ASN  65           H        ASN  65   6.468 -13.623  -3.193
  514    HA   ASN  65           HA       ASN  65   7.340 -12.281  -5.471
  515   1HB   ASN  65          1HB       ASN  65   6.031 -14.253  -6.915
  516   2HB   ASN  65          2HB       ASN  65   7.774 -14.096  -6.819
  517   1HD2  ASN  65          1HD2      ASN  65   4.947 -15.582  -5.311
  518   2HD2  ASN  65          2HD2      ASN  65   5.733 -16.990  -4.678
  519    H    VAL  66           H        VAL  66   5.636 -10.814  -5.610
  520    HA   VAL  66           HA       VAL  66   2.996 -11.734  -4.761
  521    HB   VAL  66           HB       VAL  66   4.509  -9.474  -4.198
  522   1HG1  VAL  66          1HG1      VAL  66   3.796  -8.666  -6.510
  523   2HG1  VAL  66          2HG1      VAL  66   2.144  -8.568  -5.856
  524   3HG1  VAL  66          3HG1      VAL  66   3.442  -7.581  -5.144
  525   1HG2  VAL  66          1HG2      VAL  66   3.047  -9.723  -2.523
  526   2HG2  VAL  66          2HG2      VAL  66   1.887  -8.811  -3.517
  527   3HG2  VAL  66          3HG2      VAL  66   1.891 -10.590  -3.562
  528    HA   PRO  67           HA       PRO  67   1.591 -11.647  -8.849
  529   1HB   PRO  67          1HB       PRO  67  -1.106 -11.433  -8.460
  530   2HB   PRO  67          2HB       PRO  67  -0.234 -12.947  -8.322
  531   1HG   PRO  67          1HG       PRO  67  -1.314 -11.228  -6.174
  532   2HG   PRO  67          2HG       PRO  67  -0.832 -12.910  -6.094
  533   1HD   PRO  67          1HD       PRO  67   0.645 -10.654  -5.117
  534   2HD   PRO  67          2HD       PRO  67   1.177 -12.324  -5.143
  535    H    ARG  68           H        ARG  68   1.490 -10.272 -10.537
  536    HA   ARG  68           HA       ARG  68   1.585  -7.579  -9.885
  537   1HB   ARG  68          1HB       ARG  68   2.241  -9.092 -12.090
  538   2HB   ARG  68          2HB       ARG  68   0.780  -8.320 -12.675
  539   1HG   ARG  68          1HG       ARG  68   2.671  -6.495 -11.261
  540   2HG   ARG  68          2HG       ARG  68   3.288  -7.173 -12.754
  541   1HD   ARG  68          1HD       ARG  68   0.638  -6.430 -13.390
  542   2HD   ARG  68          2HD       ARG  68   1.207  -5.130 -12.362
  543    HE   ARG  68           HE       ARG  68   2.798  -4.527 -14.000
  544   1HH1  ARG  68          2HH2      ARG  68   1.306  -7.604 -14.827
  545   2HH1  ARG  68          1HH2      ARG  68   1.960  -7.636 -16.430
  546   1HH2  ARG  68          2HH1      ARG  68   3.662  -4.568 -16.115
  547   2HH2  ARG  68          1HH1      ARG  68   3.309  -5.898 -17.168
  548    H    HIS  69           H        HIS  69  -1.040  -9.776 -10.922
  549    HA   HIS  69           HA       HIS  69  -2.907  -7.945 -11.743
  550   1HB   HIS  69          1HB       HIS  69  -3.200 -10.603 -10.329
  551   2HB   HIS  69          2HB       HIS  69  -4.571  -9.698 -10.940
  552    HD1  HIS  69           1HD      HIS  69  -4.775 -12.032 -12.411
  553    HD2  HIS  69           2HD      HIS  69  -1.694  -9.371 -13.421
  554    HE1  HIS  69           1HE      HIS  69  -4.026 -12.667 -14.766
  555    H    LEU  70           H        LEU  70  -2.011  -9.006  -8.422
  556    HA   LEU  70           HA       LEU  70  -4.085  -7.473  -7.208
  557   1HB   LEU  70          1HB       LEU  70  -3.503  -9.271  -5.935
  558   2HB   LEU  70          2HB       LEU  70  -1.797  -9.153  -6.321
  559    HG   LEU  70           HG       LEU  70  -1.976  -6.919  -4.886
  560   1HD1  LEU  70          1HD1      LEU  70  -4.549  -8.133  -4.488
  561   2HD1  LEU  70          2HD1      LEU  70  -3.654  -8.108  -2.950
  562   3HD1  LEU  70          3HD1      LEU  70  -3.912  -6.597  -3.854
  563   1HD2  LEU  70          1HD2      LEU  70  -1.520  -9.762  -4.102
  564   2HD2  LEU  70          2HD2      LEU  70  -0.400  -8.378  -4.122
  565   3HD2  LEU  70          3HD2      LEU  70  -1.597  -8.534  -2.815
  566    H    SER  71           H        SER  71  -0.525  -7.079  -7.723
  567    HA   SER  71           HA       SER  71  -0.278  -4.720  -6.349
  568   1HB   SER  71          1HB       SER  71   1.344  -6.362  -7.984
  569   2HB   SER  71          2HB       SER  71   1.403  -4.787  -8.747
  570    HG   SER  71           HG       SER  71   1.867  -3.942  -6.492
  571    H    LEU  72           H        LEU  72  -1.820  -5.433  -9.415
  572    HA   LEU  72           HA       LEU  72  -1.600  -2.795 -10.480
  573   1HB   LEU  72          1HB       LEU  72  -1.789  -4.473 -12.067
  574   2HB   LEU  72          2HB       LEU  72  -3.065  -5.306 -11.200
  575    HG   LEU  72           HG       LEU  72  -4.665  -3.554 -11.800
  576   1HD1  LEU  72          1HD1      LEU  72  -4.120  -1.722 -13.263
  577   2HD1  LEU  72          2HD1      LEU  72  -3.042  -1.673 -11.848
  578   3HD1  LEU  72          3HD1      LEU  72  -2.436  -2.280 -13.408
  579   1HD2  LEU  72          1HD2      LEU  72  -5.121  -4.673 -13.661
  580   2HD2  LEU  72          2HD2      LEU  72  -3.710  -3.980 -14.496
  581   3HD2  LEU  72          3HD2      LEU  72  -3.528  -5.455 -13.515
  582    H    ALA  73           H        ALA  73  -4.129  -4.707  -8.739
  583    HA   ALA  73           HA       ALA  73  -5.972  -2.535  -8.765
  584   1HB   ALA  73          1HB       ALA  73  -7.300  -4.011  -7.330
  585   2HB   ALA  73          2HB       ALA  73  -6.619  -4.938  -8.688
  586   3HB   ALA  73          3HB       ALA  73  -5.888  -5.064  -7.070
  587    H    LEU  74           H        LEU  74  -3.414  -3.764  -6.592
  588    HA   LEU  74           HA       LEU  74  -4.115  -2.448  -4.278
  589   1HB   LEU  74          1HB       LEU  74  -1.656  -3.565  -5.470
  590   2HB   LEU  74          2HB       LEU  74  -1.404  -2.364  -4.218
  591    HG   LEU  74           HG       LEU  74  -3.234  -4.725  -3.785
  592   1HD1  LEU  74          1HD1      LEU  74  -0.814  -5.324  -4.524
  593   2HD1  LEU  74          2HD1      LEU  74  -0.363  -4.761  -2.897
  594   3HD1  LEU  74          3HD1      LEU  74  -1.513  -6.107  -3.087
  595   1HD2  LEU  74          1HD2      LEU  74  -2.597  -2.444  -2.262
  596   2HD2  LEU  74          2HD2      LEU  74  -3.520  -3.879  -1.755
  597   3HD2  LEU  74          3HD2      LEU  74  -1.762  -3.810  -1.484
  598    H    PHE  75           H        PHE  75  -1.920  -1.280  -6.931
  599    HA   PHE  75           HA       PHE  75  -1.597   1.264  -5.836
  600   1HB   PHE  75          1HB       PHE  75  -0.128   0.313  -7.579
  601   2HB   PHE  75          2HB       PHE  75  -1.486   0.050  -8.654
  602    HD1  PHE  75           1HD      PHE  75  -0.499   3.077  -6.709
  603    HD2  PHE  75           2HD      PHE  75  -1.099   1.342 -10.534
  604    HE1  PHE  75           1HE      PHE  75  -0.077   5.305  -7.786
  605    HE2  PHE  75           2HE      PHE  75  -0.677   3.569 -11.611
  606    HZ   PHE  75           HZ       PHE  75  -0.171   5.524 -10.224
  607    H    GLN  76           H        GLN  76  -3.976  -0.074  -8.198
  608    HA   GLN  76           HA       GLN  76  -5.078   2.271  -9.022
  609   1HB   GLN  76          1HB       GLN  76  -6.095  -0.544  -8.708
  610   2HB   GLN  76          2HB       GLN  76  -7.263   0.707  -9.085
  611   1HG   GLN  76          1HG       GLN  76  -5.210   1.309 -10.856
  612   2HG   GLN  76          2HG       GLN  76  -5.108  -0.439 -10.781
  613   1HE2  GLN  76          1HE2      GLN  76  -6.937  -1.711 -11.291
  614   2HE2  GLN  76          2HE2      GLN  76  -8.196  -1.125 -12.327
  615    H    SER  77           H        SER  77  -5.823   0.315  -6.077
  616    HA   SER  77           HA       SER  77  -7.810   2.218  -5.289
  617   1HB   SER  77          1HB       SER  77  -8.279  -0.081  -4.759
  618   2HB   SER  77          2HB       SER  77  -6.696  -0.323  -4.047
  619    HG   SER  77           HG       SER  77  -8.894   1.230  -2.997
  620    H    PHE  78           H        PHE  78  -5.482   3.629  -5.616
  621    HA   PHE  78           HA       PHE  78  -5.117   4.859  -3.180
  622   1HB   PHE  78          1HB       PHE  78  -3.361   2.500  -3.827
  623   2HB   PHE  78          2HB       PHE  78  -2.489   3.925  -3.298
  624    HD1  PHE  78           1HD      PHE  78  -3.251   1.013  -2.050
  625    HD2  PHE  78           2HD      PHE  78  -4.308   5.049  -1.277
  626    HE1  PHE  78           1HE      PHE  78  -3.743   0.427   0.341
  627    HE2  PHE  78           2HE      PHE  78  -4.800   4.463   1.113
  628    HZ   PHE  78           HZ       PHE  78  -4.511   2.159   1.894
  629    H    GLU  79           H        GLU  79  -4.903   6.867  -4.059
  630    HA   GLU  79           HA       GLU  79  -2.559   7.513  -5.423
  631   1HB   GLU  79          1HB       GLU  79  -3.933   6.349  -7.266
  632   2HB   GLU  79          2HB       GLU  79  -5.039   7.705  -7.178
  633   1HG   GLU  79          1HG       GLU  79  -3.599   9.115  -8.265
  634   2HG   GLU  79          2HG       GLU  79  -2.209   8.550  -7.359
  635    H    THR  80           H        THR  80  -2.240   9.787  -5.431
  636    HA   THR  80           HA       THR  80  -4.168  11.234  -3.829
  637    HB   THR  80           HB       THR  80  -1.501  11.175  -3.737
  638    HG1  THR  80           1HG      THR  80  -1.801  13.527  -3.043
  639   1HG2  THR  80          1HG2      THR  80  -0.611  13.254  -4.874
  640   2HG2  THR  80          2HG2      THR  80  -1.052  11.978  -6.033
  641   3HG2  THR  80          3HG2      THR  80  -2.137  13.366  -5.783
  642    H    GLY  81           H        GLY  81  -3.283  10.874  -7.212
  643   1HA   GLY  81          1HA       GLY  81  -5.510  12.004  -8.268
  644   2HA   GLY  81          2HA       GLY  81  -4.451  13.380  -8.027
  645    H    HIS  82           H        HIS  82  -5.416  12.095 -10.569
  646    HA   HIS  82           HA       HIS  82  -3.111  12.348 -12.046
  647   1HB   HIS  82          1HB       HIS  82  -2.193  10.370 -11.155
  648   2HB   HIS  82          2HB       HIS  82  -3.718   9.510 -11.232
  649    HD1  HIS  82           1HD      HIS  82  -4.450   8.532 -13.552
  650    HD2  HIS  82           2HD      HIS  82  -0.709  10.430 -13.560
  651    HE1  HIS  82           1HE      HIS  82  -3.318   7.871 -15.741
  652    H    CYS  83           H        CYS  83  -3.496  11.591 -14.396
  653    HA   CYS  83           HA       CYS  83  -4.788  11.358 -16.168
  654   1HB   CYS  83          1HB       CYS  83  -6.351  10.010 -14.203
  655   2HB   CYS  83          2HB       CYS  83  -7.449  11.008 -15.135
  656    HG   CYS  83           HG       CYS  83  -7.646   9.409 -16.870
  657    H    LEU  84           H        LEU  84  -4.384  13.820 -14.377
  658    HA   LEU  84           HA       LEU  84  -6.782  15.351 -14.964
  659   1HB   LEU  84          1HB       LEU  84  -4.389  15.673 -13.221
  660   2HB   LEU  84          2HB       LEU  84  -5.179  17.126 -13.798
  661    HG   LEU  84           HG       LEU  84  -5.872  16.205 -11.514
  662   1HD1  LEU  84          1HD1      LEU  84  -8.421  16.564 -12.222
  663   2HD1  LEU  84          2HD1      LEU  84  -7.247  17.899 -12.140
  664   3HD1  LEU  84          3HD1      LEU  84  -7.643  17.157 -13.709
  665   1HD2  LEU  84          1HD2      LEU  84  -7.454  14.426 -11.401
  666   2HD2  LEU  84          2HD2      LEU  84  -7.536  14.299 -13.175
  667   3HD2  LEU  84          3HD2      LEU  84  -6.048  13.832 -12.317
  668    H    ASN  85           H        ASN  85  -5.699  14.452 -17.315
  669    HA   ASN  85           HA       ASN  85  -5.301  15.316 -19.290
  670   1HB   ASN  85          1HB       ASN  85  -5.727  17.683 -17.853
  671   2HB   ASN  85          2HB       ASN  85  -4.116  17.928 -18.499
  672   1HD2  ASN  85          1HD2      ASN  85  -7.073  18.784 -19.062
  673   2HD2  ASN  85          2HD2      ASN  85  -7.188  18.756 -20.790
  674    H    GLU  86           H        GLU  86  -3.268  15.939 -20.635
  675    HA   GLU  86           HA       GLU  86  -1.066  14.604 -19.599
  676   1HB   GLU  86          1HB       GLU  86  -0.919  16.571 -21.905
  677   2HB   GLU  86          2HB       GLU  86  -0.009  15.089 -21.684
  678   1HG   GLU  86          1HG       GLU  86  -2.761  14.331 -21.613
  679   2HG   GLU  86          2HG       GLU  86  -2.612  15.467 -22.939
  680    H    THR  87           H        THR  87  -0.631  15.655 -17.532
  681    HA   THR  87           HA       THR  87   0.746  18.239 -17.868
  682    HB   THR  87           HB       THR  87  -0.953  17.153 -15.562
  683    HG1  THR  87           1HG      THR  87  -2.323  18.186 -16.997
  684   1HG2  THR  87          1HG2      THR  87  -0.264  19.988 -15.454
  685   2HG2  THR  87          2HG2      THR  87  -0.039  18.744 -14.200
  686   3HG2  THR  87          3HG2      THR  87   1.220  19.005 -15.430
  687    H    ASN  88           H        ASN  88   2.206  16.037 -18.493
  688    HA   ASN  88           HA       ASN  88   3.895  14.772 -17.926
  689   1HB   ASN  88          1HB       ASN  88   4.907  17.074 -17.828
  690   2HB   ASN  88          2HB       ASN  88   4.535  17.163 -16.118
  691   1HD2  ASN  88          1HD2      ASN  88   6.909  17.573 -16.144
  692   2HD2  ASN  88          2HD2      ASN  88   7.980  16.223 -15.971
  693    H    VAL  89           H        VAL  89   1.577  14.102 -16.394
  694    HA   VAL  89           HA       VAL  89   2.479  13.847 -13.641
  695    HB   VAL  89           HB       VAL  89  -0.117  12.865 -14.802
  696   1HG1  VAL  89          1HG1      VAL  89  -0.819  12.663 -12.662
  697   2HG1  VAL  89          2HG1      VAL  89   0.923  12.616 -12.299
  698   3HG1  VAL  89          3HG1      VAL  89   0.021  14.142 -12.134
  699   1HG2  VAL  89          1HG2      VAL  89   0.524  15.704 -13.933
  700   2HG2  VAL  89          2HG2      VAL  89   0.108  15.164 -15.577
  701   3HG2  VAL  89          3HG2      VAL  89  -1.105  15.074 -14.277
  702    H    THR  90           H        THR  90   4.085  12.485 -15.556
  703    HA   THR  90           HA       THR  90   3.199   9.737 -15.623
  704    HB   THR  90           HB       THR  90   4.462  10.870 -17.495
  705    HG1  THR  90           1HG      THR  90   6.135   9.041 -17.444
  706   1HG2  THR  90          1HG2      THR  90   7.061  10.473 -16.118
  707   2HG2  THR  90          2HG2      THR  90   6.552  11.787 -17.206
  708   3HG2  THR  90          3HG2      THR  90   6.131  11.849 -15.477
  709    H    LYS  91           H        LYS  91   4.561  11.757 -13.268
  710    HA   LYS  91           HA       LYS  91   5.646   9.387 -11.916
  711   1HB   LYS  91          1HB       LYS  91   7.356  10.797 -10.896
  712   2HB   LYS  91          2HB       LYS  91   7.492  10.806 -12.643
  713   1HG   LYS  91          1HG       LYS  91   6.000  12.959 -12.550
  714   2HG   LYS  91          2HG       LYS  91   6.385  12.992 -10.841
  715   1HD   LYS  91          1HD       LYS  91   8.757  12.575 -12.578
  716   2HD   LYS  91          2HD       LYS  91   7.944  14.101 -12.863
  717   1HE   LYS  91          1HE       LYS  91   8.138  13.602  -9.991
  718   2HE   LYS  91          2HE       LYS  91   9.721  13.463 -10.728
  719   1HZ   LYS  91          1HZ       LYS  91   7.915  15.759 -10.768
  720   2HZ   LYS  91          2HZ       LYS  91   9.473  15.695 -10.282
  721   3HZ   LYS  91          3HZ       LYS  91   9.110  15.620 -11.873
  722    H    ASP  92           H        ASP  92   3.812   8.898 -10.718
  723    HA   ASP  92           HA       ASP  92   2.869  11.085  -9.037
  724   1HB   ASP  92          1HB       ASP  92   1.469   8.565 -10.038
  725   2HB   ASP  92          2HB       ASP  92   0.791   9.589  -8.788
  726    H    VAL  93           H        VAL  93   3.098  10.776  -6.792
  727    HA   VAL  93           HA       VAL  93   4.057   8.129  -5.961
  728    HB   VAL  93           HB       VAL  93   5.072   9.348  -4.067
  729   1HG1  VAL  93          1HG1      VAL  93   6.688  10.749  -5.672
  730   2HG1  VAL  93          2HG1      VAL  93   6.696   8.969  -5.631
  731   3HG1  VAL  93          3HG1      VAL  93   5.816   9.826  -6.920
  732   1HG2  VAL  93          1HG2      VAL  93   3.399  11.465  -4.956
  733   2HG2  VAL  93          2HG2      VAL  93   4.523  11.452  -3.576
  734   3HG2  VAL  93          3HG2      VAL  93   5.083  12.000  -5.174
  735    H    VAL  94           H        VAL  94   3.376   7.440  -3.733
  736    HA   VAL  94           HA       VAL  94   0.694   8.484  -3.134
  737    HB   VAL  94           HB       VAL  94   1.706   5.635  -3.048
  738   1HG1  VAL  94          1HG1      VAL  94  -0.463   4.976  -2.258
  739   2HG1  VAL  94          2HG1      VAL  94   0.149   6.246  -1.171
  740   3HG1  VAL  94          3HG1      VAL  94  -1.081   6.640  -2.396
  741   1HG2  VAL  94          1HG2      VAL  94   0.717   7.093  -5.203
  742   2HG2  VAL  94          2HG2      VAL  94   0.798   5.319  -5.070
  743   3HG2  VAL  94          3HG2      VAL  94  -0.695   6.178  -4.619
  744    H    CYS  95           H        CYS  95   0.076   8.421  -0.859
  745    HA   CYS  95           HA       CYS  95   2.284   9.094   0.795
  746   1HB   CYS  95          1HB       CYS  95  -0.700   9.030   1.126
  747   2HB   CYS  95          2HB       CYS  95   0.307   9.110   2.558
  748    HG   CYS  95           HG       CYS  95   0.495  11.466   2.478
  749    H    LEU  96           H        LEU  96   3.272   7.820   2.391
  750    HA   LEU  96           HA       LEU  96   2.653   5.001   2.276
  751   1HB   LEU  96          1HB       LEU  96   4.892   6.695   3.273
  752   2HB   LEU  96          2HB       LEU  96   4.672   5.115   3.998
  753    HG   LEU  96           HG       LEU  96   4.667   5.199   1.027
  754   1HD1  LEU  96          1HD1      LEU  96   7.352   5.284   2.352
  755   2HD1  LEU  96          2HD1      LEU  96   6.888   5.664   0.676
  756   3HD1  LEU  96          3HD1      LEU  96   6.509   6.808   1.986
  757   1HD2  LEU  96          1HD2      LEU  96   4.939   3.268   3.091
  758   2HD2  LEU  96          2HD2      LEU  96   4.929   3.020   1.328
  759   3HD2  LEU  96          3HD2      LEU  96   6.467   3.301   2.179
  760    H    ASN  97           H        ASN  97   2.587   7.735   4.625
  761    HA   ASN  97           HA       ASN  97   1.902   6.221   6.820
  762   1HB   ASN  97          1HB       ASN  97   1.984   9.049   6.062
  763   2HB   ASN  97          2HB       ASN  97   0.564   8.742   7.043
  764   1HD2  ASN  97          1HD2      ASN  97   3.147  10.156   7.532
  765   2HD2  ASN  97          2HD2      ASN  97   3.791   9.494   8.997
  766    H    ASP  98           H        ASP  98  -0.063   7.888   4.274
  767    HA   ASP  98           HA       ASP  98  -2.534   7.518   5.382
  768   1HB   ASP  98          1HB       ASP  98  -1.504   7.723   2.542
  769   2HB   ASP  98          2HB       ASP  98  -3.204   7.387   2.805
  770    H    VAL  99           H        VAL  99  -0.528   5.412   3.222
  771    HA   VAL  99           HA       VAL  99  -2.497   3.397   2.949
  772    HB   VAL  99           HB       VAL  99   0.476   3.542   2.466
  773   1HG1  VAL  99          1HG1      VAL  99   0.255   1.258   2.871
  774   2HG1  VAL  99          2HG1      VAL  99  -1.397   1.195   2.213
  775   3HG1  VAL  99          3HG1      VAL  99  -0.008   1.369   1.114
  776   1HG2  VAL  99          1HG2      VAL  99  -0.043   3.840   0.214
  777   2HG2  VAL  99          2HG2      VAL  99  -1.679   3.161   0.394
  778   3HG2  VAL  99          3HG2      VAL  99  -1.312   4.781   1.035
  779    H    SER 100           H        SER 100   0.281   3.972   5.167
  780    HA   SER 100           HA       SER 100   0.317   1.519   6.363
  781   1HB   SER 100          1HB       SER 100   2.026   3.241   6.751
  782   2HB   SER 100          2HB       SER 100   0.858   4.274   7.552
  783    HG   SER 100           HG       SER 100   2.379   2.283   8.623
  784    H    CYS 101           H        CYS 101  -2.082   4.064   6.510
  785    HA   CYS 101           HA       CYS 101  -3.154   3.306   9.035
  786   1HB   CYS 101          1HB       CYS 101  -3.318   5.595   7.778
  787   2HB   CYS 101          2HB       CYS 101  -4.679   4.862   6.953
  788    HG   CYS 101           HG       CYS 101  -6.267   4.700   8.773
  789    H    TYR 102           H        TYR 102  -4.066   2.894   5.539
  790    HA   TYR 102           HA       TYR 102  -6.362   1.407   5.931
  791   1HB   TYR 102          1HB       TYR 102  -4.992   2.454   3.841
  792   2HB   TYR 102          2HB       TYR 102  -4.292   0.850   3.752
  793    HD1  TYR 102           1HD      TYR 102  -7.802   1.971   4.474
  794    HD2  TYR 102           2HD      TYR 102  -5.187  -0.214   1.888
  795    HE1  TYR 102           1HE      TYR 102  -9.799   1.169   3.121
  796    HE2  TYR 102           2HE      TYR 102  -7.193  -1.009   0.543
  797    HH   TYR 102           HH       TYR 102 -10.360   0.317   1.077
  798    H    PHE 103           H        PHE 103  -2.941   0.278   5.484
  799    HA   PHE 103           HA       PHE 103  -3.548  -2.437   5.601
  800   1HB   PHE 103          1HB       PHE 103  -1.151  -0.629   6.162
  801   2HB   PHE 103          2HB       PHE 103  -1.001  -2.347   6.473
  802    HD1  PHE 103           1HD      PHE 103  -2.804  -0.651   3.693
  803    HD2  PHE 103           2HD      PHE 103   0.481  -3.084   4.834
  804    HE1  PHE 103           1HE      PHE 103  -2.253  -1.042   1.276
  805    HE2  PHE 103           2HE      PHE 103   1.032  -3.474   2.417
  806    HZ   PHE 103           HZ       PHE 103  -0.342  -2.449   0.667
  807    H    SER 104           H        SER 104  -3.012   0.019   8.140
  808    HA   SER 104           HA       SER 104  -2.564  -1.783  10.210
  809   1HB   SER 104          1HB       SER 104  -2.077   0.683  10.268
  810   2HB   SER 104          2HB       SER 104  -3.798   1.005  10.340
  811    HG   SER 104           HG       SER 104  -3.745  -0.459  12.329
  812    H    LEU 105           H        LEU 105  -5.526  -0.368   8.750
  813    HA   LEU 105           HA       LEU 105  -7.249  -1.426  10.763
  814   1HB   LEU 105          1HB       LEU 105  -7.401   0.486   8.745
  815   2HB   LEU 105          2HB       LEU 105  -8.489  -0.781   8.214
  816    HG   LEU 105           HG       LEU 105  -8.890  -0.183  11.031
  817   1HD1  LEU 105          1HD1      LEU 105  -9.226   2.125   9.096
  818   2HD1  LEU 105          2HD1      LEU 105  -9.817   2.071  10.774
  819   3HD1  LEU 105          3HD1      LEU 105  -8.068   2.036  10.445
  820   1HD2  LEU 105          1HD2      LEU 105 -10.368  -1.310   9.149
  821   2HD2  LEU 105          2HD2      LEU 105 -11.101  -0.419  10.504
  822   3HD2  LEU 105          3HD2      LEU 105 -10.927   0.364   8.915
  823    H    LEU 106           H        LEU 106  -5.892  -2.509   7.659
  824    HA   LEU 106           HA       LEU 106  -7.637  -4.475   6.955
  825   1HB   LEU 106          1HB       LEU 106  -4.798  -3.881   6.561
  826   2HB   LEU 106          2HB       LEU 106  -5.168  -5.591   6.454
  827    HG   LEU 106           HG       LEU 106  -7.030  -4.910   4.806
  828   1HD1  LEU 106          1HD1      LEU 106  -6.932  -2.483   5.397
  829   2HD1  LEU 106          2HD1      LEU 106  -5.351  -2.400   4.582
  830   3HD1  LEU 106          3HD1      LEU 106  -6.810  -2.824   3.654
  831   1HD2  LEU 106          1HD2      LEU 106  -4.108  -5.103   4.388
  832   2HD2  LEU 106          2HD2      LEU 106  -5.443  -6.044   3.681
  833   3HD2  LEU 106          3HD2      LEU 106  -5.046  -4.436   3.030
  834    H    GLU 107           H        GLU 107  -4.727  -4.943   9.091
  835    HA   GLU 107           HA       GLU 107  -5.268  -7.509   9.778
  836   1HB   GLU 107          1HB       GLU 107  -3.651  -7.244  11.463
  837   2HB   GLU 107          2HB       GLU 107  -3.241  -5.964  10.338
  838   1HG   GLU 107          1HG       GLU 107  -4.810  -4.450  11.784
  839   2HG   GLU 107          2HG       GLU 107  -4.720  -5.722  12.985
  840    H    GLY 108           H        GLY 108  -6.683  -4.480  11.051
  841   1HA   GLY 108          1HA       GLY 108  -8.353  -6.080  12.892
  842   2HA   GLY 108          2HA       GLY 108  -7.934  -4.391  13.101
  843    H    GLY 109           H        GLY 109  -9.043  -6.180  10.144
  844   1HA   GLY 109          1HA       GLY 109 -11.144  -4.151   9.814
  845   2HA   GLY 109          2HA       GLY 109 -10.492  -5.206   8.576
  846    H    ARG 110           H        ARG 110 -11.822  -5.804  11.911
  847    HA   ARG 110           HA       ARG 110 -13.003  -8.188  11.148
  848   1HB   ARG 110          1HB       ARG 110 -13.011  -6.399  13.528
  849   2HB   ARG 110          2HB       ARG 110 -14.471  -7.355  13.367
  850   1HG   ARG 110          1HG       ARG 110 -12.231  -9.081  12.796
  851   2HG   ARG 110          2HG       ARG 110 -11.862  -8.206  14.269
  852   1HD   ARG 110          1HD       ARG 110 -14.564  -8.924  14.599
  853   2HD   ARG 110          2HD       ARG 110 -13.865 -10.323  13.808
  854    HE   ARG 110           HE       ARG 110 -13.345  -9.444  16.524
  855   1HH1  ARG 110          2HH2      ARG 110 -11.869 -11.065  13.771
  856   2HH1  ARG 110          1HH2      ARG 110 -10.738 -11.953  14.737
  857   1HH2  ARG 110          2HH1      ARG 110 -11.854 -10.615  17.799
  858   2HH2  ARG 110          1HH1      ARG 110 -10.729 -11.695  17.044
  859    HA   PRO 111           HA       PRO 111 -16.490  -6.319   9.167
  860   1HB   PRO 111          1HB       PRO 111 -17.433  -8.578   7.952
  861   2HB   PRO 111          2HB       PRO 111 -16.208  -7.547   7.240
  862   1HG   PRO 111          1HG       PRO 111 -15.889 -10.192   8.521
  863   2HG   PRO 111          2HG       PRO 111 -14.788  -9.353   7.447
  864   1HD   PRO 111          1HD       PRO 111 -14.551  -9.603  10.295
  865   2HD   PRO 111          2HD       PRO 111 -13.515  -8.667   9.235
  866    H    GLU 112           H        GLU 112 -18.906  -6.589   9.077
  867    HA   GLU 112           HA       GLU 112 -19.631  -7.384  11.744
  868   1HB   GLU 112          1HB       GLU 112 -20.357  -5.211  10.441
  869   2HB   GLU 112          2HB       GLU 112 -21.547  -6.254   9.688
  870   1HG   GLU 112          1HG       GLU 112 -22.351  -6.939  11.981
  871   2HG   GLU 112          2HG       GLU 112 -21.206  -5.820  12.694
  872    H    ASP 113           H        ASP 113 -19.728  -8.593   8.469
  873    HA   ASP 113           HA       ASP 113 -21.043 -10.941   9.439
  874   1HB   ASP 113          1HB       ASP 113 -22.454  -8.947   7.876
  875   2HB   ASP 113          2HB       ASP 113 -22.258 -10.383   6.890
  876    H    LYS 114           H        LYS 114 -19.224 -12.213   8.868
  877    HA   LYS 114           HA       LYS 114 -17.592 -11.754   6.678
  878   1HB   LYS 114          1HB       LYS 114 -16.606 -13.854   7.181
  879   2HB   LYS 114          2HB       LYS 114 -17.088 -13.144   8.708
  880   1HG   LYS 114          1HG       LYS 114 -19.162 -14.523   8.716
  881   2HG   LYS 114          2HG       LYS 114 -18.730 -15.206   7.161
  882   1HD   LYS 114          1HD       LYS 114 -17.453 -16.778   8.176
  883   2HD   LYS 114          2HD       LYS 114 -16.458 -15.532   8.902
  884   1HE   LYS 114          1HE       LYS 114 -18.607 -15.349  10.556
  885   2HE   LYS 114          2HE       LYS 114 -18.793 -17.022  10.071
  886   1HZ   LYS 114          1HZ       LYS 114 -16.110 -16.316  10.735
  887   2HZ   LYS 114          2HZ       LYS 114 -17.148 -16.162  11.987
  888   3HZ   LYS 114          3HZ       LYS 114 -17.000 -17.596  11.220
  889    H    LEU 115           H        LEU 115 -17.301 -13.709   4.955
  890    HA   LEU 115           HA       LEU 115 -19.904 -13.823   3.621
  891   1HB   LEU 115          1HB       LEU 115 -17.113 -13.475   2.749
  892   2HB   LEU 115          2HB       LEU 115 -18.054 -14.577   1.762
  893    HG   LEU 115           HG       LEU 115 -19.220 -11.898   2.436
  894   1HD1  LEU 115          1HD1      LEU 115 -17.186 -11.056   1.735
  895   2HD1  LEU 115          2HD1      LEU 115 -16.899 -12.393   0.596
  896   3HD1  LEU 115          3HD1      LEU 115 -18.101 -11.137   0.211
  897   1HD2  LEU 115          1HD2      LEU 115 -20.787 -13.016   1.233
  898   2HD2  LEU 115          2HD2      LEU 115 -19.857 -12.332  -0.121
  899   3HD2  LEU 115          3HD2      LEU 115 -19.588 -14.019   0.381
  900    H    GLU 116           H        GLU 116 -19.873 -15.907   2.010
  901    HA   GLU 116           HA       GLU 116 -18.780 -18.179   3.380
  902   1HB   GLU 116          1HB       GLU 116 -21.669 -18.544   2.799
  903   2HB   GLU 116          2HB       GLU 116 -20.720 -19.121   4.154
  904   1HG   GLU 116          1HG       GLU 116 -20.744 -16.843   5.163
  905   2HG   GLU 116          2HG       GLU 116 -21.649 -16.232   3.793
  906    H    TRP 117           H        TRP 117 -18.160 -19.727   1.900
  907    HA   TRP 117           HA       TRP 117 -18.762 -19.168  -0.871
  908   1HB   TRP 117          1HB       TRP 117 -16.958 -21.203   0.449
  909   2HB   TRP 117          2HB       TRP 117 -17.135 -21.004  -1.283
  910    HD1  TRP 117           HD       TRP 117 -16.889 -17.899  -1.655
  911    HE1  TRP 117           1HE      TRP 117 -14.696 -16.525  -1.136
  912    HE3  TRP 117           3HE      TRP 117 -14.881 -21.308   1.538
  913    HZ2  TRP 117           2HZ      TRP 117 -12.419 -17.008   0.516
  914    HZ3  TRP 117           3HZ      TRP 117 -12.670 -20.779   2.561
  915    HH2  TRP 117           HH       TRP 117 -11.446 -18.715   2.096
  916    H    SER 118           H        SER 118 -18.235 -22.509  -0.237
  917    HA   SER 118           HA       SER 118 -21.015 -23.003  -0.869
  918   1HB   SER 118          1HB       SER 118 -18.617 -24.088  -1.824
  919   2HB   SER 118          2HB       SER 118 -19.219 -25.340  -0.756
  920    HG   SER 118           HG       SER 118 -20.045 -25.608  -2.911
  Start of MODEL   15
    1   1H    MET   1           H        MET   1  -7.410   8.759   5.270
    2    HA   MET   1           HA       MET   1  -8.651  10.312   7.405
    3   1HB   MET   1          1HB       MET   1  -6.599  11.193   5.737
    4   2HB   MET   1          2HB       MET   1  -8.010  11.713   4.837
    5   1HG   MET   1          1HG       MET   1  -8.842  13.012   6.726
    6   2HG   MET   1          2HG       MET   1  -7.653  12.315   7.808
    7   1HE   MET   1          1HE       MET   1  -4.402  13.260   6.641
    8   2HE   MET   1          2HE       MET   1  -5.012  14.186   8.034
    9   3HE   MET   1          3HE       MET   1  -5.483  12.482   7.822
   10    H    ALA   2           H        ALA   2 -10.147   8.289   6.477
   11    HA   ALA   2           HA       ALA   2 -11.910   7.655   5.266
   12   1HB   ALA   2          1HB       ALA   2 -12.532  10.594   5.760
   13   2HB   ALA   2          2HB       ALA   2 -13.729   9.385   5.235
   14   3HB   ALA   2          3HB       ALA   2 -12.933   9.220   6.819
   15    H    LYS   3           H        LYS   3  -9.597   8.302   3.658
   16    HA   LYS   3           HA       LYS   3 -10.842   9.579   1.334
   17   1HB   LYS   3          1HB       LYS   3  -8.576   9.930   0.518
   18   2HB   LYS   3          2HB       LYS   3  -8.771  10.616   2.118
   19   1HG   LYS   3          1HG       LYS   3  -7.938   7.890   2.477
   20   2HG   LYS   3          2HG       LYS   3  -6.905   8.578   1.241
   21   1HD   LYS   3          1HD       LYS   3  -7.459  10.078   3.829
   22   2HD   LYS   3          2HD       LYS   3  -6.199   8.862   3.744
   23   1HE   LYS   3          1HE       LYS   3  -4.933  10.707   3.141
   24   2HE   LYS   3          2HE       LYS   3  -5.492  10.248   1.545
   25   1HZ   LYS   3          1HZ       LYS   3  -7.268  11.822   1.749
   26   2HZ   LYS   3          2HZ       LYS   3  -6.832  12.211   3.274
   27   3HZ   LYS   3          3HZ       LYS   3  -5.849  12.582   2.025
   28    H    GLU   4           H        GLU   4  -8.324   8.009   0.036
   29    HA   GLU   4           HA       GLU   4  -7.992   6.134  -1.021
   30   1HB   GLU   4          1HB       GLU   4  -8.587   5.015   1.177
   31   2HB   GLU   4          2HB       GLU   4 -10.237   4.866   0.607
   32   1HG   GLU   4          1HG       GLU   4  -9.477   2.824  -0.146
   33   2HG   GLU   4          2HG       GLU   4  -8.984   3.773  -1.534
   34    H    ARG   5           H        ARG   5  -8.697   5.241  -3.019
   35    HA   ARG   5           HA       ARG   5 -11.433   5.962  -3.702
   36   1HB   ARG   5          1HB       ARG   5 -10.596   6.420  -6.039
   37   2HB   ARG   5          2HB       ARG   5  -9.925   7.517  -4.848
   38   1HG   ARG   5          1HG       ARG   5  -7.839   6.198  -4.743
   39   2HG   ARG   5          2HG       ARG   5  -8.510   4.990  -5.821
   40   1HD   ARG   5          1HD       ARG   5  -8.827   7.513  -7.144
   41   2HD   ARG   5          2HD       ARG   5  -7.199   7.498  -6.495
   42    HE   ARG   5           HE       ARG   5  -7.745   4.960  -7.733
   43   1HH1  ARG   5          2HH2      ARG   5  -7.114   8.323  -8.556
   44   2HH1  ARG   5          1HH2      ARG   5  -6.436   7.949 -10.105
   45   1HH2  ARG   5          2HH1      ARG   5  -6.851   4.467  -9.777
   46   2HH2  ARG   5          1HH1      ARG   5  -6.285   5.741 -10.804
   47    H    GLY   6           H        GLY   6 -12.357   4.596  -5.529
   48   1HA   GLY   6          1HA       GLY   6 -12.897   2.561  -6.321
   49   2HA   GLY   6          2HA       GLY   6 -11.184   2.379  -6.644
   50    H    LEU   7           H        LEU   7 -13.871   1.366  -4.685
   51    HA   LEU   7           HA       LEU   7 -12.346   0.307  -2.531
   52   1HB   LEU   7          1HB       LEU   7 -15.180   0.201  -3.456
   53   2HB   LEU   7          2HB       LEU   7 -14.632  -1.013  -2.316
   54    HG   LEU   7           HG       LEU   7 -15.715   0.889  -1.209
   55   1HD1  LEU   7          1HD1      LEU   7 -14.243   1.044   0.584
   56   2HD1  LEU   7          2HD1      LEU   7 -13.750  -0.466  -0.219
   57   3HD1  LEU   7          3HD1      LEU   7 -12.803   1.022  -0.462
   58   1HD2  LEU   7          1HD2      LEU   7 -13.544   2.485  -2.564
   59   2HD2  LEU   7          2HD2      LEU   7 -15.305   2.738  -2.591
   60   3HD2  LEU   7          3HD2      LEU   7 -14.381   3.068  -1.106
   61    H    ILE   8           H        ILE   8 -11.068  -1.456  -2.555
   62    HA   ILE   8           HA       ILE   8 -10.900  -3.068  -4.862
   63    HB   ILE   8           HB       ILE   8  -9.362  -4.421  -3.418
   64   1HG1  ILE   8          1HG1      ILE   8  -9.748  -2.254  -1.347
   65   2HG1  ILE   8          2HG1      ILE   8 -10.615  -3.775  -1.275
   66   1HG2  ILE   8          1HG2      ILE   8  -7.913  -3.048  -4.387
   67   2HG2  ILE   8          2HG2      ILE   8  -9.094  -1.716  -4.390
   68   3HG2  ILE   8          3HG2      ILE   8  -8.051  -1.978  -2.971
   69   1HD1  ILE   8          1HD1      ILE   8  -7.661  -3.976  -1.729
   70   2HD1  ILE   8          2HD1      ILE   8  -8.185  -3.413  -0.123
   71   3HD1  ILE   8          3HD1      ILE   8  -8.731  -4.993  -0.734
   72    H    SER   9           H        SER   9 -12.201  -4.696  -5.494
   73    HA   SER   9           HA       SER   9 -14.398  -5.475  -4.136
   74   1HB   SER   9          1HB       SER   9 -13.085  -6.184  -6.541
   75   2HB   SER   9          2HB       SER   9 -13.307  -7.701  -5.694
   76    HG   SER   9           HG       SER   9 -15.240  -7.521  -6.692
   77    HA   PRO  10           HA       PRO  10 -13.200  -8.607  -1.336
   78   1HB   PRO  10          1HB       PRO  10 -14.734 -10.813  -1.837
   79   2HB   PRO  10          2HB       PRO  10 -15.334  -9.401  -0.989
   80   1HG   PRO  10          1HG       PRO  10 -15.871 -10.262  -3.766
   81   2HG   PRO  10          2HG       PRO  10 -16.766  -9.126  -2.776
   82   1HD   PRO  10          1HD       PRO  10 -14.950  -8.490  -4.904
   83   2HD   PRO  10          2HD       PRO  10 -15.756  -7.355  -3.839
   84    H    SER  11           H        SER  11 -12.432  -9.027  -4.504
   85    HA   SER  11           HA       SER  11 -11.223 -11.579  -4.189
   86   1HB   SER  11          1HB       SER  11 -11.743  -9.674  -6.350
   87   2HB   SER  11          2HB       SER  11 -10.110 -10.300  -6.457
   88    HG   SER  11           HG       SER  11 -11.037 -11.996  -7.381
   89    H    ASP  12           H        ASP  12 -10.112  -8.136  -4.453
   90    HA   ASP  12           HA       ASP  12  -7.414  -8.717  -4.291
   91   1HB   ASP  12          1HB       ASP  12  -8.904  -6.464  -4.696
   92   2HB   ASP  12          2HB       ASP  12  -8.435  -6.191  -3.030
   93    H    PHE  13           H        PHE  13  -9.956  -7.965  -1.830
   94    HA   PHE  13           HA       PHE  13  -8.294  -7.738   0.381
   95   1HB   PHE  13          1HB       PHE  13 -10.803  -7.202   0.079
   96   2HB   PHE  13          2HB       PHE  13 -11.124  -8.924   0.136
   97    HD1  PHE  13           1HD      PHE  13 -10.803  -5.965   2.047
   98    HD2  PHE  13           2HD      PHE  13 -10.329 -10.175   2.271
   99    HE1  PHE  13           1HE      PHE  13 -10.973  -5.851   4.549
  100    HE2  PHE  13           2HE      PHE  13 -10.498 -10.062   4.773
  101    HZ   PHE  13           HZ       PHE  13 -10.818  -7.901   5.882
  102    H    ALA  14           H        ALA  14  -9.938 -10.616  -1.072
  103    HA   ALA  14           HA       ALA  14  -9.269 -12.429   0.916
  104   1HB   ALA  14          1HB       ALA  14  -9.236 -13.776  -1.576
  105   2HB   ALA  14          2HB       ALA  14 -10.610 -13.596  -0.458
  106   3HB   ALA  14          3HB       ALA  14 -10.367 -12.414  -1.766
  107    H    GLN  15           H        GLN  15  -7.570 -11.740  -2.227
  108    HA   GLN  15           HA       GLN  15  -5.476 -13.417  -1.841
  109   1HB   GLN  15          1HB       GLN  15  -6.081 -11.987  -3.892
  110   2HB   GLN  15          2HB       GLN  15  -5.223 -10.667  -3.122
  111   1HG   GLN  15          1HG       GLN  15  -3.929 -13.390  -3.568
  112   2HG   GLN  15          2HG       GLN  15  -3.880 -12.129  -4.784
  113   1HE2  GLN  15          1HE2      GLN  15  -1.560 -13.039  -3.858
  114   2HE2  GLN  15          2HE2      GLN  15  -0.766 -11.899  -2.823
  115    H    LEU  16           H        LEU  16  -5.677  -9.905  -0.922
  116    HA   LEU  16           HA       LEU  16  -3.170  -9.730   0.227
  117   1HB   LEU  16          1HB       LEU  16  -5.427  -8.109  -0.127
  118   2HB   LEU  16          2HB       LEU  16  -5.147  -8.125   1.603
  119    HG   LEU  16           HG       LEU  16  -3.199  -7.276  -0.554
  120   1HD1  LEU  16          1HD1      LEU  16  -4.861  -5.596  -0.113
  121   2HD1  LEU  16          2HD1      LEU  16  -4.620  -5.752   1.644
  122   3HD1  LEU  16          3HD1      LEU  16  -3.322  -5.088   0.624
  123   1HD2  LEU  16          1HD2      LEU  16  -2.083  -6.582   1.887
  124   2HD2  LEU  16          2HD2      LEU  16  -2.687  -8.236   2.151
  125   3HD2  LEU  16          3HD2      LEU  16  -1.558  -7.903   0.815
  126    H    GLN  17           H        GLN  17  -6.348 -10.645   1.699
  127    HA   GLN  17           HA       GLN  17  -5.374 -10.923   4.264
  128   1HB   GLN  17          1HB       GLN  17  -7.792 -10.834   3.606
  129   2HB   GLN  17          2HB       GLN  17  -7.660 -12.448   2.938
  130   1HG   GLN  17          1HG       GLN  17  -7.415 -13.461   5.051
  131   2HG   GLN  17          2HG       GLN  17  -6.782 -12.006   5.795
  132   1HE2  GLN  17          1HE2      GLN  17  -9.676 -13.429   4.336
  133   2HE2  GLN  17          2HE2      GLN  17 -10.852 -12.572   5.276
  134    H    LYS  18           H        LYS  18  -5.965 -13.474   1.734
  135    HA   LYS  18           HA       LYS  18  -5.054 -15.636   3.109
  136   1HB   LYS  18          1HB       LYS  18  -6.137 -15.671   0.887
  137   2HB   LYS  18          2HB       LYS  18  -4.673 -15.043   0.159
  138   1HG   LYS  18          1HG       LYS  18  -4.046 -17.352   1.838
  139   2HG   LYS  18          2HG       LYS  18  -5.302 -17.767   0.689
  140   1HD   LYS  18          1HD       LYS  18  -3.829 -16.709  -1.136
  141   2HD   LYS  18          2HD       LYS  18  -2.552 -16.605   0.060
  142   1HE   LYS  18          1HE       LYS  18  -3.094 -19.191   0.434
  143   2HE   LYS  18          2HE       LYS  18  -3.803 -19.075  -1.165
  144   1HZ   LYS  18          1HZ       LYS  18  -1.030 -18.705  -0.377
  145   2HZ   LYS  18          2HZ       LYS  18  -1.645 -19.555  -1.629
  146   3HZ   LYS  18          3HZ       LYS  18  -1.576 -17.925  -1.705
  147    H    TYR  19           H        TYR  19  -3.067 -13.421   1.023
  148    HA   TYR  19           HA       TYR  19  -0.632 -14.649   1.615
  149   1HB   TYR  19          1HB       TYR  19  -1.762 -12.066   0.541
  150   2HB   TYR  19          2HB       TYR  19  -0.114 -11.944   1.125
  151    HD1  TYR  19           1HD      TYR  19  -1.798 -14.778  -0.657
  152    HD2  TYR  19           2HD      TYR  19   1.210 -11.738  -0.791
  153    HE1  TYR  19           1HE      TYR  19  -0.943 -15.711  -2.862
  154    HE2  TYR  19           2HE      TYR  19   2.055 -12.681  -2.996
  155    HH   TYR  19           HH       TYR  19   1.776 -14.155  -4.544
  156    H    MET  20           H        MET  20  -2.278 -11.776   3.096
  157    HA   MET  20           HA       MET  20  -0.252 -11.127   4.826
  158   1HB   MET  20          1HB       MET  20  -2.362  -9.797   4.305
  159   2HB   MET  20          2HB       MET  20  -3.282 -10.926   5.281
  160   1HG   MET  20          1HG       MET  20  -1.758 -10.343   7.251
  161   2HG   MET  20          2HG       MET  20  -1.037  -9.095   6.254
  162   1HE   MET  20          1HE       MET  20  -4.104  -7.648   4.788
  163   2HE   MET  20          2HE       MET  20  -3.247  -6.433   5.766
  164   3HE   MET  20          3HE       MET  20  -2.325  -7.653   4.854
  165    H    GLU  21           H        GLU  21  -3.207 -13.152   5.478
  166    HA   GLU  21           HA       GLU  21  -2.806 -13.763   8.034
  167   1HB   GLU  21          1HB       GLU  21  -4.171 -14.975   5.774
  168   2HB   GLU  21          2HB       GLU  21  -3.524 -16.237   6.803
  169   1HG   GLU  21          1HG       GLU  21  -4.545 -14.584   8.724
  170   2HG   GLU  21          2HG       GLU  21  -5.627 -14.185   7.403
  171    H    TYR  22           H        TYR  22  -1.321 -15.542   5.233
  172    HA   TYR  22           HA       TYR  22   0.126 -17.368   6.732
  173   1HB   TYR  22          1HB       TYR  22  -0.335 -16.674   4.073
  174   2HB   TYR  22          2HB       TYR  22   1.315 -16.112   4.252
  175    HD1  TYR  22           1HD      TYR  22  -0.331 -18.651   2.857
  176    HD2  TYR  22           2HD      TYR  22   2.614 -18.102   5.912
  177    HE1  TYR  22           1HE      TYR  22   0.523 -21.015   2.470
  178    HE2  TYR  22           2HE      TYR  22   3.457 -20.467   5.514
  179    HH   TYR  22           HH       TYR  22   2.281 -22.660   4.567
  180    H    SER  23           H        SER  23   0.832 -13.965   5.848
  181    HA   SER  23           HA       SER  23   3.516 -14.169   6.752
  182   1HB   SER  23          1HB       SER  23   2.567 -12.558   4.969
  183   2HB   SER  23          2HB       SER  23   1.923 -11.615   6.298
  184    HG   SER  23           HG       SER  23   4.676 -12.145   5.639
  185    H    THR  24           H        THR  24   4.323 -12.555   8.518
  186    HA   THR  24           HA       THR  24   2.319 -12.178  10.620
  187    HB   THR  24           HB       THR  24   3.940 -13.205  12.250
  188    HG1  THR  24           1HG      THR  24   5.719 -14.405  11.094
  189   1HG2  THR  24          1HG2      THR  24   3.481 -15.112   9.903
  190   2HG2  THR  24          2HG2      THR  24   3.660 -15.540  11.621
  191   3HG2  THR  24          3HG2      THR  24   2.201 -14.686  11.064
  192    H    LYS  25           H        LYS  25   4.196 -10.664   8.537
  193    HA   LYS  25           HA       LYS  25   5.705  -9.040  10.385
  194   1HB   LYS  25          1HB       LYS  25   5.421  -9.183   7.391
  195   2HB   LYS  25          2HB       LYS  25   6.156  -7.782   8.144
  196   1HG   LYS  25          1HG       LYS  25   7.082 -10.538   8.981
  197   2HG   LYS  25          2HG       LYS  25   7.637  -9.891   7.450
  198   1HD   LYS  25          1HD       LYS  25   8.111  -7.714   9.000
  199   2HD   LYS  25          2HD       LYS  25   8.228  -8.945  10.242
  200   1HE   LYS  25          1HE       LYS  25  10.167  -9.849   9.367
  201   2HE   LYS  25          2HE       LYS  25   9.674  -9.581   7.707
  202   1HZ   LYS  25          1HZ       LYS  25  10.432  -7.371   9.477
  203   2HZ   LYS  25          2HZ       LYS  25  11.521  -8.165   8.555
  204   3HZ   LYS  25          3HZ       LYS  25  10.295  -7.348   7.850
  205    H    LYS  26           H        LYS  26   5.466  -6.478   9.616
  206    HA   LYS  26           HA       LYS  26   2.604  -5.881   9.654
  207   1HB   LYS  26          1HB       LYS  26   4.659  -5.042  11.695
  208   2HB   LYS  26          2HB       LYS  26   3.249  -4.051  11.380
  209   1HG   LYS  26          1HG       LYS  26   1.985  -6.427  11.630
  210   2HG   LYS  26          2HG       LYS  26   3.405  -6.808  12.583
  211   1HD   LYS  26          1HD       LYS  26   2.975  -4.582  13.844
  212   2HD   LYS  26          2HD       LYS  26   1.413  -4.552  13.051
  213   1HE   LYS  26          1HE       LYS  26   1.422  -7.133  14.002
  214   2HE   LYS  26          2HE       LYS  26   2.403  -6.350  15.225
  215   1HZ   LYS  26          1HZ       LYS  26   0.478  -4.607  15.059
  216   2HZ   LYS  26          2HZ       LYS  26  -0.374  -5.910  14.565
  217   3HZ   LYS  26          3HZ       LYS  26   0.360  -5.919  16.024
  218    H    VAL  27           H        VAL  27   2.108  -3.678   8.914
  219    HA   VAL  27           HA       VAL  27   3.776  -2.976   6.731
  220    HB   VAL  27           HB       VAL  27   1.271  -2.831   6.871
  221   1HG1  VAL  27          1HG1      VAL  27   1.938  -0.422   8.590
  222   2HG1  VAL  27          2HG1      VAL  27   0.359  -0.679   7.809
  223   3HG1  VAL  27          3HG1      VAL  27   0.948  -1.835   9.028
  224   1HG2  VAL  27          1HG2      VAL  27   1.676  -1.690   4.993
  225   2HG2  VAL  27          2HG2      VAL  27   1.591  -0.199   5.961
  226   3HG2  VAL  27          3HG2      VAL  27   3.163  -0.982   5.669
  227    H    SER  28           H        SER  28   3.361  -1.879  10.093
  228    HA   SER  28           HA       SER  28   4.698   0.554   9.731
  229   1HB   SER  28          1HB       SER  28   4.728   0.667  12.166
  230   2HB   SER  28          2HB       SER  28   3.179   0.032  11.649
  231    HG   SER  28           HG       SER  28   3.679  -1.465  13.138
  232    H    ASP  29           H        ASP  29   5.720  -2.784  10.003
  233    HA   ASP  29           HA       ASP  29   8.257  -2.282  11.086
  234   1HB   ASP  29          1HB       ASP  29   6.753  -4.521  10.573
  235   2HB   ASP  29          2HB       ASP  29   7.881  -4.605   9.234
  236    H    VAL  30           H        VAL  30   6.889  -2.726   7.758
  237    HA   VAL  30           HA       VAL  30   9.420  -2.468   6.476
  238    HB   VAL  30           HB       VAL  30   6.565  -2.377   5.489
  239   1HG1  VAL  30          1HG1      VAL  30   7.843  -2.964   3.255
  240   2HG1  VAL  30          2HG1      VAL  30   7.620  -1.272   3.761
  241   3HG1  VAL  30          3HG1      VAL  30   9.177  -2.087   4.041
  242   1HG2  VAL  30          1HG2      VAL  30   7.979  -4.513   6.469
  243   2HG2  VAL  30          2HG2      VAL  30   6.639  -4.620   5.302
  244   3HG2  VAL  30          3HG2      VAL  30   8.323  -4.616   4.726
  245    H    LEU  31           H        LEU  31   6.800  -0.296   7.520
  246    HA   LEU  31           HA       LEU  31   7.374   1.892   5.938
  247   1HB   LEU  31          1HB       LEU  31   5.788   1.258   8.219
  248   2HB   LEU  31          2HB       LEU  31   6.637   2.754   8.553
  249    HG   LEU  31           HG       LEU  31   5.777   3.527   6.233
  250   1HD1  LEU  31          1HD1      LEU  31   3.854   2.490   5.334
  251   2HD1  LEU  31          2HD1      LEU  31   5.030   1.185   5.615
  252   3HD1  LEU  31          3HD1      LEU  31   3.673   1.419   6.744
  253   1HD2  LEU  31          1HD2      LEU  31   4.585   4.822   7.580
  254   2HD2  LEU  31          2HD2      LEU  31   3.341   3.552   7.673
  255   3HD2  LEU  31          3HD2      LEU  31   4.657   3.599   8.871
  256    H    LYS  32           H        LYS  32   8.647   1.095   9.248
  257    HA   LYS  32           HA       LYS  32  10.397   3.257   9.357
  258   1HB   LYS  32          1HB       LYS  32  11.051   2.382  11.357
  259   2HB   LYS  32          2HB       LYS  32   9.545   1.510  11.154
  260   1HG   LYS  32          1HG       LYS  32  10.912  -0.354  10.015
  261   2HG   LYS  32          2HG       LYS  32  12.354   0.492  10.541
  262   1HD   LYS  32          1HD       LYS  32  10.323   0.069  12.682
  263   2HD   LYS  32          2HD       LYS  32  11.015  -1.407  12.038
  264   1HE   LYS  32          1HE       LYS  32  12.769  -1.040  13.442
  265   2HE   LYS  32          2HE       LYS  32  13.263   0.223  12.333
  266   1HZ   LYS  32          1HZ       LYS  32  11.807   0.471  14.834
  267   2HZ   LYS  32          2HZ       LYS  32  13.071   1.346  14.282
  268   3HZ   LYS  32          3HZ       LYS  32  11.575   1.604  13.681
  269    H    LEU  33           H        LEU  33  10.483   0.283   7.524
  270    HA   LEU  33           HA       LEU  33  13.340   0.341   7.191
  271   1HB   LEU  33          1HB       LEU  33  11.097  -1.345   6.112
  272   2HB   LEU  33          2HB       LEU  33  12.715  -1.454   5.450
  273    HG   LEU  33           HG       LEU  33  12.270  -1.765   8.410
  274   1HD1  LEU  33          1HD1      LEU  33  12.353  -4.338   7.649
  275   2HD1  LEU  33          2HD1      LEU  33  10.837  -3.444   7.912
  276   3HD1  LEU  33          3HD1      LEU  33  11.471  -3.653   6.262
  277   1HD2  LEU  33          1HD2      LEU  33  14.477  -2.109   6.520
  278   2HD2  LEU  33          2HD2      LEU  33  14.494  -1.899   8.287
  279   3HD2  LEU  33          3HD2      LEU  33  14.236  -3.514   7.586
  280    H    PHE  34           H        PHE  34  10.445   1.652   5.649
  281    HA   PHE  34           HA       PHE  34  11.707   2.161   3.151
  282   1HB   PHE  34          1HB       PHE  34   9.138   2.573   4.597
  283   2HB   PHE  34          2HB       PHE  34   9.527   3.940   3.571
  284    HD1  PHE  34           1HD      PHE  34   7.404   1.480   3.505
  285    HD2  PHE  34           2HD      PHE  34  10.833   2.616   1.279
  286    HE1  PHE  34           1HE      PHE  34   6.522   0.236   1.512
  287    HE2  PHE  34           2HE      PHE  34   9.951   1.372  -0.715
  288    HZ   PHE  34           HZ       PHE  34   7.806   0.196  -0.574
  289    H    GLU  35           H        GLU  35  12.021   3.543   6.266
  290    HA   GLU  35           HA       GLU  35  12.682   6.132   5.120
  291   1HB   GLU  35          1HB       GLU  35  12.700   6.883   7.548
  292   2HB   GLU  35          2HB       GLU  35  11.142   6.348   6.951
  293   1HG   GLU  35          1HG       GLU  35  11.489   4.111   7.979
  294   2HG   GLU  35          2HG       GLU  35  13.083   4.591   8.527
  295    H    ASP  36           H        ASP  36  13.931   3.484   7.240
  296    HA   ASP  36           HA       ASP  36  16.585   4.606   6.791
  297   1HB   ASP  36          1HB       ASP  36  15.298   3.959   9.209
  298   2HB   ASP  36          2HB       ASP  36  16.347   2.583   8.929
  299    H    GLY  37           H        GLY  37  14.414   1.763   6.805
  300   1HA   GLY  37          1HA       GLY  37  16.165  -0.337   6.499
  301   2HA   GLY  37          2HA       GLY  37  14.558  -0.246   5.806
  302    H    GLU  38           H        GLU  38  15.959  -1.648   4.176
  303    HA   GLU  38           HA       GLU  38  17.650  -0.116   2.489
  304   1HB   GLU  38          1HB       GLU  38  16.641  -2.951   2.568
  305   2HB   GLU  38          2HB       GLU  38  17.278  -2.355   1.049
  306   1HG   GLU  38          1HG       GLU  38  18.949  -1.699   3.430
  307   2HG   GLU  38          2HG       GLU  38  18.816  -3.412   3.087
  308    H    MET  39           H        MET  39  14.244  -0.572   2.804
  309    HA   MET  39           HA       MET  39  13.615  -0.355   0.057
  310   1HB   MET  39          1HB       MET  39  12.080  -0.072   2.684
  311   2HB   MET  39          2HB       MET  39  11.286   0.251   1.155
  312   1HG   MET  39          1HG       MET  39  12.799  -2.351   1.596
  313   2HG   MET  39          2HG       MET  39  11.145  -2.174   2.148
  314   1HE   MET  39          1HE       MET  39  13.628  -2.529  -0.367
  315   2HE   MET  39          2HE       MET  39  12.770  -3.105  -1.816
  316   3HE   MET  39          3HE       MET  39  13.084  -1.367  -1.600
  317    H    ALA  40           H        ALA  40  14.817   1.860   2.362
  318    HA   ALA  40           HA       ALA  40  13.354   4.155   1.496
  319   1HB   ALA  40          1HB       ALA  40  15.763   3.619   3.244
  320   2HB   ALA  40          2HB       ALA  40  15.315   5.281   2.792
  321   3HB   ALA  40          3HB       ALA  40  14.169   4.265   3.699
  322    H    LYS  41           H        LYS  41  15.541   2.175  -0.067
  323    HA   LYS  41           HA       LYS  41  17.206   4.180  -1.232
  324   1HB   LYS  41          1HB       LYS  41  18.218   2.418  -2.400
  325   2HB   LYS  41          2HB       LYS  41  17.777   1.727  -0.851
  326   1HG   LYS  41          1HG       LYS  41  15.851   0.601  -1.784
  327   2HG   LYS  41          2HG       LYS  41  15.939   1.524  -3.272
  328   1HD   LYS  41          1HD       LYS  41  16.874  -0.613  -3.808
  329   2HD   LYS  41          2HD       LYS  41  18.249   0.463  -3.666
  330   1HE   LYS  41          1HE       LYS  41  18.406  -0.303  -1.191
  331   2HE   LYS  41          2HE       LYS  41  17.264  -1.563  -1.613
  332   1HZ   LYS  41          1HZ       LYS  41  18.848  -2.680  -2.646
  333   2HZ   LYS  41          2HZ       LYS  41  19.394  -1.383  -3.473
  334   3HZ   LYS  41          3HZ       LYS  41  19.935  -1.672  -1.960
  335    H    TYR  42           H        TYR  42  13.981   2.932  -1.758
  336    HA   TYR  42           HA       TYR  42  13.903   4.421  -4.296
  337   1HB   TYR  42          1HB       TYR  42  12.660   1.800  -3.292
  338   2HB   TYR  42          2HB       TYR  42  11.937   2.653  -4.640
  339    HD1  TYR  42           1HD      TYR  42  14.315   3.588  -6.139
  340    HD2  TYR  42           2HD      TYR  42  13.569  -0.153  -4.201
  341    HE1  TYR  42           1HE      TYR  42  15.929   2.434  -7.729
  342    HE2  TYR  42           2HE      TYR  42  15.186  -1.294  -5.797
  343    HH   TYR  42           HH       TYR  42  17.076   0.593  -8.102
  344    H    VAL  43           H        VAL  43  13.503   5.868  -2.002
  345    HA   VAL  43           HA       VAL  43  10.579   6.148  -1.986
  346    HB   VAL  43           HB       VAL  43  12.540   6.210   0.301
  347   1HG1  VAL  43          1HG1      VAL  43  10.012   6.807   1.345
  348   2HG1  VAL  43          2HG1      VAL  43  11.410   7.902   1.224
  349   3HG1  VAL  43          3HG1      VAL  43  10.185   7.876  -0.068
  350   1HG2  VAL  43          1HG2      VAL  43   9.937   4.716  -0.165
  351   2HG2  VAL  43          2HG2      VAL  43  11.580   4.032  -0.214
  352   3HG2  VAL  43          3HG2      VAL  43  10.916   4.643   1.320
  353    H    GLN  44           H        GLN  44   9.834   8.187  -2.426
  354    HA   GLN  44           HA       GLN  44  11.920  10.186  -2.777
  355   1HB   GLN  44          1HB       GLN  44   9.192   9.827  -4.074
  356   2HB   GLN  44          2HB       GLN  44  10.100  11.318  -4.224
  357   1HG   GLN  44          1HG       GLN  44  12.005   9.338  -4.820
  358   2HG   GLN  44          2HG       GLN  44  10.538   8.719  -5.552
  359   1HE2  GLN  44          1HE2      GLN  44   9.530   9.816  -7.204
  360   2HE2  GLN  44          2HE2      GLN  44  10.274  11.102  -8.094
  361    H    GLY  45           H        GLY  45  12.023  10.977  -0.618
  362   1HA   GLY  45          1HA       GLY  45  11.456  12.389   1.041
  363   2HA   GLY  45          2HA       GLY  45  10.140  12.978   0.045
  364    H    ASP  46           H        ASP  46   8.016  12.146   0.295
  365    HA   ASP  46           HA       ASP  46   7.772  10.203   2.455
  366   1HB   ASP  46          1HB       ASP  46   6.532  12.891   2.084
  367   2HB   ASP  46          2HB       ASP  46   5.405  11.634   2.554
  368    H    ALA  47           H        ALA  47   7.664  10.387  -0.724
  369    HA   ALA  47           HA       ALA  47   5.149   8.894  -0.948
  370   1HB   ALA  47          1HB       ALA  47   4.447  10.110  -2.793
  371   2HB   ALA  47          2HB       ALA  47   5.236  11.392  -1.844
  372   3HB   ALA  47          3HB       ALA  47   6.095  10.638  -3.209
  373    H    ILE  48           H        ILE  48   5.269   7.042  -2.234
  374    HA   ILE  48           HA       ILE  48   7.925   6.524  -3.381
  375    HB   ILE  48           HB       ILE  48   7.593   5.250  -1.349
  376   1HG1  ILE  48          1HG1      ILE  48   7.270   3.262  -3.583
  377   2HG1  ILE  48          2HG1      ILE  48   8.667   4.319  -3.548
  378   1HG2  ILE  48          1HG2      ILE  48   5.646   4.391  -0.725
  379   2HG2  ILE  48          2HG2      ILE  48   4.913   5.087  -2.190
  380   3HG2  ILE  48          3HG2      ILE  48   5.540   3.421  -2.214
  381   1HD1  ILE  48          1HD1      ILE  48   9.631   3.158  -1.848
  382   2HD1  ILE  48          2HD1      ILE  48   8.122   3.142  -0.905
  383   3HD1  ILE  48          3HD1      ILE  48   8.402   1.908  -2.157
  384    H    GLY  49           H        GLY  49   7.904   5.008  -5.256
  385   1HA   GLY  49          1HA       GLY  49   5.613   5.630  -6.960
  386   2HA   GLY  49          2HA       GLY  49   7.177   5.013  -7.455
  387    H    TYR  50           H        TYR  50   5.579   3.558  -8.739
  388    HA   TYR  50           HA       TYR  50   4.095   1.606  -7.363
  389   1HB   TYR  50          1HB       TYR  50   4.313   2.549  -9.911
  390   2HB   TYR  50          2HB       TYR  50   5.440   1.217 -10.074
  391    HD1  TYR  50           1HD      TYR  50   1.930   1.964  -9.007
  392    HD2  TYR  50           2HD      TYR  50   4.652  -0.925 -10.603
  393    HE1  TYR  50           1HE      TYR  50  -0.004   0.372  -9.444
  394    HE2  TYR  50           2HE      TYR  50   2.709  -2.507 -11.034
  395    HH   TYR  50           HH       TYR  50   0.527  -2.690 -11.125
  396    H    GLU  51           H        GLU  51   7.322   1.440  -9.036
  397    HA   GLU  51           HA       GLU  51   7.862  -1.155  -8.539
  398   1HB   GLU  51          1HB       GLU  51   9.250   1.041  -9.541
  399   2HB   GLU  51          2HB       GLU  51  10.207   0.605  -8.139
  400   1HG   GLU  51          1HG       GLU  51  10.614  -1.609  -8.949
  401   2HG   GLU  51          2HG       GLU  51   9.295  -1.528 -10.100
  402    H    GLY  52           H        GLY  52   7.987   1.610  -6.291
  403   1HA   GLY  52          1HA       GLY  52   9.370   0.145  -4.225
  404   2HA   GLY  52          2HA       GLY  52   8.674   1.750  -4.124
  405    H    PHE  53           H        PHE  53   6.010   0.810  -5.231
  406    HA   PHE  53           HA       PHE  53   4.910   0.048  -2.707
  407   1HB   PHE  53          1HB       PHE  53   4.053   1.582  -4.741
  408   2HB   PHE  53          2HB       PHE  53   3.511   0.062  -5.425
  409    HD1  PHE  53           1HD      PHE  53   2.243  -1.448  -3.493
  410    HD2  PHE  53           2HD      PHE  53   2.411   2.788  -3.688
  411    HE1  PHE  53           1HE      PHE  53   0.133  -1.302  -2.141
  412    HE2  PHE  53           2HE      PHE  53   0.301   2.934  -2.336
  413    HZ   PHE  53           HZ       PHE  53  -0.813   0.887  -1.579
  414    H    GLN  54           H        GLN  54   5.514  -1.498  -5.897
  415    HA   GLN  54           HA       GLN  54   4.047  -3.812  -5.247
  416   1HB   GLN  54          1HB       GLN  54   5.227  -4.759  -7.283
  417   2HB   GLN  54          2HB       GLN  54   4.352  -3.268  -7.571
  418   1HG   GLN  54          1HG       GLN  54   6.261  -2.330  -8.350
  419   2HG   GLN  54          2HG       GLN  54   6.957  -2.465  -6.748
  420   1HE2  GLN  54          1HE2      GLN  54   7.525  -3.106  -9.842
  421   2HE2  GLN  54          2HE2      GLN  54   8.520  -4.521  -9.755
  422    H    GLN  55           H        GLN  55   7.445  -2.754  -4.897
  423    HA   GLN  55           HA       GLN  55   8.387  -5.335  -4.255
  424   1HB   GLN  55          1HB       GLN  55  10.490  -4.287  -3.903
  425   2HB   GLN  55          2HB       GLN  55   9.735  -3.343  -5.170
  426   1HG   GLN  55          1HG       GLN  55   8.984  -1.660  -3.495
  427   2HG   GLN  55          2HG       GLN  55   9.681  -2.617  -2.202
  428   1HE2  GLN  55          1HE2      GLN  55  10.565  -0.216  -2.191
  429   2HE2  GLN  55          2HE2      GLN  55  12.147  -0.023  -2.868
  430    H    PHE  56           H        PHE  56   6.817  -2.711  -2.507
  431    HA   PHE  56           HA       PHE  56   7.748  -3.255   0.058
  432   1HB   PHE  56          1HB       PHE  56   6.504  -1.260  -0.116
  433   2HB   PHE  56          2HB       PHE  56   5.441  -1.925  -1.341
  434    HD1  PHE  56           1HD      PHE  56   6.185  -2.450   2.287
  435    HD2  PHE  56           2HD      PHE  56   3.236  -2.206  -0.754
  436    HE1  PHE  56           1HE      PHE  56   4.384  -2.743   4.010
  437    HE2  PHE  56           2HE      PHE  56   1.435  -2.500   0.969
  438    HZ   PHE  56           HZ       PHE  56   2.030  -2.765   3.331
  439    H    LEU  57           H        LEU  57   4.947  -4.570  -1.812
  440    HA   LEU  57           HA       LEU  57   3.796  -6.013   0.249
  441   1HB   LEU  57          1HB       LEU  57   3.859  -6.379  -2.738
  442   2HB   LEU  57          2HB       LEU  57   2.966  -7.465  -1.692
  443    HG   LEU  57           HG       LEU  57   2.273  -4.755  -1.021
  444   1HD1  LEU  57          1HD1      LEU  57   3.079  -4.715  -3.592
  445   2HD1  LEU  57          2HD1      LEU  57   1.385  -5.217  -3.811
  446   3HD1  LEU  57          3HD1      LEU  57   1.761  -3.704  -2.952
  447   1HD2  LEU  57          1HD2      LEU  57   0.149  -5.578  -1.007
  448   2HD2  LEU  57          2HD2      LEU  57   0.394  -6.564  -2.468
  449   3HD2  LEU  57          3HD2      LEU  57   1.049  -7.110  -0.905
  450    H    LYS  58           H        LYS  58   6.822  -6.460  -1.426
  451    HA   LYS  58           HA       LYS  58   7.055  -9.241  -1.121
  452   1HB   LYS  58          1HB       LYS  58   8.403  -7.677  -2.615
  453   2HB   LYS  58          2HB       LYS  58   9.320  -7.236  -1.188
  454   1HG   LYS  58          1HG       LYS  58   9.966  -9.600  -0.827
  455   2HG   LYS  58          2HG       LYS  58   8.969 -10.106  -2.177
  456   1HD   LYS  58          1HD       LYS  58  10.605  -8.083  -3.267
  457   2HD   LYS  58          2HD       LYS  58  11.678  -8.954  -2.189
  458   1HE   LYS  58          1HE       LYS  58  11.920 -10.332  -4.023
  459   2HE   LYS  58          2HE       LYS  58  10.483 -11.088  -3.364
  460   1HZ   LYS  58          1HZ       LYS  58   9.494  -9.065  -4.826
  461   2HZ   LYS  58          2HZ       LYS  58  10.769  -9.540  -5.729
  462   3HZ   LYS  58          3HZ       LYS  58   9.609 -10.616  -5.326
  463    H    ILE  59           H        ILE  59   8.481  -6.529   0.841
  464    HA   ILE  59           HA       ILE  59   9.267  -8.313   2.900
  465    HB   ILE  59           HB       ILE  59   8.988  -5.307   2.959
  466   1HG1  ILE  59          1HG1      ILE  59  11.628  -5.736   2.568
  467   2HG1  ILE  59          2HG1      ILE  59  10.982  -7.093   1.666
  468   1HG2  ILE  59          1HG2      ILE  59  10.195  -5.280   4.892
  469   2HG2  ILE  59          2HG2      ILE  59   9.347  -6.831   5.104
  470   3HG2  ILE  59          3HG2      ILE  59  11.032  -6.808   4.530
  471   1HD1  ILE  59          1HD1      ILE  59  10.075  -5.756   0.037
  472   2HD1  ILE  59          2HD1      ILE  59   9.561  -4.515   1.205
  473   3HD1  ILE  59          3HD1      ILE  59  11.249  -4.563   0.642
  474    H    TYR  60           H        TYR  60   6.515  -6.023   2.413
  475    HA   TYR  60           HA       TYR  60   5.320  -6.011   4.800
  476   1HB   TYR  60          1HB       TYR  60   4.513  -5.035   2.599
  477   2HB   TYR  60          2HB       TYR  60   4.122  -6.645   2.031
  478    HD1  TYR  60           1HD      TYR  60   1.822  -5.756   1.566
  479    HD2  TYR  60           2HD      TYR  60   3.415  -5.970   5.531
  480    HE1  TYR  60           1HE      TYR  60  -0.520  -5.524   2.527
  481    HE2  TYR  60           2HE      TYR  60   1.067  -5.737   6.478
  482    HH   TYR  60           HH       TYR  60  -1.076  -5.789   6.004
  483    H    LEU  61           H        LEU  61   4.350  -8.499   2.333
  484    HA   LEU  61           HA       LEU  61   3.429 -10.175   4.507
  485   1HB   LEU  61          1HB       LEU  61   3.307 -10.829   1.578
  486   2HB   LEU  61          2HB       LEU  61   2.285 -11.407   2.879
  487    HG   LEU  61           HG       LEU  61   2.035  -8.555   2.749
  488   1HD1  LEU  61          1HD1      LEU  61   2.467  -8.181   0.574
  489   2HD1  LEU  61          2HD1      LEU  61   2.267  -9.892   0.124
  490   3HD1  LEU  61          3HD1      LEU  61   0.836  -8.854   0.336
  491   1HD2  LEU  61          1HD2      LEU  61   0.099  -9.353   3.514
  492   2HD2  LEU  61          2HD2      LEU  61  -0.329  -9.641   1.811
  493   3HD2  LEU  61          3HD2      LEU  61   0.371 -10.954   2.787
  494    H    GLU  62           H        GLU  62   6.372  -9.536   3.083
  495    HA   GLU  62           HA       GLU  62   8.289 -10.557   3.102
  496   1HB   GLU  62          1HB       GLU  62   7.136 -11.531   5.354
  497   2HB   GLU  62          2HB       GLU  62   7.330 -13.041   4.485
  498   1HG   GLU  62          1HG       GLU  62   9.724 -12.730   4.282
  499   2HG   GLU  62          2HG       GLU  62   9.623 -11.058   4.796
  500    H    VAL  63           H        VAL  63   5.765 -11.404   1.311
  501    HA   VAL  63           HA       VAL  63   6.230 -13.990   0.412
  502    HB   VAL  63           HB       VAL  63   5.136 -13.021  -1.715
  503   1HG1  VAL  63          1HG1      VAL  63   2.929 -12.685  -0.360
  504   2HG1  VAL  63          2HG1      VAL  63   3.738 -14.271  -0.341
  505   3HG1  VAL  63          3HG1      VAL  63   3.924 -13.160   1.038
  506   1HG2  VAL  63          1HG2      VAL  63   4.024 -10.762  -0.282
  507   2HG2  VAL  63          2HG2      VAL  63   5.790 -10.599  -0.442
  508   3HG2  VAL  63          3HG2      VAL  63   4.782 -10.825  -1.892
  509    H    ASP  64           H        ASP  64   7.250 -14.731  -1.604
  510    HA   ASP  64           HA       ASP  64   9.758 -13.375  -1.929
  511   1HB   ASP  64          1HB       ASP  64   8.645 -16.076  -2.433
  512   2HB   ASP  64          2HB       ASP  64   9.715 -15.533  -3.710
  513    H    ASN  65           H        ASN  65   6.630 -13.351  -3.309
  514    HA   ASN  65           HA       ASN  65   7.429 -11.703  -5.410
  515   1HB   ASN  65          1HB       ASN  65   6.209 -13.487  -7.107
  516   2HB   ASN  65          2HB       ASN  65   7.948 -13.366  -6.930
  517   1HD2  ASN  65          1HD2      ASN  65   9.065 -14.815  -5.589
  518   2HD2  ASN  65          2HD2      ASN  65   8.421 -16.365  -5.162
  519    H    VAL  66           H        VAL  66   5.666 -10.302  -5.421
  520    HA   VAL  66           HA       VAL  66   3.090 -11.366  -4.566
  521    HB   VAL  66           HB       VAL  66   4.529  -9.063  -3.985
  522   1HG1  VAL  66          1HG1      VAL  66   3.876  -8.048  -6.113
  523   2HG1  VAL  66          2HG1      VAL  66   2.160  -8.352  -5.749
  524   3HG1  VAL  66          3HG1      VAL  66   3.093  -7.211  -4.751
  525   1HG2  VAL  66          1HG2      VAL  66   3.139  -9.419  -2.269
  526   2HG2  VAL  66          2HG2      VAL  66   1.906  -8.531  -3.196
  527   3HG2  VAL  66          3HG2      VAL  66   1.985 -10.306  -3.294
  528    HA   PRO  67           HA       PRO  67   1.534 -11.214  -8.597
  529   1HB   PRO  67          1HB       PRO  67  -1.153 -11.118  -8.107
  530   2HB   PRO  67          2HB       PRO  67  -0.220 -12.600  -8.045
  531   1HG   PRO  67          1HG       PRO  67  -1.286 -10.986  -5.809
  532   2HG   PRO  67          2HG       PRO  67  -0.738 -12.650  -5.798
  533   1HD   PRO  67          1HD       PRO  67   0.687 -10.367  -4.805
  534   2HD   PRO  67          2HD       PRO  67   1.281 -12.013  -4.900
  535    H    ARG  68           H        ARG  68   1.598  -9.716 -10.143
  536    HA   ARG  68           HA       ARG  68   1.495  -7.076  -9.420
  537   1HB   ARG  68          1HB       ARG  68   1.551  -6.602 -11.825
  538   2HB   ARG  68          2HB       ARG  68   2.550  -8.008 -11.513
  539   1HG   ARG  68          1HG       ARG  68   1.331  -8.895 -13.256
  540   2HG   ARG  68          2HG       ARG  68   0.206  -9.289 -11.972
  541   1HD   ARG  68          1HD       ARG  68  -1.274  -8.181 -13.362
  542   2HD   ARG  68          2HD       ARG  68  -0.679  -6.784 -12.486
  543    HE   ARG  68           HE       ARG  68   1.036  -7.339 -14.743
  544   1HH1  ARG  68          2HH2      ARG  68  -2.112  -5.995 -13.926
  545   2HH1  ARG  68          1HH2      ARG  68  -2.180  -4.971 -15.321
  546   1HH2  ARG  68          2HH1      ARG  68   0.947  -5.988 -16.584
  547   2HH2  ARG  68          1HH1      ARG  68  -0.428  -4.967 -16.843
  548    H    HIS  69           H        HIS  69  -1.047  -9.343 -10.483
  549    HA   HIS  69           HA       HIS  69  -2.988  -7.569 -11.268
  550   1HB   HIS  69          1HB       HIS  69  -3.282  -9.889 -11.651
  551   2HB   HIS  69          2HB       HIS  69  -3.113 -10.282  -9.952
  552    HD1  HIS  69           1HD      HIS  69  -5.216 -10.259  -8.512
  553    HD2  HIS  69           2HD      HIS  69  -5.816  -8.628 -12.330
  554    HE1  HIS  69           1HE      HIS  69  -7.734  -9.924  -8.759
  555    H    LEU  70           H        LEU  70  -2.052  -8.673  -7.968
  556    HA   LEU  70           HA       LEU  70  -4.165  -7.221  -6.724
  557   1HB   LEU  70          1HB       LEU  70  -3.530  -9.044  -5.503
  558   2HB   LEU  70          2HB       LEU  70  -1.826  -8.848  -5.862
  559    HG   LEU  70           HG       LEU  70  -2.048  -6.691  -4.368
  560   1HD1  LEU  70          1HD1      LEU  70  -4.159  -6.383  -3.667
  561   2HD1  LEU  70          2HD1      LEU  70  -4.609  -8.087  -3.924
  562   3HD1  LEU  70          3HD1      LEU  70  -3.739  -7.608  -2.446
  563   1HD2  LEU  70          1HD2      LEU  70  -1.859  -8.434  -2.318
  564   2HD2  LEU  70          2HD2      LEU  70  -1.602  -9.540  -3.689
  565   3HD2  LEU  70          3HD2      LEU  70  -0.547  -8.122  -3.480
  566    H    SER  71           H        SER  71  -0.650  -6.699  -7.341
  567    HA   SER  71           HA       SER  71  -0.385  -4.410  -5.865
  568   1HB   SER  71          1HB       SER  71   1.660  -4.100  -7.002
  569   2HB   SER  71          2HB       SER  71   1.391  -5.828  -7.119
  570    HG   SER  71           HG       SER  71   0.871  -3.839  -9.158
  571    H    LEU  72           H        LEU  72  -1.811  -4.975  -9.085
  572    HA   LEU  72           HA       LEU  72  -1.844  -2.261  -9.874
  573   1HB   LEU  72          1HB       LEU  72  -1.958  -3.768 -11.610
  574   2HB   LEU  72          2HB       LEU  72  -3.113  -4.804 -10.794
  575    HG   LEU  72           HG       LEU  72  -4.920  -3.271 -11.233
  576   1HD1  LEU  72          1HD1      LEU  72  -4.593  -1.087 -11.412
  577   2HD1  LEU  72          2HD1      LEU  72  -2.831  -1.334 -11.465
  578   3HD1  LEU  72          3HD1      LEU  72  -3.777  -1.338 -12.973
  579   1HD2  LEU  72          1HD2      LEU  72  -3.370  -3.465 -13.818
  580   2HD2  LEU  72          2HD2      LEU  72  -4.095  -4.882 -13.021
  581   3HD2  LEU  72          3HD2      LEU  72  -5.130  -3.539 -13.564
  582    H    ALA  73           H        ALA  73  -4.264  -4.464  -8.328
  583    HA   ALA  73           HA       ALA  73  -6.243  -2.443  -8.168
  584   1HB   ALA  73          1HB       ALA  73  -6.964  -4.284  -6.295
  585   2HB   ALA  73          2HB       ALA  73  -7.247  -4.488  -8.041
  586   3HB   ALA  73          3HB       ALA  73  -5.834  -5.251  -7.274
  587    H    LEU  74           H        LEU  74  -3.463  -3.435  -6.204
  588    HA   LEU  74           HA       LEU  74  -4.285  -2.280  -3.790
  589   1HB   LEU  74          1HB       LEU  74  -1.785  -3.301  -4.989
  590   2HB   LEU  74          2HB       LEU  74  -1.581  -2.129  -3.702
  591    HG   LEU  74           HG       LEU  74  -3.292  -4.606  -3.401
  592   1HD1  LEU  74          1HD1      LEU  74  -0.883  -5.117  -3.986
  593   2HD1  LEU  74          2HD1      LEU  74  -0.436  -4.337  -2.450
  594   3HD1  LEU  74          3HD1      LEU  74  -1.476  -5.781  -2.445
  595   1HD2  LEU  74          1HD2      LEU  74  -3.937  -3.407  -1.607
  596   2HD2  LEU  74          2HD2      LEU  74  -2.398  -3.981  -0.922
  597   3HD2  LEU  74          3HD2      LEU  74  -2.498  -2.360  -1.650
  598    H    PHE  75           H        PHE  75  -2.343  -0.998  -6.565
  599    HA   PHE  75           HA       PHE  75  -1.940   1.521  -5.397
  600   1HB   PHE  75          1HB       PHE  75  -0.879   0.205  -7.467
  601   2HB   PHE  75          2HB       PHE  75  -2.202   0.900  -8.383
  602    HD1  PHE  75           1HD      PHE  75   0.288   2.128  -5.871
  603    HD2  PHE  75           2HD      PHE  75  -1.643   2.766  -9.596
  604    HE1  PHE  75           1HE      PHE  75   1.621   4.228  -6.203
  605    HE2  PHE  75           2HE      PHE  75  -0.310   4.866  -9.927
  606    HZ   PHE  75           HZ       PHE  75   1.307   5.572  -8.227
  607    H    GLN  76           H        GLN  76  -4.482   0.176  -7.568
  608    HA   GLN  76           HA       GLN  76  -5.676   2.537  -8.254
  609   1HB   GLN  76          1HB       GLN  76  -6.581  -0.317  -8.005
  610   2HB   GLN  76          2HB       GLN  76  -7.825   0.901  -8.203
  611   1HG   GLN  76          1HG       GLN  76  -6.120   1.748 -10.140
  612   2HG   GLN  76          2HG       GLN  76  -5.668   0.055 -10.118
  613   1HE2  GLN  76          1HE2      GLN  76  -7.152  -1.537 -10.652
  614   2HE2  GLN  76          2HE2      GLN  76  -8.622  -1.211 -11.508
  615    H    SER  77           H        SER  77  -5.648   0.810  -5.183
  616    HA   SER  77           HA       SER  77  -7.992   1.981  -4.167
  617   1HB   SER  77          1HB       SER  77  -6.607  -0.128  -3.379
  618   2HB   SER  77          2HB       SER  77  -5.699   1.033  -2.431
  619    HG   SER  77           HG       SER  77  -7.416   0.226  -1.156
  620    H    PHE  78           H        PHE  78  -4.446   2.673  -3.829
  621    HA   PHE  78           HA       PHE  78  -5.207   5.347  -2.884
  622   1HB   PHE  78          1HB       PHE  78  -3.527   3.205  -1.772
  623   2HB   PHE  78          2HB       PHE  78  -2.527   4.606  -2.097
  624    HD1  PHE  78           1HD      PHE  78  -3.919   3.107   0.499
  625    HD2  PHE  78           2HD      PHE  78  -4.212   6.864  -1.452
  626    HE1  PHE  78           1HE      PHE  78  -4.696   4.159   2.641
  627    HE2  PHE  78           2HE      PHE  78  -4.989   7.916   0.690
  628    HZ   PHE  78           HZ       PHE  78  -5.222   6.551   2.711
  629    H    GLU  79           H        GLU  79  -4.464   7.014  -4.121
  630    HA   GLU  79           HA       GLU  79  -1.952   7.018  -5.280
  631   1HB   GLU  79          1HB       GLU  79  -2.799   5.372  -6.866
  632   2HB   GLU  79          2HB       GLU  79  -4.231   6.332  -7.182
  633   1HG   GLU  79          1HG       GLU  79  -2.810   8.153  -8.133
  634   2HG   GLU  79          2HG       GLU  79  -1.370   7.213  -7.797
  635    H    THR  80           H        THR  80  -1.410   9.149  -5.749
  636    HA   THR  80           HA       THR  80  -3.415  11.123  -5.191
  637    HB   THR  80           HB       THR  80  -1.486  12.642  -5.311
  638    HG1  THR  80           1HG      THR  80   0.436  11.823  -6.341
  639   1HG2  THR  80          1HG2      THR  80  -0.006  10.216  -4.370
  640   2HG2  THR  80          2HG2      THR  80  -0.263  11.773  -3.546
  641   3HG2  THR  80          3HG2      THR  80  -1.544  10.538  -3.535
  642    H    GLY  81           H        GLY  81  -1.636  12.738  -7.362
  643   1HA   GLY  81          1HA       GLY  81  -1.830  12.532  -9.818
  644   2HA   GLY  81          2HA       GLY  81  -3.517  12.129  -9.566
  645    H    HIS  82           H        HIS  82  -4.587  13.867  -7.843
  646    HA   HIS  82           HA       HIS  82  -5.322  15.914  -7.557
  647   1HB   HIS  82          1HB       HIS  82  -3.176  16.529  -6.735
  648   2HB   HIS  82          2HB       HIS  82  -2.490  16.609  -8.345
  649    HD1  HIS  82           1HD      HIS  82  -5.708  18.270  -7.089
  650    HD2  HIS  82           2HD      HIS  82  -1.931  19.279  -8.609
  651    HE1  HIS  82           1HE      HIS  82  -5.714  20.803  -7.395
  652    H    CYS  83           H        CYS  83  -3.159  16.541 -10.404
  653    HA   CYS  83           HA       CYS  83  -5.540  17.450 -11.816
  654   1HB   CYS  83          1HB       CYS  83  -2.596  17.920 -12.387
  655   2HB   CYS  83          2HB       CYS  83  -3.910  18.507 -13.385
  656    HG   CYS  83           HG       CYS  83  -4.239  18.972 -10.194
  657    H    LEU  84           H        LEU  84  -6.503  15.742 -12.893
  658    HA   LEU  84           HA       LEU  84  -4.754  13.713 -14.049
  659   1HB   LEU  84          1HB       LEU  84  -7.707  13.823 -13.457
  660   2HB   LEU  84          2HB       LEU  84  -6.986  12.554 -14.427
  661    HG   LEU  84           HG       LEU  84  -7.380  11.990 -12.010
  662   1HD1  LEU  84          1HD1      LEU  84  -5.817  10.731 -13.439
  663   2HD1  LEU  84          2HD1      LEU  84  -4.499  11.815 -12.934
  664   3HD1  LEU  84          3HD1      LEU  84  -5.300  10.770 -11.736
  665   1HD2  LEU  84          1HD2      LEU  84  -4.960  13.681 -11.395
  666   2HD2  LEU  84          2HD2      LEU  84  -6.618  14.305 -11.227
  667   3HD2  LEU  84          3HD2      LEU  84  -6.096  12.896 -10.272
  668    H    ASN  85           H        ASN  85  -4.266  15.960 -15.392
  669    HA   ASN  85           HA       ASN  85  -4.930  15.342 -17.959
  670   1HB   ASN  85          1HB       ASN  85  -6.436  17.400 -18.465
  671   2HB   ASN  85          2HB       ASN  85  -7.213  16.032 -17.692
  672   1HD2  ASN  85          1HD2      ASN  85  -8.808  17.162 -16.707
  673   2HD2  ASN  85          2HD2      ASN  85  -8.568  18.271 -15.398
  674    H    GLU  86           H        GLU  86  -2.527  15.880 -17.374
  675    HA   GLU  86           HA       GLU  86  -2.076  18.622 -18.139
  676   1HB   GLU  86          1HB       GLU  86  -1.867  17.897 -15.446
  677   2HB   GLU  86          2HB       GLU  86  -0.210  17.791 -16.008
  678   1HG   GLU  86          1HG       GLU  86  -1.565  20.196 -17.042
  679   2HG   GLU  86          2HG       GLU  86  -1.582  20.143 -15.291
  680    H    THR  87           H        THR  87   0.846  18.359 -17.508
  681    HA   THR  87           HA       THR  87   1.591  16.116 -19.239
  682    HB   THR  87           HB       THR  87   2.460  19.029 -19.628
  683    HG1  THR  87           1HG      THR  87   0.723  17.141 -21.060
  684   1HG2  THR  87          1HG2      THR  87   2.735  17.171 -21.881
  685   2HG2  THR  87          2HG2      THR  87   3.964  18.236 -21.159
  686   3HG2  THR  87          3HG2      THR  87   3.687  16.613 -20.485
  687    H    ASN  88           H        ASN  88   1.773  15.931 -16.533
  688    HA   ASN  88           HA       ASN  88   4.600  15.793 -16.267
  689   1HB   ASN  88          1HB       ASN  88   3.669  18.172 -15.422
  690   2HB   ASN  88          2HB       ASN  88   3.199  17.250 -14.007
  691   1HD2  ASN  88          1HD2      ASN  88   4.647  18.365 -12.716
  692   2HD2  ASN  88          2HD2      ASN  88   6.355  18.080 -12.741
  693    H    VAL  89           H        VAL  89   3.306  13.562 -16.389
  694    HA   VAL  89           HA       VAL  89   2.677  12.794 -13.627
  695    HB   VAL  89           HB       VAL  89   1.245  11.932 -16.149
  696   1HG1  VAL  89          1HG1      VAL  89  -0.319  10.959 -14.233
  697   2HG1  VAL  89          2HG1      VAL  89   1.063  10.035 -14.869
  698   3HG1  VAL  89          3HG1      VAL  89   1.216  10.919 -13.332
  699   1HG2  VAL  89          1HG2      VAL  89   0.022  13.405 -13.813
  700   2HG2  VAL  89          2HG2      VAL  89   0.789  14.274 -15.163
  701   3HG2  VAL  89          3HG2      VAL  89  -0.603  13.208 -15.468
  702    H    THR  90           H        THR  90   5.256  12.718 -14.859
  703    HA   THR  90           HA       THR  90   5.602   9.988 -15.789
  704    HB   THR  90           HB       THR  90   7.830  10.762 -16.354
  705    HG1  THR  90           1HG      THR  90   8.518  11.921 -14.555
  706   1HG2  THR  90          1HG2      THR  90   7.469  12.868 -17.563
  707   2HG2  THR  90          2HG2      THR  90   5.991  11.888 -17.719
  708   3HG2  THR  90          3HG2      THR  90   6.043  13.241 -16.564
  709    H    LYS  91           H        LYS  91   5.479  11.672 -12.798
  710    HA   LYS  91           HA       LYS  91   6.890   9.418 -11.550
  711   1HB   LYS  91          1HB       LYS  91   6.922  12.333 -10.716
  712   2HB   LYS  91          2HB       LYS  91   7.556  11.016  -9.749
  713   1HG   LYS  91          1HG       LYS  91   9.404  10.720 -11.101
  714   2HG   LYS  91          2HG       LYS  91   8.519  11.066 -12.574
  715   1HD   LYS  91          1HD       LYS  91  10.214  12.831 -12.055
  716   2HD   LYS  91          2HD       LYS  91   8.587  13.478 -12.124
  717   1HE   LYS  91          1HE       LYS  91   8.505  13.916  -9.847
  718   2HE   LYS  91          2HE       LYS  91   9.487  12.526  -9.430
  719   1HZ   LYS  91          1HZ       LYS  91  11.172  13.912  -9.279
  720   2HZ   LYS  91          2HZ       LYS  91  11.101  14.197 -10.886
  721   3HZ   LYS  91          3HZ       LYS  91  10.299  15.170  -9.848
  722    H    ASP  92           H        ASP  92   4.950   8.216 -11.324
  723    HA   ASP  92           HA       ASP  92   2.796   9.523  -9.940
  724   1HB   ASP  92          1HB       ASP  92   2.902   6.569 -10.615
  725   2HB   ASP  92          2HB       ASP  92   1.494   7.605 -10.494
  726    H    VAL  93           H        VAL  93   3.365   9.744  -7.729
  727    HA   VAL  93           HA       VAL  93   4.282   7.288  -6.398
  728    HB   VAL  93           HB       VAL  93   5.066   9.058  -4.658
  729   1HG1  VAL  93          1HG1      VAL  93   7.020   9.418  -6.685
  730   2HG1  VAL  93          2HG1      VAL  93   7.009   8.223  -5.365
  731   3HG1  VAL  93          3HG1      VAL  93   6.293   7.814  -6.942
  732   1HG2  VAL  93          1HG2      VAL  93   3.909  10.932  -5.943
  733   2HG2  VAL  93          2HG2      VAL  93   5.595  11.226  -5.456
  734   3HG2  VAL  93          3HG2      VAL  93   5.219  10.786  -7.139
  735    H    VAL  94           H        VAL  94   3.702   7.594  -3.848
  736    HA   VAL  94           HA       VAL  94   1.119   8.810  -3.488
  737    HB   VAL  94           HB       VAL  94   0.475   6.743  -4.552
  738   1HG1  VAL  94          1HG1      VAL  94   1.644   5.069  -2.357
  739   2HG1  VAL  94          2HG1      VAL  94   1.244   4.635  -4.036
  740   3HG1  VAL  94          3HG1      VAL  94   2.700   5.599  -3.688
  741   1HG2  VAL  94          1HG2      VAL  94  -1.165   6.108  -3.042
  742   2HG2  VAL  94          2HG2      VAL  94  -0.071   6.217  -1.642
  743   3HG2  VAL  94          3HG2      VAL  94  -0.686   7.701  -2.407
  744    H    CYS  95           H        CYS  95   0.442   8.690  -1.169
  745    HA   CYS  95           HA       CYS  95   2.738   9.032   0.466
  746   1HB   CYS  95          1HB       CYS  95   0.786  10.468   0.746
  747   2HB   CYS  95          2HB       CYS  95  -0.222   9.088   1.135
  748    HG   CYS  95           HG       CYS  95   2.606   9.495   2.731
  749    H    LEU  96           H        LEU  96   3.491   7.649   2.137
  750    HA   LEU  96           HA       LEU  96   2.671   4.901   1.854
  751   1HB   LEU  96          1HB       LEU  96   4.824   6.243   3.492
  752   2HB   LEU  96          2HB       LEU  96   4.544   4.514   3.456
  753    HG   LEU  96           HG       LEU  96   4.793   5.425   0.753
  754   1HD1  LEU  96          1HD1      LEU  96   6.731   6.638   0.628
  755   2HD1  LEU  96          2HD1      LEU  96   6.033   7.303   2.124
  756   3HD1  LEU  96          3HD1      LEU  96   7.321   6.079   2.211
  757   1HD2  LEU  96          1HD2      LEU  96   6.353   3.614   2.587
  758   2HD2  LEU  96          2HD2      LEU  96   5.288   3.193   1.224
  759   3HD2  LEU  96          3HD2      LEU  96   6.879   3.930   0.916
  760    H    ASN  97           H        ASN  97   2.945   7.301   4.572
  761    HA   ASN  97           HA       ASN  97   1.844   5.815   6.513
  762   1HB   ASN  97          1HB       ASN  97   1.968   8.735   5.881
  763   2HB   ASN  97          2HB       ASN  97   0.720   8.301   7.032
  764   1HD2  ASN  97          1HD2      ASN  97   4.106   8.525   6.383
  765   2HD2  ASN  97          2HD2      ASN  97   4.704   8.187   7.973
  766    H    ASP  98           H        ASP  98   0.297   7.374   3.709
  767    HA   ASP  98           HA       ASP  98  -2.312   7.355   4.669
  768   1HB   ASP  98          1HB       ASP  98  -1.025   7.413   1.928
  769   2HB   ASP  98          2HB       ASP  98  -2.762   7.216   2.043
  770    H    VAL  99           H        VAL  99  -0.277   5.023   2.800
  771    HA   VAL  99           HA       VAL  99  -2.392   3.172   2.377
  772    HB   VAL  99           HB       VAL  99   0.616   2.996   2.158
  773   1HG1  VAL  99          1HG1      VAL  99  -0.949   1.012   0.665
  774   2HG1  VAL  99          2HG1      VAL  99   0.524   0.812   1.645
  775   3HG1  VAL  99          3HG1      VAL  99  -1.073   0.827   2.431
  776   1HG2  VAL  99          1HG2      VAL  99  -1.576   3.316   0.081
  777   2HG2  VAL  99          2HG2      VAL  99  -0.379   4.540   0.569
  778   3HG2  VAL  99          3HG2      VAL  99   0.150   3.068  -0.280
  779    H    SER 100           H        SER 100   0.288   3.548   4.760
  780    HA   SER 100           HA       SER 100  -0.050   1.125   6.008
  781   1HB   SER 100          1HB       SER 100   1.889   2.543   6.431
  782   2HB   SER 100          2HB       SER 100   0.882   3.817   7.090
  783    HG   SER 100           HG       SER 100   0.621   1.288   8.335
  784    H    CYS 101           H        CYS 101  -2.027   4.023   6.017
  785    HA   CYS 101           HA       CYS 101  -3.261   3.615   8.517
  786   1HB   CYS 101          1HB       CYS 101  -3.179   5.761   7.090
  787   2HB   CYS 101          2HB       CYS 101  -4.510   5.072   6.181
  788    HG   CYS 101           HG       CYS 101  -5.074   6.894   8.217
  789    H    TYR 102           H        TYR 102  -4.248   2.963   5.072
  790    HA   TYR 102           HA       TYR 102  -6.617   1.623   5.744
  791   1HB   TYR 102          1HB       TYR 102  -5.704   2.663   3.512
  792   2HB   TYR 102          2HB       TYR 102  -4.724   1.219   3.350
  793    HD1  TYR 102           1HD      TYR 102  -8.198   2.504   3.384
  794    HD2  TYR 102           2HD      TYR 102  -5.674  -0.861   2.604
  795    HE1  TYR 102           1HE      TYR 102 -10.127   1.317   2.230
  796    HE2  TYR 102           2HE      TYR 102  -7.612  -2.038   1.453
  797    HH   TYR 102           HH       TYR 102  -9.775  -2.012   1.098
  798    H    PHE 103           H        PHE 103  -3.249   0.478   5.122
  799    HA   PHE 103           HA       PHE 103  -3.916  -2.252   5.203
  800   1HB   PHE 103          1HB       PHE 103  -1.457  -0.476   5.501
  801   2HB   PHE 103          2HB       PHE 103  -1.287  -2.179   5.875
  802    HD1  PHE 103           1HD      PHE 103  -3.071  -0.310   3.169
  803    HD2  PHE 103           2HD      PHE 103  -0.216  -3.286   4.170
  804    HE1  PHE 103           1HE      PHE 103  -2.742  -0.814   0.733
  805    HE2  PHE 103           2HE      PHE 103   0.114  -3.789   1.733
  806    HZ   PHE 103           HZ       PHE 103  -1.153  -2.547   0.044
  807    H    SER 104           H        SER 104  -3.226   0.193   7.690
  808    HA   SER 104           HA       SER 104  -2.483  -1.511   9.723
  809   1HB   SER 104          1HB       SER 104  -2.168   0.845  10.012
  810   2HB   SER 104          2HB       SER 104  -3.852   1.199   9.682
  811    HG   SER 104           HG       SER 104  -2.636   0.551  12.078
  812    H    LEU 105           H        LEU 105  -5.655  -0.696   8.328
  813    HA   LEU 105           HA       LEU 105  -7.170  -1.736  10.496
  814   1HB   LEU 105          1HB       LEU 105  -7.677  -0.116   8.377
  815   2HB   LEU 105          2HB       LEU 105  -8.369  -1.620   7.802
  816    HG   LEU 105           HG       LEU 105 -10.118  -0.394   8.829
  817   1HD1  LEU 105          1HD1      LEU 105 -10.952  -2.228   9.754
  818   2HD1  LEU 105          2HD1      LEU 105  -9.316  -2.930   9.782
  819   3HD1  LEU 105          3HD1      LEU 105  -9.919  -2.021  11.188
  820   1HD2  LEU 105          1HD2      LEU 105 -10.002   0.374  11.201
  821   2HD2  LEU 105          2HD2      LEU 105  -8.269  -0.035  11.201
  822   3HD2  LEU 105          3HD2      LEU 105  -8.887   1.221  10.102
  823    H    LEU 106           H        LEU 106  -6.275  -2.966   7.200
  824    HA   LEU 106           HA       LEU 106  -7.521  -5.412   7.411
  825   1HB   LEU 106          1HB       LEU 106  -5.607  -4.108   5.708
  826   2HB   LEU 106          2HB       LEU 106  -5.120  -5.771   5.969
  827    HG   LEU 106           HG       LEU 106  -7.778  -6.099   5.426
  828   1HD1  LEU 106          1HD1      LEU 106  -6.841  -3.775   3.720
  829   2HD1  LEU 106          2HD1      LEU 106  -8.336  -4.712   3.484
  830   3HD1  LEU 106          3HD1      LEU 106  -8.124  -3.731   4.954
  831   1HD2  LEU 106          1HD2      LEU 106  -6.155  -7.482   4.425
  832   2HD2  LEU 106          2HD2      LEU 106  -6.978  -6.660   3.078
  833   3HD2  LEU 106          3HD2      LEU 106  -5.369  -6.111   3.605
  834    H    GLU 107           H        GLU 107  -4.012  -4.698   8.061
  835    HA   GLU 107           HA       GLU 107  -3.408  -7.155   9.060
  836   1HB   GLU 107          1HB       GLU 107  -2.136  -4.643   8.809
  837   2HB   GLU 107          2HB       GLU 107  -2.002  -5.035  10.511
  838   1HG   GLU 107          1HG       GLU 107  -1.463  -7.380   8.814
  839   2HG   GLU 107          2HG       GLU 107  -0.394  -6.045   8.428
  840    H    GLY 108           H        GLY 108  -4.652  -4.238  10.809
  841   1HA   GLY 108          1HA       GLY 108  -6.300  -5.424  12.574
  842   2HA   GLY 108          2HA       GLY 108  -4.738  -5.654  13.332
  843    H    GLY 109           H        GLY 109  -3.275  -3.439  13.006
  844   1HA   GLY 109          1HA       GLY 109  -3.067  -1.212  13.402
  845   2HA   GLY 109          2HA       GLY 109  -4.803  -1.016  13.263
  846    H    ARG 110           H        ARG 110  -2.822  -3.133  15.450
  847    HA   ARG 110           HA       ARG 110  -4.161  -1.771  17.648
  848   1HB   ARG 110          1HB       ARG 110  -3.858  -4.597  17.003
  849   2HB   ARG 110          2HB       ARG 110  -3.083  -4.277  18.542
  850   1HG   ARG 110          1HG       ARG 110  -5.508  -2.824  18.664
  851   2HG   ARG 110          2HG       ARG 110  -5.944  -4.329  17.879
  852   1HD   ARG 110          1HD       ARG 110  -5.397  -5.632  19.742
  853   2HD   ARG 110          2HD       ARG 110  -4.158  -4.523  20.296
  854    HE   ARG 110           HE       ARG 110  -5.775  -3.452  21.589
  855   1HH1  ARG 110          2HH2      ARG 110  -7.388  -5.132  18.951
  856   2HH1  ARG 110          1HH2      ARG 110  -8.981  -4.742  19.508
  857   1HH2  ARG 110          2HH1      ARG 110  -7.876  -2.937  22.323
  858   2HH2  ARG 110          1HH1      ARG 110  -9.261  -3.485  21.438
  859    HA   PRO 111           HA       PRO 111  -0.108  -0.706  18.904
  860   1HB   PRO 111          1HB       PRO 111  -0.658   0.306  21.382
  861   2HB   PRO 111          2HB       PRO 111  -0.851   1.230  19.906
  862   1HG   PRO 111          1HG       PRO 111  -2.932   0.000  21.607
  863   2HG   PRO 111          2HG       PRO 111  -3.104   1.256  20.398
  864   1HD   PRO 111          1HD       PRO 111  -3.811  -1.509  20.112
  865   2HD   PRO 111          2HD       PRO 111  -3.874  -0.276  18.867
  866    H    GLU 112           H        GLU 112   1.312  -0.820  21.102
  867    HA   GLU 112           HA       GLU 112   0.848  -2.901  22.785
  868   1HB   GLU 112          1HB       GLU 112   1.275  -3.986  20.266
  869   2HB   GLU 112          2HB       GLU 112   2.880  -4.060  20.964
  870   1HG   GLU 112          1HG       GLU 112   2.282  -5.822  22.258
  871   2HG   GLU 112          2HG       GLU 112   0.991  -4.889  22.989
  872    H    ASP 113           H        ASP 113   3.163  -1.036  20.814
  873    HA   ASP 113           HA       ASP 113   5.015  -0.018  21.295
  874   1HB   ASP 113          1HB       ASP 113   3.946   1.075  23.144
  875   2HB   ASP 113          2HB       ASP 113   3.942  -0.384  24.114
  876    H    LYS 114           H        LYS 114   6.055  -2.082  20.435
  877    HA   LYS 114           HA       LYS 114   6.842  -4.172  22.080
  878   1HB   LYS 114          1HB       LYS 114   8.338  -4.778  20.273
  879   2HB   LYS 114          2HB       LYS 114   6.795  -4.260  19.626
  880   1HG   LYS 114          1HG       LYS 114   8.187  -1.861  19.711
  881   2HG   LYS 114          2HG       LYS 114   9.475  -2.998  19.363
  882   1HD   LYS 114          1HD       LYS 114   8.713  -3.401  17.244
  883   2HD   LYS 114          2HD       LYS 114   7.046  -3.529  17.766
  884   1HE   LYS 114          1HE       LYS 114   6.962  -0.997  17.947
  885   2HE   LYS 114          2HE       LYS 114   8.584  -0.933  17.285
  886   1HZ   LYS 114          1HZ       LYS 114   7.474  -0.852  15.371
  887   2HZ   LYS 114          2HZ       LYS 114   7.366  -2.475  15.514
  888   3HZ   LYS 114          3HZ       LYS 114   6.112  -1.531  15.965
  889    H    LEU 115           H        LEU 115   9.666  -4.388  21.717
  890    HA   LEU 115           HA       LEU 115  10.500  -2.904  23.982
  891   1HB   LEU 115          1HB       LEU 115  12.519  -4.202  22.260
  892   2HB   LEU 115          2HB       LEU 115  12.295  -4.268  23.997
  893    HG   LEU 115           HG       LEU 115  10.106  -5.661  23.187
  894   1HD1  LEU 115          1HD1      LEU 115  11.903  -7.058  21.394
  895   2HD1  LEU 115          2HD1      LEU 115  10.225  -6.521  21.142
  896   3HD1  LEU 115          3HD1      LEU 115  11.574  -5.405  20.821
  897   1HD2  LEU 115          1HD2      LEU 115  12.147  -7.589  23.330
  898   2HD2  LEU 115          2HD2      LEU 115  12.687  -6.229  24.342
  899   3HD2  LEU 115          3HD2      LEU 115  11.110  -6.994  24.648
  900    H    GLU 116           H        GLU 116  12.565  -1.545  23.951
  901    HA   GLU 116           HA       GLU 116  12.837  -0.105  21.457
  902   1HB   GLU 116          1HB       GLU 116  12.509   1.421  24.062
  903   2HB   GLU 116          2HB       GLU 116  12.482   2.056  22.429
  904   1HG   GLU 116          1HG       GLU 116  10.423   0.011  23.339
  905   2HG   GLU 116          2HG       GLU 116  10.202   1.717  23.674
  906    H    TRP 117           H        TRP 117  14.929   0.803  21.145
  907    HA   TRP 117           HA       TRP 117  16.864  -0.031  23.190
  908   1HB   TRP 117          1HB       TRP 117  17.558   0.618  20.344
  909   2HB   TRP 117          2HB       TRP 117  18.444  -0.344  21.509
  910    HD1  TRP 117           HD       TRP 117  15.632  -2.108  22.241
  911    HE1  TRP 117           1HE      TRP 117  14.929  -4.085  20.641
  912    HE3  TRP 117           3HE      TRP 117  18.337  -0.527  18.235
  913    HZ2  TRP 117           2HZ      TRP 117  15.568  -4.751  17.941
  914    HZ3  TRP 117           3HZ      TRP 117  18.242  -1.899  16.156
  915    HH2  TRP 117           HH       TRP 117  16.919  -3.945  15.969
  916    H    SER 118           H        SER 118  16.104   2.008  24.354
  917    HA   SER 118           HA       SER 118  17.893   4.099  23.649
  918   1HB   SER 118          1HB       SER 118  15.466   4.342  22.436
  919   2HB   SER 118          2HB       SER 118  15.090   5.106  23.967
  920    HG   SER 118           HG       SER 118  16.540   6.092  21.854
  Start of MODEL   16
    1   1H    MET   1           H        MET   1 -12.383   8.807  13.566
    2    HA   MET   1           HA       MET   1 -11.039   8.173  11.207
    3   1HB   MET   1          1HB       MET   1 -11.672   6.416  13.645
    4   2HB   MET   1          2HB       MET   1 -10.392   6.110  12.487
    5   1HG   MET   1          1HG       MET   1  -9.016   7.756  13.356
    6   2HG   MET   1          2HG       MET   1 -10.349   8.833  13.721
    7   1HE   MET   1          1HE       MET   1 -11.847   8.744  15.439
    8   2HE   MET   1          2HE       MET   1 -12.317   7.095  15.916
    9   3HE   MET   1          3HE       MET   1 -11.500   8.160  17.084
   10    H    ALA   2           H        ALA   2 -13.705   8.428  10.415
   11    HA   ALA   2           HA       ALA   2 -14.450   5.631   9.888
   12   1HB   ALA   2          1HB       ALA   2 -16.454   7.847   9.675
   13   2HB   ALA   2          2HB       ALA   2 -16.669   6.158  10.195
   14   3HB   ALA   2          3HB       ALA   2 -15.950   7.347  11.307
   15    H    LYS   3           H        LYS   3 -12.563   6.281   8.230
   16    HA   LYS   3           HA       LYS   3 -13.423   7.929   6.067
   17   1HB   LYS   3          1HB       LYS   3 -11.042   7.593   6.823
   18   2HB   LYS   3          2HB       LYS   3 -11.112   5.972   6.161
   19   1HG   LYS   3          1HG       LYS   3 -10.306   7.058   4.285
   20   2HG   LYS   3          2HG       LYS   3 -12.018   7.283   3.987
   21   1HD   LYS   3          1HD       LYS   3 -11.921   9.521   5.100
   22   2HD   LYS   3          2HD       LYS   3 -10.211   9.296   5.408
   23   1HE   LYS   3          1HE       LYS   3 -10.069  10.490   3.420
   24   2HE   LYS   3          2HE       LYS   3 -10.120   8.866   2.762
   25   1HZ   LYS   3          1HZ       LYS   3 -12.556   9.148   2.619
   26   2HZ   LYS   3          2HZ       LYS   3 -12.380  10.717   3.038
   27   3HZ   LYS   3          3HZ       LYS   3 -11.718  10.163   1.652
   28    H    GLU   4           H        GLU   4 -12.012   5.325   4.560
   29    HA   GLU   4           HA       GLU   4 -12.724   3.784   3.209
   30   1HB   GLU   4          1HB       GLU   4 -13.457   2.600   5.226
   31   2HB   GLU   4          2HB       GLU   4 -14.973   3.478   5.244
   32   1HG   GLU   4          1HG       GLU   4 -15.411   2.495   2.889
   33   2HG   GLU   4          2HG       GLU   4 -14.043   1.438   3.179
   34    H    ARG   5           H        ARG   5 -13.954   3.583   1.279
   35    HA   ARG   5           HA       ARG   5 -16.472   4.584   0.941
   36   1HB   ARG   5          1HB       ARG   5 -14.959   6.773   1.293
   37   2HB   ARG   5          2HB       ARG   5 -14.552   6.512  -0.391
   38   1HG   ARG   5          1HG       ARG   5 -16.605   7.204  -1.115
   39   2HG   ARG   5          2HG       ARG   5 -17.450   6.258   0.093
   40   1HD   ARG   5          1HD       ARG   5 -16.142   8.356   1.526
   41   2HD   ARG   5          2HD       ARG   5 -16.839   9.110   0.106
   42    HE   ARG   5           HE       ARG   5 -18.301   8.198   2.374
   43   1HH1  ARG   5          2HH2      ARG   5 -18.486   8.065  -1.137
   44   2HH1  ARG   5          1HH2      ARG   5 -20.213   7.947  -1.170
   45   1HH2  ARG   5          2HH1      ARG   5 -20.581   8.042   2.332
   46   2HH2  ARG   5          1HH1      ARG   5 -21.413   7.934   0.817
   47    H    GLY   6           H        GLY   6 -15.127   2.273   0.170
   48   1HA   GLY   6          1HA       GLY   6 -15.394   1.054  -1.810
   49   2HA   GLY   6          2HA       GLY   6 -15.182   2.514  -2.755
   50    H    LEU   7           H        LEU   7 -13.666  -0.315  -1.585
   51    HA   LEU   7           HA       LEU   7 -11.100   0.690  -2.539
   52   1HB   LEU   7          1HB       LEU   7 -11.361  -0.878   0.025
   53   2HB   LEU   7          2HB       LEU   7  -9.895  -0.233  -0.687
   54    HG   LEU   7           HG       LEU   7 -11.415   2.040  -0.392
   55   1HD1  LEU   7          1HD1      LEU   7 -11.841   1.313   2.306
   56   2HD1  LEU   7          2HD1      LEU   7 -13.050   1.758   1.078
   57   3HD1  LEU   7          3HD1      LEU   7 -12.599   0.051   1.305
   58   1HD2  LEU   7          1HD2      LEU   7  -9.405   2.529   0.419
   59   2HD2  LEU   7          2HD2      LEU   7  -9.949   1.858   1.976
   60   3HD2  LEU   7          3HD2      LEU   7  -9.074   0.827   0.818
   61    H    ILE   8           H        ILE   8  -9.602  -1.639  -2.142
   62    HA   ILE   8           HA       ILE   8 -10.188  -3.139  -4.304
   63    HB   ILE   8           HB       ILE   8  -8.888  -4.967  -3.089
   64   1HG1  ILE   8          1HG1      ILE   8  -8.452  -2.814  -1.010
   65   2HG1  ILE   8          2HG1      ILE   8  -9.619  -4.104  -0.798
   66   1HG2  ILE   8          1HG2      ILE   8  -6.859  -3.912  -3.552
   67   2HG2  ILE   8          2HG2      ILE   8  -8.025  -3.080  -4.609
   68   3HG2  ILE   8          3HG2      ILE   8  -7.478  -2.305  -3.103
   69   1HD1  ILE   8          1HD1      ILE   8  -7.936  -5.802  -0.838
   70   2HD1  ILE   8          2HD1      ILE   8  -6.726  -4.695  -1.529
   71   3HD1  ILE   8          3HD1      ILE   8  -7.250  -4.498   0.161
   72    H    SER   9           H        SER   9 -11.801  -4.473  -4.921
   73    HA   SER   9           HA       SER   9 -14.009  -4.896  -3.422
   74   1HB   SER   9          1HB       SER   9 -13.056  -5.659  -5.974
   75   2HB   SER   9          2HB       SER   9 -13.510  -7.166  -5.205
   76    HG   SER   9           HG       SER   9 -15.197  -4.822  -5.453
   77    HA   PRO  10           HA       PRO  10 -13.275  -8.415  -0.938
   78   1HB   PRO  10          1HB       PRO  10 -15.251 -10.233  -1.447
   79   2HB   PRO  10          2HB       PRO  10 -15.494  -8.802  -0.464
   80   1HG   PRO  10          1HG       PRO  10 -16.386  -9.322  -3.235
   81   2HG   PRO  10          2HG       PRO  10 -16.963  -8.114  -2.104
   82   1HD   PRO  10          1HD       PRO  10 -15.211  -7.680  -4.333
   83   2HD   PRO  10          2HD       PRO  10 -15.696  -6.496  -3.135
   84    H    SER  11           H        SER  11 -12.842  -8.733  -4.185
   85    HA   SER  11           HA       SER  11 -12.137 -11.486  -4.122
   86   1HB   SER  11          1HB       SER  11 -12.411  -9.353  -6.122
   87   2HB   SER  11          2HB       SER  11 -10.981 -10.323  -6.414
   88    HG   SER  11           HG       SER  11 -12.587 -11.428  -7.471
   89    H    ASP  12           H        ASP  12 -10.387  -8.313  -4.349
   90    HA   ASP  12           HA       ASP  12  -7.862  -9.555  -4.288
   91   1HB   ASP  12          1HB       ASP  12  -8.981  -6.819  -4.362
   92   2HB   ASP  12          2HB       ASP  12  -7.513  -6.912  -3.409
   93    H    PHE  13           H        PHE  13 -10.207  -8.268  -1.931
   94    HA   PHE  13           HA       PHE  13  -8.524  -7.886   0.241
   95   1HB   PHE  13          1HB       PHE  13 -11.083  -7.384  -0.241
   96   2HB   PHE  13          2HB       PHE  13 -11.370  -9.027   0.298
   97    HD1  PHE  13           1HD      PHE  13 -11.135  -9.631   2.633
   98    HD2  PHE  13           2HD      PHE  13 -10.352  -5.667   1.336
   99    HE1  PHE  13           1HE      PHE  13 -11.202  -8.839   5.013
  100    HE2  PHE  13           2HE      PHE  13 -10.418  -4.875   3.717
  101    HZ   PHE  13           HZ       PHE  13 -10.842  -6.471   5.528
  102    H    ALA  14           H        ALA  14 -10.244 -10.828  -0.951
  103    HA   ALA  14           HA       ALA  14  -9.605 -12.434   1.259
  104   1HB   ALA  14          1HB       ALA  14 -11.364 -13.170  -0.122
  105   2HB   ALA  14          2HB       ALA  14 -10.422 -12.926  -1.612
  106   3HB   ALA  14          3HB       ALA  14 -10.032 -14.279  -0.525
  107    H    GLN  15           H        GLN  15  -8.028 -11.977  -1.976
  108    HA   GLN  15           HA       GLN  15  -6.058 -13.814  -1.697
  109   1HB   GLN  15          1HB       GLN  15  -6.569 -12.414  -3.733
  110   2HB   GLN  15          2HB       GLN  15  -5.764 -11.057  -2.970
  111   1HG   GLN  15          1HG       GLN  15  -4.369 -13.737  -3.368
  112   2HG   GLN  15          2HG       GLN  15  -4.360 -12.498  -4.607
  113   1HE2  GLN  15          1HE2      GLN  15  -2.018 -13.325  -3.623
  114   2HE2  GLN  15          2HE2      GLN  15  -1.271 -12.130  -2.616
  115    H    LEU  16           H        LEU  16  -5.964 -10.322  -0.692
  116    HA   LEU  16           HA       LEU  16  -3.392 -10.452   0.399
  117   1HB   LEU  16          1HB       LEU  16  -5.176  -8.498  -0.176
  118   2HB   LEU  16          2HB       LEU  16  -5.336  -8.559   1.568
  119    HG   LEU  16           HG       LEU  16  -2.909  -8.187   1.814
  120   1HD1  LEU  16          1HD1      LEU  16  -1.985  -9.156  -0.138
  121   2HD1  LEU  16          2HD1      LEU  16  -2.957  -8.117  -1.208
  122   3HD1  LEU  16          3HD1      LEU  16  -1.644  -7.412  -0.235
  123   1HD2  LEU  16          1HD2      LEU  16  -2.883  -5.836   1.117
  124   2HD2  LEU  16          2HD2      LEU  16  -4.314  -6.121   0.098
  125   3HD2  LEU  16          3HD2      LEU  16  -4.434  -6.286   1.866
  126    H    GLN  17           H        GLN  17  -6.634 -11.245   1.676
  127    HA   GLN  17           HA       GLN  17  -5.928 -11.336   4.344
  128   1HB   GLN  17          1HB       GLN  17  -8.231 -11.764   2.844
  129   2HB   GLN  17          2HB       GLN  17  -7.913 -13.361   3.491
  130   1HG   GLN  17          1HG       GLN  17  -7.797 -12.432   5.794
  131   2HG   GLN  17          2HG       GLN  17  -8.038 -10.812   5.171
  132   1HE2  GLN  17          1HE2      GLN  17 -10.018 -10.276   4.133
  133   2HE2  GLN  17          2HE2      GLN  17 -11.490 -11.104   4.517
  134    H    LYS  18           H        LYS  18  -6.160 -14.040   1.917
  135    HA   LYS  18           HA       LYS  18  -5.158 -15.995   3.634
  136   1HB   LYS  18          1HB       LYS  18  -6.436 -16.355   1.508
  137   2HB   LYS  18          2HB       LYS  18  -4.999 -15.914   0.608
  138   1HG   LYS  18          1HG       LYS  18  -4.067 -17.817   2.467
  139   2HG   LYS  18          2HG       LYS  18  -5.634 -18.436   1.988
  140   1HD   LYS  18          1HD       LYS  18  -4.862 -19.043  -0.062
  141   2HD   LYS  18          2HD       LYS  18  -4.195 -17.449  -0.355
  142   1HE   LYS  18          1HE       LYS  18  -2.169 -18.042   0.985
  143   2HE   LYS  18          2HE       LYS  18  -2.838 -19.630   1.303
  144   1HZ   LYS  18          1HZ       LYS  18  -2.885 -19.972  -1.113
  145   2HZ   LYS  18          2HZ       LYS  18  -2.124 -18.543  -1.330
  146   3HZ   LYS  18          3HZ       LYS  18  -1.373 -19.755  -0.534
  147    H    TYR  19           H        TYR  19  -3.605 -13.428   1.772
  148    HA   TYR  19           HA       TYR  19  -1.006 -14.620   1.861
  149   1HB   TYR  19          1HB       TYR  19  -2.470 -12.223   0.886
  150   2HB   TYR  19          2HB       TYR  19  -0.907 -11.775   1.538
  151    HD1  TYR  19           1HD      TYR  19  -2.077 -14.715  -0.492
  152    HD2  TYR  19           2HD      TYR  19   0.596 -11.389  -0.183
  153    HE1  TYR  19           1HE      TYR  19  -0.965 -15.396  -2.675
  154    HE2  TYR  19           2HE      TYR  19   1.699 -12.081  -2.366
  155    HH   TYR  19           HH       TYR  19   0.959 -15.124  -3.873
  156    H    MET  20           H        MET  20  -2.811 -12.113   3.732
  157    HA   MET  20           HA       MET  20  -0.539 -11.565   5.345
  158   1HB   MET  20          1HB       MET  20  -3.497 -10.808   5.383
  159   2HB   MET  20          2HB       MET  20  -2.456 -10.350   6.716
  160   1HG   MET  20          1HG       MET  20  -0.947  -9.135   5.160
  161   2HG   MET  20          2HG       MET  20  -1.911  -9.649   3.790
  162   1HE   MET  20          1HE       MET  20  -3.129  -8.056   7.468
  163   2HE   MET  20          2HE       MET  20  -1.490  -7.705   6.869
  164   3HE   MET  20          3HE       MET  20  -2.733  -6.431   6.857
  165    H    GLU  21           H        GLU  21  -3.621 -13.417   5.694
  166    HA   GLU  21           HA       GLU  21  -3.590 -13.981   8.306
  167   1HB   GLU  21          1HB       GLU  21  -5.001 -15.801   7.811
  168   2HB   GLU  21          2HB       GLU  21  -5.188 -14.767   6.409
  169   1HG   GLU  21          1HG       GLU  21  -3.482 -16.124   5.179
  170   2HG   GLU  21          2HG       GLU  21  -3.289 -17.156   6.582
  171    H    TYR  22           H        TYR  22  -1.679 -15.659   5.730
  172    HA   TYR  22           HA       TYR  22  -0.475 -17.470   7.565
  173   1HB   TYR  22          1HB       TYR  22  -0.828 -17.130   4.802
  174   2HB   TYR  22          2HB       TYR  22   0.855 -16.678   4.982
  175    HD1  TYR  22           1HD      TYR  22  -1.487 -19.414   6.049
  176    HD2  TYR  22           2HD      TYR  22   2.462 -18.345   4.799
  177    HE1  TYR  22           1HE      TYR  22  -0.820 -21.867   6.036
  178    HE2  TYR  22           2HE      TYR  22   3.117 -20.801   4.791
  179    HH   TYR  22           HH       TYR  22   1.758 -23.032   6.333
  180    H    SER  23           H        SER  23   0.236 -14.199   6.372
  181    HA   SER  23           HA       SER  23   2.950 -14.295   7.157
  182   1HB   SER  23          1HB       SER  23   1.249 -12.535   5.693
  183   2HB   SER  23          2HB       SER  23   1.878 -11.593   7.031
  184    HG   SER  23           HG       SER  23   3.404 -11.396   5.408
  185    H    THR  24           H        THR  24   3.926 -13.109   8.970
  186    HA   THR  24           HA       THR  24   2.024 -12.390  11.090
  187    HB   THR  24           HB       THR  24   3.525 -13.628  12.689
  188    HG1  THR  24           1HG      THR  24   5.493 -13.895  11.674
  189   1HG2  THR  24          1HG2      THR  24   2.552 -15.289  10.305
  190   2HG2  THR  24          2HG2      THR  24   3.090 -15.976  11.856
  191   3HG2  THR  24          3HG2      THR  24   1.636 -14.952  11.793
  192    H    LYS  25           H        LYS  25   4.045 -11.139   8.967
  193    HA   LYS  25           HA       LYS  25   5.898  -9.802  10.680
  194   1HB   LYS  25          1HB       LYS  25   5.150  -9.595   7.765
  195   2HB   LYS  25          2HB       LYS  25   6.221  -8.425   8.509
  196   1HG   LYS  25          1HG       LYS  25   6.913 -11.231   9.176
  197   2HG   LYS  25          2HG       LYS  25   6.996 -10.889   7.459
  198   1HD   LYS  25          1HD       LYS  25   8.384  -8.802   8.062
  199   2HD   LYS  25          2HD       LYS  25   8.463  -9.427   9.698
  200   1HE   LYS  25          1HE       LYS  25   9.165 -11.432   7.617
  201   2HE   LYS  25          2HE       LYS  25  10.248 -10.055   7.664
  202   1HZ   LYS  25          1HZ       LYS  25   9.773 -10.787  10.274
  203   2HZ   LYS  25          2HZ       LYS  25  10.067 -12.175   9.466
  204   3HZ   LYS  25          3HZ       LYS  25  11.160 -10.962   9.431
  205    H    LYS  26           H        LYS  26   5.883  -7.165  10.097
  206    HA   LYS  26           HA       LYS  26   3.167  -6.239  10.660
  207   1HB   LYS  26          1HB       LYS  26   5.614  -5.839  12.369
  208   2HB   LYS  26          2HB       LYS  26   4.349  -4.627  12.339
  209   1HG   LYS  26          1HG       LYS  26   3.093  -7.220  12.580
  210   2HG   LYS  26          2HG       LYS  26   4.383  -7.132  13.763
  211   1HD   LYS  26          1HD       LYS  26   3.269  -5.598  15.034
  212   2HD   LYS  26          2HD       LYS  26   2.843  -4.623  13.641
  213   1HE   LYS  26          1HE       LYS  26   0.731  -5.450  13.651
  214   2HE   LYS  26          2HE       LYS  26   1.334  -7.090  13.510
  215   1HZ   LYS  26          1HZ       LYS  26   0.406  -5.719  15.813
  216   2HZ   LYS  26          2HZ       LYS  26   0.561  -7.324  15.553
  217   3HZ   LYS  26          3HZ       LYS  26   1.841  -6.453  16.074
  218    H    VAL  27           H        VAL  27   2.632  -4.322   9.647
  219    HA   VAL  27           HA       VAL  27   4.351  -3.501   7.550
  220    HB   VAL  27           HB       VAL  27   1.758  -3.534   7.772
  221   1HG1  VAL  27          1HG1      VAL  27   0.691  -1.548   8.507
  222   2HG1  VAL  27          2HG1      VAL  27   1.843  -1.981   9.793
  223   3HG1  VAL  27          3HG1      VAL  27   2.236  -0.675   8.649
  224   1HG2  VAL  27          1HG2      VAL  27   2.246  -2.844   5.688
  225   2HG2  VAL  27          2HG2      VAL  27   1.924  -1.208   6.311
  226   3HG2  VAL  27          3HG2      VAL  27   3.594  -1.820   6.239
  227    H    SER  28           H        SER  28   3.963  -2.634  10.919
  228    HA   SER  28           HA       SER  28   4.735  -0.003  10.832
  229   1HB   SER  28          1HB       SER  28   5.420  -0.337  13.198
  230   2HB   SER  28          2HB       SER  28   3.864  -1.069  12.860
  231    HG   SER  28           HG       SER  28   6.420  -2.416  13.057
  232    H    ASP  29           H        ASP  29   6.660  -3.046  10.836
  233    HA   ASP  29           HA       ASP  29   9.119  -1.696  11.097
  234   1HB   ASP  29          1HB       ASP  29   8.356  -4.503  10.180
  235   2HB   ASP  29          2HB       ASP  29  10.025  -3.980  10.293
  236    H    VAL  30           H        VAL  30   7.025  -2.891   8.438
  237    HA   VAL  30           HA       VAL  30   8.967  -2.568   6.393
  238    HB   VAL  30           HB       VAL  30   5.950  -2.763   6.305
  239   1HG1  VAL  30          1HG1      VAL  30   6.028  -2.990   4.018
  240   2HG1  VAL  30          2HG1      VAL  30   7.363  -1.838   4.261
  241   3HG1  VAL  30          3HG1      VAL  30   7.712  -3.566   4.019
  242   1HG2  VAL  30          1HG2      VAL  30   7.487  -5.095   5.442
  243   2HG2  VAL  30          2HG2      VAL  30   7.787  -4.672   7.145
  244   3HG2  VAL  30          3HG2      VAL  30   6.126  -4.979   6.584
  245    H    LEU  31           H        LEU  31   6.656  -0.472   8.071
  246    HA   LEU  31           HA       LEU  31   6.570   1.543   6.101
  247   1HB   LEU  31          1HB       LEU  31   5.681   1.141   8.873
  248   2HB   LEU  31          2HB       LEU  31   6.060   2.805   8.474
  249    HG   LEU  31           HG       LEU  31   3.654   2.123   8.187
  250   1HD1  LEU  31          1HD1      LEU  31   3.912   4.084   7.111
  251   2HD1  LEU  31          2HD1      LEU  31   5.345   3.531   6.212
  252   3HD1  LEU  31          3HD1      LEU  31   3.716   3.078   5.656
  253   1HD2  LEU  31          1HD2      LEU  31   3.619  -0.003   7.289
  254   2HD2  LEU  31          2HD2      LEU  31   3.254   1.003   5.867
  255   3HD2  LEU  31          3HD2      LEU  31   4.896   0.357   6.101
  256    H    LYS  32           H        LYS  32   8.323   1.430   9.288
  257    HA   LYS  32           HA       LYS  32   9.866   3.680   8.772
  258   1HB   LYS  32          1HB       LYS  32  11.244   2.902  10.642
  259   2HB   LYS  32          2HB       LYS  32   9.534   2.777  11.004
  260   1HG   LYS  32          1HG       LYS  32   9.532   0.379  10.616
  261   2HG   LYS  32          2HG       LYS  32  11.135   0.425   9.908
  262   1HD   LYS  32          1HD       LYS  32  10.620   1.293  12.784
  263   2HD   LYS  32          2HD       LYS  32  10.955  -0.376  12.366
  264   1HE   LYS  32          1HE       LYS  32  12.926   1.248  11.035
  265   2HE   LYS  32          2HE       LYS  32  12.828   1.807  12.693
  266   1HZ   LYS  32          1HZ       LYS  32  12.765  -0.905  12.861
  267   2HZ   LYS  32          2HZ       LYS  32  13.879  -0.612  11.704
  268   3HZ   LYS  32          3HZ       LYS  32  14.046   0.054  13.185
  269    H    LEU  33           H        LEU  33   9.968   0.496   7.400
  270    HA   LEU  33           HA       LEU  33  12.730   0.377   6.854
  271   1HB   LEU  33          1HB       LEU  33  10.293  -1.101   6.184
  272   2HB   LEU  33          2HB       LEU  33  11.478  -1.098   4.893
  273    HG   LEU  33           HG       LEU  33  11.858  -2.093   7.726
  274   1HD1  LEU  33          1HD1      LEU  33  10.711  -3.399   5.673
  275   2HD1  LEU  33          2HD1      LEU  33  12.418  -3.794   5.361
  276   3HD1  LEU  33          3HD1      LEU  33  11.682  -4.201   6.930
  277   1HD2  LEU  33          1HD2      LEU  33  14.035  -1.708   7.568
  278   2HD2  LEU  33          2HD2      LEU  33  14.099  -2.773   6.143
  279   3HD2  LEU  33          3HD2      LEU  33  13.832  -1.025   5.936
  280    H    PHE  34           H        PHE  34   9.868   1.607   5.023
  281    HA   PHE  34           HA       PHE  34  11.560   2.435   2.852
  282   1HB   PHE  34          1HB       PHE  34   8.625   2.509   3.666
  283   2HB   PHE  34          2HB       PHE  34   9.140   3.569   2.369
  284    HD1  PHE  34           1HD      PHE  34   9.160  -0.005   3.402
  285    HD2  PHE  34           2HD      PHE  34   9.281   2.761   0.186
  286    HE1  PHE  34           1HE      PHE  34   8.937  -1.896   1.767
  287    HE2  PHE  34           2HE      PHE  34   9.058   0.870  -1.449
  288    HZ   PHE  34           HZ       PHE  34   8.889  -1.436  -0.639
  289    H    GLU  35           H        GLU  35  10.686   3.681   5.932
  290    HA   GLU  35           HA       GLU  35  10.664   6.413   5.098
  291   1HB   GLU  35          1HB       GLU  35  10.783   5.217   7.902
  292   2HB   GLU  35          2HB       GLU  35  10.442   6.893   7.520
  293   1HG   GLU  35          1HG       GLU  35   8.678   5.146   5.982
  294   2HG   GLU  35          2HG       GLU  35   8.578   4.745   7.685
  295    H    ASP  36           H        ASP  36  12.781   4.402   7.279
  296    HA   ASP  36           HA       ASP  36  14.997   6.022   6.320
  297   1HB   ASP  36          1HB       ASP  36  13.977   6.366   8.825
  298   2HB   ASP  36          2HB       ASP  36  15.062   5.029   9.155
  299    H    GLY  37           H        GLY  37  13.822   3.249   5.748
  300   1HA   GLY  37          1HA       GLY  37  15.941   1.508   6.819
  301   2HA   GLY  37          2HA       GLY  37  14.410   0.996   6.136
  302    H    GLU  38           H        GLU  38  15.594  -0.456   4.692
  303    HA   GLU  38           HA       GLU  38  17.419   0.701   2.850
  304   1HB   GLU  38          1HB       GLU  38  16.981  -1.849   3.817
  305   2HB   GLU  38          2HB       GLU  38  16.272  -1.968   2.219
  306   1HG   GLU  38          1HG       GLU  38  18.580  -2.555   1.939
  307   2HG   GLU  38          2HG       GLU  38  18.429  -0.933   1.292
  308    H    MET  39           H        MET  39  13.957   0.200   3.050
  309    HA   MET  39           HA       MET  39  13.599   0.304   0.215
  310   1HB   MET  39          1HB       MET  39  11.643   0.459   2.576
  311   2HB   MET  39          2HB       MET  39  11.141   0.346   0.900
  312   1HG   MET  39          1HG       MET  39  12.946  -1.724   2.237
  313   2HG   MET  39          2HG       MET  39  11.201  -1.875   2.179
  314   1HE   MET  39          1HE       MET  39  14.251  -3.145  -0.548
  315   2HE   MET  39          2HE       MET  39  14.252  -1.401  -0.903
  316   3HE   MET  39          3HE       MET  39  14.425  -1.968   0.775
  317    H    ALA  40           H        ALA  40  14.779   2.586   2.103
  318    HA   ALA  40           HA       ALA  40  12.901   4.707   1.444
  319   1HB   ALA  40          1HB       ALA  40  14.950   4.196   3.456
  320   2HB   ALA  40          2HB       ALA  40  15.191   5.777   2.674
  321   3HB   ALA  40          3HB       ALA  40  13.637   5.398   3.456
  322    H    LYS  41           H        LYS  41  15.292   2.990  -0.130
  323    HA   LYS  41           HA       LYS  41  16.613   5.250  -1.336
  324   1HB   LYS  41          1HB       LYS  41  17.980   3.644  -2.428
  325   2HB   LYS  41          2HB       LYS  41  17.762   3.089  -0.781
  326   1HG   LYS  41          1HG       LYS  41  16.317   1.336  -1.409
  327   2HG   LYS  41          2HG       LYS  41  15.818   2.133  -2.888
  328   1HD   LYS  41          1HD       LYS  41  17.326   0.839  -3.985
  329   2HD   LYS  41          2HD       LYS  41  18.586   1.801  -3.237
  330   1HE   LYS  41          1HE       LYS  41  18.912   0.233  -1.467
  331   2HE   LYS  41          2HE       LYS  41  17.354  -0.527  -1.725
  332   1HZ   LYS  41          1HZ       LYS  41  19.749  -0.743  -3.391
  333   2HZ   LYS  41          2HZ       LYS  41  18.901  -1.941  -2.673
  334   3HZ   LYS  41          3HZ       LYS  41  18.277  -1.159  -3.964
  335    H    TYR  42           H        TYR  42  13.732   3.351  -1.794
  336    HA   TYR  42           HA       TYR  42  13.518   4.371  -4.545
  337   1HB   TYR  42          1HB       TYR  42  12.544   1.959  -2.949
  338   2HB   TYR  42          2HB       TYR  42  11.563   2.490  -4.301
  339    HD1  TYR  42           1HD      TYR  42  15.125   3.036  -4.676
  340    HD2  TYR  42           2HD      TYR  42  11.987   0.182  -5.236
  341    HE1  TYR  42           1HE      TYR  42  16.602   1.714  -6.268
  342    HE2  TYR  42           2HE      TYR  42  13.475  -1.130  -6.826
  343    HH   TYR  42           HH       TYR  42  16.447  -1.108  -6.942
  344    H    VAL  43           H        VAL  43  13.058   6.128  -2.325
  345    HA   VAL  43           HA       VAL  43  10.140   6.404  -2.535
  346    HB   VAL  43           HB       VAL  43  11.970   6.894  -0.183
  347   1HG1  VAL  43          1HG1      VAL  43   9.008   7.525  -0.286
  348   2HG1  VAL  43          2HG1      VAL  43  10.174   7.911   1.003
  349   3HG1  VAL  43          3HG1      VAL  43  10.274   8.745  -0.567
  350   1HG2  VAL  43          1HG2      VAL  43   9.460   5.204  -0.322
  351   2HG2  VAL  43          2HG2      VAL  43  11.086   4.558  -0.652
  352   3HG2  VAL  43          3HG2      VAL  43  10.704   5.232   0.951
  353    H    GLN  44           H        GLN  44   9.387   8.396  -3.194
  354    HA   GLN  44           HA       GLN  44  11.488  10.301  -3.832
  355   1HB   GLN  44          1HB       GLN  44   8.707   9.847  -4.980
  356   2HB   GLN  44          2HB       GLN  44   9.642  11.282  -5.351
  357   1HG   GLN  44          1HG       GLN  44  11.414   9.062  -5.703
  358   2HG   GLN  44          2HG       GLN  44   9.900   8.604  -6.458
  359   1HE2  GLN  44          1HE2      GLN  44   8.885  10.201  -7.907
  360   2HE2  GLN  44          2HE2      GLN  44   9.893  11.168  -8.931
  361    H    GLY  45           H        GLY  45  11.683  11.354  -1.794
  362   1HA   GLY  45          1HA       GLY  45  11.205  13.001  -0.334
  363   2HA   GLY  45          2HA       GLY  45   9.829  13.447  -1.324
  364    H    ASP  46           H        ASP  46   7.738  12.789  -0.754
  365    HA   ASP  46           HA       ASP  46   7.634  11.152   1.658
  366   1HB   ASP  46          1HB       ASP  46   6.838  13.766   1.455
  367   2HB   ASP  46          2HB       ASP  46   5.350  12.972   0.981
  368    H    ALA  47           H        ALA  47   7.323  10.903  -1.549
  369    HA   ALA  47           HA       ALA  47   4.922   9.229  -1.370
  370   1HB   ALA  47          1HB       ALA  47   3.968  10.163  -3.261
  371   2HB   ALA  47          2HB       ALA  47   4.748  11.602  -2.563
  372   3HB   ALA  47          3HB       ALA  47   5.529  10.729  -3.902
  373    H    ILE  48           H        ILE  48   5.063   7.260  -2.487
  374    HA   ILE  48           HA       ILE  48   7.730   6.723  -3.589
  375    HB   ILE  48           HB       ILE  48   7.368   5.444  -1.633
  376   1HG1  ILE  48          1HG1      ILE  48   6.949   3.794  -4.138
  377   2HG1  ILE  48          2HG1      ILE  48   8.475   4.232  -3.396
  378   1HG2  ILE  48          1HG2      ILE  48   4.978   5.656  -1.382
  379   2HG2  ILE  48          2HG2      ILE  48   4.698   4.642  -2.818
  380   3HG2  ILE  48          3HG2      ILE  48   5.424   3.933  -1.356
  381   1HD1  ILE  48          1HD1      ILE  48   7.986   1.957  -2.734
  382   2HD1  ILE  48          2HD1      ILE  48   7.724   2.980  -1.301
  383   3HD1  ILE  48          3HD1      ILE  48   6.332   2.394  -2.244
  384    H    GLY  49           H        GLY  49   7.856   5.325  -5.493
  385   1HA   GLY  49          1HA       GLY  49   5.786   5.986  -7.390
  386   2HA   GLY  49          2HA       GLY  49   7.289   5.135  -7.690
  387    H    TYR  50           H        TYR  50   5.167   4.101  -8.989
  388    HA   TYR  50           HA       TYR  50   3.691   2.219  -7.460
  389   1HB   TYR  50          1HB       TYR  50   3.061   3.298  -9.685
  390   2HB   TYR  50          2HB       TYR  50   4.414   2.485 -10.445
  391    HD1  TYR  50           1HD      TYR  50   1.462   1.546  -8.311
  392    HD2  TYR  50           2HD      TYR  50   3.903   0.608 -11.697
  393    HE1  TYR  50           1HE      TYR  50  -0.024  -0.449  -8.838
  394    HE2  TYR  50           2HE      TYR  50   2.409  -1.383 -12.213
  395    HH   TYR  50           HH       TYR  50   0.256  -2.637 -10.016
  396    H    GLU  51           H        GLU  51   6.816   2.207  -9.160
  397    HA   GLU  51           HA       GLU  51   6.988  -0.598  -9.296
  398   1HB   GLU  51          1HB       GLU  51   8.427   1.593 -10.307
  399   2HB   GLU  51          2HB       GLU  51   9.565   0.816  -9.224
  400   1HG   GLU  51          1HG       GLU  51   9.417  -1.283 -10.388
  401   2HG   GLU  51          2HG       GLU  51   7.960  -0.805 -11.237
  402    H    GLY  52           H        GLY  52   8.430   1.912  -7.104
  403   1HA   GLY  52          1HA       GLY  52   9.886   0.228  -5.454
  404   2HA   GLY  52          2HA       GLY  52   9.199   1.775  -4.998
  405    H    PHE  53           H        PHE  53   6.376   0.844  -5.633
  406    HA   PHE  53           HA       PHE  53   5.750  -0.075  -3.057
  407   1HB   PHE  53          1HB       PHE  53   4.318   1.284  -4.685
  408   2HB   PHE  53          2HB       PHE  53   4.192  -0.130  -5.712
  409    HD1  PHE  53           1HD      PHE  53   3.301   1.198  -2.373
  410    HD2  PHE  53           2HD      PHE  53   2.564  -1.788  -5.297
  411    HE1  PHE  53           1HE      PHE  53   1.264   0.459  -1.106
  412    HE2  PHE  53           2HE      PHE  53   0.527  -2.526  -4.030
  413    HZ   PHE  53           HZ       PHE  53  -0.099  -1.394  -1.950
  414    H    GLN  54           H        GLN  54   6.528  -1.708  -6.098
  415    HA   GLN  54           HA       GLN  54   5.231  -4.097  -5.615
  416   1HB   GLN  54          1HB       GLN  54   7.899  -3.832  -7.051
  417   2HB   GLN  54          2HB       GLN  54   6.638  -5.012  -7.348
  418   1HG   GLN  54          1HG       GLN  54   5.520  -2.333  -7.575
  419   2HG   GLN  54          2HG       GLN  54   6.955  -2.448  -8.575
  420   1HE2  GLN  54          1HE2      GLN  54   5.709  -2.313 -10.440
  421   2HE2  GLN  54          2HE2      GLN  54   4.786  -3.643 -11.054
  422    H    GLN  55           H        GLN  55   8.691  -3.164  -4.976
  423    HA   GLN  55           HA       GLN  55   9.396  -5.527  -3.774
  424   1HB   GLN  55          1HB       GLN  55  11.216  -4.111  -2.677
  425   2HB   GLN  55          2HB       GLN  55  11.116  -3.995  -4.423
  426   1HG   GLN  55          1HG       GLN  55   9.975  -1.862  -4.315
  427   2HG   GLN  55          2HG       GLN  55   9.676  -2.027  -2.596
  428   1HE2  GLN  55          1HE2      GLN  55  10.700  -0.204  -1.962
  429   2HE2  GLN  55          2HE2      GLN  55  12.412   0.050  -2.049
  430    H    PHE  56           H        PHE  56   7.554  -2.756  -2.551
  431    HA   PHE  56           HA       PHE  56   7.899  -3.102   0.164
  432   1HB   PHE  56          1HB       PHE  56   6.584  -1.373  -1.412
  433   2HB   PHE  56          2HB       PHE  56   5.230  -2.462  -1.184
  434    HD1  PHE  56           1HD      PHE  56   6.783   0.404   0.042
  435    HD2  PHE  56           2HD      PHE  56   4.785  -3.095   1.375
  436    HE1  PHE  56           1HE      PHE  56   6.227   1.546   2.207
  437    HE2  PHE  56           2HE      PHE  56   4.230  -1.953   3.540
  438    HZ   PHE  56           HZ       PHE  56   4.957   0.354   3.930
  439    H    LEU  57           H        LEU  57   5.331  -4.496  -2.002
  440    HA   LEU  57           HA       LEU  57   4.059  -5.950  -0.004
  441   1HB   LEU  57          1HB       LEU  57   4.213  -6.163  -2.994
  442   2HB   LEU  57          2HB       LEU  57   3.351  -7.369  -2.059
  443    HG   LEU  57           HG       LEU  57   2.716  -4.463  -1.645
  444   1HD1  LEU  57          1HD1      LEU  57   1.347  -4.271  -3.502
  445   2HD1  LEU  57          2HD1      LEU  57   2.766  -5.123  -4.157
  446   3HD1  LEU  57          3HD1      LEU  57   1.284  -6.030  -3.773
  447   1HD2  LEU  57          1HD2      LEU  57   0.649  -6.597  -1.732
  448   2HD2  LEU  57          2HD2      LEU  57   1.811  -6.649  -0.385
  449   3HD2  LEU  57          3HD2      LEU  57   0.818  -5.195  -0.648
  450    H    LYS  58           H        LYS  58   7.133  -6.408  -1.601
  451    HA   LYS  58           HA       LYS  58   7.297  -9.206  -1.280
  452   1HB   LYS  58          1HB       LYS  58   8.760  -7.262  -2.568
  453   2HB   LYS  58          2HB       LYS  58   9.820  -7.688  -1.240
  454   1HG   LYS  58          1HG       LYS  58  10.425  -9.568  -2.348
  455   2HG   LYS  58          2HG       LYS  58   8.780 -10.159  -2.215
  456   1HD   LYS  58          1HD       LYS  58   8.620 -10.006  -4.472
  457   2HD   LYS  58          2HD       LYS  58   8.650  -8.262  -4.300
  458   1HE   LYS  58          1HE       LYS  58  11.337  -8.817  -4.093
  459   2HE   LYS  58          2HE       LYS  58  10.831 -10.125  -5.144
  460   1HZ   LYS  58          1HZ       LYS  58   9.975  -7.387  -5.691
  461   2HZ   LYS  58          2HZ       LYS  58  11.446  -7.905  -6.174
  462   3HZ   LYS  58          3HZ       LYS  58  10.099  -8.645  -6.726
  463    H    ILE  59           H        ILE  59   8.756  -6.467   0.617
  464    HA   ILE  59           HA       ILE  59   9.528  -8.238   2.707
  465    HB   ILE  59           HB       ILE  59   9.376  -5.223   2.705
  466   1HG1  ILE  59          1HG1      ILE  59  12.015  -6.339   2.253
  467   2HG1  ILE  59          2HG1      ILE  59  10.904  -6.863   1.004
  468   1HG2  ILE  59          1HG2      ILE  59  11.030  -7.148   4.363
  469   2HG2  ILE  59          2HG2      ILE  59  11.116  -5.371   4.419
  470   3HG2  ILE  59          3HG2      ILE  59   9.629  -6.207   4.927
  471   1HD1  ILE  59          1HD1      ILE  59  11.221  -3.958   1.886
  472   2HD1  ILE  59          2HD1      ILE  59  12.035  -4.677   0.476
  473   3HD1  ILE  59          3HD1      ILE  59  10.260  -4.552   0.510
  474    H    TYR  60           H        TYR  60   6.918  -5.771   2.247
  475    HA   TYR  60           HA       TYR  60   5.777  -5.838   4.713
  476   1HB   TYR  60          1HB       TYR  60   5.023  -4.399   2.855
  477   2HB   TYR  60          2HB       TYR  60   4.693  -5.787   1.838
  478    HD1  TYR  60           1HD      TYR  60   3.644  -4.639   5.265
  479    HD2  TYR  60           2HD      TYR  60   2.446  -6.169   1.454
  480    HE1  TYR  60           1HE      TYR  60   1.213  -4.615   6.011
  481    HE2  TYR  60           2HE      TYR  60   0.020  -6.140   2.212
  482    HH   TYR  60           HH       TYR  60  -0.892  -5.973   5.324
  483    H    LEU  61           H        LEU  61   4.357  -7.739   1.967
  484    HA   LEU  61           HA       LEU  61   3.048  -9.476   3.787
  485   1HB   LEU  61          1HB       LEU  61   3.282  -9.164   0.840
  486   2HB   LEU  61          2HB       LEU  61   2.801 -10.738   1.443
  487    HG   LEU  61           HG       LEU  61   1.379  -8.241   2.353
  488   1HD1  LEU  61          1HD1      LEU  61   0.431  -7.875   0.383
  489   2HD1  LEU  61          2HD1      LEU  61   1.518  -9.087  -0.338
  490   3HD1  LEU  61          3HD1      LEU  61  -0.082  -9.576   0.270
  491   1HD2  LEU  61          1HD2      LEU  61   0.700 -10.002   3.686
  492   2HD2  LEU  61          2HD2      LEU  61  -0.525 -10.017   2.395
  493   3HD2  LEU  61          3HD2      LEU  61   0.813 -11.190   2.365
  494    H    GLU  62           H        GLU  62   6.280  -9.204   2.845
  495    HA   GLU  62           HA       GLU  62   8.022 -10.478   3.073
  496   1HB   GLU  62          1HB       GLU  62   6.859 -10.985   5.309
  497   2HB   GLU  62          2HB       GLU  62   6.316 -12.489   4.594
  498   1HG   GLU  62          1HG       GLU  62   9.097 -12.332   4.002
  499   2HG   GLU  62          2HG       GLU  62   8.946 -11.810   5.668
  500    H    VAL  63           H        VAL  63   5.712 -11.040   0.995
  501    HA   VAL  63           HA       VAL  63   5.997 -13.785   0.345
  502    HB   VAL  63           HB       VAL  63   4.969 -12.925  -1.847
  503   1HG1  VAL  63          1HG1      VAL  63   2.865 -12.163  -0.187
  504   2HG1  VAL  63          2HG1      VAL  63   3.240 -13.814  -0.738
  505   3HG1  VAL  63          3HG1      VAL  63   3.853 -13.238   0.831
  506   1HG2  VAL  63          1HG2      VAL  63   4.331 -10.741  -2.092
  507   2HG2  VAL  63          2HG2      VAL  63   4.206 -10.461  -0.338
  508   3HG2  VAL  63          3HG2      VAL  63   5.804 -10.498  -1.123
  509    H    ASP  64           H        ASP  64   7.035 -14.650  -1.620
  510    HA   ASP  64           HA       ASP  64   9.617 -13.470  -1.893
  511   1HB   ASP  64          1HB       ASP  64   8.362 -16.064  -2.329
  512   2HB   ASP  64          2HB       ASP  64   9.259 -15.607  -3.764
  513    H    ASN  65           H        ASN  65   6.532 -13.236  -3.404
  514    HA   ASN  65           HA       ASN  65   7.471 -11.518  -5.371
  515   1HB   ASN  65          1HB       ASN  65   6.340 -13.234  -7.220
  516   2HB   ASN  65          2HB       ASN  65   8.066 -13.074  -6.965
  517   1HD2  ASN  65          1HD2      ASN  65   5.179 -14.890  -6.127
  518   2HD2  ASN  65          2HD2      ASN  65   5.952 -16.358  -5.631
  519    H    VAL  66           H        VAL  66   5.718 -10.105  -5.402
  520    HA   VAL  66           HA       VAL  66   3.083 -11.212  -4.818
  521    HB   VAL  66           HB       VAL  66   4.486  -8.969  -3.951
  522   1HG1  VAL  66          1HG1      VAL  66   2.272  -8.153  -5.861
  523   2HG1  VAL  66          2HG1      VAL  66   2.993  -7.082  -4.636
  524   3HG1  VAL  66          3HG1      VAL  66   3.997  -7.725  -5.959
  525   1HG2  VAL  66          1HG2      VAL  66   1.722  -8.594  -3.384
  526   2HG2  VAL  66          2HG2      VAL  66   2.025 -10.348  -3.430
  527   3HG2  VAL  66          3HG2      VAL  66   2.978  -9.308  -2.345
  528    HA   PRO  67           HA       PRO  67   1.833 -10.703  -8.925
  529   1HB   PRO  67          1HB       PRO  67  -0.882 -10.607  -8.631
  530   2HB   PRO  67          2HB       PRO  67   0.031 -12.103  -8.623
  531   1HG   PRO  67          1HG       PRO  67  -1.188 -10.664  -6.347
  532   2HG   PRO  67          2HG       PRO  67  -0.656 -12.331  -6.433
  533   1HD   PRO  67          1HD       PRO  67   0.708 -10.158  -5.150
  534   2HD   PRO  67          2HD       PRO  67   1.294 -11.799  -5.337
  535    H    ARG  68           H        ARG  68   1.661  -9.174 -10.486
  536    HA   ARG  68           HA       ARG  68   1.673  -6.557  -9.528
  537   1HB   ARG  68          1HB       ARG  68   2.759  -7.458 -11.676
  538   2HB   ARG  68          2HB       ARG  68   1.165  -7.465 -12.403
  539   1HG   ARG  68          1HG       ARG  68   1.378  -4.894 -11.259
  540   2HG   ARG  68          2HG       ARG  68   2.976  -5.200 -11.910
  541   1HD   ARG  68          1HD       ARG  68   0.957  -6.090 -13.820
  542   2HD   ARG  68          2HD       ARG  68   0.634  -4.432 -13.353
  543    HE   ARG  68           HE       ARG  68   3.420  -4.601 -13.833
  544   1HH1  ARG  68          2HH2      ARG  68   0.431  -4.968 -15.654
  545   2HH1  ARG  68          1HH2      ARG  68   1.137  -4.476 -17.157
  546   1HH2  ARG  68          2HH1      ARG  68   4.351  -3.952 -15.816
  547   2HH2  ARG  68          1HH1      ARG  68   3.382  -3.894 -17.250
  548    H    HIS  69           H        HIS  69  -0.823  -8.704 -10.934
  549    HA   HIS  69           HA       HIS  69  -2.723  -6.857 -11.623
  550   1HB   HIS  69          1HB       HIS  69  -2.817  -9.267 -12.117
  551   2HB   HIS  69          2HB       HIS  69  -3.119  -9.614 -10.425
  552    HD1  HIS  69           1HD      HIS  69  -4.789  -8.402 -13.549
  553    HD2  HIS  69           2HD      HIS  69  -5.739  -8.933  -9.498
  554    HE1  HIS  69           1HE      HIS  69  -7.329  -8.222 -13.380
  555    H    LEU  70           H        LEU  70  -2.064  -8.368  -8.403
  556    HA   LEU  70           HA       LEU  70  -4.177  -6.919  -7.155
  557   1HB   LEU  70          1HB       LEU  70  -3.773  -8.901  -6.106
  558   2HB   LEU  70          2HB       LEU  70  -2.038  -8.813  -6.333
  559    HG   LEU  70           HG       LEU  70  -2.170  -6.842  -4.610
  560   1HD1  LEU  70          1HD1      LEU  70  -4.896  -7.953  -4.531
  561   2HD1  LEU  70          2HD1      LEU  70  -4.115  -7.777  -2.941
  562   3HD1  LEU  70          3HD1      LEU  70  -4.278  -6.366  -4.013
  563   1HD2  LEU  70          1HD2      LEU  70  -2.543  -9.066  -2.905
  564   2HD2  LEU  70          2HD2      LEU  70  -1.786  -9.678  -4.396
  565   3HD2  LEU  70          3HD2      LEU  70  -1.014  -8.360  -3.482
  566    H    SER  71           H        SER  71  -0.626  -6.542  -7.557
  567    HA   SER  71           HA       SER  71  -0.271  -4.513  -5.755
  568   1HB   SER  71          1HB       SER  71   1.121  -4.928  -8.439
  569   2HB   SER  71          2HB       SER  71   1.727  -3.916  -7.143
  570    HG   SER  71           HG       SER  71   2.444  -5.646  -6.088
  571    H    LEU  72           H        LEU  72  -1.560  -4.496  -9.095
  572    HA   LEU  72           HA       LEU  72  -1.434  -1.714  -9.474
  573   1HB   LEU  72          1HB       LEU  72  -1.636  -2.901 -11.418
  574   2HB   LEU  72          2HB       LEU  72  -2.807  -4.025 -10.756
  575    HG   LEU  72           HG       LEU  72  -4.466  -2.071 -10.753
  576   1HD1  LEU  72          1HD1      LEU  72  -3.955  -0.327 -12.500
  577   2HD1  LEU  72          2HD1      LEU  72  -3.031  -0.193 -10.984
  578   3HD1  LEU  72          3HD1      LEU  72  -2.261  -0.870 -12.440
  579   1HD2  LEU  72          1HD2      LEU  72  -3.543  -2.894 -13.507
  580   2HD2  LEU  72          2HD2      LEU  72  -4.332  -4.028 -12.384
  581   3HD2  LEU  72          3HD2      LEU  72  -5.196  -2.571 -12.932
  582    H    ALA  73           H        ALA  73  -4.049  -3.924  -8.292
  583    HA   ALA  73           HA       ALA  73  -5.882  -1.814  -7.870
  584   1HB   ALA  73          1HB       ALA  73  -7.136  -3.572  -6.628
  585   2HB   ALA  73          2HB       ALA  73  -6.583  -4.133  -8.224
  586   3HB   ALA  73          3HB       ALA  73  -5.720  -4.643  -6.753
  587    H    LEU  74           H        LEU  74  -3.301  -3.362  -5.946
  588    HA   LEU  74           HA       LEU  74  -4.048  -2.450  -3.441
  589   1HB   LEU  74          1HB       LEU  74  -1.591  -3.424  -4.756
  590   2HB   LEU  74          2HB       LEU  74  -1.336  -2.444  -3.325
  591    HG   LEU  74           HG       LEU  74  -3.211  -4.813  -3.320
  592   1HD1  LEU  74          1HD1      LEU  74  -0.876  -5.436  -4.079
  593   2HD1  LEU  74          2HD1      LEU  74  -0.313  -4.927  -2.469
  594   3HD1  LEU  74          3HD1      LEU  74  -1.479  -6.263  -2.623
  595   1HD2  LEU  74          1HD2      LEU  74  -2.376  -2.831  -1.380
  596   2HD2  LEU  74          2HD2      LEU  74  -3.660  -4.060  -1.279
  597   3HD2  LEU  74          3HD2      LEU  74  -1.990  -4.478  -0.826
  598    H    PHE  75           H        PHE  75  -2.164  -0.857  -6.073
  599    HA   PHE  75           HA       PHE  75  -1.622   1.450  -4.522
  600   1HB   PHE  75          1HB       PHE  75  -0.180   1.005  -6.389
  601   2HB   PHE  75          2HB       PHE  75  -1.514   0.525  -7.419
  602    HD1  PHE  75           1HD      PHE  75   0.666   3.191  -6.473
  603    HD2  PHE  75           2HD      PHE  75  -3.090   2.349  -8.260
  604    HE1  PHE  75           1HE      PHE  75   0.652   5.473  -7.518
  605    HE2  PHE  75           2HE      PHE  75  -3.104   4.632  -9.304
  606    HZ   PHE  75           HZ       PHE  75  -1.233   6.167  -8.921
  607    H    GLN  76           H        GLN  76  -4.164   0.495  -6.885
  608    HA   GLN  76           HA       GLN  76  -5.248   2.989  -7.262
  609   1HB   GLN  76          1HB       GLN  76  -6.238   0.163  -7.490
  610   2HB   GLN  76          2HB       GLN  76  -7.445   1.433  -7.522
  611   1HG   GLN  76          1HG       GLN  76  -5.908   2.582  -9.303
  612   2HG   GLN  76          2HG       GLN  76  -5.103   1.030  -9.421
  613   1HE2  GLN  76          1HE2      GLN  76  -5.931  -0.510 -10.647
  614   2HE2  GLN  76          2HE2      GLN  76  -7.487  -0.495 -11.409
  615    H    SER  77           H        SER  77  -5.229   0.946  -4.440
  616    HA   SER  77           HA       SER  77  -7.578   1.473  -3.238
  617   1HB   SER  77          1HB       SER  77  -6.424   1.103  -1.110
  618   2HB   SER  77          2HB       SER  77  -5.781   0.014  -2.324
  619    HG   SER  77           HG       SER  77  -4.020   1.618  -2.644
  620    H    PHE  78           H        PHE  78  -4.694   3.599  -3.544
  621    HA   PHE  78           HA       PHE  78  -6.288   5.745  -2.326
  622   1HB   PHE  78          1HB       PHE  78  -4.308   5.202  -0.976
  623   2HB   PHE  78          2HB       PHE  78  -3.301   5.051  -2.403
  624    HD1  PHE  78           1HD      PHE  78  -2.204   6.938  -3.330
  625    HD2  PHE  78           2HD      PHE  78  -5.086   7.477  -0.262
  626    HE1  PHE  78           1HE      PHE  78  -1.486   9.330  -3.076
  627    HE2  PHE  78           2HE      PHE  78  -4.369   9.869  -0.008
  628    HZ   PHE  78           HZ       PHE  78  -2.577  10.767  -1.418
  629    H    GLU  79           H        GLU  79  -3.307   5.480  -4.394
  630    HA   GLU  79           HA       GLU  79  -2.784   6.369  -6.306
  631   1HB   GLU  79          1HB       GLU  79  -4.892   5.387  -7.173
  632   2HB   GLU  79          2HB       GLU  79  -5.775   6.824  -6.698
  633   1HG   GLU  79          1HG       GLU  79  -4.502   8.209  -8.270
  634   2HG   GLU  79          2HG       GLU  79  -3.416   6.883  -8.635
  635    H    THR  80           H        THR  80  -2.406   8.492  -7.368
  636    HA   THR  80           HA       THR  80  -2.142  10.560  -5.555
  637    HB   THR  80           HB       THR  80  -1.898  11.890  -7.817
  638    HG1  THR  80           1HG      THR  80  -1.677  10.107  -9.537
  639   1HG2  THR  80          1HG2      THR  80   0.063  10.808  -6.624
  640   2HG2  THR  80          2HG2      THR  80  -0.300   9.296  -7.491
  641   3HG2  THR  80          3HG2      THR  80   0.207  10.742  -8.397
  642    H    GLY  81           H        GLY  81  -3.869  11.701  -8.352
  643   1HA   GLY  81          1HA       GLY  81  -6.324  12.069  -6.776
  644   2HA   GLY  81          2HA       GLY  81  -5.482  13.479  -7.388
  645    H    HIS  82           H        HIS  82  -8.045  11.516  -8.030
  646    HA   HIS  82           HA       HIS  82  -7.607  11.401 -10.899
  647   1HB   HIS  82          1HB       HIS  82  -9.453   9.926 -10.993
  648   2HB   HIS  82          2HB       HIS  82  -8.487   9.432  -9.617
  649    HD1  HIS  82           1HD      HIS  82  -9.606   9.411  -7.329
  650    HD2  HIS  82           2HD      HIS  82 -11.921  11.299 -10.274
  651    HE1  HIS  82           1HE      HIS  82 -11.895   9.826  -6.281
  652    H    CYS  83           H        CYS  83  -8.884  12.540 -12.410
  653    HA   CYS  83           HA       CYS  83 -11.117  14.046 -11.664
  654   1HB   CYS  83          1HB       CYS  83 -10.199  16.332 -11.881
  655   2HB   CYS  83          2HB       CYS  83  -9.595  15.496 -10.464
  656    HG   CYS  83           HG       CYS  83  -7.373  14.618 -11.634
  657    H    LEU  84           H        LEU  84 -11.967  15.221 -13.596
  658    HA   LEU  84           HA       LEU  84 -10.985  13.969 -16.015
  659   1HB   LEU  84          1HB       LEU  84 -13.479  15.388 -15.178
  660   2HB   LEU  84          2HB       LEU  84 -13.084  15.297 -16.883
  661    HG   LEU  84           HG       LEU  84 -14.618  13.522 -16.236
  662   1HD1  LEU  84          1HD1      LEU  84 -12.374  13.238 -17.782
  663   2HD1  LEU  84          2HD1      LEU  84 -12.243  11.850 -16.675
  664   3HD1  LEU  84          3HD1      LEU  84 -13.706  12.062 -17.666
  665   1HD2  LEU  84          1HD2      LEU  84 -14.441  12.239 -14.414
  666   2HD2  LEU  84          2HD2      LEU  84 -12.706  11.941 -14.670
  667   3HD2  LEU  84          3HD2      LEU  84 -13.242  13.433 -13.862
  668    H    ASN  85           H        ASN  85  -9.037  15.647 -15.043
  669    HA   ASN  85           HA       ASN  85  -9.109  17.688 -17.083
  670   1HB   ASN  85          1HB       ASN  85  -8.609  18.179 -14.110
  671   2HB   ASN  85          2HB       ASN  85  -8.004  19.282 -15.329
  672   1HD2  ASN  85          1HD2      ASN  85  -9.440  20.423 -16.657
  673   2HD2  ASN  85          2HD2      ASN  85 -11.092  20.700 -16.215
  674    H    GLU  86           H        GLU  86  -6.679  18.854 -16.849
  675    HA   GLU  86           HA       GLU  86  -4.808  16.692 -16.292
  676   1HB   GLU  86          1HB       GLU  86  -4.718  18.550 -18.710
  677   2HB   GLU  86          2HB       GLU  86  -3.512  17.341 -18.316
  678   1HG   GLU  86          1HG       GLU  86  -5.480  15.626 -18.349
  679   2HG   GLU  86          2HG       GLU  86  -6.408  16.889 -19.134
  680    H    THR  87           H        THR  87  -3.690  17.418 -14.523
  681    HA   THR  87           HA       THR  87  -2.765  20.215 -14.613
  682    HB   THR  87           HB       THR  87  -3.590  18.474 -12.230
  683    HG1  THR  87           1HG      THR  87  -4.591  20.871 -13.600
  684   1HG2  THR  87          1HG2      THR  87  -3.418  21.356 -11.784
  685   2HG2  THR  87          2HG2      THR  87  -2.643  20.043 -10.865
  686   3HG2  THR  87          3HG2      THR  87  -1.835  20.725 -12.297
  687    H    ASN  88           H        ASN  88  -1.288  18.379 -16.009
  688    HA   ASN  88           HA       ASN  88   0.675  17.467 -16.180
  689   1HB   ASN  88          1HB       ASN  88   1.481  19.734 -15.632
  690   2HB   ASN  88          2HB       ASN  88   1.312  19.426 -13.915
  691   1HD2  ASN  88          1HD2      ASN  88   3.468  19.891 -13.544
  692   2HD2  ASN  88          2HD2      ASN  88   4.757  18.808 -13.950
  693    H    VAL  89           H        VAL  89  -0.757  15.613 -14.986
  694    HA   VAL  89           HA       VAL  89   0.581  14.907 -12.471
  695    HB   VAL  89           HB       VAL  89  -1.818  13.422 -13.312
  696   1HG1  VAL  89          1HG1      VAL  89  -1.532  12.895 -11.153
  697   2HG1  VAL  89          2HG1      VAL  89  -0.448  14.279 -10.874
  698   3HG1  VAL  89          3HG1      VAL  89  -2.212  14.497 -10.783
  699   1HG2  VAL  89          1HG2      VAL  89  -1.955  16.389 -12.703
  700   2HG2  VAL  89          2HG2      VAL  89  -2.568  15.538 -14.141
  701   3HG2  VAL  89          3HG2      VAL  89  -3.344  15.285 -12.559
  702    H    THR  90           H        THR  90   2.489  14.042 -13.438
  703    HA   THR  90           HA       THR  90   1.986  11.530 -14.894
  704    HB   THR  90           HB       THR  90   2.912  13.512 -16.271
  705    HG1  THR  90           1HG      THR  90   4.033  11.880 -17.337
  706   1HG2  THR  90          1HG2      THR  90   4.685  13.800 -14.127
  707   2HG2  THR  90          2HG2      THR  90   5.639  12.864 -15.303
  708   3HG2  THR  90          3HG2      THR  90   4.954  14.440 -15.766
  709    H    LYS  91           H        LYS  91   2.945  12.903 -12.007
  710    HA   LYS  91           HA       LYS  91   5.069  10.958 -11.562
  711   1HB   LYS  91          1HB       LYS  91   5.550  12.206  -9.556
  712   2HB   LYS  91          2HB       LYS  91   5.438  13.311 -10.911
  713   1HG   LYS  91          1HG       LYS  91   2.855  13.424 -10.132
  714   2HG   LYS  91          2HG       LYS  91   3.546  12.947  -8.594
  715   1HD   LYS  91          1HD       LYS  91   5.112  15.086  -9.882
  716   2HD   LYS  91          2HD       LYS  91   3.443  15.559  -9.637
  717   1HE   LYS  91          1HE       LYS  91   4.532  16.181  -7.610
  718   2HE   LYS  91          2HE       LYS  91   3.697  14.693  -7.210
  719   1HZ   LYS  91          1HZ       LYS  91   6.514  14.822  -8.033
  720   2HZ   LYS  91          2HZ       LYS  91   6.009  14.739  -6.483
  721   3HZ   LYS  91          3HZ       LYS  91   5.719  13.498  -7.504
  722    H    ASP  92           H        ASP  92   3.706   9.057 -11.696
  723    HA   ASP  92           HA       ASP  92   1.451   8.803 -10.078
  724   1HB   ASP  92          1HB       ASP  92   3.295   6.628 -11.174
  725   2HB   ASP  92          2HB       ASP  92   1.662   6.371 -10.592
  726    H    VAL  93           H        VAL  93   1.983   9.342  -7.870
  727    HA   VAL  93           HA       VAL  93   3.764   7.402  -6.576
  728    HB   VAL  93           HB       VAL  93   4.458   9.246  -5.056
  729   1HG1  VAL  93          1HG1      VAL  93   5.333  10.256  -7.691
  730   2HG1  VAL  93          2HG1      VAL  93   6.284   9.615  -6.329
  731   3HG1  VAL  93          3HG1      VAL  93   5.500   8.498  -7.471
  732   1HG2  VAL  93          1HG2      VAL  93   2.829  10.911  -5.223
  733   2HG2  VAL  93          2HG2      VAL  93   4.202  11.597  -6.124
  734   3HG2  VAL  93          3HG2      VAL  93   2.832  10.877  -7.003
  735    H    VAL  94           H        VAL  94   3.314   7.394  -4.098
  736    HA   VAL  94           HA       VAL  94   0.536   8.049  -3.524
  737    HB   VAL  94           HB       VAL  94   1.732   5.281  -3.280
  738   1HG1  VAL  94          1HG1      VAL  94  -0.640   6.564  -2.019
  739   2HG1  VAL  94          2HG1      VAL  94  -0.866   4.922  -2.668
  740   3HG1  VAL  94          3HG1      VAL  94   0.389   5.230  -1.444
  741   1HG2  VAL  94          1HG2      VAL  94  -0.523   6.366  -4.999
  742   2HG2  VAL  94          2HG2      VAL  94   1.052   5.753  -5.556
  743   3HG2  VAL  94          3HG2      VAL  94  -0.123   4.642  -4.814
  744    H    CYS  95           H        CYS  95   0.100   8.175  -1.217
  745    HA   CYS  95           HA       CYS  95   2.387   9.092   0.195
  746   1HB   CYS  95          1HB       CYS  95   0.011  10.031   0.332
  747   2HB   CYS  95          2HB       CYS  95  -0.380   8.655   1.344
  748    HG   CYS  95           HG       CYS  95   2.376  10.330   1.913
  749    H    LEU  96           H        LEU  96   3.545   8.016   1.825
  750    HA   LEU  96           HA       LEU  96   3.183   5.178   1.942
  751   1HB   LEU  96          1HB       LEU  96   5.197   7.170   2.790
  752   2HB   LEU  96          2HB       LEU  96   5.094   5.725   3.776
  753    HG   LEU  96           HG       LEU  96   5.171   5.208   0.871
  754   1HD1  LEU  96          1HD1      LEU  96   7.246   6.875   2.188
  755   2HD1  LEU  96          2HD1      LEU  96   7.815   5.544   1.153
  756   3HD1  LEU  96          3HD1      LEU  96   6.739   6.794   0.484
  757   1HD2  LEU  96          1HD2      LEU  96   5.282   3.351   2.343
  758   2HD2  LEU  96          2HD2      LEU  96   6.911   3.556   1.655
  759   3HD2  LEU  96          3HD2      LEU  96   6.569   4.104   3.314
  760    H    ASN  97           H        ASN  97   2.173   8.000   3.775
  761    HA   ASN  97           HA       ASN  97   1.788   6.614   6.195
  762   1HB   ASN  97          1HB       ASN  97   2.013   9.160   5.874
  763   2HB   ASN  97          2HB       ASN  97   0.380   9.159   5.238
  764   1HD2  ASN  97          1HD2      ASN  97   0.310  10.697   7.140
  765   2HD2  ASN  97          2HD2      ASN  97  -0.191  10.054   8.668
  766    H    ASP  98           H        ASP  98  -0.180   7.482   3.303
  767    HA   ASP  98           HA       ASP  98  -2.647   6.789   4.339
  768   1HB   ASP  98          1HB       ASP  98  -1.460   6.990   1.565
  769   2HB   ASP  98          2HB       ASP  98  -3.060   6.296   1.739
  770    H    VAL  99           H        VAL  99  -0.082   4.954   2.569
  771    HA   VAL  99           HA       VAL  99  -1.575   2.579   2.288
  772    HB   VAL  99           HB       VAL  99   1.378   3.210   2.223
  773   1HG1  VAL  99          1HG1      VAL  99   0.116   0.641   2.437
  774   2HG1  VAL  99          2HG1      VAL  99   0.826   0.804   0.813
  775   3HG1  VAL  99          3HG1      VAL  99   1.843   1.031   2.256
  776   1HG2  VAL  99          1HG2      VAL  99  -0.836   3.306   0.282
  777   2HG2  VAL  99          2HG2      VAL  99   0.743   4.129   0.269
  778   3HG2  VAL  99          3HG2      VAL  99   0.611   2.448  -0.302
  779    H    SER 100           H        SER 100   0.277   4.052   4.915
  780    HA   SER 100           HA       SER 100   0.683   1.663   6.330
  781   1HB   SER 100          1HB       SER 100   1.575   3.027   8.031
  782   2HB   SER 100          2HB       SER 100   1.873   3.961   6.578
  783    HG   SER 100           HG       SER 100   0.958   5.454   7.913
  784    H    CYS 101           H        CYS 101  -1.920   4.107   6.144
  785    HA   CYS 101           HA       CYS 101  -3.277   3.122   8.445
  786   1HB   CYS 101          1HB       CYS 101  -3.362   5.493   7.252
  787   2HB   CYS 101          2HB       CYS 101  -4.663   4.751   6.342
  788    HG   CYS 101           HG       CYS 101  -4.286   4.917   9.630
  789    H    TYR 102           H        TYR 102  -3.497   2.794   4.852
  790    HA   TYR 102           HA       TYR 102  -5.844   1.344   4.710
  791   1HB   TYR 102          1HB       TYR 102  -4.646   2.258   2.755
  792   2HB   TYR 102          2HB       TYR 102  -3.181   1.396   3.179
  793    HD1  TYR 102           1HD      TYR 102  -2.677  -0.589   2.068
  794    HD2  TYR 102           2HD      TYR 102  -6.746   0.722   2.227
  795    HE1  TYR 102           1HE      TYR 102  -3.357  -2.491   0.525
  796    HE2  TYR 102           2HE      TYR 102  -7.413  -1.184   0.683
  797    HH   TYR 102           HH       TYR 102  -5.602  -2.670  -1.229
  798    H    PHE 103           H        PHE 103  -2.426   0.138   4.977
  799    HA   PHE 103           HA       PHE 103  -3.137  -2.562   5.001
  800   1HB   PHE 103          1HB       PHE 103  -0.812  -0.818   5.940
  801   2HB   PHE 103          2HB       PHE 103  -0.777  -2.532   6.303
  802    HD1  PHE 103           1HD      PHE 103   0.879  -0.544   4.364
  803    HD2  PHE 103           2HD      PHE 103  -1.955  -3.654   3.818
  804    HE1  PHE 103           1HE      PHE 103   1.825  -1.006   2.085
  805    HE2  PHE 103           2HE      PHE 103  -1.009  -4.117   1.540
  806    HZ   PHE 103           HZ       PHE 103   0.870  -2.787   0.700
  807    H    SER 104           H        SER 104  -2.696  -0.136   7.633
  808    HA   SER 104           HA       SER 104  -2.777  -1.911   9.730
  809   1HB   SER 104          1HB       SER 104  -2.172   0.539   9.829
  810   2HB   SER 104          2HB       SER 104  -3.872   0.936   9.677
  811    HG   SER 104           HG       SER 104  -2.621  -0.552  11.824
  812    H    LEU 105           H        LEU 105  -5.340  -0.555   7.670
  813    HA   LEU 105           HA       LEU 105  -7.500  -1.133   9.376
  814   1HB   LEU 105          1HB       LEU 105  -7.514   0.464   7.486
  815   2HB   LEU 105          2HB       LEU 105  -7.428  -0.881   6.367
  816    HG   LEU 105           HG       LEU 105  -9.698  -0.019   6.541
  817   1HD1  LEU 105          1HD1      LEU 105 -10.724  -2.047   6.453
  818   2HD1  LEU 105          2HD1      LEU 105  -9.030  -2.593   6.415
  819   3HD1  LEU 105          3HD1      LEU 105  -9.946  -2.638   7.941
  820   1HD2  LEU 105          1HD2      LEU 105 -10.555   0.704   8.452
  821   2HD2  LEU 105          2HD2      LEU 105 -10.500  -0.946   9.118
  822   3HD2  LEU 105          3HD2      LEU 105  -9.106   0.142   9.319
  823    H    LEU 106           H        LEU 106  -5.772  -2.986   6.818
  824    HA   LEU 106           HA       LEU 106  -7.508  -5.120   6.646
  825   1HB   LEU 106          1HB       LEU 106  -4.607  -4.674   6.146
  826   2HB   LEU 106          2HB       LEU 106  -5.180  -6.330   6.193
  827    HG   LEU 106           HG       LEU 106  -5.056  -5.064   3.929
  828   1HD1  LEU 106          1HD1      LEU 106  -5.980  -7.316   4.235
  829   2HD1  LEU 106          2HD1      LEU 106  -7.552  -6.611   4.683
  830   3HD1  LEU 106          3HD1      LEU 106  -6.908  -6.377   3.041
  831   1HD2  LEU 106          1HD2      LEU 106  -7.036  -3.830   3.285
  832   2HD2  LEU 106          2HD2      LEU 106  -7.744  -4.059   4.902
  833   3HD2  LEU 106          3HD2      LEU 106  -6.282  -3.064   4.704
  834    H    GLU 107           H        GLU 107  -4.824  -4.485   8.975
  835    HA   GLU 107           HA       GLU 107  -5.049  -6.956  10.238
  836   1HB   GLU 107          1HB       GLU 107  -3.593  -4.442  10.610
  837   2HB   GLU 107          2HB       GLU 107  -4.088  -5.112  12.152
  838   1HG   GLU 107          1HG       GLU 107  -3.192  -7.395  10.951
  839   2HG   GLU 107          2HG       GLU 107  -2.188  -6.226  10.115
  840    H    GLY 108           H        GLY 108  -7.202  -4.315  10.120
  841   1HA   GLY 108          1HA       GLY 108  -8.234  -4.600  12.819
  842   2HA   GLY 108          2HA       GLY 108  -8.810  -3.532  11.555
  843    H    GLY 109           H        GLY 109  -8.948  -5.683   9.476
  844   1HA   GLY 109          1HA       GLY 109 -11.603  -6.548   9.982
  845   2HA   GLY 109          2HA       GLY 109 -10.577  -6.993   8.634
  846    H    ARG 110           H        ARG 110  -9.497  -8.980   8.621
  847    HA   ARG 110           HA       ARG 110 -10.495 -10.947  10.246
  848   1HB   ARG 110          1HB       ARG 110  -8.733 -10.753   8.021
  849   2HB   ARG 110          2HB       ARG 110  -7.815 -11.605   9.247
  850   1HG   ARG 110          1HG       ARG 110 -10.314 -12.826   9.437
  851   2HG   ARG 110          2HG       ARG 110 -10.199 -12.492   7.720
  852   1HD   ARG 110          1HD       ARG 110  -7.747 -13.503   7.973
  853   2HD   ARG 110          2HD       ARG 110  -8.395 -14.220   9.435
  854    HE   ARG 110           HE       ARG 110 -10.175 -14.639   7.176
  855   1HH1  ARG 110          2HH2      ARG 110  -7.228 -15.817   8.696
  856   2HH1  ARG 110          1HH2      ARG 110  -7.371 -17.411   8.033
  857   1HH2  ARG 110          2HH1      ARG 110 -10.365 -16.741   6.301
  858   2HH2  ARG 110          1HH1      ARG 110  -9.168 -17.940   6.662
  859    HA   PRO 111           HA       PRO 111  -7.975 -10.621  13.797
  860   1HB   PRO 111          1HB       PRO 111  -8.363 -13.084  14.916
  861   2HB   PRO 111          2HB       PRO 111  -9.506 -11.766  15.080
  862   1HG   PRO 111          1HG       PRO 111  -9.690 -14.179  13.382
  863   2HG   PRO 111          2HG       PRO 111 -10.968 -13.090  13.883
  864   1HD   PRO 111          1HD       PRO 111  -9.709 -13.191  11.307
  865   2HD   PRO 111          2HD       PRO 111 -10.904 -12.027  11.845
  866    H    GLU 112           H        GLU 112  -5.985 -11.180  14.827
  867    HA   GLU 112           HA       GLU 112  -4.280 -12.382  12.857
  868   1HB   GLU 112          1HB       GLU 112  -2.447 -11.659  14.421
  869   2HB   GLU 112          2HB       GLU 112  -3.485 -10.345  13.904
  870   1HG   GLU 112          1HG       GLU 112  -4.279 -11.788  16.420
  871   2HG   GLU 112          2HG       GLU 112  -2.852 -10.775  16.508
  872    H    ASP 113           H        ASP 113  -5.664 -13.074  16.075
  873    HA   ASP 113           HA       ASP 113  -5.713 -14.860  17.300
  874   1HB   ASP 113          1HB       ASP 113  -6.503 -16.045  15.313
  875   2HB   ASP 113          2HB       ASP 113  -4.870 -16.214  14.700
  876    H    LYS 114           H        LYS 114  -3.356 -13.313  17.489
  877    HA   LYS 114           HA       LYS 114  -1.319 -15.389  17.897
  878   1HB   LYS 114          1HB       LYS 114  -1.122 -12.738  16.534
  879   2HB   LYS 114          2HB       LYS 114   0.231 -13.240  17.528
  880   1HG   LYS 114          1HG       LYS 114  -0.437 -15.565  16.078
  881   2HG   LYS 114          2HG       LYS 114  -0.644 -14.272  14.914
  882   1HD   LYS 114          1HD       LYS 114   1.858 -14.655  16.625
  883   2HD   LYS 114          2HD       LYS 114   1.699 -15.219  14.974
  884   1HE   LYS 114          1HE       LYS 114   2.318 -13.174  14.218
  885   2HE   LYS 114          2HE       LYS 114   0.896 -12.470  14.962
  886   1HZ   LYS 114          1HZ       LYS 114   3.545 -12.815  16.165
  887   2HZ   LYS 114          2HZ       LYS 114   2.730 -11.423  15.909
  888   3HZ   LYS 114          3HZ       LYS 114   2.226 -12.464  17.062
  889    H    LEU 115           H        LEU 115   0.530 -13.965  19.356
  890    HA   LEU 115           HA       LEU 115  -0.564 -13.998  21.888
  891   1HB   LEU 115          1HB       LEU 115   1.958 -13.076  20.637
  892   2HB   LEU 115          2HB       LEU 115   1.596 -12.423  22.223
  893    HG   LEU 115           HG       LEU 115   1.459 -15.391  21.755
  894   1HD1  LEU 115          1HD1      LEU 115   3.759 -15.708  22.127
  895   2HD1  LEU 115          2HD1      LEU 115   3.657 -14.434  20.888
  896   3HD1  LEU 115          3HD1      LEU 115   4.011 -14.005  22.578
  897   1HD2  LEU 115          1HD2      LEU 115   0.946 -13.761  23.945
  898   2HD2  LEU 115          2HD2      LEU 115   1.194 -15.524  23.960
  899   3HD2  LEU 115          3HD2      LEU 115   2.564 -14.429  24.270
  900    H    GLU 116           H        GLU 116  -0.300 -11.908  23.413
  901    HA   GLU 116           HA       GLU 116  -1.210  -9.543  22.085
  902   1HB   GLU 116          1HB       GLU 116  -3.025 -10.328  24.317
  903   2HB   GLU 116          2HB       GLU 116  -3.387  -9.472  22.831
  904   1HG   GLU 116          1HG       GLU 116  -3.216 -11.607  21.548
  905   2HG   GLU 116          2HG       GLU 116  -2.823 -12.470  23.021
  906    H    TRP 117           H        TRP 117  -0.478  -7.731  23.172
  907    HA   TRP 117           HA       TRP 117   0.719  -8.245  25.802
  908   1HB   TRP 117          1HB       TRP 117   1.355  -6.229  23.648
  909   2HB   TRP 117          2HB       TRP 117   1.999  -6.126  25.275
  910    HD1  TRP 117           HD       TRP 117   1.826  -9.710  24.216
  911    HE1  TRP 117           1HE      TRP 117   4.172 -10.685  23.501
  912    HE3  TRP 117           3HE      TRP 117   4.203  -5.223  23.968
  913    HZ2  TRP 117           2HZ      TRP 117   6.701  -9.496  22.925
  914    HZ3  TRP 117           3HZ      TRP 117   6.611  -5.218  23.322
  915    HH2  TRP 117           HH       TRP 117   7.856  -7.258  22.809
  916    H    SER 118           H        SER 118   0.397  -4.935  24.930
  917    HA   SER 118           HA       SER 118  -0.871  -3.303  25.594
  918   1HB   SER 118          1HB       SER 118  -2.701  -4.765  24.495
  919   2HB   SER 118          2HB       SER 118  -3.150  -5.250  26.118
  920    HG   SER 118           HG       SER 118  -3.385  -2.900  26.604
  Start of MODEL   17
    1   1H    MET   1           H        MET   1 -12.791   7.202   1.335
    2    HA   MET   1           HA       MET   1 -11.102   5.305   2.678
    3   1HB   MET   1          1HB       MET   1 -12.341   3.348   1.758
    4   2HB   MET   1          2HB       MET   1 -13.398   4.292   2.790
    5   1HG   MET   1          1HG       MET   1 -14.287   5.470   0.728
    6   2HG   MET   1          2HG       MET   1 -13.296   4.418  -0.264
    7   1HE   MET   1          1HE       MET   1 -16.173   4.839   2.134
    8   2HE   MET   1          2HE       MET   1 -16.942   3.239   2.260
    9   3HE   MET   1          3HE       MET   1 -15.402   3.555   3.096
   10    H    ALA   2           H        ALA   2 -10.515   7.437   0.860
   11    HA   ALA   2           HA       ALA   2  -9.728   7.903  -1.190
   12   1HB   ALA   2          1HB       ALA   2  -8.165   6.047   0.222
   13   2HB   ALA   2          2HB       ALA   2  -8.195   5.432  -1.449
   14   3HB   ALA   2          3HB       ALA   2  -7.630   7.088  -1.120
   15    H    LYS   3           H        LYS   3 -12.328   6.551  -1.253
   16    HA   LYS   3           HA       LYS   3 -12.440   5.984  -3.978
   17   1HB   LYS   3          1HB       LYS   3 -11.237   3.901  -3.171
   18   2HB   LYS   3          2HB       LYS   3 -12.698   3.477  -2.301
   19   1HG   LYS   3          1HG       LYS   3 -13.682   2.708  -4.195
   20   2HG   LYS   3          2HG       LYS   3 -13.403   4.230  -5.018
   21   1HD   LYS   3          1HD       LYS   3 -10.953   3.424  -5.342
   22   2HD   LYS   3          2HD       LYS   3 -11.520   1.843  -4.840
   23   1HE   LYS   3          1HE       LYS   3 -12.918   3.366  -7.072
   24   2HE   LYS   3          2HE       LYS   3 -11.496   2.396  -7.399
   25   1HZ   LYS   3          1HZ       LYS   3 -14.144   1.551  -6.752
   26   2HZ   LYS   3          2HZ       LYS   3 -12.970   0.764  -7.571
   27   3HZ   LYS   3          3HZ       LYS   3 -12.985   0.737  -5.938
   28    H    GLU   4           H        GLU   4 -14.564   3.756  -2.804
   29    HA   GLU   4           HA       GLU   4 -16.370   5.102  -1.298
   30   1HB   GLU   4          1HB       GLU   4 -16.245   6.401  -3.757
   31   2HB   GLU   4          2HB       GLU   4 -17.611   5.325  -3.975
   32   1HG   GLU   4          1HG       GLU   4 -18.805   6.262  -2.127
   33   2HG   GLU   4          2HG       GLU   4 -17.366   7.002  -1.454
   34    H    ARG   5           H        ARG   5 -18.812   4.292  -2.845
   35    HA   ARG   5           HA       ARG   5 -18.985   1.719  -1.957
   36   1HB   ARG   5          1HB       ARG   5 -20.602   3.568  -3.580
   37   2HB   ARG   5          2HB       ARG   5 -20.826   1.911  -4.103
   38   1HG   ARG   5          1HG       ARG   5 -20.958   1.539  -1.401
   39   2HG   ARG   5          2HG       ARG   5 -21.534   3.191  -1.485
   40   1HD   ARG   5          1HD       ARG   5 -23.522   2.579  -2.451
   41   2HD   ARG   5          2HD       ARG   5 -22.751   1.456  -3.553
   42    HE   ARG   5           HE       ARG   5 -23.945   0.807  -0.987
   43   1HH1  ARG   5          2HH2      ARG   5 -21.398  -0.143  -3.221
   44   2HH1  ARG   5          1HH2      ARG   5 -21.348  -1.784  -2.668
   45   1HH2  ARG   5          2HH1      ARG   5 -23.879  -1.357  -0.256
   46   2HH2  ARG   5          1HH1      ARG   5 -22.769  -2.479  -0.969
   47    H    GLY   6           H        GLY   6 -18.309  -0.255  -2.773
   48   1HA   GLY   6          1HA       GLY   6 -17.820  -1.827  -4.362
   49   2HA   GLY   6          2HA       GLY   6 -17.992  -0.630  -5.629
   50    H    LEU   7           H        LEU   7 -15.790  -2.193  -3.364
   51    HA   LEU   7           HA       LEU   7 -13.584  -0.709  -4.612
   52   1HB   LEU   7          1HB       LEU   7 -13.723  -1.768  -1.786
   53   2HB   LEU   7          2HB       LEU   7 -12.342  -0.983  -2.525
   54    HG   LEU   7           HG       LEU   7 -14.155   0.962  -2.907
   55   1HD1  LEU   7          1HD1      LEU   7 -16.076   0.041  -1.964
   56   2HD1  LEU   7          2HD1      LEU   7 -15.187  -0.664  -0.592
   57   3HD1  LEU   7          3HD1      LEU   7 -15.443   1.096  -0.678
   58   1HD2  LEU   7          1HD2      LEU   7 -13.360   1.796  -0.550
   59   2HD2  LEU   7          2HD2      LEU   7 -12.320   0.353  -0.617
   60   3HD2  LEU   7          3HD2      LEU   7 -12.197   1.597  -1.884
   61    H    ILE   8           H        ILE   8 -11.478  -2.314  -3.674
   62    HA   ILE   8           HA       ILE   8 -11.289  -4.246  -5.541
   63    HB   ILE   8           HB       ILE   8  -9.625  -5.315  -3.978
   64   1HG1  ILE   8          1HG1      ILE   8 -10.206  -2.974  -2.158
   65   2HG1  ILE   8          2HG1      ILE   8 -10.918  -4.554  -1.901
   66   1HG2  ILE   8          1HG2      ILE   8  -9.183  -2.345  -4.170
   67   2HG2  ILE   8          2HG2      ILE   8  -8.027  -3.679  -4.398
   68   3HG2  ILE   8          3HG2      ILE   8  -9.271  -3.359  -5.630
   69   1HD1  ILE   8          1HD1      ILE   8  -8.865  -5.563  -1.397
   70   2HD1  ILE   8          2HD1      ILE   8  -7.934  -4.368  -2.332
   71   3HD1  ILE   8          3HD1      ILE   8  -8.613  -3.925  -0.747
   72    H    SER   9           H        SER   9 -12.555  -5.944  -6.044
   73    HA   SER   9           HA       SER   9 -14.572  -6.873  -4.511
   74   1HB   SER   9          1HB       SER   9 -13.358  -7.545  -6.985
   75   2HB   SER   9          2HB       SER   9 -13.417  -9.047  -6.085
   76    HG   SER   9           HG       SER   9 -15.406  -9.004  -7.015
   77    HA   PRO  10           HA       PRO  10 -12.902  -9.790  -1.723
   78   1HB   PRO  10          1HB       PRO  10 -14.300 -12.118  -2.025
   79   2HB   PRO  10          2HB       PRO  10 -14.933 -10.724  -1.172
   80   1HG   PRO  10          1HG       PRO  10 -15.631 -11.722  -3.865
   81   2HG   PRO  10          2HG       PRO  10 -16.525 -10.619  -2.837
   82   1HD   PRO  10          1HD       PRO  10 -14.946  -9.930  -5.131
   83   2HD   PRO  10          2HD       PRO  10 -15.744  -8.819  -4.036
   84    H    SER  11           H        SER  11 -12.311 -10.207  -4.907
   85    HA   SER  11           HA       SER  11 -10.939 -12.682  -4.668
   86   1HB   SER  11          1HB       SER  11 -11.774 -10.894  -6.783
   87   2HB   SER  11          2HB       SER  11 -10.065 -11.222  -6.981
   88    HG   SER  11           HG       SER  11 -11.458 -12.795  -8.062
   89    H    ASP  12           H        ASP  12 -10.064  -9.176  -4.912
   90    HA   ASP  12           HA       ASP  12  -7.302  -9.707  -4.804
   91   1HB   ASP  12          1HB       ASP  12  -9.104  -7.353  -4.863
   92   2HB   ASP  12          2HB       ASP  12  -7.647  -7.074  -3.929
   93    H    PHE  13           H        PHE  13  -9.908  -8.778  -2.488
   94    HA   PHE  13           HA       PHE  13  -8.233  -8.255  -0.302
   95   1HB   PHE  13          1HB       PHE  13 -10.861  -7.925  -0.920
   96   2HB   PHE  13          2HB       PHE  13 -11.022  -9.459  -0.088
   97    HD1  PHE  13           1HD      PHE  13 -10.871  -5.944   0.300
   98    HD2  PHE  13           2HD      PHE  13 -10.012  -9.585   2.304
   99    HE1  PHE  13           1HE      PHE  13 -10.922  -4.744   2.503
  100    HE2  PHE  13           2HE      PHE  13 -10.064  -8.384   4.507
  101    HZ   PHE  13           HZ       PHE  13 -10.518  -5.978   4.581
  102    H    ALA  14           H        ALA  14 -10.004 -11.223  -1.384
  103    HA   ALA  14           HA       ALA  14  -9.369 -12.788   0.827
  104   1HB   ALA  14          1HB       ALA  14  -9.808 -14.680  -0.815
  105   2HB   ALA  14          2HB       ALA  14 -11.096 -13.456  -0.703
  106   3HB   ALA  14          3HB       ALA  14  -9.969 -13.440  -2.081
  107    H    GLN  15           H        GLN  15  -7.620 -12.155  -2.265
  108    HA   GLN  15           HA       GLN  15  -5.630 -14.034  -1.823
  109   1HB   GLN  15          1HB       GLN  15  -6.101 -12.963  -4.018
  110   2HB   GLN  15          2HB       GLN  15  -5.522 -11.427  -3.405
  111   1HG   GLN  15          1HG       GLN  15  -3.654 -12.332  -4.573
  112   2HG   GLN  15          2HG       GLN  15  -3.291 -12.630  -2.885
  113   1HE2  GLN  15          1HE2      GLN  15  -3.386 -13.949  -5.898
  114   2HE2  GLN  15          2HE2      GLN  15  -3.448 -15.639  -5.524
  115    H    LEU  16           H        LEU  16  -5.774 -10.476  -1.127
  116    HA   LEU  16           HA       LEU  16  -3.202 -10.346  -0.016
  117   1HB   LEU  16          1HB       LEU  16  -5.576  -8.627  -0.261
  118   2HB   LEU  16          2HB       LEU  16  -4.593  -8.303   1.153
  119    HG   LEU  16           HG       LEU  16  -3.472  -8.413  -1.657
  120   1HD1  LEU  16          1HD1      LEU  16  -4.393  -5.989  -0.086
  121   2HD1  LEU  16          2HD1      LEU  16  -3.505  -5.956  -1.629
  122   3HD1  LEU  16          3HD1      LEU  16  -5.144  -6.648  -1.559
  123   1HD2  LEU  16          1HD2      LEU  16  -1.463  -7.806  -0.809
  124   2HD2  LEU  16          2HD2      LEU  16  -2.177  -6.862   0.521
  125   3HD2  LEU  16          3HD2      LEU  16  -2.094  -8.637   0.633
  126    H    GLN  17           H        GLN  17  -6.469 -10.956   1.381
  127    HA   GLN  17           HA       GLN  17  -5.617 -10.911   4.022
  128   1HB   GLN  17          1HB       GLN  17  -8.022 -10.887   2.981
  129   2HB   GLN  17          2HB       GLN  17  -7.905 -12.635   3.027
  130   1HG   GLN  17          1HG       GLN  17  -7.509 -12.595   5.460
  131   2HG   GLN  17          2HG       GLN  17  -7.449 -10.844   5.458
  132   1HE2  GLN  17          1HE2      GLN  17  -9.456 -13.676   5.097
  133   2HE2  GLN  17          2HE2      GLN  17 -10.999 -12.918   5.307
  134    H    LYS  18           H        LYS  18  -5.584 -13.428   1.495
  135    HA   LYS  18           HA       LYS  18  -5.035 -15.557   3.305
  136   1HB   LYS  18          1HB       LYS  18  -6.112 -15.647   0.962
  137   2HB   LYS  18          2HB       LYS  18  -4.478 -15.550   0.337
  138   1HG   LYS  18          1HG       LYS  18  -5.044 -17.573   2.505
  139   2HG   LYS  18          2HG       LYS  18  -5.636 -17.913   0.892
  140   1HD   LYS  18          1HD       LYS  18  -3.511 -18.179   0.007
  141   2HD   LYS  18          2HD       LYS  18  -2.802 -16.962   1.050
  142   1HE   LYS  18          1HE       LYS  18  -2.528 -18.462   2.854
  143   2HE   LYS  18          2HE       LYS  18  -3.799 -19.532   2.297
  144   1HZ   LYS  18          1HZ       LYS  18  -1.967 -19.530   0.293
  145   2HZ   LYS  18          2HZ       LYS  18  -1.056 -19.555   1.648
  146   3HZ   LYS  18          3HZ       LYS  18  -2.183 -20.710   1.402
  147    H    TYR  19           H        TYR  19  -3.102 -13.349   1.217
  148    HA   TYR  19           HA       TYR  19  -0.643 -14.648   1.791
  149   1HB   TYR  19          1HB       TYR  19  -1.678 -12.006   0.653
  150   2HB   TYR  19          2HB       TYR  19   0.040 -12.163   0.958
  151    HD1  TYR  19           1HD      TYR  19   0.475 -15.026   0.176
  152    HD2  TYR  19           2HD      TYR  19  -1.813 -11.930  -1.692
  153    HE1  TYR  19           1HE      TYR  19   0.766 -16.162  -2.080
  154    HE2  TYR  19           2HE      TYR  19  -1.514 -13.076  -3.941
  155    HH   TYR  19           HH       TYR  19  -0.129 -14.584  -5.021
  156    H    MET  20           H        MET  20  -2.152 -11.540   2.926
  157    HA   MET  20           HA       MET  20  -0.101 -10.916   4.666
  158   1HB   MET  20          1HB       MET  20  -1.614  -9.219   5.461
  159   2HB   MET  20          2HB       MET  20  -2.109  -9.490   3.802
  160   1HG   MET  20          1HG       MET  20  -4.198  -9.714   4.746
  161   2HG   MET  20          2HG       MET  20  -3.673 -11.362   5.023
  162   1HE   MET  20          1HE       MET  20  -2.153  -8.189   7.321
  163   2HE   MET  20          2HE       MET  20  -3.465  -7.849   6.167
  164   3HE   MET  20          3HE       MET  20  -3.799  -7.867   7.916
  165    H    GLU  21           H        GLU  21  -2.629 -13.317   4.878
  166    HA   GLU  21           HA       GLU  21  -3.032 -13.411   7.588
  167   1HB   GLU  21          1HB       GLU  21  -3.491 -15.138   5.269
  168   2HB   GLU  21          2HB       GLU  21  -3.097 -16.090   6.686
  169   1HG   GLU  21          1HG       GLU  21  -4.933 -13.949   7.427
  170   2HG   GLU  21          2HG       GLU  21  -5.589 -14.842   6.069
  171    H    TYR  22           H        TYR  22  -0.619 -15.231   5.568
  172    HA   TYR  22           HA       TYR  22   0.595 -16.525   7.736
  173   1HB   TYR  22          1HB       TYR  22   0.723 -16.319   4.891
  174   2HB   TYR  22          2HB       TYR  22   2.301 -15.766   5.415
  175    HD1  TYR  22           1HD      TYR  22   0.697 -18.534   4.232
  176    HD2  TYR  22           2HD      TYR  22   3.197 -17.399   7.513
  177    HE1  TYR  22           1HE      TYR  22   1.462 -20.945   4.493
  178    HE2  TYR  22           2HE      TYR  22   3.954 -19.813   7.763
  179    HH   TYR  22           HH       TYR  22   2.472 -22.372   5.858
  180    H    SER  23           H        SER  23   0.801 -13.231   6.531
  181    HA   SER  23           HA       SER  23   3.341 -12.823   7.815
  182   1HB   SER  23          1HB       SER  23   1.850 -11.551   5.713
  183   2HB   SER  23          2HB       SER  23   2.092 -10.357   6.972
  184    HG   SER  23           HG       SER  23   3.973 -10.154   5.890
  185    H    THR  24           H        THR  24   3.479 -12.306   9.965
  186    HA   THR  24           HA       THR  24   1.146 -10.962  11.166
  187    HB   THR  24           HB       THR  24   1.551 -13.424  11.795
  188    HG1  THR  24           1HG      THR  24   0.434 -12.128  13.302
  189   1HG2  THR  24          1HG2      THR  24   4.193 -12.258  12.449
  190   2HG2  THR  24          2HG2      THR  24   3.436 -13.069  13.841
  191   3HG2  THR  24          3HG2      THR  24   3.718 -13.969  12.331
  192    H    LYS  25           H        LYS  25   3.864 -10.087   9.856
  193    HA   LYS  25           HA       LYS  25   5.268  -8.947  12.062
  194   1HB   LYS  25          1HB       LYS  25   5.588  -9.188   9.161
  195   2HB   LYS  25          2HB       LYS  25   6.083  -7.619   9.763
  196   1HG   LYS  25          1HG       LYS  25   6.993  -9.817  11.511
  197   2HG   LYS  25          2HG       LYS  25   7.590  -9.987   9.872
  198   1HD   LYS  25          1HD       LYS  25   7.893  -7.228  10.486
  199   2HD   LYS  25          2HD       LYS  25   8.392  -8.074  11.937
  200   1HE   LYS  25          1HE       LYS  25   9.543  -9.556   9.809
  201   2HE   LYS  25          2HE       LYS  25   9.758  -7.879   9.350
  202   1HZ   LYS  25          1HZ       LYS  25  10.536  -9.038  11.936
  203   2HZ   LYS  25          2HZ       LYS  25  11.555  -8.649  10.721
  204   3HZ   LYS  25          3HZ       LYS  25  10.736  -7.475  11.507
  205    H    LYS  26           H        LYS  26   5.778  -6.363  11.611
  206    HA   LYS  26           HA       LYS  26   3.113  -5.155  11.789
  207   1HB   LYS  26          1HB       LYS  26   5.773  -4.346  12.994
  208   2HB   LYS  26          2HB       LYS  26   4.341  -3.338  13.037
  209   1HG   LYS  26          1HG       LYS  26   3.973  -6.175  13.934
  210   2HG   LYS  26          2HG       LYS  26   4.955  -5.164  14.975
  211   1HD   LYS  26          1HD       LYS  26   3.092  -3.439  14.966
  212   2HD   LYS  26          2HD       LYS  26   2.109  -4.560  14.047
  213   1HE   LYS  26          1HE       LYS  26   1.652  -5.861  15.879
  214   2HE   LYS  26          2HE       LYS  26   3.303  -5.793  16.461
  215   1HZ   LYS  26          1HZ       LYS  26   2.160  -3.265  16.696
  216   2HZ   LYS  26          2HZ       LYS  26   1.140  -4.348  17.369
  217   3HZ   LYS  26          3HZ       LYS  26   2.687  -4.254  17.884
  218    H    VAL  27           H        VAL  27   2.601  -3.301  10.576
  219    HA   VAL  27           HA       VAL  27   4.006  -3.111   8.110
  220    HB   VAL  27           HB       VAL  27   1.561  -2.907   8.374
  221   1HG1  VAL  27          1HG1      VAL  27   0.875  -0.437   9.064
  222   2HG1  VAL  27          2HG1      VAL  27   1.051  -1.727  10.278
  223   3HG1  VAL  27          3HG1      VAL  27   2.363  -0.548  10.035
  224   1HG2  VAL  27          1HG2      VAL  27   1.832  -0.333   7.209
  225   2HG2  VAL  27          2HG2      VAL  27   3.308  -1.244   6.810
  226   3HG2  VAL  27          3HG2      VAL  27   1.712  -1.908   6.387
  227    H    SER  28           H        SER  28   4.103  -1.477  11.237
  228    HA   SER  28           HA       SER  28   5.258   0.893  10.311
  229   1HB   SER  28          1HB       SER  28   5.833   1.271  12.691
  230   2HB   SER  28          2HB       SER  28   4.178   0.725  12.514
  231    HG   SER  28           HG       SER  28   5.342  -0.378  14.244
  232    H    ASP  29           H        ASP  29   6.452  -2.359  10.813
  233    HA   ASP  29           HA       ASP  29   9.128  -1.664  11.299
  234   1HB   ASP  29          1HB       ASP  29   8.192  -3.880  11.875
  235   2HB   ASP  29          2HB       ASP  29   7.848  -4.205  10.188
  236    H    VAL  30           H        VAL  30   7.204  -2.729   8.405
  237    HA   VAL  30           HA       VAL  30   9.381  -2.651   6.616
  238    HB   VAL  30           HB       VAL  30   6.388  -2.532   6.202
  239   1HG1  VAL  30          1HG1      VAL  30   7.452  -1.643   4.227
  240   2HG1  VAL  30          2HG1      VAL  30   8.628  -2.979   4.203
  241   3HG1  VAL  30          3HG1      VAL  30   6.908  -3.302   3.880
  242   1HG2  VAL  30          1HG2      VAL  30   6.386  -4.713   6.657
  243   2HG2  VAL  30          2HG2      VAL  30   7.587  -4.996   5.375
  244   3HG2  VAL  30          3HG2      VAL  30   8.124  -4.636   7.033
  245    H    LEU  31           H        LEU  31   7.131  -0.236   7.919
  246    HA   LEU  31           HA       LEU  31   7.426   1.702   5.944
  247   1HB   LEU  31          1HB       LEU  31   6.164   1.411   8.445
  248   2HB   LEU  31          2HB       LEU  31   7.169   2.840   8.577
  249    HG   LEU  31           HG       LEU  31   6.039   3.427   6.237
  250   1HD1  LEU  31          1HD1      LEU  31   3.852   1.815   7.570
  251   2HD1  LEU  31          2HD1      LEU  31   3.786   2.677   6.014
  252   3HD1  LEU  31          3HD1      LEU  31   4.817   1.236   6.191
  253   1HD2  LEU  31          1HD2      LEU  31   5.166   5.101   7.413
  254   2HD2  LEU  31          2HD2      LEU  31   4.100   4.007   8.327
  255   3HD2  LEU  31          3HD2      LEU  31   5.773   4.278   8.869
  256    H    LYS  32           H        LYS  32   9.265   1.181   9.030
  257    HA   LYS  32           HA       LYS  32  11.024   3.298   8.655
  258   1HB   LYS  32          1HB       LYS  32  11.311   0.692  10.173
  259   2HB   LYS  32          2HB       LYS  32  12.470   2.002  10.264
  260   1HG   LYS  32          1HG       LYS  32  11.033   3.392  11.450
  261   2HG   LYS  32          2HG       LYS  32   9.596   2.756  10.674
  262   1HD   LYS  32          1HD       LYS  32   9.475   1.959  12.922
  263   2HD   LYS  32          2HD       LYS  32   9.998   0.573  11.985
  264   1HE   LYS  32          1HE       LYS  32  11.832   0.401  13.307
  265   2HE   LYS  32          2HE       LYS  32  12.388   1.951  12.708
  266   1HZ   LYS  32          1HZ       LYS  32  12.094   2.627  14.776
  267   2HZ   LYS  32          2HZ       LYS  32  10.484   2.602  14.503
  268   3HZ   LYS  32          3HZ       LYS  32  11.214   1.322  15.208
  269    H    LEU  33           H        LEU  33  10.864   0.064   7.218
  270    HA   LEU  33           HA       LEU  33  13.538  -0.035   6.345
  271   1HB   LEU  33          1HB       LEU  33  11.027  -1.516   5.904
  272   2HB   LEU  33          2HB       LEU  33  12.164  -1.576   4.571
  273    HG   LEU  33           HG       LEU  33  12.742  -2.387   7.435
  274   1HD1  LEU  33          1HD1      LEU  33  13.106  -4.593   5.808
  275   2HD1  LEU  33          2HD1      LEU  33  11.706  -4.274   6.860
  276   3HD1  LEU  33          3HD1      LEU  33  11.647  -3.822   5.139
  277   1HD2  LEU  33          1HD2      LEU  33  14.498  -2.327   4.977
  278   2HD2  LEU  33          2HD2      LEU  33  14.777  -1.565   6.561
  279   3HD2  LEU  33          3HD2      LEU  33  14.854  -3.336   6.399
  280    H    PHE  34           H        PHE  34  10.570   1.500   5.114
  281    HA   PHE  34           HA       PHE  34  11.724   2.041   2.552
  282   1HB   PHE  34          1HB       PHE  34   9.210   2.536   4.141
  283   2HB   PHE  34          2HB       PHE  34   9.548   3.742   2.915
  284    HD1  PHE  34           1HD      PHE  34   9.044   3.328   0.662
  285    HD2  PHE  34           2HD      PHE  34   9.086   0.092   3.408
  286    HE1  PHE  34           1HE      PHE  34   8.046   1.831  -1.087
  287    HE2  PHE  34           2HE      PHE  34   8.088  -1.405   1.658
  288    HZ   PHE  34           HZ       PHE  34   7.580  -0.518  -0.569
  289    H    GLU  35           H        GLU  35  12.120   3.345   5.689
  290    HA   GLU  35           HA       GLU  35  12.709   5.971   4.587
  291   1HB   GLU  35          1HB       GLU  35  12.056   6.872   6.578
  292   2HB   GLU  35          2HB       GLU  35  11.244   5.335   6.807
  293   1HG   GLU  35          1HG       GLU  35  13.275   4.447   7.984
  294   2HG   GLU  35          2HG       GLU  35  14.068   5.996   7.771
  295    H    ASP  36           H        ASP  36  14.039   3.293   6.615
  296    HA   ASP  36           HA       ASP  36  16.663   4.489   6.193
  297   1HB   ASP  36          1HB       ASP  36  15.595   3.941   8.589
  298   2HB   ASP  36          2HB       ASP  36  16.132   2.313   8.226
  299    H    GLY  37           H        GLY  37  14.576   1.578   6.042
  300   1HA   GLY  37          1HA       GLY  37  16.395  -0.426   5.533
  301   2HA   GLY  37          2HA       GLY  37  14.763  -0.349   4.900
  302    H    GLU  38           H        GLU  38  16.022  -1.552   3.079
  303    HA   GLU  38           HA       GLU  38  17.698   0.083   1.484
  304   1HB   GLU  38          1HB       GLU  38  16.745  -2.717   1.503
  305   2HB   GLU  38          2HB       GLU  38  16.931  -2.066  -0.114
  306   1HG   GLU  38          1HG       GLU  38  19.172  -1.394   1.725
  307   2HG   GLU  38          2HG       GLU  38  18.989  -3.111   1.424
  308    H    MET  39           H        MET  39  14.244  -0.710   1.650
  309    HA   MET  39           HA       MET  39  13.587   0.016  -0.952
  310   1HB   MET  39          1HB       MET  39  12.284  -0.978   1.326
  311   2HB   MET  39          2HB       MET  39  11.576   0.617   1.168
  312   1HG   MET  39          1HG       MET  39  10.248  -1.044  -0.100
  313   2HG   MET  39          2HG       MET  39  10.952   0.132  -1.192
  314   1HE   MET  39          1HE       MET  39  12.821  -4.000  -0.393
  315   2HE   MET  39          2HE       MET  39  13.395  -2.549   0.463
  316   3HE   MET  39          3HE       MET  39  11.722  -3.111   0.688
  317    H    ALA  40           H        ALA  40  14.859   1.911   1.558
  318    HA   ALA  40           HA       ALA  40  13.333   4.282   1.101
  319   1HB   ALA  40          1HB       ALA  40  14.658   3.519   3.207
  320   2HB   ALA  40          2HB       ALA  40  16.086   4.143   2.348
  321   3HB   ALA  40          3HB       ALA  40  14.735   5.234   2.736
  322    H    LYS  41           H        LYS  41  15.429   2.567  -0.849
  323    HA   LYS  41           HA       LYS  41  16.840   4.880  -1.879
  324   1HB   LYS  41          1HB       LYS  41  18.184   3.375  -3.039
  325   2HB   LYS  41          2HB       LYS  41  17.832   2.532  -1.543
  326   1HG   LYS  41          1HG       LYS  41  16.128   1.163  -2.611
  327   2HG   LYS  41          2HG       LYS  41  16.164   2.140  -4.065
  328   1HD   LYS  41          1HD       LYS  41  17.456   0.203  -4.600
  329   2HD   LYS  41          2HD       LYS  41  18.638   1.466  -4.318
  330   1HE   LYS  41          1HE       LYS  41  17.864  -0.048  -1.871
  331   2HE   LYS  41          2HE       LYS  41  18.663  -1.017  -3.093
  332   1HZ   LYS  41          1HZ       LYS  41  19.824   0.769  -1.358
  333   2HZ   LYS  41          2HZ       LYS  41  20.558  -0.076  -2.547
  334   3HZ   LYS  41          3HZ       LYS  41  19.989   1.426  -2.844
  335    H    TYR  42           H        TYR  42  13.874   3.124  -2.355
  336    HA   TYR  42           HA       TYR  42  13.593   4.311  -5.028
  337   1HB   TYR  42          1HB       TYR  42  12.116   2.096  -3.471
  338   2HB   TYR  42          2HB       TYR  42  11.700   2.573  -5.105
  339    HD1  TYR  42           1HD      TYR  42  12.872  -0.111  -3.659
  340    HD2  TYR  42           2HD      TYR  42  14.384   2.847  -6.355
  341    HE1  TYR  42           1HE      TYR  42  14.542  -1.793  -4.579
  342    HE2  TYR  42           2HE      TYR  42  16.049   1.155  -7.266
  343    HH   TYR  42           HH       TYR  42  16.828  -1.624  -5.707
  344    H    VAL  43           H        VAL  43  13.309   5.692  -2.321
  345    HA   VAL  43           HA       VAL  43  10.446   6.318  -2.493
  346    HB   VAL  43           HB       VAL  43  12.469   6.494  -0.265
  347   1HG1  VAL  43          1HG1      VAL  43  10.110   8.165  -0.724
  348   2HG1  VAL  43          2HG1      VAL  43  10.043   7.287   0.822
  349   3HG1  VAL  43          3HG1      VAL  43  11.429   8.343   0.459
  350   1HG2  VAL  43          1HG2      VAL  43   9.767   5.282   0.063
  351   2HG2  VAL  43          2HG2      VAL  43  10.931   4.406  -0.959
  352   3HG2  VAL  43          3HG2      VAL  43  11.339   4.784   0.732
  353    H    GLN  44           H        GLN  44   9.811   8.331  -3.148
  354    HA   GLN  44           HA       GLN  44  11.959  10.289  -3.405
  355   1HB   GLN  44          1HB       GLN  44  10.455  11.132  -5.400
  356   2HB   GLN  44          2HB       GLN  44  11.550   9.786  -5.646
  357   1HG   GLN  44          1HG       GLN  44   8.817   9.079  -4.640
  358   2HG   GLN  44          2HG       GLN  44   8.890   9.702  -6.276
  359   1HE2  GLN  44          1HE2      GLN  44  10.152   8.647  -7.847
  360   2HE2  GLN  44          2HE2      GLN  44  10.577   6.973  -7.713
  361    H    GLY  45           H        GLY  45  11.569  12.287  -2.490
  362   1HA   GLY  45          1HA       GLY  45  10.529  13.862  -1.270
  363   2HA   GLY  45          2HA       GLY  45   9.139  13.585  -2.301
  364    H    ASP  46           H        ASP  46  10.423  10.888  -0.401
  365    HA   ASP  46           HA       ASP  46   9.805  10.010   1.524
  366   1HB   ASP  46          1HB       ASP  46   9.020  12.522   2.079
  367   2HB   ASP  46          2HB       ASP  46   7.422  11.832   1.882
  368    H    ALA  47           H        ALA  47   8.053  10.544  -1.311
  369    HA   ALA  47           HA       ALA  47   5.793   8.865  -0.539
  370   1HB   ALA  47          1HB       ALA  47   5.693  11.110  -1.888
  371   2HB   ALA  47          2HB       ALA  47   6.229  10.107  -3.257
  372   3HB   ALA  47          3HB       ALA  47   4.703   9.731  -2.421
  373    H    ILE  48           H        ILE  48   5.236   6.977  -1.884
  374    HA   ILE  48           HA       ILE  48   7.680   5.649  -2.765
  375    HB   ILE  48           HB       ILE  48   6.489   3.604  -2.480
  376   1HG1  ILE  48          1HG1      ILE  48   4.026   5.311  -2.026
  377   2HG1  ILE  48          2HG1      ILE  48   4.318   4.215  -3.362
  378   1HG2  ILE  48          1HG2      ILE  48   7.238   5.228  -0.449
  379   2HG2  ILE  48          2HG2      ILE  48   5.529   4.958  -0.031
  380   3HG2  ILE  48          3HG2      ILE  48   6.626   3.571  -0.232
  381   1HD1  ILE  48          1HD1      ILE  48   4.297   2.277  -1.884
  382   2HD1  ILE  48          2HD1      ILE  48   4.250   3.323  -0.445
  383   3HD1  ILE  48          3HD1      ILE  48   2.849   3.252  -1.539
  384    H    GLY  49           H        GLY  49   7.555   4.281  -4.764
  385   1HA   GLY  49          1HA       GLY  49   5.929   5.675  -6.802
  386   2HA   GLY  49          2HA       GLY  49   7.507   4.962  -7.072
  387    H    TYR  50           H        TYR  50   6.105   3.933  -8.892
  388    HA   TYR  50           HA       TYR  50   4.141   2.068  -8.363
  389   1HB   TYR  50          1HB       TYR  50   5.099   3.096 -10.571
  390   2HB   TYR  50          2HB       TYR  50   6.414   1.946 -10.437
  391    HD1  TYR  50           1HD      TYR  50   6.188   0.324 -12.080
  392    HD2  TYR  50           2HD      TYR  50   2.703   1.603  -9.954
  393    HE1  TYR  50           1HE      TYR  50   4.792  -1.407 -13.313
  394    HE2  TYR  50           2HE      TYR  50   1.319  -0.132 -11.194
  395    HH   TYR  50           HH       TYR  50   1.877  -1.359 -13.791
  396    H    GLU  51           H        GLU  51   7.689   1.459  -8.904
  397    HA   GLU  51           HA       GLU  51   7.479  -1.241  -8.279
  398   1HB   GLU  51          1HB       GLU  51   9.541   0.642  -9.027
  399   2HB   GLU  51          2HB       GLU  51  10.129  -0.314  -7.682
  400   1HG   GLU  51          1HG       GLU  51  10.347  -2.171  -8.978
  401   2HG   GLU  51          2HG       GLU  51   8.716  -2.016  -9.599
  402    H    GLY  52           H        GLY  52   8.182   1.684  -6.314
  403   1HA   GLY  52          1HA       GLY  52   9.021   0.398  -3.968
  404   2HA   GLY  52          2HA       GLY  52   8.328   2.002  -4.095
  405    H    PHE  53           H        PHE  53   5.829   0.806  -5.458
  406    HA   PHE  53           HA       PHE  53   4.384   0.425  -3.033
  407   1HB   PHE  53          1HB       PHE  53   3.628   1.610  -5.185
  408   2HB   PHE  53          2HB       PHE  53   3.634   0.056  -5.995
  409    HD1  PHE  53           1HD      PHE  53   1.981  -1.684  -5.340
  410    HD2  PHE  53           2HD      PHE  53   1.818   2.256  -3.770
  411    HE1  PHE  53           1HE      PHE  53  -0.392  -2.069  -4.619
  412    HE2  PHE  53           2HE      PHE  53  -0.555   1.870  -3.049
  413    HZ   PHE  53           HZ       PHE  53  -1.632  -0.287  -3.482
  414    H    GLN  54           H        GLN  54   4.881  -1.622  -6.004
  415    HA   GLN  54           HA       GLN  54   3.683  -3.854  -4.852
  416   1HB   GLN  54          1HB       GLN  54   4.970  -5.063  -6.763
  417   2HB   GLN  54          2HB       GLN  54   3.779  -3.857  -7.206
  418   1HG   GLN  54          1HG       GLN  54   6.356  -2.567  -6.765
  419   2HG   GLN  54          2HG       GLN  54   6.550  -3.896  -7.891
  420   1HE2  GLN  54          1HE2      GLN  54   6.855  -2.702  -9.693
  421   2HE2  GLN  54          2HE2      GLN  54   5.649  -1.710 -10.442
  422    H    GLN  55           H        GLN  55   6.942  -2.493  -4.676
  423    HA   GLN  55           HA       GLN  55   8.286  -4.812  -3.965
  424   1HB   GLN  55          1HB       GLN  55   8.773  -1.869  -3.781
  425   2HB   GLN  55          2HB       GLN  55   9.723  -2.864  -2.695
  426   1HG   GLN  55          1HG       GLN  55   9.538  -3.207  -5.725
  427   2HG   GLN  55          2HG       GLN  55  10.901  -2.533  -4.854
  428   1HE2  GLN  55          1HE2      GLN  55  11.545  -4.015  -2.890
  429   2HE2  GLN  55          2HE2      GLN  55  11.823  -5.678  -3.285
  430    H    PHE  56           H        PHE  56   6.237  -2.544  -2.141
  431    HA   PHE  56           HA       PHE  56   7.073  -3.278   0.426
  432   1HB   PHE  56          1HB       PHE  56   5.687  -1.268  -0.235
  433   2HB   PHE  56          2HB       PHE  56   4.383  -2.328  -0.732
  434    HD1  PHE  56           1HD      PHE  56   5.988  -0.675   2.052
  435    HD2  PHE  56           2HD      PHE  56   3.125  -3.621   0.989
  436    HE1  PHE  56           1HE      PHE  56   5.023  -0.572   4.367
  437    HE2  PHE  56           2HE      PHE  56   2.160  -3.519   3.304
  438    HZ   PHE  56           HZ       PHE  56   3.121  -1.996   4.965
  439    H    LEU  57           H        LEU  57   4.400  -4.487  -1.703
  440    HA   LEU  57           HA       LEU  57   3.258  -6.220   0.115
  441   1HB   LEU  57          1HB       LEU  57   3.455  -6.205  -2.886
  442   2HB   LEU  57          2HB       LEU  57   2.611  -7.483  -2.034
  443    HG   LEU  57           HG       LEU  57   1.522  -5.201  -0.913
  444   1HD1  LEU  57          1HD1      LEU  57   2.840  -4.153  -3.022
  445   2HD1  LEU  57          2HD1      LEU  57   1.288  -4.559  -3.795
  446   3HD1  LEU  57          3HD1      LEU  57   1.321  -3.492  -2.371
  447   1HD2  LEU  57          1HD2      LEU  57  -0.418  -6.102  -1.615
  448   2HD2  LEU  57          2HD2      LEU  57   0.129  -6.245  -3.303
  449   3HD2  LEU  57          3HD2      LEU  57   0.622  -7.462  -2.101
  450    H    LYS  58           H        LYS  58   6.364  -6.340  -1.482
  451    HA   LYS  58           HA       LYS  58   6.697  -9.145  -1.396
  452   1HB   LYS  58          1HB       LYS  58   7.976  -7.192  -2.678
  453   2HB   LYS  58          2HB       LYS  58   9.025  -7.269  -1.278
  454   1HG   LYS  58          1HG       LYS  58   9.957  -9.224  -1.971
  455   2HG   LYS  58          2HG       LYS  58   8.389  -9.967  -2.210
  456   1HD   LYS  58          1HD       LYS  58   8.373  -9.525  -4.463
  457   2HD   LYS  58          2HD       LYS  58   9.047  -7.921  -4.257
  458   1HE   LYS  58          1HE       LYS  58  10.736 -10.435  -3.907
  459   2HE   LYS  58          2HE       LYS  58  10.527  -9.669  -5.469
  460   1HZ   LYS  58          1HZ       LYS  58  11.392  -8.099  -3.164
  461   2HZ   LYS  58          2HZ       LYS  58  12.472  -8.969  -4.027
  462   3HZ   LYS  58          3HZ       LYS  58  11.610  -7.786  -4.752
  463    H    ILE  59           H        ILE  59   8.014  -6.481   0.705
  464    HA   ILE  59           HA       ILE  59   8.891  -8.364   2.651
  465    HB   ILE  59           HB       ILE  59   8.648  -5.355   2.670
  466   1HG1  ILE  59          1HG1      ILE  59  11.131  -7.065   2.398
  467   2HG1  ILE  59          2HG1      ILE  59  10.229  -6.465   1.020
  468   1HG2  ILE  59          1HG2      ILE  59  10.453  -6.722   4.584
  469   2HG2  ILE  59          2HG2      ILE  59   9.490  -5.236   4.762
  470   3HG2  ILE  59          3HG2      ILE  59   8.709  -6.827   4.925
  471   1HD1  ILE  59          1HD1      ILE  59  10.503  -4.117   1.911
  472   2HD1  ILE  59          2HD1      ILE  59  11.532  -4.778   3.204
  473   3HD1  ILE  59          3HD1      ILE  59  12.045  -4.907   1.504
  474    H    TYR  60           H        TYR  60   6.144  -6.023   2.376
  475    HA   TYR  60           HA       TYR  60   5.009  -6.264   4.809
  476   1HB   TYR  60          1HB       TYR  60   4.193  -4.912   2.849
  477   2HB   TYR  60          2HB       TYR  60   3.794  -6.380   1.979
  478    HD1  TYR  60           1HD      TYR  60   1.477  -6.262   1.652
  479    HD2  TYR  60           2HD      TYR  60   3.077  -5.506   5.548
  480    HE1  TYR  60           1HE      TYR  60  -0.876  -6.187   2.612
  481    HE2  TYR  60           2HE      TYR  60   0.719  -5.433   6.494
  482    HH   TYR  60           HH       TYR  60  -1.539  -6.489   5.781
  483    H    LEU  61           H        LEU  61   3.898  -8.315   2.019
  484    HA   LEU  61           HA       LEU  61   2.712 -10.170   3.832
  485   1HB   LEU  61          1HB       LEU  61   3.164 -10.500   0.870
  486   2HB   LEU  61          2HB       LEU  61   1.984 -11.318   1.876
  487    HG   LEU  61           HG       LEU  61   1.629  -8.443   2.030
  488   1HD1  LEU  61          1HD1      LEU  61   0.663  -8.760  -0.545
  489   2HD1  LEU  61          2HD1      LEU  61   2.103  -7.832  -0.060
  490   3HD1  LEU  61          3HD1      LEU  61   2.272  -9.518  -0.606
  491   1HD2  LEU  61          1HD2      LEU  61  -0.422 -10.093   0.706
  492   2HD2  LEU  61          2HD2      LEU  61   0.088 -10.673   2.309
  493   3HD2  LEU  61          3HD2      LEU  61  -0.538  -9.018   2.119
  494    H    GLU  62           H        GLU  62   5.839  -9.748   2.278
  495    HA   GLU  62           HA       GLU  62   7.725 -10.780   2.751
  496   1HB   GLU  62          1HB       GLU  62   6.166 -11.806   4.805
  497   2HB   GLU  62          2HB       GLU  62   6.676 -13.266   3.979
  498   1HG   GLU  62          1HG       GLU  62   8.871 -11.306   4.305
  499   2HG   GLU  62          2HG       GLU  62   8.192 -11.825   5.835
  500    H    VAL  63           H        VAL  63   5.452 -11.442   0.639
  501    HA   VAL  63           HA       VAL  63   5.958 -14.084  -0.198
  502    HB   VAL  63           HB       VAL  63   4.928 -13.199  -2.347
  503   1HG1  VAL  63          1HG1      VAL  63   2.998 -12.441  -0.255
  504   2HG1  VAL  63          2HG1      VAL  63   2.919 -13.730  -1.480
  505   3HG1  VAL  63          3HG1      VAL  63   3.813 -13.996   0.036
  506   1HG2  VAL  63          1HG2      VAL  63   4.302 -10.729  -0.723
  507   2HG2  VAL  63          2HG2      VAL  63   5.699 -10.802  -1.823
  508   3HG2  VAL  63          3HG2      VAL  63   4.052 -11.019  -2.461
  509    H    ASP  64           H        ASP  64   6.932 -14.585  -2.434
  510    HA   ASP  64           HA       ASP  64   9.477 -13.197  -2.518
  511   1HB   ASP  64          1HB       ASP  64   8.848 -15.897  -2.512
  512   2HB   ASP  64          2HB       ASP  64   9.048 -15.601  -4.227
  513    H    ASN  65           H        ASN  65   6.431 -13.179  -3.971
  514    HA   ASN  65           HA       ASN  65   7.273 -11.593  -6.090
  515   1HB   ASN  65          1HB       ASN  65   6.091 -13.424  -7.776
  516   2HB   ASN  65          2HB       ASN  65   7.825 -13.266  -7.581
  517   1HD2  ASN  65          1HD2      ASN  65   4.952 -15.024  -6.634
  518   2HD2  ASN  65          2HD2      ASN  65   5.724 -16.453  -6.032
  519    H    VAL  66           H        VAL  66   5.506 -10.199  -6.170
  520    HA   VAL  66           HA       VAL  66   2.890 -11.320  -5.480
  521    HB   VAL  66           HB       VAL  66   4.282  -9.118  -4.545
  522   1HG1  VAL  66          1HG1      VAL  66   3.020  -7.151  -5.230
  523   2HG1  VAL  66          2HG1      VAL  66   3.781  -7.911  -6.648
  524   3HG1  VAL  66          3HG1      VAL  66   2.042  -8.135  -6.345
  525   1HG2  VAL  66          1HG2      VAL  66   1.402  -8.853  -4.174
  526   2HG2  VAL  66          2HG2      VAL  66   1.949 -10.534  -3.967
  527   3HG2  VAL  66          3HG2      VAL  66   2.676  -9.235  -2.991
  528    HA   PRO  67           HA       PRO  67   1.590 -10.725  -9.560
  529   1HB   PRO  67          1HB       PRO  67  -1.122 -10.662  -9.232
  530   2HB   PRO  67          2HB       PRO  67  -0.196 -12.149  -9.272
  531   1HG   PRO  67          1HG       PRO  67  -1.400 -10.777  -6.946
  532   2HG   PRO  67          2HG       PRO  67  -0.854 -12.437  -7.080
  533   1HD   PRO  67          1HD       PRO  67   0.506 -10.284  -5.760
  534   2HD   PRO  67          2HD       PRO  67   1.104 -11.914  -5.994
  535    H    ARG  68           H        ARG  68   2.107  -8.964 -10.687
  536    HA   ARG  68           HA       ARG  68   1.760  -6.466  -9.719
  537   1HB   ARG  68          1HB       ARG  68   3.137  -7.130 -11.731
  538   2HB   ARG  68          2HB       ARG  68   1.662  -7.302 -12.663
  539   1HG   ARG  68          1HG       ARG  68   1.142  -4.845 -12.038
  540   2HG   ARG  68          2HG       ARG  68   2.786  -4.747 -11.437
  541   1HD   ARG  68          1HD       ARG  68   2.309  -5.809 -14.234
  542   2HD   ARG  68          2HD       ARG  68   2.232  -4.080 -13.957
  543    HE   ARG  68           HE       ARG  68   4.555  -4.042 -13.533
  544   1HH1  ARG  68          2HH2      ARG  68   3.404  -7.362 -13.713
  545   2HH1  ARG  68          1HH2      ARG  68   4.994  -8.046 -13.764
  546   1HH2  ARG  68          2HH1      ARG  68   6.654  -4.943 -13.601
  547   2HH2  ARG  68          1HH1      ARG  68   6.855  -6.661 -13.700
  548    H    HIS  69           H        HIS  69  -0.598  -8.630 -11.202
  549    HA   HIS  69           HA       HIS  69  -2.423  -6.769 -12.144
  550   1HB   HIS  69          1HB       HIS  69  -2.624  -9.616 -11.188
  551   2HB   HIS  69          2HB       HIS  69  -4.070  -8.728 -11.626
  552    HD1  HIS  69           1HD      HIS  69  -3.434 -11.135 -13.317
  553    HD2  HIS  69           2HD      HIS  69  -1.911  -7.321 -14.176
  554    HE1  HIS  69           1HE      HIS  69  -2.834 -11.146 -15.798
  555    H    LEU  70           H        LEU  70  -1.944  -8.215  -8.876
  556    HA   LEU  70           HA       LEU  70  -4.229  -6.930  -7.784
  557   1HB   LEU  70          1HB       LEU  70  -3.712  -8.794  -6.608
  558   2HB   LEU  70          2HB       LEU  70  -1.984  -8.605  -6.823
  559    HG   LEU  70           HG       LEU  70  -2.220  -6.600  -5.180
  560   1HD1  LEU  70          1HD1      LEU  70  -4.676  -8.145  -4.330
  561   2HD1  LEU  70          2HD1      LEU  70  -4.040  -6.624  -3.659
  562   3HD1  LEU  70          3HD1      LEU  70  -4.740  -6.651  -5.295
  563   1HD2  LEU  70          1HD2      LEU  70  -2.638  -9.334  -3.975
  564   2HD2  LEU  70          2HD2      LEU  70  -1.137  -8.887  -4.820
  565   3HD2  LEU  70          3HD2      LEU  70  -1.647  -7.984  -3.374
  566    H    SER  71           H        SER  71  -0.684  -6.247  -7.863
  567    HA   SER  71           HA       SER  71  -0.724  -4.088  -6.184
  568   1HB   SER  71          1HB       SER  71   1.047  -5.099  -8.360
  569   2HB   SER  71          2HB       SER  71   1.240  -3.400  -7.980
  570    HG   SER  71           HG       SER  71   2.450  -5.261  -6.708
  571    H    LEU  72           H        LEU  72  -1.868  -4.452  -9.504
  572    HA   LEU  72           HA       LEU  72  -1.825  -1.682 -10.140
  573   1HB   LEU  72          1HB       LEU  72  -1.725  -3.094 -11.965
  574   2HB   LEU  72          2HB       LEU  72  -2.967  -4.167 -11.351
  575    HG   LEU  72           HG       LEU  72  -4.708  -2.582 -11.886
  576   1HD1  LEU  72          1HD1      LEU  72  -2.427  -0.702 -12.207
  577   2HD1  LEU  72          2HD1      LEU  72  -3.804  -0.509 -13.319
  578   3HD1  LEU  72          3HD1      LEU  72  -4.064  -0.434 -11.559
  579   1HD2  LEU  72          1HD2      LEU  72  -2.733  -3.101 -14.112
  580   2HD2  LEU  72          2HD2      LEU  72  -4.202  -4.013 -13.692
  581   3HD2  LEU  72          3HD2      LEU  72  -4.337  -2.381 -14.390
  582    H    ALA  73           H        ALA  73  -4.321  -4.017  -8.958
  583    HA   ALA  73           HA       ALA  73  -6.349  -2.025  -8.872
  584   1HB   ALA  73          1HB       ALA  73  -6.074  -4.812  -7.682
  585   2HB   ALA  73          2HB       ALA  73  -7.556  -3.831  -7.581
  586   3HB   ALA  73          3HB       ALA  73  -6.938  -4.349  -9.168
  587    H    LEU  74           H        LEU  74  -3.917  -3.358  -6.602
  588    HA   LEU  74           HA       LEU  74  -4.936  -2.391  -4.239
  589   1HB   LEU  74          1HB       LEU  74  -2.304  -3.203  -5.288
  590   2HB   LEU  74          2HB       LEU  74  -2.246  -2.132  -3.902
  591    HG   LEU  74           HG       LEU  74  -3.936  -4.633  -3.888
  592   1HD1  LEU  74          1HD1      LEU  74  -1.392  -4.954  -4.432
  593   2HD1  LEU  74          2HD1      LEU  74  -1.187  -4.619  -2.696
  594   3HD1  LEU  74          3HD1      LEU  74  -2.198  -5.984  -3.225
  595   1HD2  LEU  74          1HD2      LEU  74  -2.814  -3.989  -1.359
  596   2HD2  LEU  74          2HD2      LEU  74  -3.480  -2.491  -2.052
  597   3HD2  LEU  74          3HD2      LEU  74  -4.518  -3.926  -1.870
  598    H    PHE  75           H        PHE  75  -2.855  -0.734  -6.690
  599    HA   PHE  75           HA       PHE  75  -2.536   1.630  -5.283
  600   1HB   PHE  75          1HB       PHE  75  -1.673   0.548  -7.636
  601   2HB   PHE  75          2HB       PHE  75  -2.953   1.548  -8.294
  602    HD1  PHE  75           1HD      PHE  75  -0.130   1.888  -5.864
  603    HD2  PHE  75           2HD      PHE  75  -2.348   3.640  -9.028
  604    HE1  PHE  75           1HE      PHE  75   1.410   3.870  -5.845
  605    HE2  PHE  75           2HE      PHE  75  -0.808   5.623  -9.010
  606    HZ   PHE  75           HZ       PHE  75   1.052   5.714  -7.418
  607    H    GLN  76           H        GLN  76  -5.100   0.603  -7.622
  608    HA   GLN  76           HA       GLN  76  -6.380   2.992  -7.848
  609   1HB   GLN  76          1HB       GLN  76  -7.410   0.133  -7.890
  610   2HB   GLN  76          2HB       GLN  76  -8.472   1.490  -8.208
  611   1HG   GLN  76          1HG       GLN  76  -6.701   2.242  -9.968
  612   2HG   GLN  76          2HG       GLN  76  -6.010   0.642  -9.786
  613   1HE2  GLN  76          1HE2      GLN  76  -6.498  -0.309 -11.643
  614   2HE2  GLN  76          2HE2      GLN  76  -8.088  -0.550 -12.285
  615    H    SER  77           H        SER  77  -6.364   0.667  -5.159
  616    HA   SER  77           HA       SER  77  -8.656   1.458  -3.882
  617   1HB   SER  77          1HB       SER  77  -7.159  -0.508  -3.311
  618   2HB   SER  77          2HB       SER  77  -6.041   0.613  -2.561
  619    HG   SER  77           HG       SER  77  -8.028  -0.557  -1.343
  620    H    PHE  78           H        PHE  78  -5.239   2.533  -3.197
  621    HA   PHE  78           HA       PHE  78  -6.377   5.098  -2.341
  622   1HB   PHE  78          1HB       PHE  78  -4.159   4.910  -0.806
  623   2HB   PHE  78          2HB       PHE  78  -5.659   4.171  -0.283
  624    HD1  PHE  78           1HD      PHE  78  -6.001   1.710  -0.646
  625    HD2  PHE  78           2HD      PHE  78  -2.252   3.590  -1.297
  626    HE1  PHE  78           1HE      PHE  78  -4.861  -0.523  -0.531
  627    HE2  PHE  78           2HE      PHE  78  -1.113   1.356  -1.182
  628    HZ   PHE  78           HZ       PHE  78  -2.431  -0.673  -0.801
  629    H    GLU  79           H        GLU  79  -5.190   6.965  -2.902
  630    HA   GLU  79           HA       GLU  79  -2.621   6.637  -4.093
  631   1HB   GLU  79          1HB       GLU  79  -4.749   6.366  -5.831
  632   2HB   GLU  79          2HB       GLU  79  -4.442   8.088  -5.943
  633   1HG   GLU  79          1HG       GLU  79  -2.279   7.797  -6.809
  634   2HG   GLU  79          2HG       GLU  79  -2.069   6.228  -6.057
  635    H    THR  80           H        THR  80  -2.207   9.088  -5.255
  636    HA   THR  80           HA       THR  80  -3.414  11.302  -4.164
  637    HB   THR  80           HB       THR  80  -2.885  10.854  -1.925
  638    HG1  THR  80           1HG      THR  80  -0.994  12.182  -1.562
  639   1HG2  THR  80          1HG2      THR  80  -1.708   8.743  -2.075
  640   2HG2  THR  80          2HG2      THR  80  -0.397   9.470  -3.035
  641   3HG2  THR  80          3HG2      THR  80  -0.567   9.876  -1.310
  642    H    GLY  81           H        GLY  81  -2.697  13.069  -5.231
  643   1HA   GLY  81          1HA       GLY  81  -0.582  14.235  -5.884
  644   2HA   GLY  81          2HA       GLY  81  -0.145  12.741  -6.689
  645    H    HIS  82           H        HIS  82  -2.135  15.647  -6.801
  646    HA   HIS  82           HA       HIS  82  -2.338  15.656  -9.530
  647   1HB   HIS  82          1HB       HIS  82  -4.187  13.801  -8.381
  648   2HB   HIS  82          2HB       HIS  82  -5.104  15.160  -9.000
  649    HD1  HIS  82           1HD      HIS  82  -5.958  13.216 -10.736
  650    HD2  HIS  82           2HD      HIS  82  -2.013  14.571 -11.184
  651    HE1  HIS  82           1HE      HIS  82  -5.217  12.502 -13.071
  652    H    CYS  83           H        CYS  83  -4.387  16.267  -6.593
  653    HA   CYS  83           HA       CYS  83  -5.308  18.099  -5.811
  654   1HB   CYS  83          1HB       CYS  83  -2.761  18.737  -5.941
  655   2HB   CYS  83          2HB       CYS  83  -3.284  19.844  -7.195
  656    HG   CYS  83           HG       CYS  83  -4.014  21.559  -5.747
  657    H    LEU  84           H        LEU  84  -5.829  17.046  -8.687
  658    HA   LEU  84           HA       LEU  84  -6.893  17.640 -10.549
  659   1HB   LEU  84          1HB       LEU  84  -8.382  18.574  -8.231
  660   2HB   LEU  84          2HB       LEU  84  -8.789  19.478  -9.677
  661    HG   LEU  84           HG       LEU  84 -10.273  17.539  -9.261
  662   1HD1  LEU  84          1HD1      LEU  84 -10.653  17.483 -11.448
  663   2HD1  LEU  84          2HD1      LEU  84  -9.130  18.375 -11.676
  664   3HD1  LEU  84          3HD1      LEU  84  -9.139  16.596 -11.751
  665   1HD2  LEU  84          1HD2      LEU  84  -7.852  16.180  -8.760
  666   2HD2  LEU  84          2HD2      LEU  84  -9.509  15.530  -8.719
  667   3HD2  LEU  84          3HD2      LEU  84  -8.555  15.441 -10.219
  668    H    ASN  85           H        ASN  85  -4.458  19.004 -10.322
  669    HA   ASN  85           HA       ASN  85  -5.015  21.173 -12.027
  670   1HB   ASN  85          1HB       ASN  85  -5.203  21.968  -9.439
  671   2HB   ASN  85          2HB       ASN  85  -3.459  22.051  -9.590
  672   1HD2  ASN  85          1HD2      ASN  85  -6.390  23.592 -10.133
  673   2HD2  ASN  85          2HD2      ASN  85  -5.867  24.907 -11.132
  674    H    GLU  86           H        GLU  86  -3.583  18.824 -12.432
  675    HA   GLU  86           HA       GLU  86  -1.588  17.875 -12.632
  676   1HB   GLU  86          1HB       GLU  86  -0.052  19.541 -14.057
  677   2HB   GLU  86          2HB       GLU  86  -1.507  18.833 -14.730
  678   1HG   GLU  86          1HG       GLU  86  -2.806  20.848 -14.210
  679   2HG   GLU  86          2HG       GLU  86  -1.466  21.541 -13.319
  680    H    THR  87           H        THR  87  -0.765  17.595 -10.504
  681    HA   THR  87           HA       THR  87   0.866  19.778  -9.440
  682    HB   THR  87           HB       THR  87  -0.220  17.161  -8.274
  683    HG1  THR  87           1HG      THR  87  -1.835  18.584  -7.746
  684   1HG2  THR  87          1HG2      THR  87   0.417  18.629  -6.108
  685   2HG2  THR  87          2HG2      THR  87   1.602  17.518  -6.835
  686   3HG2  THR  87          3HG2      THR  87   1.674  19.259  -7.199
  687    H    ASN  88           H        ASN  88   1.870  18.628 -11.810
  688    HA   ASN  88           HA       ASN  88   3.557  17.516 -12.653
  689   1HB   ASN  88          1HB       ASN  88   4.587  19.510 -11.333
  690   2HB   ASN  88          2HB       ASN  88   5.064  18.336 -10.123
  691   1HD2  ASN  88          1HD2      ASN  88   7.234  18.784 -10.493
  692   2HD2  ASN  88          2HD2      ASN  88   8.097  18.189 -11.872
  693    H    VAL  89           H        VAL  89   1.888  15.705 -11.282
  694    HA   VAL  89           HA       VAL  89   3.673  14.071  -9.647
  695    HB   VAL  89           HB       VAL  89   0.744  13.607 -10.165
  696   1HG1  VAL  89          1HG1      VAL  89   0.959  11.961  -8.673
  697   2HG1  VAL  89          2HG1      VAL  89   2.718  12.230  -8.705
  698   3HG1  VAL  89          3HG1      VAL  89   1.713  13.058  -7.492
  699   1HG2  VAL  89          1HG2      VAL  89   0.827  15.894  -9.441
  700   2HG2  VAL  89          2HG2      VAL  89   0.320  14.903  -8.052
  701   3HG2  VAL  89          3HG2      VAL  89   1.992  15.505  -8.153
  702    H    THR  90           H        THR  90   4.350  14.291 -12.394
  703    HA   THR  90           HA       THR  90   3.228  12.431 -14.086
  704    HB   THR  90           HB       THR  90   5.482  12.547 -15.198
  705    HG1  THR  90           1HG      THR  90   7.070  13.831 -13.893
  706   1HG2  THR  90          1HG2      THR  90   5.739  15.242 -14.685
  707   2HG2  THR  90          2HG2      THR  90   4.562  14.573 -15.840
  708   3HG2  THR  90          3HG2      THR  90   4.054  14.971 -14.181
  709    H    LYS  91           H        LYS  91   5.227  11.917 -11.224
  710    HA   LYS  91           HA       LYS  91   5.407   9.082 -11.947
  711   1HB   LYS  91          1HB       LYS  91   7.021  10.778 -10.025
  712   2HB   LYS  91          2HB       LYS  91   7.133   9.032 -10.100
  713   1HG   LYS  91          1HG       LYS  91   8.669   9.305 -11.751
  714   2HG   LYS  91          2HG       LYS  91   7.346   9.793 -12.792
  715   1HD   LYS  91          1HD       LYS  91   8.746  11.654 -12.984
  716   2HD   LYS  91          2HD       LYS  91   7.701  12.176 -11.679
  717   1HE   LYS  91          1HE       LYS  91   9.560  12.469 -10.409
  718   2HE   LYS  91          2HE       LYS  91   9.738  10.726 -10.372
  719   1HZ   LYS  91          1HZ       LYS  91  11.357  12.572 -11.649
  720   2HZ   LYS  91          2HZ       LYS  91  11.535  10.950 -11.593
  721   3HZ   LYS  91          3HZ       LYS  91  10.691  11.637 -12.811
  722    H    ASP  92           H        ASP  92   3.152   8.682 -11.459
  723    HA   ASP  92           HA       ASP  92   1.756   9.392  -9.335
  724   1HB   ASP  92          1HB       ASP  92   1.875   6.463 -10.152
  725   2HB   ASP  92          2HB       ASP  92   0.479   7.357  -9.584
  726    H    VAL  93           H        VAL  93   2.275   9.397  -7.143
  727    HA   VAL  93           HA       VAL  93   3.778   7.082  -6.134
  728    HB   VAL  93           HB       VAL  93   4.805   8.664  -4.513
  729   1HG1  VAL  93          1HG1      VAL  93   5.800   9.904  -6.925
  730   2HG1  VAL  93          2HG1      VAL  93   6.558   8.668  -5.892
  731   3HG1  VAL  93          3HG1      VAL  93   5.471   8.179  -7.214
  732   1HG2  VAL  93          1HG2      VAL  93   3.925  10.909  -6.331
  733   2HG2  VAL  93          2HG2      VAL  93   2.961  10.427  -4.914
  734   3HG2  VAL  93          3HG2      VAL  93   4.634  10.996  -4.700
  735    H    VAL  94           H        VAL  94   3.514   7.045  -3.574
  736    HA   VAL  94           HA       VAL  94   0.817   7.880  -2.848
  737    HB   VAL  94           HB       VAL  94   1.861   5.046  -2.721
  738   1HG1  VAL  94          1HG1      VAL  94   0.673   5.057  -0.772
  739   2HG1  VAL  94          2HG1      VAL  94  -0.352   6.424  -1.272
  740   3HG1  VAL  94          3HG1      VAL  94  -0.678   4.791  -1.901
  741   1HG2  VAL  94          1HG2      VAL  94   0.935   5.911  -4.923
  742   2HG2  VAL  94          2HG2      VAL  94   0.132   4.472  -4.250
  743   3HG2  VAL  94          3HG2      VAL  94  -0.635   6.072  -4.099
  744    H    CYS  95           H        CYS  95   0.507   8.035  -0.530
  745    HA   CYS  95           HA       CYS  95   2.924   8.764   0.777
  746   1HB   CYS  95          1HB       CYS  95   0.625   9.885   1.009
  747   2HB   CYS  95          2HB       CYS  95   0.195   8.555   2.066
  748    HG   CYS  95           HG       CYS  95   1.602   9.039   3.984
  749    H    LEU  96           H        LEU  96   3.896   7.700   2.601
  750    HA   LEU  96           HA       LEU  96   3.618   4.877   2.570
  751   1HB   LEU  96          1HB       LEU  96   5.317   6.901   3.914
  752   2HB   LEU  96          2HB       LEU  96   5.146   5.360   4.732
  753    HG   LEU  96           HG       LEU  96   5.695   4.862   1.957
  754   1HD1  LEU  96          1HD1      LEU  96   8.113   6.180   2.946
  755   2HD1  LEU  96          2HD1      LEU  96   7.344   6.234   1.341
  756   3HD1  LEU  96          3HD1      LEU  96   6.769   7.307   2.640
  757   1HD2  LEU  96          1HD2      LEU  96   6.114   3.364   3.901
  758   2HD2  LEU  96          2HD2      LEU  96   7.521   3.567   2.829
  759   3HD2  LEU  96          3HD2      LEU  96   7.455   4.431   4.384
  760    H    ASN  97           H        ASN  97   2.608   7.533   4.788
  761    HA   ASN  97           HA       ASN  97   1.706   5.898   6.812
  762   1HB   ASN  97          1HB       ASN  97   1.998   8.421   6.908
  763   2HB   ASN  97          2HB       ASN  97   0.557   8.598   5.927
  764   1HD2  ASN  97          1HD2      ASN  97  -1.467   7.931   6.738
  765   2HD2  ASN  97          2HD2      ASN  97  -1.783   7.827   8.438
  766    H    ASP  98           H        ASP  98   0.253   7.038   3.735
  767    HA   ASP  98           HA       ASP  98  -2.373   6.449   4.256
  768   1HB   ASP  98          1HB       ASP  98  -0.646   6.735   1.832
  769   2HB   ASP  98          2HB       ASP  98  -2.140   5.857   1.577
  770    H    VAL  99           H        VAL  99   0.316   4.454   2.850
  771    HA   VAL  99           HA       VAL  99  -1.285   2.161   2.437
  772    HB   VAL  99           HB       VAL  99   1.712   2.475   2.704
  773   1HG1  VAL  99          1HG1      VAL  99   1.224   0.403   0.943
  774   2HG1  VAL  99          2HG1      VAL  99   1.698   0.230   2.650
  775   3HG1  VAL  99          3HG1      VAL  99  -0.021   0.161   2.192
  776   1HG2  VAL  99          1HG2      VAL  99   1.185   2.179   0.030
  777   2HG2  VAL  99          2HG2      VAL  99  -0.197   3.166   0.565
  778   3HG2  VAL  99          3HG2      VAL  99   1.466   3.733   0.852
  779    H    SER 100           H        SER 100   0.469   3.543   5.187
  780    HA   SER 100           HA       SER 100   0.548   1.127   6.637
  781   1HB   SER 100          1HB       SER 100   2.118   2.989   7.068
  782   2HB   SER 100          2HB       SER 100   0.791   4.029   7.546
  783    HG   SER 100           HG       SER 100   0.551   2.953   9.450
  784    H    CYS 101           H        CYS 101  -1.816   3.693   6.085
  785    HA   CYS 101           HA       CYS 101  -3.361   3.113   8.405
  786   1HB   CYS 101          1HB       CYS 101  -3.226   5.308   6.947
  787   2HB   CYS 101          2HB       CYS 101  -4.480   4.530   6.002
  788    HG   CYS 101           HG       CYS 101  -6.322   4.745   7.506
  789    H    TYR 102           H        TYR 102  -3.563   2.449   4.840
  790    HA   TYR 102           HA       TYR 102  -5.938   1.056   4.826
  791   1HB   TYR 102          1HB       TYR 102  -4.724   1.729   2.794
  792   2HB   TYR 102          2HB       TYR 102  -3.272   0.896   3.313
  793    HD1  TYR 102           1HD      TYR 102  -6.829   0.207   2.355
  794    HD2  TYR 102           2HD      TYR 102  -2.801  -1.231   2.470
  795    HE1  TYR 102           1HE      TYR 102  -7.513  -1.840   1.010
  796    HE2  TYR 102           2HE      TYR 102  -3.499  -3.273   1.125
  797    HH   TYR 102           HH       TYR 102  -6.500  -3.450  -0.453
  798    H    PHE 103           H        PHE 103  -2.574  -0.312   5.065
  799    HA   PHE 103           HA       PHE 103  -3.484  -2.932   5.479
  800   1HB   PHE 103          1HB       PHE 103  -0.923  -1.341   6.035
  801   2HB   PHE 103          2HB       PHE 103  -1.007  -3.049   6.416
  802    HD1  PHE 103           1HD      PHE 103  -2.542  -4.083   4.105
  803    HD2  PHE 103           2HD      PHE 103   0.582  -1.216   4.266
  804    HE1  PHE 103           1HE      PHE 103  -1.907  -4.642   1.742
  805    HE2  PHE 103           2HE      PHE 103   1.217  -1.775   1.903
  806    HZ   PHE 103           HZ       PHE 103  -0.035  -3.482   0.669
  807    H    SER 104           H        SER 104  -2.912  -0.166   7.642
  808    HA   SER 104           HA       SER 104  -2.621  -1.552   9.999
  809   1HB   SER 104          1HB       SER 104  -2.153   0.706  10.236
  810   2HB   SER 104          2HB       SER 104  -3.481   1.207   9.208
  811    HG   SER 104           HG       SER 104  -3.469   1.349  11.812
  812    H    LEU 105           H        LEU 105  -5.481  -0.801   8.024
  813    HA   LEU 105           HA       LEU 105  -7.360  -1.393  10.085
  814   1HB   LEU 105          1HB       LEU 105  -7.378  -0.557   7.273
  815   2HB   LEU 105          2HB       LEU 105  -8.696  -1.631   7.698
  816    HG   LEU 105           HG       LEU 105  -9.299   0.747   7.888
  817   1HD1  LEU 105          1HD1      LEU 105 -10.217  -1.157   9.388
  818   2HD1  LEU 105          2HD1      LEU 105  -9.297  -0.358  10.686
  819   3HD1  LEU 105          3HD1      LEU 105 -10.570   0.534   9.817
  820   1HD2  LEU 105          1HD2      LEU 105  -8.242   2.294   9.196
  821   2HD2  LEU 105          2HD2      LEU 105  -7.616   1.077  10.335
  822   3HD2  LEU 105          3HD2      LEU 105  -6.853   1.279   8.740
  823    H    LEU 106           H        LEU 106  -5.905  -3.152   7.290
  824    HA   LEU 106           HA       LEU 106  -7.440  -5.435   7.445
  825   1HB   LEU 106          1HB       LEU 106  -4.981  -4.562   6.209
  826   2HB   LEU 106          2HB       LEU 106  -4.836  -6.222   6.751
  827    HG   LEU 106           HG       LEU 106  -7.263  -6.330   5.528
  828   1HD1  LEU 106          1HD1      LEU 106  -6.859  -5.141   3.292
  829   2HD1  LEU 106          2HD1      LEU 106  -7.404  -4.158   4.672
  830   3HD1  LEU 106          3HD1      LEU 106  -5.693  -4.136   4.185
  831   1HD2  LEU 106          1HD2      LEU 106  -6.173  -7.500   3.753
  832   2HD2  LEU 106          2HD2      LEU 106  -4.638  -6.653   4.057
  833   3HD2  LEU 106          3HD2      LEU 106  -5.264  -7.814   5.251
  834    H    GLU 107           H        GLU 107  -4.219  -4.804   9.011
  835    HA   GLU 107           HA       GLU 107  -4.101  -7.151  10.388
  836   1HB   GLU 107          1HB       GLU 107  -2.908  -4.425  10.698
  837   2HB   GLU 107          2HB       GLU 107  -2.814  -5.467  12.104
  838   1HG   GLU 107          1HG       GLU 107  -1.957  -7.293  10.405
  839   2HG   GLU 107          2HG       GLU 107  -1.664  -5.937   9.334
  840    H    GLY 108           H        GLY 108  -5.555  -3.990  11.402
  841   1HA   GLY 108          1HA       GLY 108  -6.765  -5.371  13.714
  842   2HA   GLY 108          2HA       GLY 108  -6.463  -3.650  13.581
  843    H    GLY 109           H        GLY 109  -8.032  -6.107  11.399
  844   1HA   GLY 109          1HA       GLY 109 -10.181  -4.199  10.871
  845   2HA   GLY 109          2HA       GLY 109  -9.838  -5.687  10.010
  846    H    ARG 110           H        ARG 110 -10.304  -4.988  13.548
  847    HA   ARG 110           HA       ARG 110 -11.680  -7.339  13.971
  848   1HB   ARG 110          1HB       ARG 110 -12.422  -6.142  16.139
  849   2HB   ARG 110          2HB       ARG 110 -10.694  -6.255  15.871
  850   1HG   ARG 110          1HG       ARG 110 -11.633  -3.854  14.568
  851   2HG   ARG 110          2HG       ARG 110 -12.300  -3.880  16.189
  852   1HD   ARG 110          1HD       ARG 110  -9.371  -4.549  15.806
  853   2HD   ARG 110          2HD       ARG 110  -9.871  -2.871  15.742
  854    HE   ARG 110           HE       ARG 110 -11.079  -4.005  18.048
  855   1HH1  ARG 110          2HH2      ARG 110  -7.849  -3.286  16.853
  856   2HH1  ARG 110          1HH2      ARG 110  -7.173  -3.070  18.434
  857   1HH2  ARG 110          2HH1      ARG 110 -10.189  -3.721  20.133
  858   2HH2  ARG 110          1HH1      ARG 110  -8.514  -3.320  20.312
  859    HA   PRO 111           HA       PRO 111 -15.562  -6.042  12.343
  860   1HB   PRO 111          1HB       PRO 111 -16.873  -8.427  12.597
  861   2HB   PRO 111          2HB       PRO 111 -15.866  -8.029  11.220
  862   1HG   PRO 111          1HG       PRO 111 -15.278  -9.836  13.484
  863   2HG   PRO 111          2HG       PRO 111 -14.497  -9.749  11.918
  864   1HD   PRO 111          1HD       PRO 111 -13.481  -8.734  14.401
  865   2HD   PRO 111          2HD       PRO 111 -12.756  -8.545  12.817
  866    H    GLU 112           H        GLU 112 -17.716  -5.516  12.980
  867    HA   GLU 112           HA       GLU 112 -17.819  -4.704  15.578
  868   1HB   GLU 112          1HB       GLU 112 -19.708  -4.958  13.319
  869   2HB   GLU 112          2HB       GLU 112 -20.499  -5.045  14.880
  870   1HG   GLU 112          1HG       GLU 112 -20.453  -2.754  14.750
  871   2HG   GLU 112          2HG       GLU 112 -18.819  -2.943  15.355
  872    H    ASP 113           H        ASP 113 -18.214  -7.899  14.267
  873    HA   ASP 113           HA       ASP 113 -18.833  -8.831  16.917
  874   1HB   ASP 113          1HB       ASP 113 -20.748  -8.828  14.718
  875   2HB   ASP 113          2HB       ASP 113 -20.362 -10.481  15.151
  876    H    LYS 114           H        LYS 114 -17.007 -10.146  17.175
  877    HA   LYS 114           HA       LYS 114 -15.563 -11.242  15.074
  878   1HB   LYS 114          1HB       LYS 114 -14.343 -12.433  16.778
  879   2HB   LYS 114          2HB       LYS 114 -14.694 -10.814  17.348
  880   1HG   LYS 114          1HG       LYS 114 -15.649 -11.728  19.189
  881   2HG   LYS 114          2HG       LYS 114 -16.928 -12.350  18.165
  882   1HD   LYS 114          1HD       LYS 114 -15.680 -14.436  17.776
  883   2HD   LYS 114          2HD       LYS 114 -14.285 -13.807  18.629
  884   1HE   LYS 114          1HE       LYS 114 -16.923 -13.863  20.095
  885   2HE   LYS 114          2HE       LYS 114 -16.091 -15.386  19.849
  886   1HZ   LYS 114          1HZ       LYS 114 -15.517 -14.108  21.901
  887   2HZ   LYS 114          2HZ       LYS 114 -14.244 -14.605  21.007
  888   3HZ   LYS 114          3HZ       LYS 114 -14.721 -13.044  20.953
  889    H    LEU 115           H        LEU 115 -15.150 -13.953  15.616
  890    HA   LEU 115           HA       LEU 115 -17.136 -15.124  14.097
  891   1HB   LEU 115          1HB       LEU 115 -15.521 -16.735  16.026
  892   2HB   LEU 115          2HB       LEU 115 -15.983 -17.098  14.375
  893    HG   LEU 115           HG       LEU 115 -13.779 -16.679  14.039
  894   1HD1  LEU 115          1HD1      LEU 115 -15.421 -14.649  13.179
  895   2HD1  LEU 115          2HD1      LEU 115 -14.105 -13.766  13.990
  896   3HD1  LEU 115          3HD1      LEU 115 -13.733 -14.909  12.677
  897   1HD2  LEU 115          1HD2      LEU 115 -12.392 -15.934  15.616
  898   2HD2  LEU 115          2HD2      LEU 115 -13.232 -14.370  15.737
  899   3HD2  LEU 115          3HD2      LEU 115 -13.828 -15.773  16.655
  900    H    GLU 116           H        GLU 116 -18.722 -16.816  14.695
  901    HA   GLU 116           HA       GLU 116 -19.524 -16.821  17.444
  902   1HB   GLU 116          1HB       GLU 116 -21.797 -16.170  15.631
  903   2HB   GLU 116          2HB       GLU 116 -21.505 -15.665  17.283
  904   1HG   GLU 116          1HG       GLU 116 -19.807 -14.030  16.520
  905   2HG   GLU 116          2HG       GLU 116 -19.982 -14.580  14.866
  906    H    TRP 117           H        TRP 117 -20.405 -18.807  17.984
  907    HA   TRP 117           HA       TRP 117 -20.834 -20.636  15.737
  908   1HB   TRP 117          1HB       TRP 117 -20.185 -21.110  18.648
  909   2HB   TRP 117          2HB       TRP 117 -20.632 -22.387  17.534
  910    HD1  TRP 117           HD       TRP 117 -18.072 -19.463  17.028
  911    HE1  TRP 117           1HE      TRP 117 -15.734 -20.414  16.260
  912    HE3  TRP 117           3HE      TRP 117 -19.407 -24.365  17.237
  913    HZ2  TRP 117           2HZ      TRP 117 -14.727 -23.051  15.836
  914    HZ3  TRP 117           3HZ      TRP 117 -17.687 -26.064  16.630
  915    HH2  TRP 117           HH       TRP 117 -15.415 -25.474  15.948
  916    H    SER 118           H        SER 118 -22.515 -18.490  17.652
  917    HA   SER 118           HA       SER 118 -24.564 -18.285  18.351
  918   1HB   SER 118          1HB       SER 118 -25.170 -18.446  16.028
  919   2HB   SER 118          2HB       SER 118 -24.999 -20.190  16.023
  920    HG   SER 118           HG       SER 118 -27.211 -18.708  16.585
  Start of MODEL   18
    1   1H    MET   1           H        MET   1 -15.988   5.889   6.163
    2    HA   MET   1           HA       MET   1 -14.816   7.687   6.588
    3   1HB   MET   1          1HB       MET   1 -13.282   5.431   7.929
    4   2HB   MET   1          2HB       MET   1 -12.638   7.057   8.040
    5   1HG   MET   1          1HG       MET   1 -14.741   7.870   9.054
    6   2HG   MET   1          2HG       MET   1 -15.492   6.302   8.835
    7   1HE   MET   1          1HE       MET   1 -11.693   7.222  10.506
    8   2HE   MET   1          2HE       MET   1 -12.969   8.451  10.338
    9   3HE   MET   1          3HE       MET   1 -12.604   7.760  11.937
   10    H    ALA   2           H        ALA   2 -13.860   8.896   5.012
   11    HA   ALA   2           HA       ALA   2 -12.583   9.348   3.224
   12   1HB   ALA   2          1HB       ALA   2 -10.663   8.662   5.466
   13   2HB   ALA   2          2HB       ALA   2 -10.087   9.299   3.907
   14   3HB   ALA   2          3HB       ALA   2 -11.198  10.266   4.908
   15    H    LYS   3           H        LYS   3 -13.686   6.747   2.988
   16    HA   LYS   3           HA       LYS   3 -11.764   4.778   2.498
   17   1HB   LYS   3          1HB       LYS   3 -14.186   4.383   2.871
   18   2HB   LYS   3          2HB       LYS   3 -14.536   5.088   1.306
   19   1HG   LYS   3          1HG       LYS   3 -14.196   3.053   0.368
   20   2HG   LYS   3          2HG       LYS   3 -12.501   3.181   0.794
   21   1HD   LYS   3          1HD       LYS   3 -14.130   2.417   3.120
   22   2HD   LYS   3          2HD       LYS   3 -14.352   1.295   1.792
   23   1HE   LYS   3          1HE       LYS   3 -12.467   0.346   2.764
   24   2HE   LYS   3          2HE       LYS   3 -11.679   1.440   1.645
   25   1HZ   LYS   3          1HZ       LYS   3 -10.731   2.317   3.413
   26   2HZ   LYS   3          2HZ       LYS   3 -12.175   2.933   3.864
   27   3HZ   LYS   3          3HZ       LYS   3 -11.679   1.495   4.459
   28    H    GLU   4           H        GLU   4 -13.521   4.905  -0.374
   29    HA   GLU   4           HA       GLU   4 -12.256   6.772  -1.886
   30   1HB   GLU   4          1HB       GLU   4 -10.094   5.832  -1.461
   31   2HB   GLU   4          2HB       GLU   4 -10.671   4.191  -1.674
   32   1HG   GLU   4          1HG       GLU   4  -9.494   4.732  -3.696
   33   2HG   GLU   4          2HG       GLU   4 -11.196   4.787  -4.109
   34    H    ARG   5           H        ARG   5 -13.018   6.687  -4.054
   35    HA   ARG   5           HA       ARG   5 -15.223   5.024  -4.411
   36   1HB   ARG   5          1HB       ARG   5 -14.425   7.388  -5.499
   37   2HB   ARG   5          2HB       ARG   5 -13.921   6.324  -6.797
   38   1HG   ARG   5          1HG       ARG   5 -16.171   6.957  -7.331
   39   2HG   ARG   5          2HG       ARG   5 -16.279   5.309  -6.745
   40   1HD   ARG   5          1HD       ARG   5 -17.522   5.916  -4.921
   41   2HD   ARG   5          2HD       ARG   5 -16.485   7.280  -4.555
   42    HE   ARG   5           HE       ARG   5 -18.000   7.880  -6.917
   43   1HH1  ARG   5          2HH2      ARG   5 -18.423   7.493  -3.445
   44   2HH1  ARG   5          1HH2      ARG   5 -19.786   8.558  -3.363
   45   1HH2  ARG   5          2HH1      ARG   5 -19.798   9.286  -6.809
   46   2HH2  ARG   5          1HH1      ARG   5 -20.574   9.586  -5.290
   47    H    GLY   6           H        GLY   6 -15.213   2.882  -5.016
   48   1HA   GLY   6          1HA       GLY   6 -14.686   1.010  -6.163
   49   2HA   GLY   6          2HA       GLY   6 -13.645   1.955  -7.209
   50    H    LEU   7           H        LEU   7 -13.761  -0.360  -4.676
   51    HA   LEU   7           HA       LEU   7 -11.003   0.199  -3.884
   52   1HB   LEU   7          1HB       LEU   7 -13.003  -1.727  -2.696
   53   2HB   LEU   7          2HB       LEU   7 -11.418  -1.343  -2.058
   54    HG   LEU   7           HG       LEU   7 -13.211  -0.230  -0.814
   55   1HD1  LEU   7          1HD1      LEU   7 -11.422   1.079  -0.443
   56   2HD1  LEU   7          2HD1      LEU   7 -11.034   1.228  -2.174
   57   3HD1  LEU   7          3HD1      LEU   7 -12.304   2.248  -1.455
   58   1HD2  LEU   7          1HD2      LEU   7 -13.794   1.522  -3.189
   59   2HD2  LEU   7          2HD2      LEU   7 -14.667  -0.010  -2.944
   60   3HD2  LEU   7          3HD2      LEU   7 -14.745   1.267  -1.706
   61    H    ILE   8           H        ILE   8 -10.277  -2.463  -3.168
   62    HA   ILE   8           HA       ILE   8  -9.799  -3.488  -5.845
   63    HB   ILE   8           HB       ILE   8  -8.066  -4.815  -4.798
   64   1HG1  ILE   8          1HG1      ILE   8  -9.067  -3.644  -2.187
   65   2HG1  ILE   8          2HG1      ILE   8  -9.130  -5.327  -2.673
   66   1HG2  ILE   8          1HG2      ILE   8  -6.951  -2.946  -5.320
   67   2HG2  ILE   8          2HG2      ILE   8  -8.202  -1.886  -4.627
   68   3HG2  ILE   8          3HG2      ILE   8  -6.972  -2.620  -3.571
   69   1HD1  ILE   8          1HD1      ILE   8  -6.944  -3.878  -1.438
   70   2HD1  ILE   8          2HD1      ILE   8  -7.073  -5.620  -1.780
   71   3HD1  ILE   8          3HD1      ILE   8  -6.414  -4.518  -3.013
   72    H    SER   9           H        SER   9 -12.444  -3.660  -4.277
   73    HA   SER   9           HA       SER   9 -14.016  -5.105  -3.874
   74   1HB   SER   9          1HB       SER   9 -12.769  -5.915  -6.323
   75   2HB   SER   9          2HB       SER   9 -13.191  -7.384  -5.464
   76    HG   SER   9           HG       SER   9 -15.174  -7.048  -6.184
   77    HA   PRO  10           HA       PRO  10 -12.795  -8.229  -1.088
   78   1HB   PRO  10          1HB       PRO  10 -14.638 -10.233  -1.324
   79   2HB   PRO  10          2HB       PRO  10 -14.949  -8.742  -0.458
   80   1HG   PRO  10          1HG       PRO  10 -15.931  -9.580  -3.117
   81   2HG   PRO  10          2HG       PRO  10 -16.549  -8.322  -2.065
   82   1HD   PRO  10          1HD       PRO  10 -14.950  -7.959  -4.419
   83   2HD   PRO  10          2HD       PRO  10 -15.471  -6.712  -3.303
   84    H    SER  11           H        SER  11 -12.410  -8.749  -4.287
   85    HA   SER  11           HA       SER  11 -11.550 -11.449  -4.081
   86   1HB   SER  11          1HB       SER  11 -12.095  -9.532  -6.177
   87   2HB   SER  11          2HB       SER  11 -10.492 -10.192  -6.436
   88    HG   SER  11           HG       SER  11 -11.979 -11.560  -7.475
   89    H    ASP  12           H        ASP  12  -9.968  -8.210  -4.541
   90    HA   ASP  12           HA       ASP  12  -7.384  -9.325  -4.402
   91   1HB   ASP  12          1HB       ASP  12  -8.473  -6.913  -5.223
   92   2HB   ASP  12          2HB       ASP  12  -7.733  -6.448  -3.705
   93    H    PHE  13           H        PHE  13  -9.737  -7.807  -2.160
   94    HA   PHE  13           HA       PHE  13  -8.012  -7.284  -0.041
   95   1HB   PHE  13          1HB       PHE  13 -10.686  -6.954  -0.694
   96   2HB   PHE  13          2HB       PHE  13 -10.823  -8.281   0.442
   97    HD1  PHE  13           1HD      PHE  13 -10.883  -4.827   0.158
   98    HD2  PHE  13           2HD      PHE  13  -9.381  -7.888   2.684
   99    HE1  PHE  13           1HE      PHE  13 -10.782  -3.201   2.068
  100    HE2  PHE  13           2HE      PHE  13  -9.281  -6.263   4.594
  101    HZ   PHE  13           HZ       PHE  13  -9.983  -3.939   4.263
  102    H    ALA  14           H        ALA  14  -9.664 -10.270  -1.114
  103    HA   ALA  14           HA       ALA  14  -9.266 -11.704   1.279
  104   1HB   ALA  14          1HB       ALA  14 -10.420 -12.085  -1.322
  105   2HB   ALA  14          2HB       ALA  14  -9.320 -13.446  -0.992
  106   3HB   ALA  14          3HB       ALA  14 -10.638 -13.070   0.144
  107    H    GLN  15           H        GLN  15  -7.457 -11.595  -1.869
  108    HA   GLN  15           HA       GLN  15  -5.531 -13.396  -1.216
  109   1HB   GLN  15          1HB       GLN  15  -6.040 -11.630  -3.320
  110   2HB   GLN  15          2HB       GLN  15  -4.487 -11.081  -2.722
  111   1HG   GLN  15          1HG       GLN  15  -3.957 -12.755  -4.340
  112   2HG   GLN  15          2HG       GLN  15  -3.725 -13.543  -2.792
  113   1HE2  GLN  15          1HE2      GLN  15  -3.958 -15.467  -4.142
  114   2HE2  GLN  15          2HE2      GLN  15  -5.535 -16.118  -4.442
  115    H    LEU  16           H        LEU  16  -5.400  -9.785  -0.785
  116    HA   LEU  16           HA       LEU  16  -2.931  -9.654   0.405
  117   1HB   LEU  16          1HB       LEU  16  -4.462  -7.805  -0.406
  118   2HB   LEU  16          2HB       LEU  16  -5.298  -7.932   1.129
  119    HG   LEU  16           HG       LEU  16  -3.883  -6.311   1.763
  120   1HD1  LEU  16          1HD1      LEU  16  -1.992  -8.673   1.907
  121   2HD1  LEU  16          2HD1      LEU  16  -1.745  -7.114   2.731
  122   3HD1  LEU  16          3HD1      LEU  16  -3.141  -8.134   3.155
  123   1HD2  LEU  16          1HD2      LEU  16  -1.511  -6.135   0.643
  124   2HD2  LEU  16          2HD2      LEU  16  -2.256  -7.172  -0.598
  125   3HD2  LEU  16          3HD2      LEU  16  -2.972  -5.588  -0.214
  126    H    GLN  17           H        GLN  17  -6.150 -10.360   1.869
  127    HA   GLN  17           HA       GLN  17  -5.196 -10.384   4.486
  128   1HB   GLN  17          1HB       GLN  17  -7.680 -10.707   3.162
  129   2HB   GLN  17          2HB       GLN  17  -7.454 -12.191   4.067
  130   1HG   GLN  17          1HG       GLN  17  -7.685 -11.144   6.095
  131   2HG   GLN  17          2HG       GLN  17  -6.718  -9.767   5.607
  132   1HE2  GLN  17          1HE2      GLN  17  -9.863 -11.320   5.058
  133   2HE2  GLN  17          2HE2      GLN  17 -10.799  -9.875   4.872
  134    H    LYS  18           H        LYS  18  -6.018 -13.124   2.232
  135    HA   LYS  18           HA       LYS  18  -5.208 -15.181   3.839
  136   1HB   LYS  18          1HB       LYS  18  -6.419 -15.332   1.654
  137   2HB   LYS  18          2HB       LYS  18  -4.905 -15.025   0.827
  138   1HG   LYS  18          1HG       LYS  18  -4.910 -17.219   2.885
  139   2HG   LYS  18          2HG       LYS  18  -5.776 -17.530   1.394
  140   1HD   LYS  18          1HD       LYS  18  -3.350 -16.357   0.546
  141   2HD   LYS  18          2HD       LYS  18  -2.876 -17.402   1.870
  142   1HE   LYS  18          1HE       LYS  18  -4.832 -18.612  -0.034
  143   2HE   LYS  18          2HE       LYS  18  -3.261 -18.257  -0.724
  144   1HZ   LYS  18          1HZ       LYS  18  -3.958 -20.303   1.045
  145   2HZ   LYS  18          2HZ       LYS  18  -2.539 -20.064   0.272
  146   3HZ   LYS  18          3HZ       LYS  18  -2.797 -19.385   1.735
  147    H    TYR  19           H        TYR  19  -3.214 -13.266   1.493
  148    HA   TYR  19           HA       TYR  19  -0.832 -14.628   1.966
  149   1HB   TYR  19          1HB       TYR  19  -1.779 -11.884   1.033
  150   2HB   TYR  19          2HB       TYR  19  -0.060 -12.097   1.294
  151    HD1  TYR  19           1HD      TYR  19   0.376 -14.866   0.324
  152    HD2  TYR  19           2HD      TYR  19  -2.038 -11.721  -1.285
  153    HE1  TYR  19           1HE      TYR  19   0.599 -15.874  -2.000
  154    HE2  TYR  19           2HE      TYR  19  -1.807 -12.740  -3.603
  155    HH   TYR  19           HH       TYR  19  -0.835 -15.819  -4.129
  156    H    MET  20           H        MET  20  -2.310 -11.760   3.588
  157    HA   MET  20           HA       MET  20  -0.077 -11.202   5.152
  158   1HB   MET  20          1HB       MET  20  -1.900  -9.574   4.790
  159   2HB   MET  20          2HB       MET  20  -3.073 -10.657   5.514
  160   1HG   MET  20          1HG       MET  20  -1.714 -10.520   7.689
  161   2HG   MET  20          2HG       MET  20  -0.758  -9.260   6.934
  162   1HE   MET  20          1HE       MET  20  -1.784  -7.570   5.541
  163   2HE   MET  20          2HE       MET  20  -3.539  -7.322   5.377
  164   3HE   MET  20          3HE       MET  20  -2.604  -6.333   6.524
  165    H    GLU  21           H        GLU  21  -3.085 -13.117   5.802
  166    HA   GLU  21           HA       GLU  21  -2.682 -13.656   8.418
  167   1HB   GLU  21          1HB       GLU  21  -4.089 -14.971   6.158
  168   2HB   GLU  21          2HB       GLU  21  -3.713 -16.049   7.487
  169   1HG   GLU  21          1HG       GLU  21  -4.648 -13.767   8.804
  170   2HG   GLU  21          2HG       GLU  21  -5.653 -13.817   7.370
  171    H    TYR  22           H        TYR  22  -1.449 -15.570   5.586
  172    HA   TYR  22           HA       TYR  22  -0.142 -17.539   6.981
  173   1HB   TYR  22          1HB       TYR  22  -0.495 -16.651   4.363
  174   2HB   TYR  22          2HB       TYR  22   1.195 -16.253   4.596
  175    HD1  TYR  22           1HD      TYR  22  -1.194 -19.115   4.978
  176    HD2  TYR  22           2HD      TYR  22   2.828 -17.878   4.203
  177    HE1  TYR  22           1HE      TYR  22  -0.548 -21.517   4.455
  178    HE2  TYR  22           2HE      TYR  22   3.460 -20.285   3.683
  179    HH   TYR  22           HH       TYR  22   0.998 -22.832   3.668
  180    H    SER  23           H        SER  23   0.937 -14.195   6.193
  181    HA   SER  23           HA       SER  23   3.540 -14.690   7.202
  182   1HB   SER  23          1HB       SER  23   2.817 -12.959   5.415
  183   2HB   SER  23          2HB       SER  23   2.258 -11.970   6.749
  184    HG   SER  23           HG       SER  23   4.845 -12.420   5.846
  185    H    THR  24           H        THR  24   4.346 -12.850   8.922
  186    HA   THR  24           HA       THR  24   2.338 -12.464  10.997
  187    HB   THR  24           HB       THR  24   3.682 -14.770  11.150
  188    HG1  THR  24           1HG      THR  24   3.285 -14.471  13.404
  189   1HG2  THR  24          1HG2      THR  24   5.518 -13.259  12.930
  190   2HG2  THR  24          2HG2      THR  24   5.856 -14.671  11.901
  191   3HG2  THR  24          3HG2      THR  24   5.867 -13.035  11.199
  192    H    LYS  25           H        LYS  25   4.135 -10.937   8.970
  193    HA   LYS  25           HA       LYS  25   5.769  -9.424  10.826
  194   1HB   LYS  25          1HB       LYS  25   5.474  -9.540   7.834
  195   2HB   LYS  25          2HB       LYS  25   6.235  -8.152   8.585
  196   1HG   LYS  25          1HG       LYS  25   7.901  -9.584   9.687
  197   2HG   LYS  25          2HG       LYS  25   7.080 -11.033   9.141
  198   1HD   LYS  25          1HD       LYS  25   8.139 -10.968   7.133
  199   2HD   LYS  25          2HD       LYS  25   7.634  -9.313   6.855
  200   1HE   LYS  25          1HE       LYS  25   9.909  -8.927   6.974
  201   2HE   LYS  25          2HE       LYS  25   9.562  -8.814   8.688
  202   1HZ   LYS  25          1HZ       LYS  25   9.992 -11.283   8.712
  203   2HZ   LYS  25          2HZ       LYS  25  10.649 -11.103   7.227
  204   3HZ   LYS  25          3HZ       LYS  25  11.292 -10.317   8.506
  205    H    LYS  26           H        LYS  26   5.611  -6.843  10.051
  206    HA   LYS  26           HA       LYS  26   2.770  -6.155  10.145
  207   1HB   LYS  26          1HB       LYS  26   4.890  -5.400  12.149
  208   2HB   LYS  26          2HB       LYS  26   3.530  -4.337  11.850
  209   1HG   LYS  26          1HG       LYS  26   2.499  -7.020  12.104
  210   2HG   LYS  26          2HG       LYS  26   3.602  -6.746  13.439
  211   1HD   LYS  26          1HD       LYS  26   2.389  -4.769  14.158
  212   2HD   LYS  26          2HD       LYS  26   1.441  -4.733  12.685
  213   1HE   LYS  26          1HE       LYS  26  -0.136  -5.938  13.793
  214   2HE   LYS  26          2HE       LYS  26   0.952  -7.308  13.689
  215   1HZ   LYS  26          1HZ       LYS  26   1.500  -7.101  15.824
  216   2HZ   LYS  26          2HZ       LYS  26   1.541  -5.469  15.806
  217   3HZ   LYS  26          3HZ       LYS  26   0.115  -6.249  15.964
  218    H    VAL  27           H        VAL  27   2.241  -4.205   9.096
  219    HA   VAL  27           HA       VAL  27   3.950  -3.477   7.011
  220    HB   VAL  27           HB       VAL  27   1.457  -3.320   7.101
  221   1HG1  VAL  27          1HG1      VAL  27   0.323  -1.625   8.237
  222   2HG1  VAL  27          2HG1      VAL  27   1.559  -2.136   9.413
  223   3HG1  VAL  27          3HG1      VAL  27   1.796  -0.650   8.461
  224   1HG2  VAL  27          1HG2      VAL  27   2.772  -0.694   6.347
  225   2HG2  VAL  27          2HG2      VAL  27   2.919  -2.184   5.385
  226   3HG2  VAL  27          3HG2      VAL  27   1.322  -1.438   5.631
  227    H    SER  28           H        SER  28   3.413  -2.171  10.303
  228    HA   SER  28           HA       SER  28   4.740   0.221   9.922
  229   1HB   SER  28          1HB       SER  28   3.591  -1.264  12.098
  230   2HB   SER  28          2HB       SER  28   5.191  -0.758  12.602
  231    HG   SER  28           HG       SER  28   4.647   1.429  12.148
  232    H    ASP  29           H        ASP  29   5.884  -3.088  10.220
  233    HA   ASP  29           HA       ASP  29   8.468  -2.411  11.128
  234   1HB   ASP  29          1HB       ASP  29   6.943  -4.787  10.557
  235   2HB   ASP  29          2HB       ASP  29   8.432  -4.897   9.640
  236    H    VAL  30           H        VAL  30   6.882  -3.195   7.966
  237    HA   VAL  30           HA       VAL  30   9.313  -2.990   6.487
  238    HB   VAL  30           HB       VAL  30   6.404  -3.053   5.660
  239   1HG1  VAL  30          1HG1      VAL  30   7.255  -2.300   3.698
  240   2HG1  VAL  30          2HG1      VAL  30   8.917  -2.789   4.104
  241   3HG1  VAL  30          3HG1      VAL  30   7.755  -3.998   3.508
  242   1HG2  VAL  30          1HG2      VAL  30   8.218  -5.088   6.615
  243   2HG2  VAL  30          2HG2      VAL  30   6.495  -5.218   6.186
  244   3HG2  VAL  30          3HG2      VAL  30   7.742  -5.430   4.934
  245    H    LEU  31           H        LEU  31   6.819  -0.793   7.663
  246    HA   LEU  31           HA       LEU  31   7.166   1.250   5.785
  247   1HB   LEU  31          1HB       LEU  31   5.625   0.749   8.068
  248   2HB   LEU  31          2HB       LEU  31   6.536   2.198   8.446
  249    HG   LEU  31           HG       LEU  31   5.669   2.832   5.953
  250   1HD1  LEU  31          1HD1      LEU  31   4.343   0.531   6.207
  251   2HD1  LEU  31          2HD1      LEU  31   3.177   1.602   7.021
  252   3HD1  LEU  31          3HD1      LEU  31   3.672   1.936   5.344
  253   1HD2  LEU  31          1HD2      LEU  31   5.470   4.332   7.783
  254   2HD2  LEU  31          2HD2      LEU  31   3.832   4.099   7.126
  255   3HD2  LEU  31          3HD2      LEU  31   4.317   3.267   8.623
  256    H    LYS  32           H        LYS  32   8.687   0.688   9.032
  257    HA   LYS  32           HA       LYS  32  10.319   2.938   8.955
  258   1HB   LYS  32          1HB       LYS  32  11.529   1.887  10.763
  259   2HB   LYS  32          2HB       LYS  32   9.810   1.625  10.977
  260   1HG   LYS  32          1HG       LYS  32   9.994  -0.645  10.729
  261   2HG   LYS  32          2HG       LYS  32  11.100  -0.505   9.377
  262   1HD   LYS  32          1HD       LYS  32  12.572  -1.385  10.934
  263   2HD   LYS  32          2HD       LYS  32  12.799   0.315  11.294
  264   1HE   LYS  32          1HE       LYS  32  11.675   0.189  13.315
  265   2HE   LYS  32          2HE       LYS  32  10.530  -1.002  12.732
  266   1HZ   LYS  32          1HZ       LYS  32  13.341  -1.696  13.140
  267   2HZ   LYS  32          2HZ       LYS  32  12.270  -1.750  14.371
  268   3HZ   LYS  32          3HZ       LYS  32  12.051  -2.695  13.058
  269    H    LEU  33           H        LEU  33  10.513  -0.179   7.311
  270    HA   LEU  33           HA       LEU  33  13.286  -0.048   6.756
  271   1HB   LEU  33          1HB       LEU  33  10.956  -1.679   5.886
  272   2HB   LEU  33          2HB       LEU  33  12.363  -1.663   4.842
  273    HG   LEU  33           HG       LEU  33  12.425  -2.398   7.781
  274   1HD1  LEU  33          1HD1      LEU  33  11.092  -3.934   6.222
  275   2HD1  LEU  33          2HD1      LEU  33  12.662  -4.340   5.486
  276   3HD1  LEU  33          3HD1      LEU  33  12.376  -4.669   7.212
  277   1HD2  LEU  33          1HD2      LEU  33  14.565  -1.596   7.127
  278   2HD2  LEU  33          2HD2      LEU  33  14.658  -3.374   7.150
  279   3HD2  LEU  33          3HD2      LEU  33  14.518  -2.510   5.600
  280    H    PHE  34           H        PHE  34  10.299   1.110   5.136
  281    HA   PHE  34           HA       PHE  34  11.771   1.979   2.832
  282   1HB   PHE  34          1HB       PHE  34   8.968   1.840   3.903
  283   2HB   PHE  34          2HB       PHE  34   9.254   3.212   2.851
  284    HD1  PHE  34           1HD      PHE  34   8.544  -0.274   2.999
  285    HD2  PHE  34           2HD      PHE  34  10.230   2.732   0.524
  286    HE1  PHE  34           1HE      PHE  34   8.227  -1.748   0.992
  287    HE2  PHE  34           2HE      PHE  34   9.912   1.259  -1.483
  288    HZ   PHE  34           HZ       PHE  34   8.914  -0.964  -1.225
  289    H    GLU  35           H        GLU  35  11.228   3.176   6.012
  290    HA   GLU  35           HA       GLU  35  11.235   5.926   5.196
  291   1HB   GLU  35          1HB       GLU  35  10.330   6.270   7.238
  292   2HB   GLU  35          2HB       GLU  35  10.308   4.530   7.445
  293   1HG   GLU  35          1HG       GLU  35  12.537   4.568   8.486
  294   2HG   GLU  35          2HG       GLU  35  12.713   6.278   8.143
  295    H    ASP  36           H        ASP  36  13.388   3.636   7.015
  296    HA   ASP  36           HA       ASP  36  15.562   5.473   6.377
  297   1HB   ASP  36          1HB       ASP  36  14.804   4.055   8.879
  298   2HB   ASP  36          2HB       ASP  36  16.500   3.898   8.468
  299    H    GLY  37           H        GLY  37  14.303   2.133   6.651
  300   1HA   GLY  37          1HA       GLY  37  16.570   0.620   6.216
  301   2HA   GLY  37          2HA       GLY  37  14.946   0.195   5.713
  302    H    GLU  38           H        GLU  38  17.217  -0.557   4.193
  303    HA   GLU  38           HA       GLU  38  18.025   1.162   2.262
  304   1HB   GLU  38          1HB       GLU  38  18.883  -0.713   1.174
  305   2HB   GLU  38          2HB       GLU  38  18.652  -1.345   2.792
  306   1HG   GLU  38          1HG       GLU  38  16.181  -1.876   1.759
  307   2HG   GLU  38          2HG       GLU  38  17.121  -1.938   0.282
  308    H    MET  39           H        MET  39  14.852  -0.194   2.767
  309    HA   MET  39           HA       MET  39  14.000  -0.083   0.091
  310   1HB   MET  39          1HB       MET  39  12.544  -0.081   2.788
  311   2HB   MET  39          2HB       MET  39  11.683  -0.147   1.263
  312   1HG   MET  39          1HG       MET  39  13.770  -2.176   2.200
  313   2HG   MET  39          2HG       MET  39  12.036  -2.426   2.218
  314   1HE   MET  39          1HE       MET  39  11.370  -0.758  -0.662
  315   2HE   MET  39          2HE       MET  39  11.113  -2.269  -1.566
  316   3HE   MET  39          3HE       MET  39  10.548  -2.131   0.116
  317    H    ALA  40           H        ALA  40  14.966   2.380   2.141
  318    HA   ALA  40           HA       ALA  40  12.880   4.258   1.498
  319   1HB   ALA  40          1HB       ALA  40  14.340   5.824   2.757
  320   2HB   ALA  40          2HB       ALA  40  14.026   4.328   3.669
  321   3HB   ALA  40          3HB       ALA  40  15.591   4.562   2.854
  322    H    LYS  41           H        LYS  41  15.319   2.813  -0.264
  323    HA   LYS  41           HA       LYS  41  16.380   5.128  -1.550
  324   1HB   LYS  41          1HB       LYS  41  17.609   3.602  -2.879
  325   2HB   LYS  41          2HB       LYS  41  17.561   2.921  -1.266
  326   1HG   LYS  41          1HG       LYS  41  15.760   1.378  -1.902
  327   2HG   LYS  41          2HG       LYS  41  15.594   2.145  -3.468
  328   1HD   LYS  41          1HD       LYS  41  17.077   0.613  -4.253
  329   2HD   LYS  41          2HD       LYS  41  18.317   1.493  -3.382
  330   1HE   LYS  41          1HE       LYS  41  18.256   0.015  -1.526
  331   2HE   LYS  41          2HE       LYS  41  16.645  -0.560  -1.907
  332   1HZ   LYS  41          1HZ       LYS  41  18.811  -1.030  -3.796
  333   2HZ   LYS  41          2HZ       LYS  41  18.668  -1.990  -2.483
  334   3HZ   LYS  41          3HZ       LYS  41  17.445  -1.894  -3.562
  335    H    TYR  42           H        TYR  42  13.428   3.324  -1.726
  336    HA   TYR  42           HA       TYR  42  12.900   4.455  -4.389
  337   1HB   TYR  42          1HB       TYR  42  11.707   2.135  -2.746
  338   2HB   TYR  42          2HB       TYR  42  11.091   2.613  -4.316
  339    HD1  TYR  42           1HD      TYR  42  13.692   3.119  -5.754
  340    HD2  TYR  42           2HD      TYR  42  12.485  -0.052  -3.148
  341    HE1  TYR  42           1HE      TYR  42  15.353   1.554  -6.876
  342    HE2  TYR  42           2HE      TYR  42  14.149  -1.606  -4.279
  343    HH   TYR  42           HH       TYR  42  16.263  -0.404  -6.871
  344    H    VAL  43           H        VAL  43  12.773   6.205  -2.183
  345    HA   VAL  43           HA       VAL  43   9.887   6.657  -2.112
  346    HB   VAL  43           HB       VAL  43  11.753   6.670   0.267
  347   1HG1  VAL  43          1HG1      VAL  43  10.246   7.834   1.507
  348   2HG1  VAL  43          2HG1      VAL  43   9.799   8.500  -0.082
  349   3HG1  VAL  43          3HG1      VAL  43   8.846   7.175   0.628
  350   1HG2  VAL  43          1HG2      VAL  43   9.932   5.059   1.129
  351   2HG2  VAL  43          2HG2      VAL  43   9.447   4.913  -0.577
  352   3HG2  VAL  43          3HG2      VAL  43  11.090   4.445  -0.076
  353    H    GLN  44           H        GLN  44   9.351   8.759  -2.552
  354    HA   GLN  44           HA       GLN  44  11.620  10.552  -2.839
  355   1HB   GLN  44          1HB       GLN  44   8.865  10.481  -4.122
  356   2HB   GLN  44          2HB       GLN  44   9.890  11.899  -4.230
  357   1HG   GLN  44          1HG       GLN  44  11.685   9.935  -4.941
  358   2HG   GLN  44          2HG       GLN  44  10.195   9.232  -5.539
  359   1HE2  GLN  44          1HE2      GLN  44   9.140  10.099  -7.249
  360   2HE2  GLN  44          2HE2      GLN  44   9.737  11.403  -8.220
  361    H    GLY  45           H        GLY  45  11.687  11.004  -0.502
  362   1HA   GLY  45          1HA       GLY  45  11.327  12.521   1.143
  363   2HA   GLY  45          2HA       GLY  45  10.067  13.270   0.183
  364    H    ASP  46           H        ASP  46   7.891  12.760   0.543
  365    HA   ASP  46           HA       ASP  46   7.482  10.803   2.665
  366   1HB   ASP  46          1HB       ASP  46   6.901  13.450   2.814
  367   2HB   ASP  46          2HB       ASP  46   5.424  12.909   2.042
  368    H    ALA  47           H        ALA  47   7.493  10.796  -0.501
  369    HA   ALA  47           HA       ALA  47   4.898   9.452  -0.746
  370   1HB   ALA  47          1HB       ALA  47   6.007  10.966  -3.085
  371   2HB   ALA  47          2HB       ALA  47   4.316  10.625  -2.645
  372   3HB   ALA  47          3HB       ALA  47   5.221  11.895  -1.787
  373    H    ILE  48           H        ILE  48   4.954   7.520  -1.908
  374    HA   ILE  48           HA       ILE  48   7.637   6.741  -2.817
  375    HB   ILE  48           HB       ILE  48   7.097   5.460  -0.924
  376   1HG1  ILE  48          1HG1      ILE  48   6.434   3.816  -3.385
  377   2HG1  ILE  48          2HG1      ILE  48   8.046   4.204  -2.817
  378   1HG2  ILE  48          1HG2      ILE  48   4.877   4.033  -1.076
  379   2HG2  ILE  48          2HG2      ILE  48   4.880   5.684  -0.412
  380   3HG2  ILE  48          3HG2      ILE  48   4.344   5.399  -2.085
  381   1HD1  ILE  48          1HD1      ILE  48   7.953   2.334  -1.541
  382   2HD1  ILE  48          2HD1      ILE  48   6.730   3.156  -0.543
  383   3HD1  ILE  48          3HD1      ILE  48   6.222   2.117  -1.896
  384    H    GLY  49           H        GLY  49   7.700   5.254  -4.697
  385   1HA   GLY  49          1HA       GLY  49   5.706   6.083  -6.660
  386   2HA   GLY  49          2HA       GLY  49   7.245   5.301  -6.963
  387    H    TYR  50           H        TYR  50   5.662   4.015  -8.438
  388    HA   TYR  50           HA       TYR  50   3.856   2.217  -7.217
  389   1HB   TYR  50          1HB       TYR  50   3.713   2.900  -9.588
  390   2HB   TYR  50          2HB       TYR  50   5.382   2.452  -9.875
  391    HD1  TYR  50           1HD      TYR  50   5.964   0.254 -10.567
  392    HD2  TYR  50           2HD      TYR  50   2.004   1.061  -9.161
  393    HE1  TYR  50           1HE      TYR  50   5.205  -2.036 -11.369
  394    HE2  TYR  50           2HE      TYR  50   1.259  -1.232  -9.967
  395    HH   TYR  50           HH       TYR  50   2.359  -2.864 -12.020
  396    H    GLU  51           H        GLU  51   7.250   1.899  -8.450
  397    HA   GLU  51           HA       GLU  51   7.539  -0.769  -8.145
  398   1HB   GLU  51          1HB       GLU  51   9.209   1.423  -8.658
  399   2HB   GLU  51          2HB       GLU  51   9.911   0.713  -7.218
  400   1HG   GLU  51          1HG       GLU  51   9.234  -1.475  -8.932
  401   2HG   GLU  51          2HG       GLU  51   9.985  -0.269  -9.958
  402    H    GLY  52           H        GLY  52   8.251   1.777  -5.645
  403   1HA   GLY  52          1HA       GLY  52   8.976   0.080  -3.574
  404   2HA   GLY  52          2HA       GLY  52   8.287   1.682  -3.401
  405    H    PHE  53           H        PHE  53   5.799   0.769  -4.987
  406    HA   PHE  53           HA       PHE  53   4.348  -0.091  -2.681
  407   1HB   PHE  53          1HB       PHE  53   3.880   1.388  -4.993
  408   2HB   PHE  53          2HB       PHE  53   3.179  -0.149  -5.460
  409    HD1  PHE  53           1HD      PHE  53   1.555  -1.201  -3.633
  410    HD2  PHE  53           2HD      PHE  53   2.522   2.921  -3.931
  411    HE1  PHE  53           1HE      PHE  53  -0.550  -0.617  -2.397
  412    HE2  PHE  53           2HE      PHE  53   0.417   3.504  -2.694
  413    HZ   PHE  53           HZ       PHE  53  -1.094   1.728  -1.942
  414    H    GLN  54           H        GLN  54   4.917  -1.451  -6.009
  415    HA   GLN  54           HA       GLN  54   3.682  -3.882  -5.335
  416   1HB   GLN  54          1HB       GLN  54   4.709  -4.654  -7.528
  417   2HB   GLN  54          2HB       GLN  54   3.710  -3.218  -7.645
  418   1HG   GLN  54          1HG       GLN  54   5.459  -2.103  -8.554
  419   2HG   GLN  54          2HG       GLN  54   6.332  -2.275  -7.045
  420   1HE2  GLN  54          1HE2      GLN  54   7.126  -2.365  -9.925
  421   2HE2  GLN  54          2HE2      GLN  54   8.031  -3.828 -10.129
  422    H    GLN  55           H        GLN  55   7.017  -2.618  -5.217
  423    HA   GLN  55           HA       GLN  55   8.169  -5.173  -4.830
  424   1HB   GLN  55          1HB       GLN  55   9.210  -2.878  -5.683
  425   2HB   GLN  55          2HB       GLN  55   9.517  -2.607  -3.979
  426   1HG   GLN  55          1HG       GLN  55  10.279  -5.296  -5.096
  427   2HG   GLN  55          2HG       GLN  55  11.261  -3.926  -5.576
  428   1HE2  GLN  55          1HE2      GLN  55  12.321  -2.671  -3.995
  429   2HE2  GLN  55          2HE2      GLN  55  12.715  -3.306  -2.433
  430    H    PHE  56           H        PHE  56   6.528  -2.830  -2.823
  431    HA   PHE  56           HA       PHE  56   7.784  -3.471  -0.379
  432   1HB   PHE  56          1HB       PHE  56   6.547  -1.461  -0.321
  433   2HB   PHE  56          2HB       PHE  56   5.355  -2.055  -1.459
  434    HD1  PHE  56           1HD      PHE  56   3.455  -3.410  -0.674
  435    HD2  PHE  56           2HD      PHE  56   6.250  -1.746   2.051
  436    HE1  PHE  56           1HE      PHE  56   1.848  -3.802   1.214
  437    HE2  PHE  56           2HE      PHE  56   4.643  -2.137   3.938
  438    HZ   PHE  56           HZ       PHE  56   2.461  -3.161   3.497
  439    H    LEU  57           H        LEU  57   4.933  -4.750  -2.164
  440    HA   LEU  57           HA       LEU  57   3.826  -6.255  -0.134
  441   1HB   LEU  57          1HB       LEU  57   3.896  -6.532  -3.125
  442   2HB   LEU  57          2HB       LEU  57   3.080  -7.720  -2.128
  443    HG   LEU  57           HG       LEU  57   2.131  -5.226  -1.228
  444   1HD1  LEU  57          1HD1      LEU  57   3.181  -4.509  -3.525
  445   2HD1  LEU  57          2HD1      LEU  57   1.707  -5.251  -4.193
  446   3HD1  LEU  57          3HD1      LEU  57   1.579  -3.911  -3.028
  447   1HD2  LEU  57          1HD2      LEU  57   0.137  -6.232  -1.472
  448   2HD2  LEU  57          2HD2      LEU  57   0.449  -6.681  -3.166
  449   3HD2  LEU  57          3HD2      LEU  57   1.114  -7.672  -1.845
  450    H    LYS  58           H        LYS  58   6.860  -6.622  -1.827
  451    HA   LYS  58           HA       LYS  58   7.135  -9.410  -1.469
  452   1HB   LYS  58          1HB       LYS  58   8.397  -8.163  -3.148
  453   2HB   LYS  58          2HB       LYS  58   9.194  -7.225  -1.901
  454   1HG   LYS  58          1HG       LYS  58  10.773  -8.835  -1.694
  455   2HG   LYS  58          2HG       LYS  58   9.545  -9.980  -1.192
  456   1HD   LYS  58          1HD       LYS  58   9.331 -10.911  -3.315
  457   2HD   LYS  58          2HD       LYS  58   9.714  -9.411  -4.135
  458   1HE   LYS  58          1HE       LYS  58  11.508 -11.225  -4.300
  459   2HE   LYS  58          2HE       LYS  58  12.077  -9.666  -3.738
  460   1HZ   LYS  58          1HZ       LYS  58  11.905 -10.482  -1.485
  461   2HZ   LYS  58          2HZ       LYS  58  11.371 -11.934  -2.007
  462   3HZ   LYS  58          3HZ       LYS  58  12.888 -11.444  -2.365
  463    H    ILE  59           H        ILE  59   8.593  -6.591   0.311
  464    HA   ILE  59           HA       ILE  59   9.484  -8.301   2.407
  465    HB   ILE  59           HB       ILE  59   9.272  -5.292   2.390
  466   1HG1  ILE  59          1HG1      ILE  59  11.853  -5.776   1.732
  467   2HG1  ILE  59          2HG1      ILE  59  11.085  -7.118   0.906
  468   1HG2  ILE  59          1HG2      ILE  59  11.516  -6.657   3.731
  469   2HG2  ILE  59          2HG2      ILE  59  10.524  -5.275   4.254
  470   3HG2  ILE  59          3HG2      ILE  59   9.916  -6.936   4.457
  471   1HD1  ILE  59          1HD1      ILE  59  10.245  -5.754  -0.698
  472   2HD1  ILE  59          2HD1      ILE  59   9.545  -4.660   0.519
  473   3HD1  ILE  59          3HD1      ILE  59  11.236  -4.451   0.003
  474    H    TYR  60           H        TYR  60   6.807  -5.902   1.983
  475    HA   TYR  60           HA       TYR  60   5.740  -5.794   4.431
  476   1HB   TYR  60          1HB       TYR  60   4.819  -4.745   2.360
  477   2HB   TYR  60          2HB       TYR  60   4.461  -6.320   1.680
  478    HD1  TYR  60           1HD      TYR  60   2.124  -6.021   1.304
  479    HD2  TYR  60           2HD      TYR  60   3.765  -5.335   5.195
  480    HE1  TYR  60           1HE      TYR  60  -0.221  -5.905   2.280
  481    HE2  TYR  60           2HE      TYR  60   1.415  -5.221   6.158
  482    HH   TYR  60           HH       TYR  60  -1.419  -5.648   4.051
  483    H    LEU  61           H        LEU  61   4.401  -8.202   2.068
  484    HA   LEU  61           HA       LEU  61   3.423  -9.780   4.244
  485   1HB   LEU  61          1HB       LEU  61   3.462 -10.434   1.299
  486   2HB   LEU  61          2HB       LEU  61   2.456 -11.158   2.537
  487    HG   LEU  61           HG       LEU  61   1.947  -8.369   2.625
  488   1HD1  LEU  61          1HD1      LEU  61   2.724  -7.849   0.515
  489   2HD1  LEU  61          2HD1      LEU  61   2.277  -9.434  -0.162
  490   3HD1  LEU  61          3HD1      LEU  61   1.015  -8.229   0.193
  491   1HD2  LEU  61          1HD2      LEU  61   0.536 -10.691   2.798
  492   2HD2  LEU  61          2HD2      LEU  61  -0.185  -9.068   2.681
  493   3HD2  LEU  61          3HD2      LEU  61  -0.008 -10.070   1.221
  494    H    GLU  62           H        GLU  62   6.403  -9.489   2.521
  495    HA   GLU  62           HA       GLU  62   8.296 -10.539   2.825
  496   1HB   GLU  62          1HB       GLU  62   7.354 -11.111   5.162
  497   2HB   GLU  62          2HB       GLU  62   6.933 -12.680   4.503
  498   1HG   GLU  62          1HG       GLU  62   9.716 -11.859   3.886
  499   2HG   GLU  62          2HG       GLU  62   9.401 -12.001   5.604
  500    H    VAL  63           H        VAL  63   5.851 -11.339   0.984
  501    HA   VAL  63           HA       VAL  63   6.260 -14.054   0.339
  502    HB   VAL  63           HB       VAL  63   5.038 -13.345  -1.772
  503   1HG1  VAL  63          1HG1      VAL  63   2.922 -13.230  -0.656
  504   2HG1  VAL  63          2HG1      VAL  63   3.986 -14.266   0.324
  505   3HG1  VAL  63          3HG1      VAL  63   3.670 -12.588   0.826
  506   1HG2  VAL  63          1HG2      VAL  63   5.864 -10.920  -1.530
  507   2HG2  VAL  63          2HG2      VAL  63   4.164 -11.172  -1.994
  508   3HG2  VAL  63          3HG2      VAL  63   4.574 -10.737  -0.318
  509    H    ASP  64           H        ASP  64   6.965 -14.696  -1.998
  510    HA   ASP  64           HA       ASP  64   9.434 -13.235  -2.519
  511   1HB   ASP  64          1HB       ASP  64   8.730 -16.139  -2.428
  512   2HB   ASP  64          2HB       ASP  64   9.777 -15.675  -3.754
  513    H    ASN  65           H        ASN  65   6.290 -13.861  -3.599
  514    HA   ASN  65           HA       ASN  65   6.897 -12.867  -6.181
  515   1HB   ASN  65          1HB       ASN  65   5.237 -15.204  -6.671
  516   2HB   ASN  65          2HB       ASN  65   6.773 -14.793  -7.407
  517   1HD2  ASN  65          1HD2      ASN  65   8.733 -15.379  -6.338
  518   2HD2  ASN  65          2HD2      ASN  65   8.806 -16.760  -5.295
  519    H    VAL  66           H        VAL  66   5.329 -11.233  -6.023
  520    HA   VAL  66           HA       VAL  66   2.704 -11.991  -4.973
  521    HB   VAL  66           HB       VAL  66   4.404  -9.850  -4.470
  522   1HG1  VAL  66          1HG1      VAL  66   2.012  -8.821  -6.030
  523   2HG1  VAL  66          2HG1      VAL  66   3.288  -7.859  -5.246
  524   3HG1  VAL  66          3HG1      VAL  66   3.677  -8.872  -6.656
  525   1HG2  VAL  66          1HG2      VAL  66   3.006  -9.618  -2.734
  526   2HG2  VAL  66          2HG2      VAL  66   1.611  -9.302  -3.794
  527   3HG2  VAL  66          3HG2      VAL  66   2.089 -10.977  -3.427
  528    HA   PRO  67           HA       PRO  67   1.033 -11.704  -8.949
  529   1HB   PRO  67          1HB       PRO  67  -1.611 -11.333  -8.367
  530   2HB   PRO  67          2HB       PRO  67  -0.832 -12.902  -8.326
  531   1HG   PRO  67          1HG       PRO  67  -1.649 -11.179  -6.067
  532   2HG   PRO  67          2HG       PRO  67  -1.271 -12.891  -6.062
  533   1HD   PRO  67          1HD       PRO  67   0.411 -10.760  -5.137
  534   2HD   PRO  67          2HD       PRO  67   0.832 -12.458  -5.240
  535    H    ARG  68           H        ARG  68   1.219 -10.221 -10.499
  536    HA   ARG  68           HA       ARG  68   1.401  -7.584  -9.796
  537   1HB   ARG  68          1HB       ARG  68   2.106  -8.883 -11.987
  538   2HB   ARG  68          2HB       ARG  68   0.508  -8.460 -12.569
  539   1HG   ARG  68          1HG       ARG  68   1.441  -6.038 -11.522
  540   2HG   ARG  68          2HG       ARG  68   2.891  -6.744 -12.208
  541   1HD   ARG  68          1HD       ARG  68   0.392  -6.865 -13.885
  542   2HD   ARG  68          2HD       ARG  68   1.142  -5.293 -13.689
  543    HE   ARG  68           HE       ARG  68   2.124  -7.424 -15.334
  544   1HH1  ARG  68          2HH2      ARG  68   3.298  -4.968 -13.104
  545   2HH1  ARG  68          1HH2      ARG  68   4.859  -4.859 -13.845
  546   1HH2  ARG  68          2HH1      ARG  68   4.185  -7.281 -16.312
  547   2HH2  ARG  68          1HH1      ARG  68   5.367  -6.183 -15.682
  548    H    HIS  69           H        HIS  69  -1.400  -9.596 -10.641
  549    HA   HIS  69           HA       HIS  69  -3.175  -7.614 -11.397
  550   1HB   HIS  69          1HB       HIS  69  -3.698 -10.231  -9.959
  551   2HB   HIS  69          2HB       HIS  69  -4.923  -9.250 -10.739
  552    HD1  HIS  69           1HD      HIS  69  -5.048  -9.295 -13.334
  553    HD2  HIS  69           2HD      HIS  69  -1.968 -11.645 -11.727
  554    HE1  HIS  69           1HE      HIS  69  -4.192 -10.754 -15.244
  555    H    LEU  70           H        LEU  70  -2.201  -8.832  -8.154
  556    HA   LEU  70           HA       LEU  70  -4.124  -7.218  -6.803
  557   1HB   LEU  70          1HB       LEU  70  -3.589  -9.115  -5.638
  558   2HB   LEU  70          2HB       LEU  70  -1.888  -9.040  -6.054
  559    HG   LEU  70           HG       LEU  70  -1.908  -6.889  -4.528
  560   1HD1  LEU  70          1HD1      LEU  70  -4.037  -6.494  -3.845
  561   2HD1  LEU  70          2HD1      LEU  70  -4.502  -8.211  -3.910
  562   3HD1  LEU  70          3HD1      LEU  70  -3.542  -7.600  -2.542
  563   1HD2  LEU  70          1HD2      LEU  70  -0.886  -8.135  -2.906
  564   2HD2  LEU  70          2HD2      LEU  70  -2.098  -9.436  -2.977
  565   3HD2  LEU  70          3HD2      LEU  70  -0.863  -9.301  -4.251
  566    H    SER  71           H        SER  71  -0.634  -6.976  -7.650
  567    HA   SER  71           HA       SER  71  -0.060  -4.763  -6.146
  568   1HB   SER  71          1HB       SER  71   1.807  -5.777  -7.115
  569   2HB   SER  71          2HB       SER  71   1.035  -5.964  -8.677
  570    HG   SER  71           HG       SER  71   1.717  -4.014  -9.291
  571    H    LEU  72           H        LEU  72  -1.220  -4.984  -9.584
  572    HA   LEU  72           HA       LEU  72  -1.288  -2.256 -10.073
  573   1HB   LEU  72          1HB       LEU  72  -1.972  -4.657 -11.384
  574   2HB   LEU  72          2HB       LEU  72  -3.406  -3.650 -11.435
  575    HG   LEU  72           HG       LEU  72  -1.924  -3.423 -13.418
  576   1HD1  LEU  72          1HD1      LEU  72  -3.101  -1.328 -11.834
  577   2HD1  LEU  72          2HD1      LEU  72  -1.679  -0.707 -12.706
  578   3HD1  LEU  72          3HD1      LEU  72  -3.000  -1.493 -13.604
  579   1HD2  LEU  72          1HD2      LEU  72   0.071  -1.683 -12.609
  580   2HD2  LEU  72          2HD2      LEU  72   0.078  -2.941 -11.350
  581   3HD2  LEU  72          3HD2      LEU  72   0.275  -3.392 -13.061
  582    H    ALA  73           H        ALA  73  -3.850  -4.480  -8.801
  583    HA   ALA  73           HA       ALA  73  -5.803  -2.487  -8.564
  584   1HB   ALA  73          1HB       ALA  73  -6.388  -4.378  -6.626
  585   2HB   ALA  73          2HB       ALA  73  -6.847  -4.483  -8.342
  586   3HB   ALA  73          3HB       ALA  73  -5.369  -5.290  -7.764
  587    H    LEU  74           H        LEU  74  -3.091  -3.535  -6.489
  588    HA   LEU  74           HA       LEU  74  -3.968  -2.199  -4.171
  589   1HB   LEU  74          1HB       LEU  74  -1.521  -3.544  -5.136
  590   2HB   LEU  74          2HB       LEU  74  -1.273  -2.324  -3.903
  591    HG   LEU  74           HG       LEU  74  -3.252  -4.591  -3.592
  592   1HD1  LEU  74          1HD1      LEU  74  -0.491  -4.568  -2.379
  593   2HD1  LEU  74          2HD1      LEU  74  -1.653  -5.911  -2.505
  594   3HD1  LEU  74          3HD1      LEU  74  -0.822  -5.313  -3.962
  595   1HD2  LEU  74          1HD2      LEU  74  -3.170  -2.318  -2.183
  596   2HD2  LEU  74          2HD2      LEU  74  -3.604  -3.888  -1.465
  597   3HD2  LEU  74          3HD2      LEU  74  -1.952  -3.250  -1.278
  598    H    PHE  75           H        PHE  75  -2.114  -1.230  -7.072
  599    HA   PHE  75           HA       PHE  75  -1.272   1.245  -5.992
  600   1HB   PHE  75          1HB       PHE  75  -0.458  -0.216  -8.046
  601   2HB   PHE  75          2HB       PHE  75  -1.792   0.506  -8.924
  602    HD1  PHE  75           1HD      PHE  75  -1.166   2.216 -10.319
  603    HD2  PHE  75           2HD      PHE  75   0.903   1.752  -6.643
  604    HE1  PHE  75           1HE      PHE  75   0.274   4.193 -10.880
  605    HE2  PHE  75           2HE      PHE  75   2.343   3.729  -7.204
  606    HZ   PHE  75           HZ       PHE  75   2.012   4.926  -9.316
  607    H    GLN  76           H        GLN  76  -3.878   0.330  -8.361
  608    HA   GLN  76           HA       GLN  76  -4.850   2.840  -8.754
  609   1HB   GLN  76          1HB       GLN  76  -6.417   0.225  -8.653
  610   2HB   GLN  76          2HB       GLN  76  -6.978   1.703  -9.407
  611   1HG   GLN  76          1HG       GLN  76  -4.730  -0.129 -10.273
  612   2HG   GLN  76          2HG       GLN  76  -6.065   0.492 -11.223
  613   1HE2  GLN  76          1HE2      GLN  76  -2.981   0.572 -11.269
  614   2HE2  GLN  76          2HE2      GLN  76  -2.595   2.219 -11.645
  615    H    SER  77           H        SER  77  -5.359   0.594  -6.026
  616    HA   SER  77           HA       SER  77  -7.581   1.540  -4.889
  617   1HB   SER  77          1HB       SER  77  -6.132  -0.303  -4.010
  618   2HB   SER  77          2HB       SER  77  -4.984   0.886  -3.426
  619    HG   SER  77           HG       SER  77  -6.181   0.695  -1.634
  620    H    PHE  78           H        PHE  78  -4.241   2.921  -4.525
  621    HA   PHE  78           HA       PHE  78  -5.501   5.342  -3.447
  622   1HB   PHE  78          1HB       PHE  78  -2.924   3.802  -3.026
  623   2HB   PHE  78          2HB       PHE  78  -2.815   5.545  -2.885
  624    HD1  PHE  78           1HD      PHE  78  -3.129   2.707  -1.021
  625    HD2  PHE  78           2HD      PHE  78  -4.967   6.509  -1.440
  626    HE1  PHE  78           1HE      PHE  78  -3.957   2.567   1.345
  627    HE2  PHE  78           2HE      PHE  78  -5.795   6.369   0.925
  628    HZ   PHE  78           HZ       PHE  78  -5.280   4.400   2.289
  629    H    GLU  79           H        GLU  79  -4.239   7.415  -3.973
  630    HA   GLU  79           HA       GLU  79  -2.430   7.611  -5.971
  631   1HB   GLU  79          1HB       GLU  79  -4.854   6.713  -7.095
  632   2HB   GLU  79          2HB       GLU  79  -4.823   8.426  -7.461
  633   1HG   GLU  79          1HG       GLU  79  -2.691   8.253  -8.587
  634   2HG   GLU  79          2HG       GLU  79  -2.403   6.644  -7.956
  635    H    THR  80           H        THR  80  -2.045   9.872  -6.593
  636    HA   THR  80           HA       THR  80  -3.546  11.722  -4.863
  637    HB   THR  80           HB       THR  80  -1.432  13.009  -4.807
  638    HG1  THR  80           1HG      THR  80   0.144  12.447  -6.308
  639   1HG2  THR  80          1HG2      THR  80  -0.118  11.548  -3.505
  640   2HG2  THR  80          2HG2      THR  80  -1.695  10.727  -3.427
  641   3HG2  THR  80          3HG2      THR  80  -0.449  10.155  -4.562
  642    H    GLY  81           H        GLY  81  -1.693  13.654  -6.702
  643   1HA   GLY  81          1HA       GLY  81  -3.929  14.428  -8.348
  644   2HA   GLY  81          2HA       GLY  81  -2.369  15.215  -8.212
  645    H    HIS  82           H        HIS  82  -2.569  15.402 -10.628
  646    HA   HIS  82           HA       HIS  82  -2.351  14.661 -12.715
  647   1HB   HIS  82          1HB       HIS  82  -0.039  12.987 -11.825
  648   2HB   HIS  82          2HB       HIS  82  -0.166  14.095 -13.177
  649    HD1  HIS  82           1HD      HIS  82   0.880  16.355 -12.861
  650    HD2  HIS  82           2HD      HIS  82   0.100  14.437  -9.213
  651    HE1  HIS  82           1HE      HIS  82   1.887  17.837 -11.044
  652    H    CYS  83           H        CYS  83  -4.314  13.426 -12.908
  653    HA   CYS  83           HA       CYS  83  -3.766  10.661 -13.421
  654   1HB   CYS  83          1HB       CYS  83  -4.570  11.117 -10.868
  655   2HB   CYS  83          2HB       CYS  83  -6.132  10.972 -11.648
  656    HG   CYS  83           HG       CYS  83  -3.566   8.897 -11.574
  657    H    LEU  84           H        LEU  84  -6.740  10.091 -13.355
  658    HA   LEU  84           HA       LEU  84  -8.475  10.225 -14.712
  659   1HB   LEU  84          1HB       LEU  84  -7.731  13.052 -14.269
  660   2HB   LEU  84          2HB       LEU  84  -8.787  12.748 -15.634
  661    HG   LEU  84           HG       LEU  84 -10.215  13.240 -13.839
  662   1HD1  LEU  84          1HD1      LEU  84 -10.492  10.931 -15.168
  663   2HD1  LEU  84          2HD1      LEU  84 -10.393  10.291 -13.510
  664   3HD1  LEU  84          3HD1      LEU  84 -11.645  11.485 -13.930
  665   1HD2  LEU  84          1HD2      LEU  84  -9.796  12.907 -11.667
  666   2HD2  LEU  84          2HD2      LEU  84  -9.370  11.196 -11.909
  667   3HD2  LEU  84          3HD2      LEU  84  -8.157  12.465 -12.200
  668    H    ASN  85           H        ASN  85  -6.106   9.222 -15.811
  669    HA   ASN  85           HA       ASN  85  -5.030   8.861 -17.671
  670   1HB   ASN  85          1HB       ASN  85  -7.762   9.587 -18.852
  671   2HB   ASN  85          2HB       ASN  85  -6.488   8.815 -19.775
  672   1HD2  ASN  85          1HD2      ASN  85  -5.745   6.733 -19.170
  673   2HD2  ASN  85          2HD2      ASN  85  -6.757   5.624 -18.306
  674    H    GLU  86           H        GLU  86  -3.504  10.640 -17.682
  675    HA   GLU  86           HA       GLU  86  -4.342  12.877 -19.359
  676   1HB   GLU  86          1HB       GLU  86  -3.023  12.798 -16.733
  677   2HB   GLU  86          2HB       GLU  86  -2.104  13.738 -17.892
  678   1HG   GLU  86          1HG       GLU  86  -5.035  14.249 -17.970
  679   2HG   GLU  86          2HG       GLU  86  -4.276  14.682 -16.451
  680    H    THR  87           H        THR  87  -3.153  10.196 -20.088
  681    HA   THR  87           HA       THR  87  -1.498   9.325 -21.307
  682    HB   THR  87           HB       THR  87  -2.598  11.097 -22.815
  683    HG1  THR  87           1HG      THR  87  -0.882   9.472 -23.405
  684   1HG2  THR  87          1HG2      THR  87  -0.148  12.606 -21.819
  685   2HG2  THR  87          2HG2      THR  87  -0.764  12.873 -23.467
  686   3HG2  THR  87          3HG2      THR  87  -1.802  13.218 -22.063
  687    H    ASN  88           H        ASN  88  -0.820  10.695 -18.646
  688    HA   ASN  88           HA       ASN  88   2.036  10.764 -19.207
  689   1HB   ASN  88          1HB       ASN  88   2.331  12.563 -17.562
  690   2HB   ASN  88          2HB       ASN  88   1.137  13.084 -18.734
  691   1HD2  ASN  88          1HD2      ASN  88   1.520  14.022 -16.054
  692   2HD2  ASN  88          2HD2      ASN  88   0.062  13.738 -15.163
  693    H    VAL  89           H        VAL  89   0.578   8.439 -18.461
  694    HA   VAL  89           HA       VAL  89   0.700   8.207 -15.581
  695    HB   VAL  89           HB       VAL  89   0.184   5.903 -17.401
  696   1HG1  VAL  89          1HG1      VAL  89  -1.822   6.066 -15.502
  697   2HG1  VAL  89          2HG1      VAL  89  -0.333   5.099 -15.370
  698   3HG1  VAL  89          3HG1      VAL  89  -0.406   6.724 -14.648
  699   1HG2  VAL  89          1HG2      VAL  89  -1.173   7.262 -18.648
  700   2HG2  VAL  89          2HG2      VAL  89  -2.304   6.861 -17.333
  701   3HG2  VAL  89          3HG2      VAL  89  -1.436   8.415 -17.317
  702    H    THR  90           H        THR  90   2.850   8.309 -14.933
  703    HA   THR  90           HA       THR  90   4.375   5.960 -15.249
  704    HB   THR  90           HB       THR  90   4.816   6.837 -17.509
  705    HG1  THR  90           1HG      THR  90   6.890   6.278 -16.985
  706   1HG2  THR  90          1HG2      THR  90   4.410   9.221 -17.335
  707   2HG2  THR  90          2HG2      THR  90   5.548   9.378 -15.976
  708   3HG2  THR  90          3HG2      THR  90   6.159   9.044 -17.614
  709    H    LYS  91           H        LYS  91   4.224   9.450 -14.452
  710    HA   LYS  91           HA       LYS  91   6.018   8.858 -12.203
  711   1HB   LYS  91          1HB       LYS  91   6.653  10.586 -14.050
  712   2HB   LYS  91          2HB       LYS  91   5.483  11.626 -13.262
  713   1HG   LYS  91          1HG       LYS  91   7.294  10.299 -11.338
  714   2HG   LYS  91          2HG       LYS  91   8.157  11.288 -12.499
  715   1HD   LYS  91          1HD       LYS  91   7.609  12.740 -10.659
  716   2HD   LYS  91          2HD       LYS  91   6.535  13.188 -11.969
  717   1HE   LYS  91          1HE       LYS  91   4.646  12.373 -10.898
  718   2HE   LYS  91          2HE       LYS  91   5.511  11.052 -10.136
  719   1HZ   LYS  91          1HZ       LYS  91   4.975  12.570  -8.465
  720   2HZ   LYS  91          2HZ       LYS  91   6.572  12.792  -8.725
  721   3HZ   LYS  91          3HZ       LYS  91   5.492  13.865  -9.315
  722    H    ASP  92           H        ASP  92   4.668   8.242 -10.557
  723    HA   ASP  92           HA       ASP  92   2.891  10.286  -9.629
  724   1HB   ASP  92          1HB       ASP  92   1.930   7.925 -11.030
  725   2HB   ASP  92          2HB       ASP  92   1.415   7.841  -9.357
  726    H    VAL  93           H        VAL  93   2.882  10.239  -7.337
  727    HA   VAL  93           HA       VAL  93   4.087   7.852  -6.113
  728    HB   VAL  93           HB       VAL  93   4.860   9.498  -4.352
  729   1HG1  VAL  93          1HG1      VAL  93   6.836   9.236  -5.351
  730   2HG1  VAL  93          2HG1      VAL  93   5.990   8.731  -6.834
  731   3HG1  VAL  93          3HG1      VAL  93   6.410  10.443  -6.588
  732   1HG2  VAL  93          1HG2      VAL  93   3.247  11.303  -5.448
  733   2HG2  VAL  93          2HG2      VAL  93   4.765  11.772  -4.646
  734   3HG2  VAL  93          3HG2      VAL  93   4.696  11.655  -6.421
  735    H    VAL  94           H        VAL  94   3.498   7.882  -3.598
  736    HA   VAL  94           HA       VAL  94   0.785   8.838  -3.199
  737    HB   VAL  94           HB       VAL  94   1.592   5.928  -3.038
  738   1HG1  VAL  94          1HG1      VAL  94  -0.704   5.495  -2.289
  739   2HG1  VAL  94          2HG1      VAL  94   0.152   6.557  -1.146
  740   3HG1  VAL  94          3HG1      VAL  94  -1.039   7.243  -2.277
  741   1HG2  VAL  94          1HG2      VAL  94  -0.483   5.805  -4.627
  742   2HG2  VAL  94          2HG2      VAL  94  -0.124   7.522  -4.927
  743   3HG2  VAL  94          3HG2      VAL  94   1.103   6.281  -5.279
  744    H    CYS  95           H        CYS  95   0.181   8.858  -0.909
  745    HA   CYS  95           HA       CYS  95   2.442   9.452   0.700
  746   1HB   CYS  95          1HB       CYS  95   0.267  10.688   0.809
  747   2HB   CYS  95          2HB       CYS  95  -0.475   9.268   1.520
  748    HG   CYS  95           HG       CYS  95   1.129  11.604   2.807
  749    H    LEU  96           H        LEU  96   3.323   8.203   2.400
  750    HA   LEU  96           HA       LEU  96   2.702   5.401   2.285
  751   1HB   LEU  96          1HB       LEU  96   4.874   7.113   3.220
  752   2HB   LEU  96          2HB       LEU  96   4.522   5.802   4.329
  753    HG   LEU  96           HG       LEU  96   4.641   4.880   1.560
  754   1HD1  LEU  96          1HD1      LEU  96   6.961   5.226   1.113
  755   2HD1  LEU  96          2HD1      LEU  96   6.228   6.815   1.440
  756   3HD1  LEU  96          3HD1      LEU  96   7.210   6.014   2.690
  757   1HD2  LEU  96          1HD2      LEU  96   6.050   3.166   2.501
  758   2HD2  LEU  96          2HD2      LEU  96   6.274   4.110   3.993
  759   3HD2  LEU  96          3HD2      LEU  96   4.671   3.451   3.590
  760    H    ASN  97           H        ASN  97   2.117   8.197   4.422
  761    HA   ASN  97           HA       ASN  97   1.355   6.736   6.648
  762   1HB   ASN  97          1HB       ASN  97   0.485   9.503   5.662
  763   2HB   ASN  97          2HB       ASN  97   0.103   8.887   7.258
  764   1HD2  ASN  97          1HD2      ASN  97   1.499  11.194   6.970
  765   2HD2  ASN  97          2HD2      ASN  97   3.143  11.007   7.483
  766    H    ASP  98           H        ASP  98  -0.273   7.702   3.623
  767    HA   ASP  98           HA       ASP  98  -2.889   7.308   4.509
  768   1HB   ASP  98          1HB       ASP  98  -1.470   7.571   1.880
  769   2HB   ASP  98          2HB       ASP  98  -3.045   6.804   1.822
  770    H    VAL  99           H        VAL  99  -0.512   5.282   2.640
  771    HA   VAL  99           HA       VAL  99  -2.211   3.054   2.395
  772    HB   VAL  99           HB       VAL  99   0.797   3.344   2.274
  773   1HG1  VAL  99          1HG1      VAL  99  -0.782   0.971   2.352
  774   2HG1  VAL  99          2HG1      VAL  99  -0.175   1.166   0.690
  775   3HG1  VAL  99          3HG1      VAL  99   0.966   1.133   2.056
  776   1HG2  VAL  99          1HG2      VAL  99  -0.900   4.565   0.632
  777   2HG2  VAL  99          2HG2      VAL  99   0.608   3.828   0.039
  778   3HG2  VAL  99          3HG2      VAL  99  -0.936   2.959  -0.136
  779    H    SER 100           H        SER 100   0.036   4.211   4.912
  780    HA   SER 100           HA       SER 100   0.236   1.805   6.280
  781   1HB   SER 100          1HB       SER 100   1.623   3.964   6.549
  782   2HB   SER 100          2HB       SER 100   0.315   4.573   7.543
  783    HG   SER 100           HG       SER 100   1.075   2.009   8.306
  784    H    CYS 101           H        CYS 101  -2.320   4.206   6.009
  785    HA   CYS 101           HA       CYS 101  -3.603   3.518   8.453
  786   1HB   CYS 101          1HB       CYS 101  -3.775   5.727   7.102
  787   2HB   CYS 101          2HB       CYS 101  -4.948   4.877   6.115
  788    HG   CYS 101           HG       CYS 101  -6.683   5.686   7.550
  789    H    TYR 102           H        TYR 102  -4.230   2.925   4.915
  790    HA   TYR 102           HA       TYR 102  -6.424   1.285   5.198
  791   1HB   TYR 102          1HB       TYR 102  -5.067   2.348   3.155
  792   2HB   TYR 102          2HB       TYR 102  -4.115   0.878   3.220
  793    HD1  TYR 102           1HD      TYR 102  -5.459  -1.378   3.094
  794    HD2  TYR 102           2HD      TYR 102  -7.008   2.413   1.855
  795    HE1  TYR 102           1HE      TYR 102  -7.184  -2.550   1.639
  796    HE2  TYR 102           2HE      TYR 102  -8.727   1.228   0.404
  797    HH   TYR 102           HH       TYR 102  -9.598  -0.671  -0.162
  798    H    PHE 103           H        PHE 103  -2.928   0.322   4.919
  799    HA   PHE 103           HA       PHE 103  -3.405  -2.404   5.195
  800   1HB   PHE 103          1HB       PHE 103  -1.133  -0.424   5.580
  801   2HB   PHE 103          2HB       PHE 103  -0.876  -2.051   6.178
  802    HD1  PHE 103           1HD      PHE 103   0.256  -0.258   3.723
  803    HD2  PHE 103           2HD      PHE 103  -2.254  -3.657   4.110
  804    HE1  PHE 103           1HE      PHE 103   0.908  -1.002   1.417
  805    HE2  PHE 103           2HE      PHE 103  -1.601  -4.402   1.804
  806    HZ   PHE 103           HZ       PHE 103  -0.028  -3.065   0.484
  807    H    SER 104           H        SER 104  -2.991   0.217   7.597
  808    HA   SER 104           HA       SER 104  -2.468  -1.373   9.782
  809   1HB   SER 104          1HB       SER 104  -2.147   0.964  10.037
  810   2HB   SER 104          2HB       SER 104  -3.741   1.351   9.419
  811    HG   SER 104           HG       SER 104  -3.460  -0.174  11.842
  812    H    LEU 105           H        LEU 105  -5.495  -0.587   8.068
  813    HA   LEU 105           HA       LEU 105  -7.225  -1.488  10.121
  814   1HB   LEU 105          1HB       LEU 105  -7.471  -0.073   7.785
  815   2HB   LEU 105          2HB       LEU 105  -8.192  -1.611   7.352
  816    HG   LEU 105           HG       LEU 105  -9.942  -0.188   8.093
  817   1HD1  LEU 105          1HD1      LEU 105  -9.645  -2.650   9.051
  818   2HD1  LEU 105          2HD1      LEU 105  -9.610  -1.770  10.598
  819   3HD1  LEU 105          3HD1      LEU 105 -11.013  -1.609   9.514
  820   1HD2  LEU 105          1HD2      LEU 105  -8.302   0.335  10.587
  821   2HD2  LEU 105          2HD2      LEU 105  -8.647   1.486   9.274
  822   3HD2  LEU 105          3HD2      LEU 105  -9.969   0.894  10.309
  823    H    LEU 106           H        LEU 106  -5.961  -2.973   7.063
  824    HA   LEU 106           HA       LEU 106  -7.257  -5.386   7.284
  825   1HB   LEU 106          1HB       LEU 106  -4.970  -4.278   5.854
  826   2HB   LEU 106          2HB       LEU 106  -4.784  -5.987   6.191
  827    HG   LEU 106           HG       LEU 106  -7.230  -6.150   5.219
  828   1HD1  LEU 106          1HD1      LEU 106  -7.056  -4.349   3.191
  829   2HD1  LEU 106          2HD1      LEU 106  -8.030  -4.126   4.664
  830   3HD1  LEU 106          3HD1      LEU 106  -6.411  -3.396   4.549
  831   1HD2  LEU 106          1HD2      LEU 106  -5.883  -7.391   3.930
  832   2HD2  LEU 106          2HD2      LEU 106  -5.900  -5.990   2.832
  833   3HD2  LEU 106          3HD2      LEU 106  -4.562  -6.199   3.986
  834    H    GLU 107           H        GLU 107  -3.848  -4.682   8.345
  835    HA   GLU 107           HA       GLU 107  -3.475  -7.057   9.625
  836   1HB   GLU 107          1HB       GLU 107  -2.332  -4.302  10.251
  837   2HB   GLU 107          2HB       GLU 107  -1.724  -5.782  10.964
  838   1HG   GLU 107          1HG       GLU 107  -1.653  -6.547   8.366
  839   2HG   GLU 107          2HG       GLU 107  -1.522  -4.817   8.120
  840    H    GLY 108           H        GLY 108  -5.186  -4.119  10.699
  841   1HA   GLY 108          1HA       GLY 108  -5.289  -4.512  13.431
  842   2HA   GLY 108          2HA       GLY 108  -6.527  -3.738  12.461
  843    H    GLY 109           H        GLY 109  -7.960  -5.385  11.120
  844   1HA   GLY 109          1HA       GLY 109  -8.325  -8.007  11.691
  845   2HA   GLY 109          2HA       GLY 109  -9.087  -7.207  13.050
  846    H    ARG 110           H        ARG 110  -8.949  -7.087   9.423
  847    HA   ARG 110           HA       ARG 110 -11.750  -6.303   9.529
  848   1HB   ARG 110          1HB       ARG 110 -10.277  -4.625   8.433
  849   2HB   ARG 110          2HB       ARG 110  -9.666  -5.847   7.335
  850   1HG   ARG 110          1HG       ARG 110 -11.313  -4.971   5.969
  851   2HG   ARG 110          2HG       ARG 110 -12.286  -6.169   6.797
  852   1HD   ARG 110          1HD       ARG 110 -12.154  -3.699   8.368
  853   2HD   ARG 110          2HD       ARG 110 -12.715  -3.361   6.743
  854    HE   ARG 110           HE       ARG 110 -14.029  -5.698   7.894
  855   1HH1  ARG 110          2HH2      ARG 110 -14.079  -2.182   7.759
  856   2HH1  ARG 110          1HH2      ARG 110 -15.761  -2.064   8.159
  857   1HH2  ARG 110          2HH1      ARG 110 -16.247  -5.542   8.422
  858   2HH2  ARG 110          1HH1      ARG 110 -17.001  -3.988   8.539
  859    HA   PRO 111           HA       PRO 111 -11.947 -10.418   7.789
  860   1HB   PRO 111          1HB       PRO 111 -14.455 -11.022   8.689
  861   2HB   PRO 111          2HB       PRO 111 -13.001 -11.355   9.608
  862   1HG   PRO 111          1HG       PRO 111 -15.007  -9.223  10.020
  863   2HG   PRO 111          2HG       PRO 111 -13.808  -9.834  11.143
  864   1HD   PRO 111          1HD       PRO 111 -13.685  -7.376   9.669
  865   2HD   PRO 111          2HD       PRO 111 -12.436  -8.043  10.702
  866    H    GLU 112           H        GLU 112 -13.079 -11.477   6.058
  867    HA   GLU 112           HA       GLU 112 -14.247  -9.419   4.409
  868   1HB   GLU 112          1HB       GLU 112 -14.057 -11.156   2.598
  869   2HB   GLU 112          2HB       GLU 112 -12.527 -10.764   3.356
  870   1HG   GLU 112          1HG       GLU 112 -14.112 -13.032   4.545
  871   2HG   GLU 112          2HG       GLU 112 -13.345 -13.316   2.995
  872    H    ASP 113           H        ASP 113 -15.071 -12.451   6.108
  873    HA   ASP 113           HA       ASP 113 -16.955 -13.434   6.532
  874   1HB   ASP 113          1HB       ASP 113 -17.714 -11.279   7.408
  875   2HB   ASP 113          2HB       ASP 113 -18.109 -10.707   5.800
  876    H    LYS 114           H        LYS 114 -15.886 -13.840   3.922
  877    HA   LYS 114           HA       LYS 114 -17.965 -13.477   1.980
  878   1HB   LYS 114          1HB       LYS 114 -16.420 -14.433   0.430
  879   2HB   LYS 114          2HB       LYS 114 -15.530 -13.329   1.459
  880   1HG   LYS 114          1HG       LYS 114 -14.457 -15.071   2.643
  881   2HG   LYS 114          2HG       LYS 114 -15.699 -16.244   2.252
  882   1HD   LYS 114          1HD       LYS 114 -14.964 -16.244  -0.133
  883   2HD   LYS 114          2HD       LYS 114 -13.739 -15.047   0.237
  884   1HE   LYS 114          1HE       LYS 114 -12.772 -16.697   1.944
  885   2HE   LYS 114          2HE       LYS 114 -13.892 -17.895   1.325
  886   1HZ   LYS 114          1HZ       LYS 114 -12.504 -18.257  -0.323
  887   2HZ   LYS 114          2HZ       LYS 114 -12.595 -16.706  -0.825
  888   3HZ   LYS 114          3HZ       LYS 114 -11.456 -17.148   0.259
  889    H    LEU 115           H        LEU 115 -18.328 -15.679   0.560
  890    HA   LEU 115           HA       LEU 115 -19.856 -17.314   2.323
  891   1HB   LEU 115          1HB       LEU 115 -19.461 -17.011  -0.599
  892   2HB   LEU 115          2HB       LEU 115 -19.983 -18.588  -0.043
  893    HG   LEU 115           HG       LEU 115 -21.457 -16.166   0.930
  894   1HD1  LEU 115          1HD1      LEU 115 -22.186 -15.516  -1.059
  895   2HD1  LEU 115          2HD1      LEU 115 -21.077 -16.675  -1.831
  896   3HD1  LEU 115          3HD1      LEU 115 -22.740 -17.166  -1.428
  897   1HD2  LEU 115          1HD2      LEU 115 -22.308 -18.044   1.946
  898   2HD2  LEU 115          2HD2      LEU 115 -23.364 -17.920   0.519
  899   3HD2  LEU 115          3HD2      LEU 115 -22.016 -19.083   0.531
  900    H    GLU 116           H        GLU 116 -19.673 -19.875   1.751
  901    HA   GLU 116           HA       GLU 116 -16.912 -20.644   1.603
  902   1HB   GLU 116          1HB       GLU 116 -18.274 -21.891   3.931
  903   2HB   GLU 116          2HB       GLU 116 -16.610 -21.371   3.757
  904   1HG   GLU 116          1HG       GLU 116 -17.267 -19.011   4.078
  905   2HG   GLU 116          2HG       GLU 116 -18.961 -19.455   4.118
  906    H    TRP 117           H        TRP 117 -16.718 -22.594   0.534
  907    HA   TRP 117           HA       TRP 117 -19.173 -24.200   0.325
  908   1HB   TRP 117          1HB       TRP 117 -17.177 -23.498  -1.830
  909   2HB   TRP 117          2HB       TRP 117 -18.351 -24.791  -1.979
  910    HD1  TRP 117           HD       TRP 117 -18.195 -20.934  -1.812
  911    HE1  TRP 117           1HE      TRP 117 -20.417 -19.851  -2.737
  912    HE3  TRP 117           3HE      TRP 117 -20.744 -25.306  -2.297
  913    HZ2  TRP 117           2HZ      TRP 117 -22.934 -20.921  -3.549
  914    HZ3  TRP 117           3HZ      TRP 117 -23.079 -25.199  -3.163
  915    HH2  TRP 117           HH       TRP 117 -24.176 -23.103  -3.780
  916    H    SER 118           H        SER 118 -16.457 -25.354  -1.432
  917    HA   SER 118           HA       SER 118 -16.055 -27.358   0.593
  918   1HB   SER 118          1HB       SER 118 -16.299 -28.339  -1.532
  919   2HB   SER 118          2HB       SER 118 -15.378 -27.084  -2.337
  920    HG   SER 118           HG       SER 118 -14.423 -29.301  -0.773
  Start of MODEL   19
    1   1H    MET   1           H        MET   1 -14.330   9.197   0.365
    2    HA   MET   1           HA       MET   1 -12.231   9.635   0.724
    3   1HB   MET   1          1HB       MET   1 -12.173   6.635   1.359
    4   2HB   MET   1          2HB       MET   1 -10.824   7.699   1.704
    5   1HG   MET   1          1HG       MET   1 -11.969   8.841   3.408
    6   2HG   MET   1          2HG       MET   1 -13.546   8.521   2.715
    7   1HE   MET   1          1HE       MET   1 -13.904   4.853   2.936
    8   2HE   MET   1          2HE       MET   1 -14.993   5.861   3.921
    9   3HE   MET   1          3HE       MET   1 -14.450   6.434   2.325
   10    H    ALA   2           H        ALA   2 -12.290   9.910  -1.773
   11    HA   ALA   2           HA       ALA   2 -11.489   9.489  -3.823
   12   1HB   ALA   2          1HB       ALA   2  -8.903   8.897  -2.355
   13   2HB   ALA   2          2HB       ALA   2  -9.132   9.751  -3.900
   14   3HB   ALA   2          3HB       ALA   2  -9.625  10.524  -2.375
   15    H    LYS   3           H        LYS   3 -12.842   7.209  -2.812
   16    HA   LYS   3           HA       LYS   3 -11.092   4.968  -3.415
   17   1HB   LYS   3          1HB       LYS   3 -12.682   5.039  -1.427
   18   2HB   LYS   3          2HB       LYS   3 -13.998   4.895  -2.575
   19   1HG   LYS   3          1HG       LYS   3 -13.687   2.652  -2.613
   20   2HG   LYS   3          2HG       LYS   3 -12.109   2.901  -3.333
   21   1HD   LYS   3          1HD       LYS   3 -11.287   1.925  -1.442
   22   2HD   LYS   3          2HD       LYS   3 -11.577   3.475  -0.678
   23   1HE   LYS   3          1HE       LYS   3 -14.014   1.803  -0.807
   24   2HE   LYS   3          2HE       LYS   3 -12.717   1.032   0.084
   25   1HZ   LYS   3          1HZ       LYS   3 -12.565   3.441   1.086
   26   2HZ   LYS   3          2HZ       LYS   3 -14.151   3.459   0.695
   27   3HZ   LYS   3          3HZ       LYS   3 -13.571   2.310   1.700
   28    H    GLU   4           H        GLU   4 -14.082   3.901  -4.251
   29    HA   GLU   4           HA       GLU   4 -14.571   5.067  -6.698
   30   1HB   GLU   4          1HB       GLU   4 -12.209   3.683  -6.896
   31   2HB   GLU   4          2HB       GLU   4 -13.346   2.425  -7.339
   32   1HG   GLU   4          1HG       GLU   4 -14.297   3.815  -9.120
   33   2HG   GLU   4          2HG       GLU   4 -13.365   5.205  -8.599
   34    H    ARG   5           H        ARG   5 -15.169   2.416  -8.060
   35    HA   ARG   5           HA       ARG   5 -17.149   1.436  -6.173
   36   1HB   ARG   5          1HB       ARG   5 -18.814   1.300  -8.021
   37   2HB   ARG   5          2HB       ARG   5 -18.286   2.953  -7.775
   38   1HG   ARG   5          1HG       ARG   5 -16.434   2.208  -9.617
   39   2HG   ARG   5          2HG       ARG   5 -17.709   1.093 -10.064
   40   1HD   ARG   5          1HD       ARG   5 -18.162   3.016 -11.386
   41   2HD   ARG   5          2HD       ARG   5 -19.296   3.157 -10.057
   42    HE   ARG   5           HE       ARG   5 -17.074   4.521  -9.125
   43   1HH1  ARG   5          2HH2      ARG   5 -19.016   4.743 -12.051
   44   2HH1  ARG   5          1HH2      ARG   5 -18.724   6.436 -12.269
   45   1HH2  ARG   5          2HH1      ARG   5 -16.688   6.755  -9.413
   46   2HH2  ARG   5          1HH1      ARG   5 -17.391   7.588 -10.759
   47    H    GLY   6           H        GLY   6 -14.677   0.194  -6.519
   48   1HA   GLY   6          1HA       GLY   6 -15.402  -2.401  -7.365
   49   2HA   GLY   6          2HA       GLY   6 -14.441  -1.632  -8.612
   50    H    LEU   7           H        LEU   7 -12.223  -1.606  -8.414
   51    HA   LEU   7           HA       LEU   7 -10.226  -2.085  -7.601
   52   1HB   LEU   7          1HB       LEU   7 -11.111  -1.190  -4.880
   53   2HB   LEU   7          2HB       LEU   7  -9.555  -0.994  -5.661
   54    HG   LEU   7           HG       LEU   7 -11.805   0.362  -7.021
   55   1HD1  LEU   7          1HD1      LEU   7 -11.515   0.640  -4.176
   56   2HD1  LEU   7          2HD1      LEU   7 -11.070   2.166  -4.976
   57   3HD1  LEU   7          3HD1      LEU   7 -12.663   1.434  -5.280
   58   1HD2  LEU   7          1HD2      LEU   7  -9.038   1.268  -6.179
   59   2HD2  LEU   7          2HD2      LEU   7  -9.486   0.594  -7.764
   60   3HD2  LEU   7          3HD2      LEU   7 -10.160   2.156  -7.239
   61    H    ILE   8           H        ILE   8  -9.788  -2.847  -4.641
   62    HA   ILE   8           HA       ILE   8 -10.179  -5.656  -5.091
   63    HB   ILE   8           HB       ILE   8  -8.578  -5.967  -3.545
   64   1HG1  ILE   8          1HG1      ILE   8  -9.990  -3.834  -1.996
   65   2HG1  ILE   8          2HG1      ILE   8  -9.566  -5.469  -1.527
   66   1HG2  ILE   8          1HG2      ILE   8  -8.003  -3.024  -3.839
   67   2HG2  ILE   8          2HG2      ILE   8  -6.870  -4.395  -3.774
   68   3HG2  ILE   8          3HG2      ILE   8  -7.878  -4.142  -5.219
   69   1HD1  ILE   8          1HD1      ILE   8  -7.145  -4.808  -1.464
   70   2HD1  ILE   8          2HD1      ILE   8  -7.619  -3.141  -1.866
   71   3HD1  ILE   8          3HD1      ILE   8  -8.140  -3.867  -0.327
   72    H    SER   9           H        SER   9 -11.167  -7.077  -3.384
   73    HA   SER   9           HA       SER   9 -12.675  -6.333  -1.340
   74   1HB   SER   9          1HB       SER   9 -13.916  -5.350  -3.785
   75   2HB   SER   9          2HB       SER   9 -14.973  -6.515  -3.013
   76    HG   SER   9           HG       SER   9 -13.754  -4.280  -1.631
   77    HA   PRO  10           HA       PRO  10 -14.245 -10.371  -3.300
   78   1HB   PRO  10          1HB       PRO  10 -13.518 -11.019  -5.853
   79   2HB   PRO  10          2HB       PRO  10 -15.039 -10.244  -5.458
   80   1HG   PRO  10          1HG       PRO  10 -12.619  -9.064  -6.680
   81   2HG   PRO  10          2HG       PRO  10 -14.257  -8.441  -6.666
   82   1HD   PRO  10          1HD       PRO  10 -12.066  -7.542  -5.049
   83   2HD   PRO  10          2HD       PRO  10 -13.730  -7.000  -4.954
   84    H    SER  11           H        SER  11 -11.762 -10.940  -5.591
   85    HA   SER  11           HA       SER  11 -10.569 -12.723  -3.706
   86   1HB   SER  11          1HB       SER  11 -10.729 -12.482  -6.567
   87   2HB   SER  11          2HB       SER  11  -9.030 -12.487  -6.138
   88    HG   SER  11           HG       SER  11  -9.146 -14.557  -5.570
   89    H    ASP  12           H        ASP  12  -9.742  -9.685  -5.471
   90    HA   ASP  12           HA       ASP  12  -7.126  -9.479  -4.889
   91   1HB   ASP  12          1HB       ASP  12  -9.256  -7.290  -4.821
   92   2HB   ASP  12          2HB       ASP  12  -7.534  -6.966  -4.865
   93    H    PHE  13           H        PHE  13  -9.994  -8.888  -2.805
   94    HA   PHE  13           HA       PHE  13  -8.478  -7.733  -0.681
   95   1HB   PHE  13          1HB       PHE  13 -10.958  -7.371  -1.272
   96   2HB   PHE  13          2HB       PHE  13 -11.268  -9.028  -0.793
   97    HD1  PHE  13           1HD      PHE  13 -11.179  -5.677   0.296
   98    HD2  PHE  13           2HD      PHE  13 -10.569  -9.652   1.651
   99    HE1  PHE  13           1HE      PHE  13 -11.539  -4.925   2.663
  100    HE2  PHE  13           2HE      PHE  13 -10.929  -8.900   4.018
  101    HZ   PHE  13           HZ       PHE  13 -11.410  -6.546   4.496
  102    H    ALA  14           H        ALA  14  -9.792 -10.977  -1.512
  103    HA   ALA  14           HA       ALA  14  -9.238 -12.126   1.006
  104   1HB   ALA  14          1HB       ALA  14  -9.334 -13.634  -1.614
  105   2HB   ALA  14          2HB       ALA  14  -9.923 -14.133  -0.010
  106   3HB   ALA  14          3HB       ALA  14 -10.802 -12.892  -0.935
  107    H    GLN  15           H        GLN  15  -7.467 -12.026  -2.155
  108    HA   GLN  15           HA       GLN  15  -5.395 -13.638  -1.475
  109   1HB   GLN  15          1HB       GLN  15  -6.053 -11.994  -3.616
  110   2HB   GLN  15          2HB       GLN  15  -4.584 -11.245  -3.021
  111   1HG   GLN  15          1HG       GLN  15  -3.833 -12.882  -4.587
  112   2HG   GLN  15          2HG       GLN  15  -3.533 -13.603  -3.018
  113   1HE2  GLN  15          1HE2      GLN  15  -4.002 -14.780  -5.681
  114   2HE2  GLN  15          2HE2      GLN  15  -5.318 -15.894  -5.512
  115    H    LEU  16           H        LEU  16  -5.607 -10.032  -1.057
  116    HA   LEU  16           HA       LEU  16  -3.136  -9.702   0.136
  117   1HB   LEU  16          1HB       LEU  16  -5.376  -8.145  -0.508
  118   2HB   LEU  16          2HB       LEU  16  -5.142  -7.919   1.214
  119    HG   LEU  16           HG       LEU  16  -3.097  -7.416  -0.964
  120   1HD1  LEU  16          1HD1      LEU  16  -3.505  -5.098   0.537
  121   2HD1  LEU  16          2HD1      LEU  16  -4.082  -5.430  -1.114
  122   3HD1  LEU  16          3HD1      LEU  16  -5.134  -5.770   0.282
  123   1HD2  LEU  16          1HD2      LEU  16  -1.542  -6.733   0.693
  124   2HD2  LEU  16          2HD2      LEU  16  -2.752  -6.874   1.991
  125   3HD2  LEU  16          3HD2      LEU  16  -2.140  -8.337   1.181
  126    H    GLN  17           H        GLN  17  -6.379 -10.189   1.700
  127    HA   GLN  17           HA       GLN  17  -5.457 -10.188   4.273
  128   1HB   GLN  17          1HB       GLN  17  -7.883 -10.242   3.322
  129   2HB   GLN  17          2HB       GLN  17  -7.716 -11.987   3.329
  130   1HG   GLN  17          1HG       GLN  17  -7.426 -12.066   5.713
  131   2HG   GLN  17          2HG       GLN  17  -7.095 -10.348   5.815
  132   1HE2  GLN  17          1HE2      GLN  17  -9.556 -12.764   5.089
  133   2HE2  GLN  17          2HE2      GLN  17 -10.947 -11.810   5.483
  134    H    LYS  18           H        LYS  18  -5.954 -13.013   2.041
  135    HA   LYS  18           HA       LYS  18  -5.079 -14.953   3.825
  136   1HB   LYS  18          1HB       LYS  18  -6.325 -15.533   1.853
  137   2HB   LYS  18          2HB       LYS  18  -5.105 -14.846   0.799
  138   1HG   LYS  18          1HG       LYS  18  -3.487 -16.552   1.406
  139   2HG   LYS  18          2HG       LYS  18  -4.485 -17.123   2.729
  140   1HD   LYS  18          1HD       LYS  18  -6.266 -17.762   1.029
  141   2HD   LYS  18          2HD       LYS  18  -5.148 -17.320  -0.246
  142   1HE   LYS  18          1HE       LYS  18  -3.998 -19.276  -0.047
  143   2HE   LYS  18          2HE       LYS  18  -3.854 -19.102   1.690
  144   1HZ   LYS  18          1HZ       LYS  18  -6.071 -19.962   1.919
  145   2HZ   LYS  18          2HZ       LYS  18  -6.253 -20.076   0.301
  146   3HZ   LYS  18          3HZ       LYS  18  -5.162 -21.018   1.068
  147    H    TYR  19           H        TYR  19  -3.262 -13.127   1.270
  148    HA   TYR  19           HA       TYR  19  -0.814 -14.272   1.574
  149   1HB   TYR  19          1HB       TYR  19  -1.981 -11.541   0.958
  150   2HB   TYR  19          2HB       TYR  19  -0.250 -11.587   1.225
  151    HD1  TYR  19           1HD      TYR  19   0.494 -14.179  -0.015
  152    HD2  TYR  19           2HD      TYR  19  -2.239 -11.164  -1.336
  153    HE1  TYR  19           1HE      TYR  19   0.841 -14.910  -2.426
  154    HE2  TYR  19           2HE      TYR  19  -1.883 -11.906  -3.742
  155    HH   TYR  19           HH       TYR  19  -0.924 -14.595  -4.673
  156    H    MET  20           H        MET  20  -2.485 -12.020   3.772
  157    HA   MET  20           HA       MET  20  -0.123 -11.441   5.233
  158   1HB   MET  20          1HB       MET  20  -2.062  -9.871   5.110
  159   2HB   MET  20          2HB       MET  20  -3.106 -11.068   5.850
  160   1HG   MET  20          1HG       MET  20  -2.534 -10.237   7.884
  161   2HG   MET  20          2HG       MET  20  -0.905 -10.830   7.628
  162   1HE   MET  20          1HE       MET  20  -2.445  -7.854   5.253
  163   2HE   MET  20          2HE       MET  20  -3.415  -8.195   6.706
  164   3HE   MET  20          3HE       MET  20  -2.507  -6.669   6.580
  165    H    GLU  21           H        GLU  21  -2.680 -13.893   5.317
  166    HA   GLU  21           HA       GLU  21  -2.688 -14.689   7.871
  167   1HB   GLU  21          1HB       GLU  21  -3.479 -16.790   7.099
  168   2HB   GLU  21          2HB       GLU  21  -3.924 -15.664   5.831
  169   1HG   GLU  21          1HG       GLU  21  -2.907 -17.195   4.457
  170   2HG   GLU  21          2HG       GLU  21  -1.438 -16.373   4.943
  171    H    TYR  22           H        TYR  22  -0.092 -15.150   5.462
  172    HA   TYR  22           HA       TYR  22   1.394 -16.864   7.271
  173   1HB   TYR  22          1HB       TYR  22   1.145 -16.304   4.453
  174   2HB   TYR  22          2HB       TYR  22   2.753 -15.760   4.888
  175    HD1  TYR  22           1HD      TYR  22   0.599 -18.647   4.356
  176    HD2  TYR  22           2HD      TYR  22   4.415 -17.380   5.816
  177    HE1  TYR  22           1HE      TYR  22   1.452 -21.038   4.220
  178    HE2  TYR  22           2HE      TYR  22   5.256 -19.775   5.675
  179    HH   TYR  22           HH       TYR  22   3.436 -22.232   4.076
  180    H    SER  23           H        SER  23   1.115 -13.472   6.379
  181    HA   SER  23           HA       SER  23   3.747 -12.803   7.157
  182   1HB   SER  23          1HB       SER  23   1.822 -11.549   5.687
  183   2HB   SER  23          2HB       SER  23   1.595 -10.723   7.216
  184    HG   SER  23           HG       SER  23   4.214 -10.730   6.927
  185    H    THR  24           H        THR  24   4.478 -12.769   9.249
  186    HA   THR  24           HA       THR  24   2.473 -12.327  11.360
  187    HB   THR  24           HB       THR  24   4.126 -13.602  12.771
  188    HG1  THR  24           1HG      THR  24   5.992 -12.963  11.440
  189   1HG2  THR  24          1HG2      THR  24   3.105 -15.518  12.064
  190   2HG2  THR  24          2HG2      THR  24   2.600 -14.691  10.570
  191   3HG2  THR  24          3HG2      THR  24   4.162 -15.543  10.632
  192    H    LYS  25           H        LYS  25   4.306 -10.452   9.553
  193    HA   LYS  25           HA       LYS  25   5.558  -9.054  11.801
  194   1HB   LYS  25          1HB       LYS  25   6.154  -9.298   8.891
  195   2HB   LYS  25          2HB       LYS  25   6.493  -7.752   9.642
  196   1HG   LYS  25          1HG       LYS  25   7.416  -9.814  11.436
  197   2HG   LYS  25          2HG       LYS  25   8.004 -10.205   9.833
  198   1HD   LYS  25          1HD       LYS  25   8.432  -7.438  10.004
  199   2HD   LYS  25          2HD       LYS  25   8.787  -7.993  11.628
  200   1HE   LYS  25          1HE       LYS  25  10.040  -9.922  10.029
  201   2HE   LYS  25          2HE       LYS  25  10.290  -8.445   9.120
  202   1HZ   LYS  25          1HZ       LYS  25  10.829  -8.586  11.996
  203   2HZ   LYS  25          2HZ       LYS  25  11.958  -8.983  10.885
  204   3HZ   LYS  25          3HZ       LYS  25  11.352  -7.467  10.928
  205    H    LYS  26           H        LYS  26   5.495  -6.531  11.469
  206    HA   LYS  26           HA       LYS  26   2.681  -5.890  10.955
  207   1HB   LYS  26          1HB       LYS  26   4.746  -4.581  12.747
  208   2HB   LYS  26          2HB       LYS  26   3.163  -3.902  12.423
  209   1HG   LYS  26          1HG       LYS  26   2.787  -6.673  13.123
  210   2HG   LYS  26          2HG       LYS  26   3.875  -5.976  14.307
  211   1HD   LYS  26          1HD       LYS  26   2.234  -4.056  14.599
  212   2HD   LYS  26          2HD       LYS  26   1.129  -4.889  13.524
  213   1HE   LYS  26          1HE       LYS  26   0.433  -6.283  15.182
  214   2HE   LYS  26          2HE       LYS  26   2.079  -6.721  15.596
  215   1HZ   LYS  26          1HZ       LYS  26   0.980  -4.138  16.409
  216   2HZ   LYS  26          2HZ       LYS  26   0.709  -5.480  17.299
  217   3HZ   LYS  26          3HZ       LYS  26   2.237  -4.958  17.054
  218    H    VAL  27           H        VAL  27   2.128  -4.058   9.681
  219    HA   VAL  27           HA       VAL  27   3.888  -3.613   7.525
  220    HB   VAL  27           HB       VAL  27   1.394  -3.600   7.478
  221   1HG1  VAL  27          1HG1      VAL  27   0.676  -2.387   9.335
  222   2HG1  VAL  27          2HG1      VAL  27   1.826  -1.061   9.043
  223   3HG1  VAL  27          3HG1      VAL  27   0.401  -1.250   7.993
  224   1HG2  VAL  27          1HG2      VAL  27   1.501  -2.466   5.545
  225   2HG2  VAL  27          2HG2      VAL  27   1.975  -0.954   6.356
  226   3HG2  VAL  27          3HG2      VAL  27   3.209  -2.173   5.953
  227    H    SER  28           H        SER  28   3.317  -2.026  10.641
  228    HA   SER  28           HA       SER  28   4.411   0.438   9.963
  229   1HB   SER  28          1HB       SER  28   3.951  -1.061  12.548
  230   2HB   SER  28          2HB       SER  28   4.879   0.426  12.580
  231    HG   SER  28           HG       SER  28   2.235   0.213  12.613
  232    H    ASP  29           H        ASP  29   5.805  -2.717  10.743
  233    HA   ASP  29           HA       ASP  29   8.326  -1.752  11.504
  234   1HB   ASP  29          1HB       ASP  29   7.383  -4.445  10.420
  235   2HB   ASP  29          2HB       ASP  29   9.025  -4.166  10.966
  236    H    VAL  30           H        VAL  30   6.829  -3.007   8.451
  237    HA   VAL  30           HA       VAL  30   9.209  -2.869   6.932
  238    HB   VAL  30           HB       VAL  30   6.284  -2.977   6.178
  239   1HG1  VAL  30          1HG1      VAL  30   6.862  -2.618   4.056
  240   2HG1  VAL  30          2HG1      VAL  30   8.568  -2.431   4.528
  241   3HG1  VAL  30          3HG1      VAL  30   7.930  -4.041   4.117
  242   1HG2  VAL  30          1HG2      VAL  30   6.667  -5.346   5.813
  243   2HG2  VAL  30          2HG2      VAL  30   8.391  -5.163   6.216
  244   3HG2  VAL  30          3HG2      VAL  30   7.152  -4.914   7.470
  245    H    LEU  31           H        LEU  31   6.808  -0.535   8.001
  246    HA   LEU  31           HA       LEU  31   7.097   1.349   5.966
  247   1HB   LEU  31          1HB       LEU  31   5.602   1.065   8.247
  248   2HB   LEU  31          2HB       LEU  31   6.668   2.388   8.678
  249    HG   LEU  31           HG       LEU  31   5.736   2.989   6.084
  250   1HD1  LEU  31          1HD1      LEU  31   3.988   1.173   6.752
  251   2HD1  LEU  31          2HD1      LEU  31   3.315   2.463   7.778
  252   3HD1  LEU  31          3HD1      LEU  31   3.447   2.702   6.019
  253   1HD2  LEU  31          1HD2      LEU  31   5.586   4.087   8.811
  254   2HD2  LEU  31          2HD2      LEU  31   5.969   4.881   7.264
  255   3HD2  LEU  31          3HD2      LEU  31   4.272   4.604   7.727
  256    H    LYS  32           H        LYS  32   8.821   0.990   9.139
  257    HA   LYS  32           HA       LYS  32  10.498   3.179   8.779
  258   1HB   LYS  32          1HB       LYS  32  11.510   2.494  10.716
  259   2HB   LYS  32          2HB       LYS  32   9.979   1.653  10.852
  260   1HG   LYS  32          1HG       LYS  32  11.319  -0.256   9.497
  261   2HG   LYS  32          2HG       LYS  32  12.707   0.544  10.206
  262   1HD   LYS  32          1HD       LYS  32  10.394  -0.047  12.037
  263   2HD   LYS  32          2HD       LYS  32  11.341  -1.416  11.488
  264   1HE   LYS  32          1HE       LYS  32  12.926  -0.921  13.031
  265   2HE   LYS  32          2HE       LYS  32  13.231   0.600  12.215
  266   1HZ   LYS  32          1HZ       LYS  32  11.163   0.165  14.257
  267   2HZ   LYS  32          2HZ       LYS  32  12.585   0.931  14.493
  268   3HZ   LYS  32          3HZ       LYS  32  11.461   1.583  13.504
  269    H    LEU  33           H        LEU  33  10.623  -0.165   7.548
  270    HA   LEU  33           HA       LEU  33  13.292  -0.213   6.792
  271   1HB   LEU  33          1HB       LEU  33  10.826  -1.690   6.188
  272   2HB   LEU  33          2HB       LEU  33  12.008  -1.716   4.894
  273    HG   LEU  33           HG       LEU  33  12.498  -2.582   7.757
  274   1HD1  LEU  33          1HD1      LEU  33  12.909  -4.730   6.013
  275   2HD1  LEU  33          2HD1      LEU  33  11.558  -4.500   7.149
  276   3HD1  LEU  33          3HD1      LEU  33  11.402  -3.962   5.460
  277   1HD2  LEU  33          1HD2      LEU  33  14.351  -1.732   5.791
  278   2HD2  LEU  33          2HD2      LEU  33  14.678  -2.489   7.369
  279   3HD2  LEU  33          3HD2      LEU  33  14.493  -3.502   5.918
  280    H    PHE  34           H        PHE  34  10.363   1.048   5.105
  281    HA   PHE  34           HA       PHE  34  11.926   1.818   2.826
  282   1HB   PHE  34          1HB       PHE  34   9.069   1.943   3.845
  283   2HB   PHE  34          2HB       PHE  34   9.501   3.073   2.576
  284    HD1  PHE  34           1HD      PHE  34   9.666   2.369   0.328
  285    HD2  PHE  34           2HD      PHE  34   9.337  -0.529   3.410
  286    HE1  PHE  34           1HE      PHE  34   9.288   0.581  -1.393
  287    HE2  PHE  34           2HE      PHE  34   8.959  -2.317   1.689
  288    HZ   PHE  34           HZ       PHE  34   8.939  -1.740  -0.692
  289    H    GLU  35           H        GLU  35  11.291   3.117   5.953
  290    HA   GLU  35           HA       GLU  35  11.378   5.841   5.080
  291   1HB   GLU  35          1HB       GLU  35  11.494   4.669   7.894
  292   2HB   GLU  35          2HB       GLU  35  11.255   6.360   7.505
  293   1HG   GLU  35          1HG       GLU  35   9.343   4.717   6.029
  294   2HG   GLU  35          2HG       GLU  35   9.258   4.344   7.739
  295    H    ASP  36           H        ASP  36  13.444   3.686   7.166
  296    HA   ASP  36           HA       ASP  36  15.661   5.436   6.449
  297   1HB   ASP  36          1HB       ASP  36  14.815   4.131   8.968
  298   2HB   ASP  36          2HB       ASP  36  16.505   3.849   8.600
  299    H    GLY  37           H        GLY  37  14.350   2.124   6.720
  300   1HA   GLY  37          1HA       GLY  37  16.645   0.599   6.351
  301   2HA   GLY  37          2HA       GLY  37  15.017   0.149   5.885
  302    H    GLU  38           H        GLU  38  17.439  -0.511   4.414
  303    HA   GLU  38           HA       GLU  38  18.118   1.132   2.400
  304   1HB   GLU  38          1HB       GLU  38  19.105  -0.726   1.439
  305   2HB   GLU  38          2HB       GLU  38  18.792  -1.371   3.037
  306   1HG   GLU  38          1HG       GLU  38  17.851  -3.065   1.753
  307   2HG   GLU  38          2HG       GLU  38  16.438  -2.051   1.968
  308    H    MET  39           H        MET  39  15.034  -0.470   2.920
  309    HA   MET  39           HA       MET  39  14.145  -0.517   0.292
  310   1HB   MET  39          1HB       MET  39  12.605  -0.168   2.926
  311   2HB   MET  39          2HB       MET  39  11.863  -0.621   1.404
  312   1HG   MET  39          1HG       MET  39  14.006  -2.223   2.886
  313   2HG   MET  39          2HG       MET  39  12.302  -2.624   2.808
  314   1HE   MET  39          1HE       MET  39  11.143  -2.257   0.503
  315   2HE   MET  39          2HE       MET  39  12.195  -1.594  -0.771
  316   3HE   MET  39          3HE       MET  39  11.635  -3.281  -0.868
  317    H    ALA  40           H        ALA  40  14.925   2.142   2.285
  318    HA   ALA  40           HA       ALA  40  12.877   3.905   1.307
  319   1HB   ALA  40          1HB       ALA  40  14.094   5.585   2.612
  320   2HB   ALA  40          2HB       ALA  40  13.885   4.103   3.574
  321   3HB   ALA  40          3HB       ALA  40  15.458   4.462   2.824
  322    H    LYS  41           H        LYS  41  15.501   2.417  -0.122
  323    HA   LYS  41           HA       LYS  41  16.716   4.607  -1.428
  324   1HB   LYS  41          1HB       LYS  41  17.905   2.974  -2.665
  325   2HB   LYS  41          2HB       LYS  41  17.717   2.330  -1.046
  326   1HG   LYS  41          1HG       LYS  41  15.895   0.872  -1.745
  327   2HG   LYS  41          2HG       LYS  41  15.785   1.657  -3.308
  328   1HD   LYS  41          1HD       LYS  41  18.343   0.277  -2.400
  329   2HD   LYS  41          2HD       LYS  41  17.052  -0.613  -3.184
  330   1HE   LYS  41          1HE       LYS  41  17.706   0.131  -5.226
  331   2HE   LYS  41          2HE       LYS  41  17.569   1.800  -4.710
  332   1HZ   LYS  41          1HZ       LYS  41  19.875   0.278  -3.820
  333   2HZ   LYS  41          2HZ       LYS  41  19.844   0.796  -5.368
  334   3HZ   LYS  41          3HZ       LYS  41  19.749   1.874  -4.145
  335    H    TYR  42           H        TYR  42  13.595   3.285  -1.644
  336    HA   TYR  42           HA       TYR  42  13.322   4.365  -4.368
  337   1HB   TYR  42          1HB       TYR  42  12.145   1.963  -2.865
  338   2HB   TYR  42          2HB       TYR  42  11.300   2.622  -4.251
  339    HD1  TYR  42           1HD      TYR  42  13.519   0.141  -3.256
  340    HD2  TYR  42           2HD      TYR  42  12.946   2.995  -6.392
  341    HE1  TYR  42           1HE      TYR  42  14.956  -1.268  -4.811
  342    HE2  TYR  42           2HE      TYR  42  14.385   1.576  -7.936
  343    HH   TYR  42           HH       TYR  42  15.010  -0.813  -8.120
  344    H    VAL  43           H        VAL  43  13.145   6.011  -2.053
  345    HA   VAL  43           HA       VAL  43  10.267   6.570  -2.106
  346    HB   VAL  43           HB       VAL  43  12.107   6.542   0.292
  347   1HG1  VAL  43          1HG1      VAL  43   9.391   7.090   1.007
  348   2HG1  VAL  43          2HG1      VAL  43  10.839   8.091   1.270
  349   3HG1  VAL  43          3HG1      VAL  43   9.896   8.268  -0.229
  350   1HG2  VAL  43          1HG2      VAL  43   9.700   4.908  -0.531
  351   2HG2  VAL  43          2HG2      VAL  43  11.325   4.348  -0.070
  352   3HG2  VAL  43          3HG2      VAL  43  10.233   5.020   1.163
  353    H    GLN  44           H        GLN  44   9.814   8.634  -2.713
  354    HA   GLN  44           HA       GLN  44  12.044  10.509  -2.546
  355   1HB   GLN  44          1HB       GLN  44  10.982  11.585  -4.626
  356   2HB   GLN  44          2HB       GLN  44  11.806  10.058  -4.869
  357   1HG   GLN  44          1HG       GLN  44   8.986   9.649  -4.139
  358   2HG   GLN  44          2HG       GLN  44   9.137  10.658  -5.564
  359   1HE2  GLN  44          1HE2      GLN  44   9.324   7.529  -4.260
  360   2HE2  GLN  44          2HE2      GLN  44   9.853   6.660  -5.662
  361    H    GLY  45           H        GLY  45  11.608  12.526  -1.645
  362   1HA   GLY  45          1HA       GLY  45  10.496  14.036  -0.403
  363   2HA   GLY  45          2HA       GLY  45   9.206  13.860  -1.576
  364    H    ASP  46           H        ASP  46  10.411  11.215   0.536
  365    HA   ASP  46           HA       ASP  46   9.526  10.155   2.216
  366   1HB   ASP  46          1HB       ASP  46   8.643  12.767   2.693
  367   2HB   ASP  46          2HB       ASP  46   7.148  11.853   2.711
  368    H    ALA  47           H        ALA  47   8.459  10.269  -0.724
  369    HA   ALA  47           HA       ALA  47   5.954   8.828  -0.186
  370   1HB   ALA  47          1HB       ALA  47   5.816  11.197  -1.268
  371   2HB   ALA  47          2HB       ALA  47   6.468  10.398  -2.719
  372   3HB   ALA  47          3HB       ALA  47   4.919   9.860  -2.027
  373    H    ILE  48           H        ILE  48   5.429   7.243  -2.008
  374    HA   ILE  48           HA       ILE  48   7.888   6.268  -3.266
  375    HB   ILE  48           HB       ILE  48   7.625   4.958  -1.285
  376   1HG1  ILE  48          1HG1      ILE  48   6.789   3.510  -3.809
  377   2HG1  ILE  48          2HG1      ILE  48   8.416   3.744  -3.200
  378   1HG2  ILE  48          1HG2      ILE  48   4.759   4.604  -2.179
  379   2HG2  ILE  48          2HG2      ILE  48   5.542   3.559  -0.969
  380   3HG2  ILE  48          3HG2      ILE  48   5.368   5.303  -0.659
  381   1HD1  ILE  48          1HD1      ILE  48   7.578   2.492  -1.057
  382   2HD1  ILE  48          2HD1      ILE  48   6.222   1.969  -2.085
  383   3HD1  ILE  48          3HD1      ILE  48   7.892   1.536  -2.526
  384    H    GLY  49           H        GLY  49   7.534   5.059  -5.243
  385   1HA   GLY  49          1HA       GLY  49   5.080   5.926  -6.584
  386   2HA   GLY  49          2HA       GLY  49   6.554   5.342  -7.331
  387    H    TYR  50           H        TYR  50   4.340   4.230  -8.354
  388    HA   TYR  50           HA       TYR  50   3.197   2.087  -7.024
  389   1HB   TYR  50          1HB       TYR  50   2.412   3.086  -9.173
  390   2HB   TYR  50          2HB       TYR  50   3.930   2.689  -9.953
  391    HD1  TYR  50           1HD      TYR  50   0.685   1.400  -8.842
  392    HD2  TYR  50           2HD      TYR  50   4.429   0.375 -10.640
  393    HE1  TYR  50           1HE      TYR  50  -0.294  -0.807  -9.640
  394    HE2  TYR  50           2HE      TYR  50   3.438  -1.828 -11.432
  395    HH   TYR  50           HH       TYR  50   0.495  -3.008 -10.250
  396    H    GLU  51           H        GLU  51   6.125   2.216  -9.155
  397    HA   GLU  51           HA       GLU  51   6.611  -0.457  -9.261
  398   1HB   GLU  51          1HB       GLU  51   7.811   1.565 -10.400
  399   2HB   GLU  51          2HB       GLU  51   8.844   1.581  -8.984
  400   1HG   GLU  51          1HG       GLU  51   9.241  -0.942  -9.423
  401   2HG   GLU  51          2HG       GLU  51   8.473  -0.693 -10.978
  402    H    GLY  52           H        GLY  52   7.849   1.939  -6.825
  403   1HA   GLY  52          1HA       GLY  52   9.338   0.206  -5.265
  404   2HA   GLY  52          2HA       GLY  52   8.551   1.668  -4.707
  405    H    PHE  53           H        PHE  53   5.810   0.614  -5.537
  406    HA   PHE  53           HA       PHE  53   5.161  -0.548  -3.061
  407   1HB   PHE  53          1HB       PHE  53   3.899   0.745  -5.185
  408   2HB   PHE  53          2HB       PHE  53   3.384  -0.906  -5.466
  409    HD1  PHE  53           1HD      PHE  53   1.124  -0.885  -4.900
  410    HD2  PHE  53           2HD      PHE  53   3.935   0.815  -2.213
  411    HE1  PHE  53           1HE      PHE  53  -0.684  -0.614  -3.180
  412    HE2  PHE  53           2HE      PHE  53   2.127   1.086  -0.494
  413    HZ   PHE  53           HZ       PHE  53  -0.161   0.369  -0.997
  414    H    GLN  54           H        GLN  54   6.120  -1.860  -6.203
  415    HA   GLN  54           HA       GLN  54   4.943  -4.343  -5.997
  416   1HB   GLN  54          1HB       GLN  54   7.661  -3.807  -7.256
  417   2HB   GLN  54          2HB       GLN  54   6.496  -5.031  -7.718
  418   1HG   GLN  54          1HG       GLN  54   5.222  -2.413  -7.782
  419   2HG   GLN  54          2HG       GLN  54   6.706  -2.360  -8.713
  420   1HE2  GLN  54          1HE2      GLN  54   5.640  -2.184 -10.653
  421   2HE2  GLN  54          2HE2      GLN  54   4.797  -3.494 -11.410
  422    H    GLN  55           H        GLN  55   8.379  -3.412  -5.213
  423    HA   GLN  55           HA       GLN  55   8.990  -5.850  -4.065
  424   1HB   GLN  55          1HB       GLN  55  10.946  -4.640  -3.091
  425   2HB   GLN  55          2HB       GLN  55  10.722  -4.292  -4.794
  426   1HG   GLN  55          1HG       GLN  55   9.394  -2.206  -4.077
  427   2HG   GLN  55          2HG       GLN  55   9.933  -2.521  -2.439
  428   1HE2  GLN  55          1HE2      GLN  55  12.459  -3.343  -2.658
  429   2HE2  GLN  55          2HE2      GLN  55  13.487  -2.137  -3.359
  430    H    PHE  56           H        PHE  56   7.279  -3.012  -2.832
  431    HA   PHE  56           HA       PHE  56   7.655  -3.340  -0.119
  432   1HB   PHE  56          1HB       PHE  56   6.390  -1.566  -1.652
  433   2HB   PHE  56          2HB       PHE  56   5.006  -2.627  -1.481
  434    HD1  PHE  56           1HD      PHE  56   6.903   0.003   0.013
  435    HD2  PHE  56           2HD      PHE  56   4.176  -3.130   0.883
  436    HE1  PHE  56           1HE      PHE  56   6.321   1.113   2.188
  437    HE2  PHE  56           2HE      PHE  56   3.595  -2.020   3.058
  438    HZ   PHE  56           HZ       PHE  56   4.674   0.088   3.684
  439    H    LEU  57           H        LEU  57   5.024  -4.690  -2.235
  440    HA   LEU  57           HA       LEU  57   3.683  -6.051  -0.244
  441   1HB   LEU  57          1HB       LEU  57   3.963  -6.422  -3.209
  442   2HB   LEU  57          2HB       LEU  57   3.045  -7.569  -2.253
  443    HG   LEU  57           HG       LEU  57   2.435  -4.636  -2.024
  444   1HD1  LEU  57          1HD1      LEU  57   2.569  -5.393  -4.484
  445   2HD1  LEU  57          2HD1      LEU  57   1.102  -6.334  -4.124
  446   3HD1  LEU  57          3HD1      LEU  57   1.095  -4.565  -3.929
  447   1HD2  LEU  57          1HD2      LEU  57   0.275  -6.634  -2.085
  448   2HD2  LEU  57          2HD2      LEU  57   1.438  -6.837  -0.752
  449   3HD2  LEU  57          3HD2      LEU  57   0.578  -5.292  -0.956
  450    H    LYS  58           H        LYS  58   6.816  -6.640  -1.674
  451    HA   LYS  58           HA       LYS  58   6.921  -9.419  -1.210
  452   1HB   LYS  58          1HB       LYS  58   8.441  -7.664  -2.588
  453   2HB   LYS  58          2HB       LYS  58   9.419  -7.803  -1.141
  454   1HG   LYS  58          1HG       LYS  58   9.913 -10.043  -1.509
  455   2HG   LYS  58          2HG       LYS  58   8.368 -10.376  -2.267
  456   1HD   LYS  58          1HD       LYS  58   9.270 -10.108  -4.329
  457   2HD   LYS  58          2HD       LYS  58   9.792  -8.484  -3.928
  458   1HE   LYS  58          1HE       LYS  58  11.423 -10.719  -2.766
  459   2HE   LYS  58          2HE       LYS  58  11.526 -10.512  -4.503
  460   1HZ   LYS  58          1HZ       LYS  58  12.308  -8.361  -4.246
  461   2HZ   LYS  58          2HZ       LYS  58  11.824  -8.234  -2.692
  462   3HZ   LYS  58          3HZ       LYS  58  13.094  -9.185  -3.075
  463    H    ILE  59           H        ILE  59   8.293  -6.605   0.642
  464    HA   ILE  59           HA       ILE  59   8.898  -8.309   2.856
  465    HB   ILE  59           HB       ILE  59   8.943  -5.300   2.592
  466   1HG1  ILE  59          1HG1      ILE  59  11.389  -7.028   2.486
  467   2HG1  ILE  59          2HG1      ILE  59  10.400  -6.882   1.046
  468   1HG2  ILE  59          1HG2      ILE  59  10.682  -6.730   4.528
  469   2HG2  ILE  59          2HG2      ILE  59   9.890  -5.140   4.642
  470   3HG2  ILE  59          3HG2      ILE  59   8.951  -6.625   4.926
  471   1HD1  ILE  59          1HD1      ILE  59  10.715  -4.248   2.200
  472   2HD1  ILE  59          2HD1      ILE  59  12.316  -5.012   2.053
  473   3HD1  ILE  59          3HD1      ILE  59  11.276  -4.841   0.618
  474    H    TYR  60           H        TYR  60   6.447  -5.754   2.103
  475    HA   TYR  60           HA       TYR  60   5.175  -5.626   4.508
  476   1HB   TYR  60          1HB       TYR  60   4.597  -4.231   2.566
  477   2HB   TYR  60          2HB       TYR  60   4.279  -5.638   1.572
  478    HD1  TYR  60           1HD      TYR  60   2.063  -5.126   0.873
  479    HD2  TYR  60           2HD      TYR  60   3.028  -5.144   5.041
  480    HE1  TYR  60           1HE      TYR  60  -0.407  -4.974   1.453
  481    HE2  TYR  60           2HE      TYR  60   0.555  -4.992   5.607
  482    HH   TYR  60           HH       TYR  60  -1.482  -5.139   4.817
  483    H    LEU  61           H        LEU  61   4.141  -7.768   1.750
  484    HA   LEU  61           HA       LEU  61   2.578  -9.321   3.624
  485   1HB   LEU  61          1HB       LEU  61   2.755  -8.995   0.684
  486   2HB   LEU  61          2HB       LEU  61   2.278 -10.578   1.263
  487    HG   LEU  61           HG       LEU  61   0.898  -7.984   2.005
  488   1HD1  LEU  61          1HD1      LEU  61   0.762  -9.497  -0.408
  489   2HD1  LEU  61          2HD1      LEU  61  -0.773  -9.704   0.470
  490   3HD1  LEU  61          3HD1      LEU  61  -0.186  -8.070   0.075
  491   1HD2  LEU  61          1HD2      LEU  61   0.598 -10.793   2.897
  492   2HD2  LEU  61          2HD2      LEU  61   0.225  -9.267   3.734
  493   3HD2  LEU  61          3HD2      LEU  61  -0.908  -9.919   2.526
  494    H    GLU  62           H        GLU  62   5.739  -9.140   3.306
  495    HA   GLU  62           HA       GLU  62   7.454 -10.519   3.216
  496   1HB   GLU  62          1HB       GLU  62   5.728 -11.130   5.399
  497   2HB   GLU  62          2HB       GLU  62   6.336 -12.670   4.825
  498   1HG   GLU  62          1HG       GLU  62   8.309 -10.408   5.113
  499   2HG   GLU  62          2HG       GLU  62   7.715 -11.159   6.581
  500    H    VAL  63           H        VAL  63   5.515 -10.952   1.014
  501    HA   VAL  63           HA       VAL  63   5.476 -13.823   0.661
  502    HB   VAL  63           HB       VAL  63   4.451 -13.066  -1.575
  503   1HG1  VAL  63          1HG1      VAL  63   2.343 -12.205  -0.072
  504   2HG1  VAL  63          2HG1      VAL  63   2.797 -13.912  -0.290
  505   3HG1  VAL  63          3HG1      VAL  63   3.328 -13.028   1.160
  506   1HG2  VAL  63          1HG2      VAL  63   5.362 -10.603  -0.888
  507   2HG2  VAL  63          2HG2      VAL  63   3.994 -10.887  -1.990
  508   3HG2  VAL  63          3HG2      VAL  63   3.692 -10.510  -0.277
  509    H    ASP  64           H        ASP  64   6.482 -14.885  -1.198
  510    HA   ASP  64           HA       ASP  64   9.080 -13.785  -1.628
  511   1HB   ASP  64          1HB       ASP  64   9.581 -15.930  -2.672
  512   2HB   ASP  64          2HB       ASP  64   8.677 -16.226  -1.200
  513    H    ASN  65           H        ASN  65   5.985 -13.577  -3.079
  514    HA   ASN  65           HA       ASN  65   6.950 -12.150  -5.260
  515   1HB   ASN  65          1HB       ASN  65   5.667 -13.950  -6.885
  516   2HB   ASN  65          2HB       ASN  65   7.403 -13.945  -6.646
  517   1HD2  ASN  65          1HD2      ASN  65   4.447 -15.092  -5.018
  518   2HD2  ASN  65          2HD2      ASN  65   5.033 -16.660  -4.575
  519    H    VAL  66           H        VAL  66   5.288 -10.637  -5.413
  520    HA   VAL  66           HA       VAL  66   2.605 -11.512  -4.647
  521    HB   VAL  66           HB       VAL  66   4.156  -9.339  -3.930
  522   1HG1  VAL  66          1HG1      VAL  66   2.956  -7.362  -4.790
  523   2HG1  VAL  66          2HG1      VAL  66   3.784  -8.254  -6.089
  524   3HG1  VAL  66          3HG1      VAL  66   2.023  -8.411  -5.884
  525   1HG2  VAL  66          1HG2      VAL  66   1.484  -8.617  -3.410
  526   2HG2  VAL  66          2HG2      VAL  66   1.507 -10.397  -3.437
  527   3HG2  VAL  66          3HG2      VAL  66   2.595  -9.509  -2.344
  528    HA   PRO  67           HA       PRO  67   1.296 -11.224  -8.758
  529   1HB   PRO  67          1HB       PRO  67  -1.402 -10.953  -8.418
  530   2HB   PRO  67          2HB       PRO  67  -0.574 -12.494  -8.322
  531   1HG   PRO  67          1HG       PRO  67  -1.656 -10.833  -6.130
  532   2HG   PRO  67          2HG       PRO  67  -1.220 -12.531  -6.109
  533   1HD   PRO  67          1HD       PRO  67   0.293 -10.357  -5.009
  534   2HD   PRO  67          2HD       PRO  67   0.781 -12.038  -5.091
  535    H    ARG  68           H        ARG  68   1.346  -9.765 -10.364
  536    HA   ARG  68           HA       ARG  68   1.451  -7.109  -9.595
  537   1HB   ARG  68          1HB       ARG  68   2.572  -8.004 -11.627
  538   2HB   ARG  68          2HB       ARG  68   1.018  -8.351 -12.358
  539   1HG   ARG  68          1HG       ARG  68   1.074  -5.570 -11.498
  540   2HG   ARG  68          2HG       ARG  68   2.494  -5.904 -12.470
  541   1HD   ARG  68          1HD       ARG  68   0.922  -6.990 -14.197
  542   2HD   ARG  68          2HD       ARG  68  -0.419  -6.355 -13.265
  543    HE   ARG  68           HE       ARG  68   1.309  -4.171 -13.696
  544   1HH1  ARG  68          2HH2      ARG  68  -0.560  -6.402 -15.674
  545   2HH1  ARG  68          1HH2      ARG  68  -0.788  -5.268 -16.963
  546   1HH2  ARG  68          2HH1      ARG  68   1.008  -2.675 -15.396
  547   2HH2  ARG  68          1HH1      ARG  68   0.109  -3.134 -16.804
  548    H    HIS  69           H        HIS  69  -1.162  -9.193 -10.884
  549    HA   HIS  69           HA       HIS  69  -2.951  -7.276 -11.682
  550   1HB   HIS  69          1HB       HIS  69  -3.690  -9.853 -10.281
  551   2HB   HIS  69          2HB       HIS  69  -4.637  -8.966 -11.459
  552    HD1  HIS  69           1HD      HIS  69  -2.532 -11.842 -11.230
  553    HD2  HIS  69           2HD      HIS  69  -3.067  -8.827 -14.096
  554    HE1  HIS  69           1HE      HIS  69  -1.607 -12.767 -13.421
  555    H    LEU  70           H        LEU  70  -2.232  -8.543  -8.392
  556    HA   LEU  70           HA       LEU  70  -4.339  -7.038  -7.193
  557   1HB   LEU  70          1HB       LEU  70  -3.883  -8.911  -5.990
  558   2HB   LEU  70          2HB       LEU  70  -2.161  -8.850  -6.307
  559    HG   LEU  70           HG       LEU  70  -2.211  -6.743  -4.746
  560   1HD1  LEU  70          1HD1      LEU  70  -4.825  -8.104  -4.099
  561   2HD1  LEU  70          2HD1      LEU  70  -3.944  -7.117  -2.907
  562   3HD1  LEU  70          3HD1      LEU  70  -4.508  -6.383  -4.428
  563   1HD2  LEU  70          1HD2      LEU  70  -2.443  -8.751  -2.815
  564   2HD2  LEU  70          2HD2      LEU  70  -1.882  -9.584  -4.285
  565   3HD2  LEU  70          3HD2      LEU  70  -0.961  -8.205  -3.636
  566    H    SER  71           H        SER  71  -0.769  -6.688  -7.594
  567    HA   SER  71           HA       SER  71  -0.473  -4.468  -6.021
  568   1HB   SER  71          1HB       SER  71   1.015  -5.110  -8.605
  569   2HB   SER  71          2HB       SER  71   1.586  -4.046  -7.335
  570    HG   SER  71           HG       SER  71   0.857  -6.601  -6.424
  571    H    LEU  72           H        LEU  72  -2.014  -4.863  -9.149
  572    HA   LEU  72           HA       LEU  72  -1.752  -2.135  -9.947
  573   1HB   LEU  72          1HB       LEU  72  -1.942  -3.640 -11.696
  574   2HB   LEU  72          2HB       LEU  72  -3.231  -4.546 -10.929
  575    HG   LEU  72           HG       LEU  72  -4.735  -2.546 -11.288
  576   1HD1  LEU  72          1HD1      LEU  72  -3.376  -0.702 -11.602
  577   2HD1  LEU  72          2HD1      LEU  72  -2.273  -1.564 -12.702
  578   3HD1  LEU  72          3HD1      LEU  72  -3.891  -1.079 -13.263
  579   1HD2  LEU  72          1HD2      LEU  72  -5.361  -3.230 -13.427
  580   2HD2  LEU  72          2HD2      LEU  72  -3.686  -3.589 -13.912
  581   3HD2  LEU  72          3HD2      LEU  72  -4.526  -4.652 -12.757
  582    H    ALA  73           H        ALA  73  -4.349  -4.185  -8.476
  583    HA   ALA  73           HA       ALA  73  -6.149  -1.989  -8.281
  584   1HB   ALA  73          1HB       ALA  73  -7.636  -3.578  -7.532
  585   2HB   ALA  73          2HB       ALA  73  -6.458  -4.655  -8.320
  586   3HB   ALA  73          3HB       ALA  73  -6.411  -4.423  -6.556
  587    H    LEU  74           H        LEU  74  -3.601  -3.442  -6.261
  588    HA   LEU  74           HA       LEU  74  -4.319  -2.445  -3.800
  589   1HB   LEU  74          1HB       LEU  74  -1.895  -3.426  -5.119
  590   2HB   LEU  74          2HB       LEU  74  -1.572  -2.284  -3.830
  591    HG   LEU  74           HG       LEU  74  -3.328  -4.721  -3.463
  592   1HD1  LEU  74          1HD1      LEU  74  -1.533  -6.011  -2.779
  593   2HD1  LEU  74          2HD1      LEU  74  -0.865  -5.138  -4.179
  594   3HD1  LEU  74          3HD1      LEU  74  -0.475  -4.601  -2.528
  595   1HD2  LEU  74          1HD2      LEU  74  -2.262  -2.581  -1.674
  596   2HD2  LEU  74          2HD2      LEU  74  -3.844  -3.396  -1.678
  597   3HD2  LEU  74          3HD2      LEU  74  -2.414  -4.232  -1.025
  598    H    PHE  75           H        PHE  75  -2.530  -0.858  -6.505
  599    HA   PHE  75           HA       PHE  75  -2.019   1.509  -5.083
  600   1HB   PHE  75          1HB       PHE  75  -1.248   0.357  -7.447
  601   2HB   PHE  75          2HB       PHE  75  -2.491   1.417  -8.081
  602    HD1  PHE  75           1HD      PHE  75  -1.818   3.492  -8.811
  603    HD2  PHE  75           2HD      PHE  75   0.413   1.607  -5.732
  604    HE1  PHE  75           1HE      PHE  75  -0.183   5.397  -8.829
  605    HE2  PHE  75           2HE      PHE  75   2.047   3.512  -5.749
  606    HZ   PHE  75           HZ       PHE  75   1.730   5.384  -7.298
  607    H    GLN  76           H        GLN  76  -4.601   0.574  -7.454
  608    HA   GLN  76           HA       GLN  76  -5.828   3.036  -7.511
  609   1HB   GLN  76          1HB       GLN  76  -6.933   0.228  -7.921
  610   2HB   GLN  76          2HB       GLN  76  -7.876   1.672  -8.234
  611   1HG   GLN  76          1HG       GLN  76  -5.678   2.353  -9.649
  612   2HG   GLN  76          2HG       GLN  76  -5.470   0.614  -9.708
  613   1HE2  GLN  76          1HE2      GLN  76  -5.897   0.349 -11.833
  614   2HE2  GLN  76          2HE2      GLN  76  -7.444   0.596 -12.571
  615    H    SER  77           H        SER  77  -5.851   0.478  -5.081
  616    HA   SER  77           HA       SER  77  -8.194   0.808  -3.833
  617   1HB   SER  77          1HB       SER  77  -5.593   0.682  -2.267
  618   2HB   SER  77          2HB       SER  77  -7.137  -0.034  -1.848
  619    HG   SER  77           HG       SER  77  -6.042  -1.754  -2.674
  620    H    PHE  78           H        PHE  78  -5.495   3.093  -4.026
  621    HA   PHE  78           HA       PHE  78  -7.148   5.061  -2.681
  622   1HB   PHE  78          1HB       PHE  78  -5.653   4.024  -0.936
  623   2HB   PHE  78          2HB       PHE  78  -4.258   4.282  -1.964
  624    HD1  PHE  78           1HD      PHE  78  -2.972   6.182  -1.656
  625    HD2  PHE  78           2HD      PHE  78  -6.992   6.195  -0.296
  626    HE1  PHE  78           1HE      PHE  78  -2.607   8.429  -0.598
  627    HE2  PHE  78           2HE      PHE  78  -6.627   8.442   0.762
  628    HZ   PHE  78           HZ       PHE  78  -4.439   9.532   0.599
  629    H    GLU  79           H        GLU  79  -3.696   4.718  -3.783
  630    HA   GLU  79           HA       GLU  79  -2.473   6.008  -5.048
  631   1HB   GLU  79          1HB       GLU  79  -3.799   4.765  -6.758
  632   2HB   GLU  79          2HB       GLU  79  -4.978   6.062  -6.790
  633   1HG   GLU  79          1HG       GLU  79  -3.177   7.662  -7.508
  634   2HG   GLU  79          2HG       GLU  79  -2.021   6.345  -7.510
  635    H    THR  80           H        THR  80  -2.056   7.878  -3.844
  636    HA   THR  80           HA       THR  80  -3.847   9.888  -3.267
  637    HB   THR  80           HB       THR  80  -1.280   9.314  -2.616
  638    HG1  THR  80           1HG      THR  80  -2.623  11.917  -2.826
  639   1HG2  THR  80          1HG2      THR  80  -0.963  11.866  -4.230
  640   2HG2  THR  80          2HG2      THR  80   0.300  10.800  -3.570
  641   3HG2  THR  80          3HG2      THR  80  -0.630  10.297  -5.002
  642    H    GLY  81           H        GLY  81  -2.430   9.053  -6.341
  643   1HA   GLY  81          1HA       GLY  81  -2.493  11.580  -7.579
  644   2HA   GLY  81          2HA       GLY  81  -2.543  10.017  -8.369
  645    H    HIS  82           H        HIS  82  -4.766   8.804  -8.160
  646    HA   HIS  82           HA       HIS  82  -6.933   8.736  -8.511
  647   1HB   HIS  82          1HB       HIS  82  -6.955  10.222  -6.422
  648   2HB   HIS  82          2HB       HIS  82  -7.209  11.574  -7.509
  649    HD1  HIS  82           1HD      HIS  82  -9.593  12.083  -8.100
  650    HD2  HIS  82           2HD      HIS  82  -9.103   8.156  -6.711
  651    HE1  HIS  82           1HE      HIS  82 -11.937  11.089  -7.925
  652    H    CYS  83           H        CYS  83  -8.765   9.866  -9.881
  653    HA   CYS  83           HA       CYS  83  -9.411  10.753 -11.783
  654   1HB   CYS  83          1HB       CYS  83  -7.876  12.755 -10.752
  655   2HB   CYS  83          2HB       CYS  83  -7.046  12.478 -12.270
  656    HG   CYS  83           HG       CYS  83  -9.010  14.440 -12.188
  657    H    LEU  84           H        LEU  84  -9.307   9.869 -13.856
  658    HA   LEU  84           HA       LEU  84  -6.694   8.793 -14.660
  659   1HB   LEU  84          1HB       LEU  84  -9.273   7.460 -14.282
  660   2HB   LEU  84          2HB       LEU  84  -8.571   7.172 -15.862
  661    HG   LEU  84           HG       LEU  84  -7.985   5.434 -14.220
  662   1HD1  LEU  84          1HD1      LEU  84  -5.514   5.460 -14.605
  663   2HD1  LEU  84          2HD1      LEU  84  -6.495   5.724 -16.067
  664   3HD1  LEU  84          3HD1      LEU  84  -5.688   7.100 -15.275
  665   1HD2  LEU  84          1HD2      LEU  84  -5.978   6.800 -12.706
  666   2HD2  LEU  84          2HD2      LEU  84  -7.531   7.645 -12.503
  667   3HD2  LEU  84          3HD2      LEU  84  -7.408   5.908 -12.134
  668    H    ASN  85           H        ASN  85  -7.629  11.427 -15.256
  669    HA   ASN  85           HA       ASN  85  -7.941  11.081 -18.120
  670   1HB   ASN  85          1HB       ASN  85  -9.924  12.194 -16.349
  671   2HB   ASN  85          2HB       ASN  85  -9.254  13.534 -17.259
  672   1HD2  ASN  85          1HD2      ASN  85 -11.860  12.023 -17.295
  673   2HD2  ASN  85          2HD2      ASN  85 -12.140  11.608 -18.953
  674    H    GLU  86           H        GLU  86  -5.614  11.575 -18.209
  675    HA   GLU  86           HA       GLU  86  -3.782  12.792 -17.912
  676   1HB   GLU  86          1HB       GLU  86  -5.477  15.002 -19.136
  677   2HB   GLU  86          2HB       GLU  86  -3.768  14.702 -19.387
  678   1HG   GLU  86          1HG       GLU  86  -5.851  12.611 -20.126
  679   2HG   GLU  86          2HG       GLU  86  -5.444  13.910 -21.230
  680    H    THR  87           H        THR  87  -3.513  13.015 -15.635
  681    HA   THR  87           HA       THR  87  -4.436  15.608 -14.579
  682    HB   THR  87           HB       THR  87  -5.275  13.149 -13.717
  683    HG1  THR  87           1HG      THR  87  -4.454  15.423 -12.053
  684   1HG2  THR  87          1HG2      THR  87  -2.668  12.911 -12.974
  685   2HG2  THR  87          2HG2      THR  87  -3.263  13.867 -11.596
  686   3HG2  THR  87          3HG2      THR  87  -3.996  12.288 -11.966
  687    H    ASN  88           H        ASN  88  -1.952  14.866 -16.130
  688    HA   ASN  88           HA       ASN  88   0.162  15.339 -16.079
  689   1HB   ASN  88          1HB       ASN  88  -0.669  17.498 -15.010
  690   2HB   ASN  88          2HB       ASN  88  -0.380  16.788 -13.434
  691   1HD2  ASN  88          1HD2      ASN  88   1.140  18.281 -12.848
  692   2HD2  ASN  88          2HD2      ASN  88   2.737  18.353 -13.515
  693    H    VAL  89           H        VAL  89   0.423  12.936 -15.597
  694    HA   VAL  89           HA       VAL  89   1.351  12.474 -12.849
  695    HB   VAL  89           HB       VAL  89   0.930  10.121 -14.508
  696   1HG1  VAL  89          1HG1      VAL  89   0.297  11.109 -11.770
  697   2HG1  VAL  89          2HG1      VAL  89  -0.744   9.823 -12.426
  698   3HG1  VAL  89          3HG1      VAL  89   1.013   9.569 -12.300
  699   1HG2  VAL  89          1HG2      VAL  89  -1.319  12.112 -14.213
  700   2HG2  VAL  89          2HG2      VAL  89  -0.813  11.189 -15.648
  701   3HG2  VAL  89          3HG2      VAL  89  -1.640  10.364 -14.305
  702    H    THR  90           H        THR  90   3.474  13.285 -13.109
  703    HA   THR  90           HA       THR  90   5.084  11.862 -15.123
  704    HB   THR  90           HB       THR  90   4.853  14.425 -15.213
  705    HG1  THR  90           1HG      THR  90   7.389  13.084 -14.587
  706   1HG2  THR  90          1HG2      THR  90   6.577  14.144 -12.694
  707   2HG2  THR  90          2HG2      THR  90   6.368  15.647 -13.625
  708   3HG2  THR  90          3HG2      THR  90   4.980  14.925 -12.776
  709    H    LYS  91           H        LYS  91   4.242  11.850 -11.855
  710    HA   LYS  91           HA       LYS  91   6.382  10.066 -11.277
  711   1HB   LYS  91          1HB       LYS  91   7.506  11.286  -9.567
  712   2HB   LYS  91          2HB       LYS  91   7.509  12.282 -11.008
  713   1HG   LYS  91          1HG       LYS  91   5.108  12.979  -9.685
  714   2HG   LYS  91          2HG       LYS  91   6.278  12.804  -8.392
  715   1HD   LYS  91          1HD       LYS  91   7.790  14.209 -10.195
  716   2HD   LYS  91          2HD       LYS  91   6.196  14.798 -10.624
  717   1HE   LYS  91          1HE       LYS  91   5.800  15.699  -8.455
  718   2HE   LYS  91          2HE       LYS  91   7.030  14.700  -7.707
  719   1HZ   LYS  91          1HZ       LYS  91   8.706  15.975  -8.711
  720   2HZ   LYS  91          2HZ       LYS  91   7.668  16.757  -9.699
  721   3HZ   LYS  91          3HZ       LYS  91   7.648  17.054  -8.093
  722    H    ASP  92           H        ASP  92   4.271   8.883 -11.190
  723    HA   ASP  92           HA       ASP  92   2.326   9.551  -9.357
  724   1HB   ASP  92          1HB       ASP  92   2.878   7.443 -11.181
  725   2HB   ASP  92          2HB       ASP  92   2.676   6.654  -9.630
  726    H    VAL  93           H        VAL  93   2.665   9.742  -7.134
  727    HA   VAL  93           HA       VAL  93   4.233   7.626  -5.851
  728    HB   VAL  93           HB       VAL  93   5.089   9.445  -4.308
  729   1HG1  VAL  93          1HG1      VAL  93   7.010   9.842  -5.640
  730   2HG1  VAL  93          2HG1      VAL  93   6.374   8.266  -6.169
  731   3HG1  VAL  93          3HG1      VAL  93   6.084   9.719  -7.155
  732   1HG2  VAL  93          1HG2      VAL  93   3.598  11.255  -4.870
  733   2HG2  VAL  93          2HG2      VAL  93   5.252  11.724  -5.329
  734   3HG2  VAL  93          3HG2      VAL  93   4.097  11.200  -6.578
  735    H    VAL  94           H        VAL  94   3.591   7.183  -3.640
  736    HA   VAL  94           HA       VAL  94   0.995   8.370  -2.951
  737    HB   VAL  94           HB       VAL  94   1.837   5.470  -2.781
  738   1HG1  VAL  94          1HG1      VAL  94  -0.742   6.800  -1.883
  739   2HG1  VAL  94          2HG1      VAL  94  -0.430   5.048  -1.912
  740   3HG1  VAL  94          3HG1      VAL  94   0.508   6.102  -0.825
  741   1HG2  VAL  94          1HG2      VAL  94   1.144   5.531  -4.935
  742   2HG2  VAL  94          2HG2      VAL  94  -0.478   5.497  -4.202
  743   3HG2  VAL  94          3HG2      VAL  94   0.235   7.046  -4.713
  744    H    CYS  95           H        CYS  95   0.544   8.442  -0.631
  745    HA   CYS  95           HA       CYS  95   2.903   9.071   0.817
  746   1HB   CYS  95          1HB       CYS  95  -0.014   9.357   1.204
  747   2HB   CYS  95          2HB       CYS  95   0.894   9.113   2.683
  748    HG   CYS  95           HG       CYS  95   0.668  11.646   2.452
  749    H    LEU  96           H        LEU  96   3.916   7.844   2.448
  750    HA   LEU  96           HA       LEU  96   3.267   5.046   2.451
  751   1HB   LEU  96          1HB       LEU  96   5.513   6.768   3.213
  752   2HB   LEU  96          2HB       LEU  96   5.248   5.435   4.319
  753    HG   LEU  96           HG       LEU  96   5.157   4.582   1.523
  754   1HD1  LEU  96          1HD1      LEU  96   6.720   6.249   0.990
  755   2HD1  LEU  96          2HD1      LEU  96   7.595   6.049   2.527
  756   3HD1  LEU  96          3HD1      LEU  96   7.693   4.786   1.277
  757   1HD2  LEU  96          1HD2      LEU  96   5.307   2.905   3.150
  758   2HD2  LEU  96          2HD2      LEU  96   6.944   2.999   2.457
  759   3HD2  LEU  96          3HD2      LEU  96   6.602   3.747   4.035
  760    H    ASN  97           H        ASN  97   2.825   7.901   4.530
  761    HA   ASN  97           HA       ASN  97   2.193   6.426   6.828
  762   1HB   ASN  97          1HB       ASN  97   2.140   9.258   5.935
  763   2HB   ASN  97          2HB       ASN  97   0.848   8.883   7.058
  764   1HD2  ASN  97          1HD2      ASN  97   4.125   9.582   6.658
  765   2HD2  ASN  97          2HD2      ASN  97   4.689   9.311   8.273
  766    H    ASP  98           H        ASP  98   0.381   7.817   4.045
  767    HA   ASP  98           HA       ASP  98  -2.159   7.477   5.115
  768   1HB   ASP  98          1HB       ASP  98  -1.038   7.707   2.306
  769   2HB   ASP  98          2HB       ASP  98  -2.744   7.381   2.532
  770    H    VAL  99           H        VAL  99   0.025   5.436   3.079
  771    HA   VAL  99           HA       VAL  99  -1.857   3.385   2.619
  772    HB   VAL  99           HB       VAL  99   1.123   3.682   2.396
  773   1HG1  VAL  99          1HG1      VAL  99   0.843   1.351   1.152
  774   2HG1  VAL  99          2HG1      VAL  99   1.197   1.442   2.894
  775   3HG1  VAL  99          3HG1      VAL  99  -0.468   1.147   2.338
  776   1HG2  VAL  99          1HG2      VAL  99   0.146   2.889  -0.038
  777   2HG2  VAL  99          2HG2      VAL  99  -1.224   3.818   0.615
  778   3HG2  VAL  99          3HG2      VAL  99   0.378   4.579   0.467
  779    H    SER 100           H        SER 100   0.293   4.240   5.296
  780    HA   SER 100           HA       SER 100   0.376   1.702   6.451
  781   1HB   SER 100          1HB       SER 100   1.912   3.639   6.974
  782   2HB   SER 100          2HB       SER 100   0.592   4.416   7.825
  783    HG   SER 100           HG       SER 100   0.506   2.541   9.260
  784    H    CYS 101           H        CYS 101  -1.977   4.368   6.475
  785    HA   CYS 101           HA       CYS 101  -3.404   3.381   8.732
  786   1HB   CYS 101          1HB       CYS 101  -3.288   5.810   7.598
  787   2HB   CYS 101          2HB       CYS 101  -4.710   5.213   6.766
  788    HG   CYS 101           HG       CYS 101  -6.257   4.987   8.630
  789    H    TYR 102           H        TYR 102  -3.553   3.155   5.145
  790    HA   TYR 102           HA       TYR 102  -6.061   1.928   4.968
  791   1HB   TYR 102          1HB       TYR 102  -5.009   2.822   2.983
  792   2HB   TYR 102          2HB       TYR 102  -3.458   2.114   3.385
  793    HD1  TYR 102           1HD      TYR 102  -2.913   0.876   1.463
  794    HD2  TYR 102           2HD      TYR 102  -6.783   0.413   3.226
  795    HE1  TYR 102           1HE      TYR 102  -3.400  -1.069  -0.100
  796    HE2  TYR 102           2HE      TYR 102  -7.258  -1.530   1.657
  797    HH   TYR 102           HH       TYR 102  -6.516  -2.776   0.064
  798    H    PHE 103           H        PHE 103  -2.730   0.463   4.865
  799    HA   PHE 103           HA       PHE 103  -3.655  -2.166   4.832
  800   1HB   PHE 103          1HB       PHE 103  -1.106  -0.702   5.692
  801   2HB   PHE 103          2HB       PHE 103  -1.197  -2.447   5.826
  802    HD1  PHE 103           1HD      PHE 103  -2.698  -3.118   3.351
  803    HD2  PHE 103           2HD      PHE 103   0.457  -0.355   4.000
  804    HE1  PHE 103           1HE      PHE 103  -2.010  -3.339   0.947
  805    HE2  PHE 103           2HE      PHE 103   1.145  -0.576   1.596
  806    HZ   PHE 103           HZ       PHE 103  -0.097  -2.065   0.099
  807    H    SER 104           H        SER 104  -3.245   0.178   7.451
  808    HA   SER 104           HA       SER 104  -2.955  -1.587   9.546
  809   1HB   SER 104          1HB       SER 104  -2.572   0.742   9.939
  810   2HB   SER 104          2HB       SER 104  -4.149   1.196   9.323
  811    HG   SER 104           HG       SER 104  -5.107   0.664  11.208
  812    H    LEU 105           H        LEU 105  -5.772  -0.637   7.607
  813    HA   LEU 105           HA       LEU 105  -7.695  -1.615   9.475
  814   1HB   LEU 105          1HB       LEU 105  -7.928   0.182   7.638
  815   2HB   LEU 105          2HB       LEU 105  -8.144  -1.164   6.537
  816    HG   LEU 105           HG       LEU 105 -10.296  -0.311   7.181
  817   1HD1  LEU 105          1HD1      LEU 105 -11.360  -2.303   7.630
  818   2HD1  LEU 105          2HD1      LEU 105  -9.772  -2.870   7.058
  819   3HD1  LEU 105          3HD1      LEU 105 -10.127  -2.828   8.802
  820   1HD2  LEU 105          1HD2      LEU 105  -9.081  -0.171   9.836
  821   2HD2  LEU 105          2HD2      LEU 105 -10.447   0.736   9.145
  822   3HD2  LEU 105          3HD2      LEU 105 -10.715  -0.876   9.850
  823    H    LEU 106           H        LEU 106  -5.872  -2.893   6.672
  824    HA   LEU 106           HA       LEU 106  -7.318  -5.156   6.154
  825   1HB   LEU 106          1HB       LEU 106  -4.594  -4.193   5.743
  826   2HB   LEU 106          2HB       LEU 106  -4.675  -5.938   5.893
  827    HG   LEU 106           HG       LEU 106  -4.809  -5.017   3.551
  828   1HD1  LEU 106          1HD1      LEU 106  -7.095  -6.752   4.523
  829   2HD1  LEU 106          2HD1      LEU 106  -6.573  -6.586   2.829
  830   3HD1  LEU 106          3HD1      LEU 106  -5.472  -7.295   4.034
  831   1HD2  LEU 106          1HD2      LEU 106  -7.438  -4.444   3.139
  832   2HD2  LEU 106          2HD2      LEU 106  -7.162  -3.682   4.724
  833   3HD2  LEU 106          3HD2      LEU 106  -6.150  -3.230   3.331
  834    H    GLU 107           H        GLU 107  -4.452  -4.954   8.389
  835    HA   GLU 107           HA       GLU 107  -4.863  -7.484   9.421
  836   1HB   GLU 107          1HB       GLU 107  -3.364  -6.662  11.299
  837   2HB   GLU 107          2HB       GLU 107  -2.719  -6.428   9.687
  838   1HG   GLU 107          1HG       GLU 107  -2.966  -4.113   9.762
  839   2HG   GLU 107          2HG       GLU 107  -4.375  -4.184  10.801
  840    H    GLY 108           H        GLY 108  -6.261  -4.312  10.235
  841   1HA   GLY 108          1HA       GLY 108  -7.627  -5.492  12.564
  842   2HA   GLY 108          2HA       GLY 108  -7.403  -3.785  12.241
  843    H    GLY 109           H        GLY 109  -8.540  -6.458  10.063
  844   1HA   GLY 109          1HA       GLY 109 -10.809  -4.801   9.283
  845   2HA   GLY 109          2HA       GLY 109 -10.252  -6.279   8.525
  846    H    ARG 110           H        ARG 110 -11.209  -5.410  11.929
  847    HA   ARG 110           HA       ARG 110 -12.308  -7.876  12.437
  848   1HB   ARG 110          1HB       ARG 110 -12.320  -5.180  13.699
  849   2HB   ARG 110          2HB       ARG 110 -13.716  -6.152  14.115
  850   1HG   ARG 110          1HG       ARG 110 -11.188  -7.687  14.208
  851   2HG   ARG 110          2HG       ARG 110 -11.191  -6.322  15.307
  852   1HD   ARG 110          1HD       ARG 110 -13.767  -7.520  15.571
  853   2HD   ARG 110          2HD       ARG 110 -12.631  -8.854  15.526
  854    HE   ARG 110           HE       ARG 110 -12.025  -8.258  17.690
  855   1HH1  ARG 110          2HH2      ARG 110 -13.003  -5.342  15.979
  856   2HH1  ARG 110          1HH2      ARG 110 -12.727  -4.301  17.336
  857   1HH2  ARG 110          2HH1      ARG 110 -11.662  -6.885  19.479
  858   2HH2  ARG 110          1HH1      ARG 110 -11.959  -5.184  19.340
  859    HA   PRO 111           HA       PRO 111 -16.003  -7.272  10.073
  860   1HB   PRO 111          1HB       PRO 111 -16.827  -9.878  10.075
  861   2HB   PRO 111          2HB       PRO 111 -15.716  -9.225   8.887
  862   1HG   PRO 111          1HG       PRO 111 -15.140 -10.984  11.191
  863   2HG   PRO 111          2HG       PRO 111 -14.155 -10.671   9.776
  864   1HD   PRO 111          1HD       PRO 111 -13.772  -9.593  12.406
  865   2HD   PRO 111          2HD       PRO 111 -12.859  -9.192  10.965
  866    H    GLU 112           H        GLU 112 -18.341  -7.392  10.321
  867    HA   GLU 112           HA       GLU 112 -18.870  -7.273  13.163
  868   1HB   GLU 112          1HB       GLU 112 -19.531  -5.494  11.282
  869   2HB   GLU 112          2HB       GLU 112 -20.913  -6.549  11.065
  870   1HG   GLU 112          1HG       GLU 112 -21.886  -5.834  12.995
  871   2HG   GLU 112          2HG       GLU 112 -20.413  -6.069  13.914
  872    H    ASP 113           H        ASP 113 -19.272  -9.337  10.403
  873    HA   ASP 113           HA       ASP 113 -20.585 -11.248  12.004
  874   1HB   ASP 113          1HB       ASP 113 -22.271  -9.479  10.571
  875   2HB   ASP 113          2HB       ASP 113 -22.226 -10.929   9.587
  876    H    LYS 114           H        LYS 114 -19.096 -12.845  11.366
  877    HA   LYS 114           HA       LYS 114 -18.216 -12.951   8.625
  878   1HB   LYS 114          1HB       LYS 114 -17.539 -14.641  11.050
  879   2HB   LYS 114          2HB       LYS 114 -16.799 -14.821   9.473
  880   1HG   LYS 114          1HG       LYS 114 -15.951 -12.499   9.558
  881   2HG   LYS 114          2HG       LYS 114 -16.783 -12.220  11.075
  882   1HD   LYS 114          1HD       LYS 114 -14.939 -14.584  11.005
  883   2HD   LYS 114          2HD       LYS 114 -14.172 -13.011  10.915
  884   1HE   LYS 114          1HE       LYS 114 -14.334 -12.971  13.189
  885   2HE   LYS 114          2HE       LYS 114 -16.033 -12.616  12.945
  886   1HZ   LYS 114          1HZ       LYS 114 -16.024 -15.247  12.695
  887   2HZ   LYS 114          2HZ       LYS 114 -14.794 -15.072  13.755
  888   3HZ   LYS 114          3HZ       LYS 114 -16.273 -14.481  14.116
  889    H    LEU 115           H        LEU 115 -18.437 -14.862   7.257
  890    HA   LEU 115           HA       LEU 115 -20.985 -16.202   7.799
  891   1HB   LEU 115          1HB       LEU 115 -19.711 -15.070   5.425
  892   2HB   LEU 115          2HB       LEU 115 -20.306 -16.698   5.169
  893    HG   LEU 115           HG       LEU 115 -22.092 -14.630   6.427
  894   1HD1  LEU 115          1HD1      LEU 115 -20.977 -13.801   4.242
  895   2HD1  LEU 115          2HD1      LEU 115 -22.019 -15.002   3.443
  896   3HD1  LEU 115          3HD1      LEU 115 -22.747 -13.694   4.405
  897   1HD2  LEU 115          1HD2      LEU 115 -23.485 -16.358   6.422
  898   2HD2  LEU 115          2HD2      LEU 115 -23.496 -16.273   4.644
  899   3HD2  LEU 115          3HD2      LEU 115 -22.348 -17.350   5.476
  900    H    GLU 116           H        GLU 116 -20.961 -18.488   6.503
  901    HA   GLU 116           HA       GLU 116 -18.425 -19.782   6.995
  902   1HB   GLU 116          1HB       GLU 116 -20.697 -21.381   8.002
  903   2HB   GLU 116          2HB       GLU 116 -19.110 -21.131   8.702
  904   1HG   GLU 116          1HG       GLU 116 -20.605 -20.085  10.236
  905   2HG   GLU 116          2HG       GLU 116 -19.907 -18.755   9.333
  906    H    TRP 117           H        TRP 117 -17.954 -21.214   5.362
  907    HA   TRP 117           HA       TRP 117 -20.182 -21.898   3.574
  908   1HB   TRP 117          1HB       TRP 117 -17.308 -22.119   2.781
  909   2HB   TRP 117          2HB       TRP 117 -18.728 -21.867   1.786
  910    HD1  TRP 117           HD       TRP 117 -19.921 -19.240   3.171
  911    HE1  TRP 117           1HE      TRP 117 -18.736 -16.888   3.006
  912    HE3  TRP 117           3HE      TRP 117 -15.290 -21.059   2.120
  913    HZ2  TRP 117           2HZ      TRP 117 -16.056 -16.070   2.467
  914    HZ3  TRP 117           3HZ      TRP 117 -13.445 -19.416   1.789
  915    HH2  TRP 117           HH       TRP 117 -13.770 -16.998   1.947
  916    H    SER 118           H        SER 118 -20.707 -23.585   5.287
  917    HA   SER 118           HA       SER 118 -19.084 -25.503   6.175
  918   1HB   SER 118          1HB       SER 118 -21.815 -25.091   6.122
  919   2HB   SER 118          2HB       SER 118 -21.678 -26.557   5.172
  920    HG   SER 118           HG       SER 118 -21.821 -26.579   7.714
  Start of MODEL   20
    1   1H    MET   1           H        MET   1 -10.779  12.009   2.368
    2    HA   MET   1           HA       MET   1  -9.887  10.041   2.635
    3   1HB   MET   1          1HB       MET   1  -9.991  10.912   5.554
    4   2HB   MET   1          2HB       MET   1  -9.479   9.283   5.162
    5   1HG   MET   1          1HG       MET   1  -7.507   9.992   4.127
    6   2HG   MET   1          2HG       MET   1  -8.195  11.517   3.606
    7   1HE   MET   1          1HE       MET   1  -9.318  12.964   5.278
    8   2HE   MET   1          2HE       MET   1  -8.786  13.265   6.949
    9   3HE   MET   1          3HE       MET   1  -7.868  13.949   5.586
   10    H    ALA   2           H        ALA   2 -12.632  10.179   2.151
   11    HA   ALA   2           HA       ALA   2 -13.759   8.116   3.907
   12   1HB   ALA   2          1HB       ALA   2 -14.941  10.345   3.610
   13   2HB   ALA   2          2HB       ALA   2 -15.194   9.899   1.906
   14   3HB   ALA   2          3HB       ALA   2 -15.915   8.912   3.200
   15    H    LYS   3           H        LYS   3 -12.276   6.551   2.771
   16    HA   LYS   3           HA       LYS   3 -12.769   6.081  -0.004
   17   1HB   LYS   3          1HB       LYS   3 -10.585   5.696   1.209
   18   2HB   LYS   3          2HB       LYS   3 -11.325   4.311   1.985
   19   1HG   LYS   3          1HG       LYS   3 -10.702   3.097   0.169
   20   2HG   LYS   3          2HG       LYS   3 -11.966   3.928  -0.716
   21   1HD   LYS   3          1HD       LYS   3 -10.114   4.417  -2.055
   22   2HD   LYS   3          2HD       LYS   3 -10.141   5.829  -1.018
   23   1HE   LYS   3          1HE       LYS   3  -7.956   5.307  -0.585
   24   2HE   LYS   3          2HE       LYS   3  -8.617   4.109   0.510
   25   1HZ   LYS   3          1HZ       LYS   3  -7.980   2.487  -0.833
   26   2HZ   LYS   3          2HZ       LYS   3  -8.537   3.213  -2.186
   27   3HZ   LYS   3          3HZ       LYS   3  -7.055   3.587  -1.609
   28    H    GLU   4           H        GLU   4 -12.608   3.030   1.279
   29    HA   GLU   4           HA       GLU   4 -14.006   1.381   1.460
   30   1HB   GLU   4          1HB       GLU   4 -14.809   2.426   3.495
   31   2HB   GLU   4          2HB       GLU   4 -15.826   3.538   2.601
   32   1HG   GLU   4          1HG       GLU   4 -17.512   2.015   2.420
   33   2HG   GLU   4          2HG       GLU   4 -16.422   0.750   1.889
   34    H    ARG   5           H        ARG   5 -15.515   0.208   0.181
   35    HA   ARG   5           HA       ARG   5 -16.573  -0.226  -1.659
   36   1HB   ARG   5          1HB       ARG   5 -18.031   2.307  -0.791
   37   2HB   ARG   5          2HB       ARG   5 -18.561   1.393  -2.189
   38   1HG   ARG   5          1HG       ARG   5 -18.081  -0.400   0.073
   39   2HG   ARG   5          2HG       ARG   5 -19.187   0.879   0.535
   40   1HD   ARG   5          1HD       ARG   5 -20.794  -0.430  -0.437
   41   2HD   ARG   5          2HD       ARG   5 -20.189   0.211  -1.951
   42    HE   ARG   5           HE       ARG   5 -18.554  -2.015  -1.229
   43   1HH1  ARG   5          2HH2      ARG   5 -21.852  -1.339  -2.254
   44   2HH1  ARG   5          1HH2      ARG   5 -22.074  -2.888  -2.997
   45   1HH2  ARG   5          2HH1      ARG   5 -18.847  -4.058  -2.209
   46   2HH2  ARG   5          1HH1      ARG   5 -20.353  -4.445  -2.972
   47    H    GLY   6           H        GLY   6 -15.103  -0.083  -3.380
   48   1HA   GLY   6          1HA       GLY   6 -15.153   1.132  -5.568
   49   2HA   GLY   6          2HA       GLY   6 -14.799   2.576  -4.641
   50    H    LEU   7           H        LEU   7 -13.261   0.198  -2.913
   51    HA   LEU   7           HA       LEU   7 -10.757   0.713  -4.338
   52   1HB   LEU   7          1HB       LEU   7  -9.711   0.056  -2.180
   53   2HB   LEU   7          2HB       LEU   7 -10.671   1.522  -2.134
   54    HG   LEU   7           HG       LEU   7 -10.836  -0.164  -0.182
   55   1HD1  LEU   7          1HD1      LEU   7 -13.565   0.250  -0.492
   56   2HD1  LEU   7          2HD1      LEU   7 -12.397   1.357   0.270
   57   3HD1  LEU   7          3HD1      LEU   7 -12.818   1.552  -1.449
   58   1HD2  LEU   7          1HD2      LEU   7 -11.172  -2.151  -1.637
   59   2HD2  LEU   7          2HD2      LEU   7 -12.433  -1.951  -0.397
   60   3HD2  LEU   7          3HD2      LEU   7 -12.769  -1.508  -2.088
   61    H    ILE   8           H        ILE   8  -9.198  -1.386  -3.362
   62    HA   ILE   8           HA       ILE   8  -9.503  -3.337  -5.160
   63    HB   ILE   8           HB       ILE   8  -8.284  -4.811  -3.554
   64   1HG1  ILE   8          1HG1      ILE   8  -8.590  -2.452  -1.671
   65   2HG1  ILE   8          2HG1      ILE   8  -9.364  -4.013  -1.484
   66   1HG2  ILE   8          1HG2      ILE   8  -7.016  -2.089  -3.532
   67   2HG2  ILE   8          2HG2      ILE   8  -6.289  -3.684  -3.842
   68   3HG2  ILE   8          3HG2      ILE   8  -7.324  -2.923  -5.074
   69   1HD1  ILE   8          1HD1      ILE   8  -6.792  -3.264  -0.564
   70   2HD1  ILE   8          2HD1      ILE   8  -7.503  -4.896  -0.544
   71   3HD1  ILE   8          3HD1      ILE   8  -6.504  -4.377  -1.923
   72    H    SER   9           H        SER   9 -11.250  -4.506  -5.741
   73    HA   SER   9           HA       SER   9 -13.499  -4.805  -4.300
   74   1HB   SER   9          1HB       SER   9 -12.361  -5.928  -6.698
   75   2HB   SER   9          2HB       SER   9 -13.125  -7.231  -5.809
   76    HG   SER   9           HG       SER   9 -14.956  -5.447  -5.610
   77    HA   PRO  10           HA       PRO  10 -12.887  -8.053  -1.452
   78   1HB   PRO  10          1HB       PRO  10 -14.986  -9.777  -1.747
   79   2HB   PRO  10          2HB       PRO  10 -15.117  -8.243  -0.911
   80   1HG   PRO  10          1HG       PRO  10 -16.096  -8.976  -3.602
   81   2HG   PRO  10          2HG       PRO  10 -16.571  -7.626  -2.591
   82   1HD   PRO  10          1HD       PRO  10 -14.840  -7.533  -4.876
   83   2HD   PRO  10          2HD       PRO  10 -15.223  -6.206  -3.797
   84    H    SER  11           H        SER  11 -12.473  -8.688  -4.634
   85    HA   SER  11           HA       SER  11 -11.995 -11.474  -4.342
   86   1HB   SER  11          1HB       SER  11 -12.722 -10.180  -6.475
   87   2HB   SER  11          2HB       SER  11 -11.041  -9.710  -6.626
   88    HG   SER  11           HG       SER  11 -12.247 -12.267  -6.947
   89    H    ASP  12           H        ASP  12 -10.025  -8.454  -4.665
   90    HA   ASP  12           HA       ASP  12  -7.587  -9.857  -4.562
   91   1HB   ASP  12          1HB       ASP  12  -7.709  -6.990  -3.694
   92   2HB   ASP  12          2HB       ASP  12  -6.601  -7.763  -4.810
   93    H    PHE  13           H        PHE  13  -9.776  -8.186  -2.252
   94    HA   PHE  13           HA       PHE  13  -8.098  -7.954  -0.083
   95   1HB   PHE  13          1HB       PHE  13 -10.533  -7.148  -0.503
   96   2HB   PHE  13          2HB       PHE  13 -11.060  -8.778  -0.136
   97    HD1  PHE  13           1HD      PHE  13  -9.298  -5.851   1.308
   98    HD2  PHE  13           2HD      PHE  13 -11.396  -9.456   2.088
   99    HE1  PHE  13           1HE      PHE  13  -9.383  -5.274   3.749
  100    HE2  PHE  13           2HE      PHE  13 -11.481  -8.879   4.529
  101    HZ   PHE  13           HZ       PHE  13 -10.473  -6.794   5.331
  102    H    ALA  14           H        ALA  14  -9.926 -10.788  -1.313
  103    HA   ALA  14           HA       ALA  14  -9.543 -12.384   0.975
  104   1HB   ALA  14          1HB       ALA  14 -11.273 -13.053  -0.459
  105   2HB   ALA  14          2HB       ALA  14 -10.275 -12.851  -1.919
  106   3HB   ALA  14          3HB       ALA  14  -9.987 -14.228  -0.828
  107    H    GLN  15           H        GLN  15  -7.609 -11.686  -1.955
  108    HA   GLN  15           HA       GLN  15  -5.796 -13.788  -1.501
  109   1HB   GLN  15          1HB       GLN  15  -5.912 -12.990  -3.730
  110   2HB   GLN  15          2HB       GLN  15  -5.813 -11.310  -3.242
  111   1HG   GLN  15          1HG       GLN  15  -3.656 -11.875  -4.154
  112   2HG   GLN  15          2HG       GLN  15  -3.441 -11.769  -2.418
  113   1HE2  GLN  15          1HE2      GLN  15  -3.561 -13.827  -5.201
  114   2HE2  GLN  15          2HE2      GLN  15  -2.971 -15.284  -4.474
  115    H    LEU  16           H        LEU  16  -5.685 -10.204  -0.919
  116    HA   LEU  16           HA       LEU  16  -3.161 -10.066   0.145
  117   1HB   LEU  16          1HB       LEU  16  -5.486  -8.423  -0.062
  118   2HB   LEU  16          2HB       LEU  16  -4.866  -8.290   1.571
  119    HG   LEU  16           HG       LEU  16  -3.321  -7.760  -0.981
  120   1HD1  LEU  16          1HD1      LEU  16  -5.100  -6.126   0.476
  121   2HD1  LEU  16          2HD1      LEU  16  -3.459  -5.544   0.848
  122   3HD1  LEU  16          3HD1      LEU  16  -4.002  -5.654  -0.844
  123   1HD2  LEU  16          1HD2      LEU  16  -2.379  -8.419   1.663
  124   2HD2  LEU  16          2HD2      LEU  16  -1.459  -8.112   0.171
  125   3HD2  LEU  16          3HD2      LEU  16  -1.908  -6.757   1.234
  126    H    GLN  17           H        GLN  17  -6.264 -11.010   1.707
  127    HA   GLN  17           HA       GLN  17  -5.311 -11.069   4.288
  128   1HB   GLN  17          1HB       GLN  17  -7.733 -11.429   3.183
  129   2HB   GLN  17          2HB       GLN  17  -7.324 -13.120   3.390
  130   1HG   GLN  17          1HG       GLN  17  -6.752 -12.584   5.833
  131   2HG   GLN  17          2HG       GLN  17  -7.419 -10.985   5.568
  132   1HE2  GLN  17          1HE2      GLN  17  -8.196 -14.419   5.047
  133   2HE2  GLN  17          2HE2      GLN  17  -9.875 -14.332   5.464
  134    H    LYS  18           H        LYS  18  -5.623 -13.791   1.892
  135    HA   LYS  18           HA       LYS  18  -4.553 -15.784   3.418
  136   1HB   LYS  18          1HB       LYS  18  -5.617 -15.966   1.150
  137   2HB   LYS  18          2HB       LYS  18  -4.117 -15.401   0.443
  138   1HG   LYS  18          1HG       LYS  18  -2.929 -17.323   1.651
  139   2HG   LYS  18          2HG       LYS  18  -4.508 -17.929   2.108
  140   1HD   LYS  18          1HD       LYS  18  -5.136 -18.360  -0.163
  141   2HD   LYS  18          2HD       LYS  18  -3.865 -17.338  -0.803
  142   1HE   LYS  18          1HE       LYS  18  -2.144 -18.923  -0.211
  143   2HE   LYS  18          2HE       LYS  18  -3.224 -19.827   0.831
  144   1HZ   LYS  18          1HZ       LYS  18  -4.541 -20.053  -1.391
  145   2HZ   LYS  18          2HZ       LYS  18  -3.069 -19.818  -2.058
  146   3HZ   LYS  18          3HZ       LYS  18  -3.312 -21.067  -1.034
  147    H    TYR  19           H        TYR  19  -2.827 -13.315   1.421
  148    HA   TYR  19           HA       TYR  19  -0.261 -14.335   1.893
  149   1HB   TYR  19          1HB       TYR  19  -1.583 -11.670   1.176
  150   2HB   TYR  19          2HB       TYR  19   0.152 -11.708   1.422
  151    HD1  TYR  19           1HD      TYR  19   0.829 -14.359   0.206
  152    HD2  TYR  19           2HD      TYR  19  -1.811 -11.267  -1.125
  153    HE1  TYR  19           1HE      TYR  19   1.149 -15.112  -2.201
  154    HE2  TYR  19           2HE      TYR  19  -1.482 -12.031  -3.528
  155    HH   TYR  19           HH       TYR  19  -0.256 -14.962  -4.334
  156    H    MET  20           H        MET  20  -2.284 -11.907   3.640
  157    HA   MET  20           HA       MET  20  -0.229 -11.170   5.392
  158   1HB   MET  20          1HB       MET  20  -2.183  -9.727   5.021
  159   2HB   MET  20          2HB       MET  20  -3.286 -10.998   5.508
  160   1HG   MET  20          1HG       MET  20  -2.168 -10.941   7.823
  161   2HG   MET  20          2HG       MET  20  -1.309  -9.508   7.295
  162   1HE   MET  20          1HE       MET  20  -3.510  -6.823   6.814
  163   2HE   MET  20          2HE       MET  20  -2.498  -7.900   5.823
  164   3HE   MET  20          3HE       MET  20  -4.262  -7.869   5.586
  165    H    GLU  21           H        GLU  21  -2.857 -13.627   5.514
  166    HA   GLU  21           HA       GLU  21  -2.804 -14.288   8.119
  167   1HB   GLU  21          1HB       GLU  21  -3.269 -15.839   5.586
  168   2HB   GLU  21          2HB       GLU  21  -3.142 -16.750   7.077
  169   1HG   GLU  21          1HG       GLU  21  -4.863 -15.049   8.055
  170   2HG   GLU  21          2HG       GLU  21  -5.142 -14.561   6.395
  171    H    TYR  22           H        TYR  22  -0.564 -15.463   5.526
  172    HA   TYR  22           HA       TYR  22   0.900 -17.178   7.198
  173   1HB   TYR  22          1HB       TYR  22   0.688 -16.517   4.509
  174   2HB   TYR  22          2HB       TYR  22   2.168 -15.666   4.903
  175    HD1  TYR  22           1HD      TYR  22   4.232 -16.828   5.138
  176    HD2  TYR  22           2HD      TYR  22   0.570 -19.025   4.888
  177    HE1  TYR  22           1HE      TYR  22   5.540 -18.991   4.863
  178    HE2  TYR  22           2HE      TYR  22   1.890 -21.180   4.614
  179    HH   TYR  22           HH       TYR  22   5.429 -21.162   4.798
  180    H    SER  23           H        SER  23   1.295 -13.711   6.276
  181    HA   SER  23           HA       SER  23   3.768 -13.511   7.623
  182   1HB   SER  23          1HB       SER  23   2.616 -10.921   7.357
  183   2HB   SER  23          2HB       SER  23   3.843 -11.654   6.344
  184    HG   SER  23           HG       SER  23   2.350 -12.225   4.840
  185    H    THR  24           H        THR  24   4.130 -11.990   9.521
  186    HA   THR  24           HA       THR  24   1.801 -11.551  11.198
  187    HB   THR  24           HB       THR  24   2.935 -13.965  11.494
  188    HG1  THR  24           1HG      THR  24   1.544 -13.594  13.173
  189   1HG2  THR  24          1HG2      THR  24   5.177 -12.454  12.057
  190   2HG2  THR  24          2HG2      THR  24   4.441 -12.579  13.672
  191   3HG2  THR  24          3HG2      THR  24   4.863 -14.054  12.770
  192    H    LYS  25           H        LYS  25   4.038 -10.095   9.630
  193    HA   LYS  25           HA       LYS  25   5.364  -8.770  11.853
  194   1HB   LYS  25          1HB       LYS  25   5.804  -8.995   8.912
  195   2HB   LYS  25          2HB       LYS  25   6.316  -7.506   9.682
  196   1HG   LYS  25          1HG       LYS  25   8.201  -8.600  10.319
  197   2HG   LYS  25          2HG       LYS  25   7.210  -9.482  11.464
  198   1HD   LYS  25          1HD       LYS  25   7.599 -11.402  10.329
  199   2HD   LYS  25          2HD       LYS  25   6.809 -10.731   8.916
  200   1HE   LYS  25          1HE       LYS  25   8.971 -11.230   8.104
  201   2HE   LYS  25          2HE       LYS  25   9.086  -9.518   8.460
  202   1HZ   LYS  25          1HZ       LYS  25   9.781 -11.477  10.507
  203   2HZ   LYS  25          2HZ       LYS  25  10.863 -11.084   9.348
  204   3HZ   LYS  25          3HZ       LYS  25  10.289  -9.932  10.353
  205    H    LYS  26           H        LYS  26   5.583  -6.185  11.207
  206    HA   LYS  26           HA       LYS  26   2.785  -5.316  11.144
  207   1HB   LYS  26          1HB       LYS  26   5.246  -4.034  12.365
  208   2HB   LYS  26          2HB       LYS  26   3.667  -3.278  12.299
  209   1HG   LYS  26          1HG       LYS  26   2.977  -5.710  13.365
  210   2HG   LYS  26          2HG       LYS  26   4.610  -5.563  13.984
  211   1HD   LYS  26          1HD       LYS  26   3.742  -3.052  14.545
  212   2HD   LYS  26          2HD       LYS  26   2.193  -3.872  14.570
  213   1HE   LYS  26          1HE       LYS  26   4.459  -5.192  16.049
  214   2HE   LYS  26          2HE       LYS  26   3.798  -3.729  16.751
  215   1HZ   LYS  26          1HZ       LYS  26   2.122  -5.988  15.914
  216   2HZ   LYS  26          2HZ       LYS  26   2.697  -5.814  17.433
  217   3HZ   LYS  26          3HZ       LYS  26   1.672  -4.703  16.816
  218    H    VAL  27           H        VAL  27   2.153  -3.552   9.810
  219    HA   VAL  27           HA       VAL  27   3.572  -3.456   7.354
  220    HB   VAL  27           HB       VAL  27   1.106  -3.360   7.634
  221   1HG1  VAL  27          1HG1      VAL  27  -0.015  -1.669   8.664
  222   2HG1  VAL  27          2HG1      VAL  27   1.509  -1.535   9.574
  223   3HG1  VAL  27          3HG1      VAL  27   1.190  -0.441   8.207
  224   1HG2  VAL  27          1HG2      VAL  27   1.928  -2.724   5.510
  225   2HG2  VAL  27          2HG2      VAL  27   0.782  -1.443   5.972
  226   3HG2  VAL  27          3HG2      VAL  27   2.534  -1.165   6.118
  227    H    SER  28           H        SER  28   3.337  -1.412  10.276
  228    HA   SER  28           HA       SER  28   4.610   0.792   9.070
  229   1HB   SER  28          1HB       SER  28   4.595   1.765  11.264
  230   2HB   SER  28          2HB       SER  28   3.111   0.842  11.126
  231    HG   SER  28           HG       SER  28   5.266   0.490  12.854
  232    H    ASP  29           H        ASP  29   5.653  -2.221  10.587
  233    HA   ASP  29           HA       ASP  29   8.245  -1.320  11.226
  234   1HB   ASP  29          1HB       ASP  29   6.796  -3.952  11.092
  235   2HB   ASP  29          2HB       ASP  29   8.546  -4.017  11.047
  236    H    VAL  30           H        VAL  30   6.638  -3.052   8.497
  237    HA   VAL  30           HA       VAL  30   9.065  -3.578   7.107
  238    HB   VAL  30           HB       VAL  30   6.161  -3.610   6.263
  239   1HG1  VAL  30          1HG1      VAL  30   8.338  -3.540   4.568
  240   2HG1  VAL  30          2HG1      VAL  30   8.047  -5.286   4.758
  241   3HG1  VAL  30          3HG1      VAL  30   6.741  -4.224   4.181
  242   1HG2  VAL  30          1HG2      VAL  30   7.162  -6.216   6.352
  243   2HG2  VAL  30          2HG2      VAL  30   7.826  -5.435   7.807
  244   3HG2  VAL  30          3HG2      VAL  30   6.068  -5.451   7.529
  245    H    LEU  31           H        LEU  31   6.644  -0.955   7.210
  246    HA   LEU  31           HA       LEU  31   7.567   0.309   4.846
  247   1HB   LEU  31          1HB       LEU  31   5.805   1.103   7.146
  248   2HB   LEU  31          2HB       LEU  31   6.288   2.275   5.936
  249    HG   LEU  31           HG       LEU  31   4.744  -0.284   5.429
  250   1HD1  LEU  31          1HD1      LEU  31   3.948   2.599   5.704
  251   2HD1  LEU  31          2HD1      LEU  31   3.014   1.504   4.657
  252   3HD1  LEU  31          3HD1      LEU  31   3.196   1.139   6.390
  253   1HD2  LEU  31          1HD2      LEU  31   4.448   0.909   3.122
  254   2HD2  LEU  31          2HD2      LEU  31   5.965   1.726   3.567
  255   3HD2  LEU  31          3HD2      LEU  31   5.910  -0.050   3.455
  256    H    LYS  32           H        LYS  32   8.593   0.215   8.223
  257    HA   LYS  32           HA       LYS  32   9.968   2.627   8.329
  258   1HB   LYS  32          1HB       LYS  32  10.516   1.926  10.385
  259   2HB   LYS  32          2HB       LYS  32   9.439   0.583  10.060
  260   1HG   LYS  32          1HG       LYS  32  11.365  -0.755   9.189
  261   2HG   LYS  32          2HG       LYS  32  12.444   0.590   9.501
  262   1HD   LYS  32          1HD       LYS  32  11.184   0.299  11.961
  263   2HD   LYS  32          2HD       LYS  32  11.257  -1.361  11.403
  264   1HE   LYS  32          1HE       LYS  32  13.302  -0.912  12.638
  265   2HE   LYS  32          2HE       LYS  32  13.729  -1.054  10.944
  266   1HZ   LYS  32          1HZ       LYS  32  13.119   1.556  12.109
  267   2HZ   LYS  32          2HZ       LYS  32  14.613   0.911  12.238
  268   3HZ   LYS  32          3HZ       LYS  32  13.981   1.219  10.764
  269    H    LEU  33           H        LEU  33  10.512  -0.201   6.412
  270    HA   LEU  33           HA       LEU  33  13.349   0.163   6.201
  271   1HB   LEU  33          1HB       LEU  33  11.353  -1.564   4.739
  272   2HB   LEU  33          2HB       LEU  33  13.065  -1.542   4.363
  273    HG   LEU  33           HG       LEU  33  12.235  -2.070   7.193
  274   1HD1  LEU  33          1HD1      LEU  33  12.475  -4.583   5.904
  275   2HD1  LEU  33          2HD1      LEU  33  11.059  -3.891   6.732
  276   3HD1  LEU  33          3HD1      LEU  33  11.286  -3.628   4.986
  277   1HD2  LEU  33          1HD2      LEU  33  14.324  -2.865   7.451
  278   2HD2  LEU  33          2HD2      LEU  33  14.343  -3.651   5.854
  279   3HD2  LEU  33          3HD2      LEU  33  14.658  -1.905   5.990
  280    H    PHE  34           H        PHE  34  10.393   1.048   4.364
  281    HA   PHE  34           HA       PHE  34  11.943   2.173   2.228
  282   1HB   PHE  34          1HB       PHE  34   9.084   1.708   3.053
  283   2HB   PHE  34          2HB       PHE  34   9.322   3.112   2.031
  284    HD1  PHE  34           1HD      PHE  34  10.672   2.712  -0.165
  285    HD2  PHE  34           2HD      PHE  34   8.835  -0.385   2.080
  286    HE1  PHE  34           1HE      PHE  34  10.686   1.234  -2.193
  287    HE2  PHE  34           2HE      PHE  34   8.849  -1.863   0.051
  288    HZ   PHE  34           HZ       PHE  34   9.774  -1.036  -2.061
  289    H    GLU  35           H        GLU  35  10.951   3.172   5.379
  290    HA   GLU  35           HA       GLU  35  10.691   5.928   4.673
  291   1HB   GLU  35          1HB       GLU  35  10.877   4.614   7.420
  292   2HB   GLU  35          2HB       GLU  35  10.393   6.269   7.111
  293   1HG   GLU  35          1HG       GLU  35   8.790   4.536   5.438
  294   2HG   GLU  35          2HG       GLU  35   8.755   3.903   7.072
  295    H    ASP  36           H        ASP  36  12.971   3.967   6.726
  296    HA   ASP  36           HA       ASP  36  14.939   6.051   6.190
  297   1HB   ASP  36          1HB       ASP  36  14.080   4.775   8.641
  298   2HB   ASP  36          2HB       ASP  36  15.750   4.329   8.357
  299    H    GLY  37           H        GLY  37  14.102   2.579   6.296
  300   1HA   GLY  37          1HA       GLY  37  16.586   1.387   6.011
  301   2HA   GLY  37          2HA       GLY  37  15.067   0.758   5.403
  302    H    GLU  38           H        GLU  38  17.456   0.305   3.996
  303    HA   GLU  38           HA       GLU  38  18.136   2.180   2.136
  304   1HB   GLU  38          1HB       GLU  38  19.392   0.496   1.173
  305   2HB   GLU  38          2HB       GLU  38  19.051  -0.264   2.715
  306   1HG   GLU  38          1HG       GLU  38  16.891  -1.191   1.502
  307   2HG   GLU  38          2HG       GLU  38  17.746  -0.788   0.026
  308    H    MET  39           H        MET  39  15.239   0.202   2.387
  309    HA   MET  39           HA       MET  39  14.512   0.167  -0.283
  310   1HB   MET  39          1HB       MET  39  12.765   0.285   2.240
  311   2HB   MET  39          2HB       MET  39  12.203  -0.239   0.665
  312   1HG   MET  39          1HG       MET  39  14.483  -1.581   2.197
  313   2HG   MET  39          2HG       MET  39  12.824  -2.145   2.216
  314   1HE   MET  39          1HE       MET  39  11.496  -2.127  -0.017
  315   2HE   MET  39          2HE       MET  39  12.370  -1.227  -1.280
  316   3HE   MET  39          3HE       MET  39  12.100  -2.977  -1.460
  317    H    ALA  40           H        ALA  40  14.835   2.818   1.867
  318    HA   ALA  40           HA       ALA  40  12.682   4.392   0.839
  319   1HB   ALA  40          1HB       ALA  40  15.156   5.348   2.315
  320   2HB   ALA  40          2HB       ALA  40  13.536   6.084   2.285
  321   3HB   ALA  40          3HB       ALA  40  13.799   4.546   3.141
  322    H    LYS  41           H        LYS  41  15.471   3.214  -0.569
  323    HA   LYS  41           HA       LYS  41  16.492   5.533  -1.801
  324   1HB   LYS  41          1HB       LYS  41  17.751   3.996  -3.174
  325   2HB   LYS  41          2HB       LYS  41  17.762   3.440  -1.513
  326   1HG   LYS  41          1HG       LYS  41  15.884   1.854  -2.048
  327   2HG   LYS  41          2HG       LYS  41  15.921   2.391  -3.716
  328   1HD   LYS  41          1HD       LYS  41  18.393   1.265  -2.334
  329   2HD   LYS  41          2HD       LYS  41  17.232   0.229  -3.141
  330   1HE   LYS  41          1HE       LYS  41  18.310   0.644  -5.094
  331   2HE   LYS  41          2HE       LYS  41  17.742   2.299  -5.005
  332   1HZ   LYS  41          1HZ       LYS  41  20.071   1.599  -3.432
  333   2HZ   LYS  41          2HZ       LYS  41  20.264   1.728  -5.048
  334   3HZ   LYS  41          3HZ       LYS  41  19.712   3.001  -4.188
  335    H    TYR  42           H        TYR  42  13.528   3.854  -2.148
  336    HA   TYR  42           HA       TYR  42  13.217   4.895  -4.881
  337   1HB   TYR  42          1HB       TYR  42  11.990   2.643  -3.192
  338   2HB   TYR  42          2HB       TYR  42  11.185   3.191  -4.648
  339    HD1  TYR  42           1HD      TYR  42  12.668   0.459  -3.735
  340    HD2  TYR  42           2HD      TYR  42  13.552   3.659  -6.434
  341    HE1  TYR  42           1HE      TYR  42  14.111  -1.104  -5.127
  342    HE2  TYR  42           2HE      TYR  42  14.992   2.085  -7.816
  343    HH   TYR  42           HH       TYR  42  16.334  -0.318  -6.993
  344    H    VAL  43           H        VAL  43  12.695   5.800  -1.747
  345    HA   VAL  43           HA       VAL  43   9.959   6.707  -2.171
  346    HB   VAL  43           HB       VAL  43  11.787   6.319   0.146
  347   1HG1  VAL  43          1HG1      VAL  43  11.369   8.452   0.835
  348   2HG1  VAL  43          2HG1      VAL  43   9.877   8.592  -0.124
  349   3HG1  VAL  43          3HG1      VAL  43   9.865   7.698   1.415
  350   1HG2  VAL  43          1HG2      VAL  43  10.126   4.621  -0.387
  351   2HG2  VAL  43          2HG2      VAL  43   9.718   5.406   1.157
  352   3HG2  VAL  43          3HG2      VAL  43   8.825   5.834  -0.322
  353    H    GLN  44           H        GLN  44   9.383   8.881  -2.370
  354    HA   GLN  44           HA       GLN  44  11.671  10.634  -2.800
  355   1HB   GLN  44          1HB       GLN  44   8.937  10.458  -4.079
  356   2HB   GLN  44          2HB       GLN  44   9.784  11.992  -4.080
  357   1HG   GLN  44          1HG       GLN  44  11.795  10.255  -4.876
  358   2HG   GLN  44          2HG       GLN  44  10.384   9.500  -5.589
  359   1HE2  GLN  44          1HE2      GLN  44   9.062  10.678  -7.027
  360   2HE2  GLN  44          2HE2      GLN  44   9.667  12.028  -7.928
  361    H    GLY  45           H        GLY  45  11.808  11.102  -0.476
  362   1HA   GLY  45          1HA       GLY  45  11.505  12.688   1.130
  363   2HA   GLY  45          2HA       GLY  45  10.128  13.329   0.258
  364    H    ASP  46           H        ASP  46   8.008  12.552   0.675
  365    HA   ASP  46           HA       ASP  46   7.905  10.741   2.959
  366   1HB   ASP  46          1HB       ASP  46   6.872  13.349   2.667
  367   2HB   ASP  46          2HB       ASP  46   5.473  12.322   2.429
  368    H    ALA  47           H        ALA  47   7.339  11.129  -0.373
  369    HA   ALA  47           HA       ALA  47   5.037   9.311  -0.362
  370   1HB   ALA  47          1HB       ALA  47   4.263  10.567  -2.056
  371   2HB   ALA  47          2HB       ALA  47   5.625  11.682  -1.794
  372   3HB   ALA  47          3HB       ALA  47   5.777  10.350  -2.965
  373    H    ILE  48           H        ILE  48   5.143   7.803  -2.460
  374    HA   ILE  48           HA       ILE  48   7.858   6.896  -2.933
  375    HB   ILE  48           HB       ILE  48   6.902   5.761  -0.860
  376   1HG1  ILE  48          1HG1      ILE  48   8.731   4.976  -2.672
  377   2HG1  ILE  48          2HG1      ILE  48   8.324   4.053  -1.239
  378   1HG2  ILE  48          1HG2      ILE  48   4.622   5.428  -1.728
  379   2HG2  ILE  48          2HG2      ILE  48   5.260   4.293  -2.942
  380   3HG2  ILE  48          3HG2      ILE  48   5.379   3.903  -1.210
  381   1HD1  ILE  48          1HD1      ILE  48   7.119   3.666  -4.017
  382   2HD1  ILE  48          2HD1      ILE  48   8.282   2.587  -3.211
  383   3HD1  ILE  48          3HD1      ILE  48   6.633   2.759  -2.565
  384    H    GLY  49           H        GLY  49   7.984   5.419  -4.802
  385   1HA   GLY  49          1HA       GLY  49   6.161   6.233  -6.852
  386   2HA   GLY  49          2HA       GLY  49   7.514   5.129  -6.996
  387    H    TYR  50           H        TYR  50   5.426   4.327  -8.432
  388    HA   TYR  50           HA       TYR  50   3.586   2.756  -6.880
  389   1HB   TYR  50          1HB       TYR  50   2.810   3.746  -8.961
  390   2HB   TYR  50          2HB       TYR  50   4.291   3.330  -9.801
  391    HD1  TYR  50           1HD      TYR  50   3.118   2.328 -11.681
  392    HD2  TYR  50           2HD      TYR  50   2.535   0.857  -7.706
  393    HE1  TYR  50           1HE      TYR  50   2.001   0.241 -12.609
  394    HE2  TYR  50           2HE      TYR  50   1.420  -1.225  -8.648
  395    HH   TYR  50           HH       TYR  50   0.886  -2.330 -10.424
  396    H    GLU  51           H        GLU  51   6.256   2.092  -9.254
  397    HA   GLU  51           HA       GLU  51   6.082  -0.638  -9.116
  398   1HB   GLU  51          1HB       GLU  51   7.533   1.036 -10.602
  399   2HB   GLU  51          2HB       GLU  51   8.772   0.699  -9.409
  400   1HG   GLU  51          1HG       GLU  51   9.225  -1.263 -10.444
  401   2HG   GLU  51          2HG       GLU  51   7.607  -1.826 -10.075
  402    H    GLY  52           H        GLY  52   7.937   1.691  -7.075
  403   1HA   GLY  52          1HA       GLY  52   9.455  -0.084  -5.595
  404   2HA   GLY  52          2HA       GLY  52   8.860   1.468  -5.038
  405    H    PHE  53           H        PHE  53   6.008   0.924  -5.203
  406    HA   PHE  53           HA       PHE  53   5.568  -0.138  -2.703
  407   1HB   PHE  53          1HB       PHE  53   4.152   0.986  -4.922
  408   2HB   PHE  53          2HB       PHE  53   3.380  -0.565  -4.658
  409    HD1  PHE  53           1HD      PHE  53   3.687   2.815  -3.517
  410    HD2  PHE  53           2HD      PHE  53   2.468  -1.076  -2.342
  411    HE1  PHE  53           1HE      PHE  53   2.344   3.802  -1.641
  412    HE2  PHE  53           2HE      PHE  53   1.125  -0.088  -0.466
  413    HZ   PHE  53           HZ       PHE  53   1.079   2.339  -0.138
  414    H    GLN  54           H        GLN  54   5.973  -1.750  -5.831
  415    HA   GLN  54           HA       GLN  54   4.649  -4.104  -5.206
  416   1HB   GLN  54          1HB       GLN  54   7.096  -3.901  -7.002
  417   2HB   GLN  54          2HB       GLN  54   5.764  -5.032  -7.132
  418   1HG   GLN  54          1HG       GLN  54   4.731  -2.308  -7.168
  419   2HG   GLN  54          2HG       GLN  54   5.997  -2.468  -8.369
  420   1HE2  GLN  54          1HE2      GLN  54   4.425  -2.215  -9.986
  421   2HE2  GLN  54          2HE2      GLN  54   3.393  -3.514 -10.483
  422    H    GLN  55           H        GLN  55   7.891  -2.866  -4.407
  423    HA   GLN  55           HA       GLN  55   8.905  -5.373  -3.620
  424   1HB   GLN  55          1HB       GLN  55   9.847  -2.645  -3.845
  425   2HB   GLN  55          2HB       GLN  55  10.295  -3.264  -2.268
  426   1HG   GLN  55          1HG       GLN  55  10.941  -4.504  -4.978
  427   2HG   GLN  55          2HG       GLN  55  12.077  -3.817  -3.835
  428   1HE2  GLN  55          1HE2      GLN  55  12.589  -4.897  -1.935
  429   2HE2  GLN  55          2HE2      GLN  55  12.286  -6.586  -1.699
  430    H    PHE  56           H        PHE  56   7.199  -2.669  -1.998
  431    HA   PHE  56           HA       PHE  56   7.671  -3.387   0.626
  432   1HB   PHE  56          1HB       PHE  56   6.581  -1.303   0.242
  433   2HB   PHE  56          2HB       PHE  56   5.549  -1.967  -1.009
  434    HD1  PHE  56           1HD      PHE  56   6.061  -1.880   2.662
  435    HD2  PHE  56           2HD      PHE  56   3.358  -2.665  -0.514
  436    HE1  PHE  56           1HE      PHE  56   4.174  -2.049   4.309
  437    HE2  PHE  56           2HE      PHE  56   1.472  -2.834   1.133
  438    HZ   PHE  56           HZ       PHE  56   1.902  -2.524   3.525
  439    H    LEU  57           H        LEU  57   5.066  -4.453  -1.653
  440    HA   LEU  57           HA       LEU  57   3.643  -5.962   0.198
  441   1HB   LEU  57          1HB       LEU  57   3.918  -6.040  -2.794
  442   2HB   LEU  57          2HB       LEU  57   2.919  -7.201  -1.943
  443    HG   LEU  57           HG       LEU  57   2.342  -4.455  -1.125
  444   1HD1  LEU  57          1HD1      LEU  57   1.128  -4.635  -3.704
  445   2HD1  LEU  57          2HD1      LEU  57   2.216  -3.382  -3.059
  446   3HD1  LEU  57          3HD1      LEU  57   2.890  -4.804  -3.892
  447   1HD2  LEU  57          1HD2      LEU  57   0.200  -5.209  -1.018
  448   2HD2  LEU  57          2HD2      LEU  57   0.350  -6.201  -2.488
  449   3HD2  LEU  57          3HD2      LEU  57   1.044  -6.775  -0.953
  450    H    LYS  58           H        LYS  58   6.756  -6.468  -1.302
  451    HA   LYS  58           HA       LYS  58   6.760  -9.295  -1.117
  452   1HB   LYS  58          1HB       LYS  58   8.255  -7.570  -2.477
  453   2HB   LYS  58          2HB       LYS  58   9.281  -7.681  -1.061
  454   1HG   LYS  58          1HG       LYS  58   8.250 -10.277  -2.161
  455   2HG   LYS  58          2HG       LYS  58   9.429  -9.431  -3.144
  456   1HD   LYS  58          1HD       LYS  58  10.028  -9.676  -0.206
  457   2HD   LYS  58          2HD       LYS  58  10.141 -11.139  -1.164
  458   1HE   LYS  58          1HE       LYS  58  11.558  -9.642  -2.826
  459   2HE   LYS  58          2HE       LYS  58  11.731  -8.570  -1.450
  460   1HZ   LYS  58          1HZ       LYS  58  12.309 -11.427  -1.210
  461   2HZ   LYS  58          2HZ       LYS  58  13.438 -10.378  -1.751
  462   3HZ   LYS  58          3HZ       LYS  58  12.815 -10.205  -0.251
  463    H    ILE  59           H        ILE  59   8.377  -6.716   0.876
  464    HA   ILE  59           HA       ILE  59   9.031  -8.592   2.908
  465    HB   ILE  59           HB       ILE  59   9.039  -5.573   2.973
  466   1HG1  ILE  59          1HG1      ILE  59  11.366  -7.387   2.306
  467   2HG1  ILE  59          2HG1      ILE  59  10.336  -6.681   1.076
  468   1HG2  ILE  59          1HG2      ILE  59   9.254  -7.170   5.114
  469   2HG2  ILE  59          2HG2      ILE  59  10.946  -7.206   4.562
  470   3HG2  ILE  59          3HG2      ILE  59  10.166  -5.651   4.937
  471   1HD1  ILE  59          1HD1      ILE  59  12.159  -5.155   1.306
  472   2HD1  ILE  59          2HD1      ILE  59  10.816  -4.394   2.192
  473   3HD1  ILE  59          3HD1      ILE  59  12.106  -5.236   3.083
  474    H    TYR  60           H        TYR  60   6.519  -6.027   2.485
  475    HA   TYR  60           HA       TYR  60   5.343  -5.945   4.878
  476   1HB   TYR  60          1HB       TYR  60   4.540  -4.782   2.835
  477   2HB   TYR  60          2HB       TYR  60   4.201  -6.309   2.045
  478    HD1  TYR  60           1HD      TYR  60   3.262  -6.135   5.541
  479    HD2  TYR  60           2HD      TYR  60   1.932  -5.316   1.558
  480    HE1  TYR  60           1HE      TYR  60   0.858  -6.026   6.359
  481    HE2  TYR  60           2HE      TYR  60  -0.468  -5.209   2.390
  482    HH   TYR  60           HH       TYR  60  -1.299  -6.171   5.624
  483    H    LEU  61           H        LEU  61   3.988  -8.214   2.392
  484    HA   LEU  61           HA       LEU  61   2.937  -9.839   4.524
  485   1HB   LEU  61          1HB       LEU  61   2.797 -10.357   1.560
  486   2HB   LEU  61          2HB       LEU  61   1.757 -10.993   2.819
  487    HG   LEU  61           HG       LEU  61   1.574  -8.161   2.967
  488   1HD1  LEU  61          1HD1      LEU  61   1.795  -9.196   0.181
  489   2HD1  LEU  61          2HD1      LEU  61   0.519  -8.003   0.527
  490   3HD1  LEU  61          3HD1      LEU  61   2.223  -7.607   0.858
  491   1HD2  LEU  61          1HD2      LEU  61  -0.621  -8.613   3.105
  492   2HD2  LEU  61          2HD2      LEU  61  -0.618  -9.617   1.635
  493   3HD2  LEU  61          3HD2      LEU  61  -0.083 -10.308   3.186
  494    H    GLU  62           H        GLU  62   5.941  -9.510   3.074
  495    HA   GLU  62           HA       GLU  62   7.747 -10.720   3.153
  496   1HB   GLU  62          1HB       GLU  62   6.250 -11.773   5.280
  497   2HB   GLU  62          2HB       GLU  62   6.739 -13.198   4.384
  498   1HG   GLU  62          1HG       GLU  62   9.047 -11.542   4.445
  499   2HG   GLU  62          2HG       GLU  62   8.361 -11.421   6.053
  500    H    VAL  63           H        VAL  63   5.134 -11.305   1.336
  501    HA   VAL  63           HA       VAL  63   5.346 -13.879   0.366
  502    HB   VAL  63           HB       VAL  63   4.460 -12.723  -1.779
  503   1HG1  VAL  63          1HG1      VAL  63   3.054 -13.942  -0.192
  504   2HG1  VAL  63          2HG1      VAL  63   2.975 -12.510   0.863
  505   3HG1  VAL  63          3HG1      VAL  63   2.230 -12.467  -0.754
  506   1HG2  VAL  63          1HG2      VAL  63   5.317 -10.440  -0.381
  507   2HG2  VAL  63          2HG2      VAL  63   4.344 -10.496  -1.870
  508   3HG2  VAL  63          3HG2      VAL  63   3.539 -10.417  -0.284
  509    H    ASP  64           H        ASP  64   6.522 -14.862  -1.328
  510    HA   ASP  64           HA       ASP  64   9.104 -13.732  -1.662
  511   1HB   ASP  64          1HB       ASP  64   7.816 -16.314  -1.965
  512   2HB   ASP  64          2HB       ASP  64   8.676 -15.948  -3.447
  513    H    ASN  65           H        ASN  65   6.057 -13.427  -3.200
  514    HA   ASN  65           HA       ASN  65   7.092 -11.865  -5.251
  515   1HB   ASN  65          1HB       ASN  65   5.843 -13.600  -7.006
  516   2HB   ASN  65          2HB       ASN  65   7.578 -13.531  -6.768
  517   1HD2  ASN  65          1HD2      ASN  65   4.601 -15.042  -5.597
  518   2HD2  ASN  65          2HD2      ASN  65   5.287 -16.556  -5.109
  519    H    VAL  66           H        VAL  66   5.432 -10.345  -5.322
  520    HA   VAL  66           HA       VAL  66   2.748 -11.224  -4.629
  521    HB   VAL  66           HB       VAL  66   4.299  -9.006  -4.023
  522   1HG1  VAL  66          1HG1      VAL  66   2.083  -8.170  -5.925
  523   2HG1  VAL  66          2HG1      VAL  66   3.077  -7.080  -4.930
  524   3HG1  VAL  66          3HG1      VAL  66   3.831  -8.033  -6.231
  525   1HG2  VAL  66          1HG2      VAL  66   1.655  -8.288  -3.434
  526   2HG2  VAL  66          2HG2      VAL  66   1.657 -10.068  -3.442
  527   3HG2  VAL  66          3HG2      VAL  66   2.785  -9.182  -2.389
  528    HA   PRO  67           HA       PRO  67   1.416 -11.094  -8.739
  529   1HB   PRO  67          1HB       PRO  67  -1.281 -10.813  -8.396
  530   2HB   PRO  67          2HB       PRO  67  -0.451 -12.349  -8.245
  531   1HG   PRO  67          1HG       PRO  67  -1.524 -10.605  -6.113
  532   2HG   PRO  67          2HG       PRO  67  -1.086 -12.300  -6.028
  533   1HD   PRO  67          1HD       PRO  67   0.430 -10.083  -5.022
  534   2HD   PRO  67          2HD       PRO  67   0.920 -11.765  -5.041
  535    H    ARG  68           H        ARG  68   1.428  -9.705 -10.410
  536    HA   ARG  68           HA       ARG  68   1.585  -7.027  -9.771
  537   1HB   ARG  68          1HB       ARG  68   2.595  -7.996 -11.813
  538   2HB   ARG  68          2HB       ARG  68   1.012  -8.399 -12.445
  539   1HG   ARG  68          1HG       ARG  68   1.698  -6.353 -13.533
  540   2HG   ARG  68          2HG       ARG  68   0.430  -5.924 -12.402
  541   1HD   ARG  68          1HD       ARG  68   2.023  -4.285 -11.897
  542   2HD   ARG  68          2HD       ARG  68   2.445  -5.511 -10.718
  543    HE   ARG  68           HE       ARG  68   3.971  -4.816 -13.157
  544   1HH1  ARG  68          2HH2      ARG  68   3.567  -7.020 -10.444
  545   2HH1  ARG  68          1HH2      ARG  68   5.174  -7.658 -10.558
  546   1HH2  ARG  68          2HH1      ARG  68   6.090  -5.658 -13.308
  547   2HH2  ARG  68          1HH1      ARG  68   6.618  -6.878 -12.198
  548    H    HIS  69           H        HIS  69  -1.127  -9.123 -10.791
  549    HA   HIS  69           HA       HIS  69  -2.928  -7.225 -11.607
  550   1HB   HIS  69          1HB       HIS  69  -3.033  -9.983 -10.550
  551   2HB   HIS  69          2HB       HIS  69  -4.515  -9.068 -10.353
  552    HD1  HIS  69           1HD      HIS  69  -5.830 -10.392 -12.130
  553    HD2  HIS  69           2HD      HIS  69  -2.331  -8.609 -13.606
  554    HE1  HIS  69           1HE      HIS  69  -5.941 -10.594 -14.672
  555    H    LEU  70           H        LEU  70  -2.154  -8.380  -8.273
  556    HA   LEU  70           HA       LEU  70  -4.119  -6.706  -7.079
  557   1HB   LEU  70          1HB       LEU  70  -3.656  -8.581  -5.844
  558   2HB   LEU  70          2HB       LEU  70  -1.932  -8.508  -6.151
  559    HG   LEU  70           HG       LEU  70  -2.060  -6.319  -4.682
  560   1HD1  LEU  70          1HD1      LEU  70  -4.608  -7.774  -3.993
  561   2HD1  LEU  70          2HD1      LEU  70  -3.763  -6.751  -2.807
  562   3HD1  LEU  70          3HD1      LEU  70  -4.354  -6.045  -4.330
  563   1HD2  LEU  70          1HD2      LEU  70  -2.282  -8.494  -2.800
  564   2HD2  LEU  70          2HD2      LEU  70  -1.356  -9.001  -4.233
  565   3HD2  LEU  70          3HD2      LEU  70  -0.848  -7.568  -3.307
  566    H    SER  71           H        SER  71  -0.633  -6.462  -7.868
  567    HA   SER  71           HA       SER  71  -0.044  -4.269  -6.345
  568   1HB   SER  71          1HB       SER  71   1.955  -4.309  -7.464
  569   2HB   SER  71          2HB       SER  71   1.344  -5.833  -8.076
  570    HG   SER  71           HG       SER  71   0.593  -4.754  -9.980
  571    H    LEU  72           H        LEU  72  -1.619  -4.541  -9.566
  572    HA   LEU  72           HA       LEU  72  -1.575  -1.765 -10.103
  573   1HB   LEU  72          1HB       LEU  72  -1.781  -3.009 -11.997
  574   2HB   LEU  72          2HB       LEU  72  -2.833  -4.197 -11.254
  575    HG   LEU  72           HG       LEU  72  -4.693  -2.527 -11.308
  576   1HD1  LEU  72          1HD1      LEU  72  -2.646  -0.875 -12.802
  577   2HD1  LEU  72          2HD1      LEU  72  -4.400  -0.579 -12.876
  578   3HD1  LEU  72          3HD1      LEU  72  -3.540  -0.448 -11.323
  579   1HD2  LEU  72          1HD2      LEU  72  -4.986  -2.628 -13.824
  580   2HD2  LEU  72          2HD2      LEU  72  -3.379  -3.389 -13.889
  581   3HD2  LEU  72          3HD2      LEU  72  -4.702  -4.179 -12.997
  582    H    ALA  73           H        ALA  73  -4.064  -4.029  -8.760
  583    HA   ALA  73           HA       ALA  73  -6.030  -2.063  -8.432
  584   1HB   ALA  73          1HB       ALA  73  -5.577  -4.870  -7.796
  585   2HB   ALA  73          2HB       ALA  73  -6.409  -4.037  -6.461
  586   3HB   ALA  73          3HB       ALA  73  -7.106  -4.010  -8.098
  587    H    LEU  74           H        LEU  74  -3.136  -2.942  -6.592
  588    HA   LEU  74           HA       LEU  74  -3.974  -1.668  -4.189
  589   1HB   LEU  74          1HB       LEU  74  -1.520  -2.962  -5.244
  590   2HB   LEU  74          2HB       LEU  74  -1.305  -1.799  -3.952
  591    HG   LEU  74           HG       LEU  74  -3.260  -4.093  -3.734
  592   1HD1  LEU  74          1HD1      LEU  74  -0.834  -4.795  -4.229
  593   2HD1  LEU  74          2HD1      LEU  74  -0.472  -4.185  -2.597
  594   3HD1  LEU  74          3HD1      LEU  74  -1.647  -5.505  -2.814
  595   1HD2  LEU  74          1HD2      LEU  74  -2.773  -3.706  -1.265
  596   2HD2  LEU  74          2HD2      LEU  74  -1.998  -2.184  -1.764
  597   3HD2  LEU  74          3HD2      LEU  74  -3.724  -2.458  -2.105
  598    H    PHE  75           H        PHE  75  -2.201  -0.722  -7.152
  599    HA   PHE  75           HA       PHE  75  -1.362   1.774  -6.103
  600   1HB   PHE  75          1HB       PHE  75  -0.265   0.591  -8.009
  601   2HB   PHE  75          2HB       PHE  75  -1.767   0.588  -8.912
  602    HD1  PHE  75           1HD      PHE  75  -1.201   1.796 -10.832
  603    HD2  PHE  75           2HD      PHE  75  -0.277   3.420  -7.022
  604    HE1  PHE  75           1HE      PHE  75  -0.555   3.966 -11.914
  605    HE2  PHE  75           2HE      PHE  75   0.369   5.590  -8.104
  606    HZ   PHE  75           HZ       PHE  75   0.223   5.838 -10.537
  607    H    GLN  76           H        GLN  76  -3.937   0.810  -8.488
  608    HA   GLN  76           HA       GLN  76  -4.934   3.347  -8.824
  609   1HB   GLN  76          1HB       GLN  76  -6.852   2.279  -9.836
  610   2HB   GLN  76          2HB       GLN  76  -5.445   1.311 -10.226
  611   1HG   GLN  76          1HG       GLN  76  -6.037  -0.101  -8.121
  612   2HG   GLN  76          2HG       GLN  76  -7.580   0.729  -8.136
  613   1HE2  GLN  76          1HE2      GLN  76  -5.367  -0.723 -10.527
  614   2HE2  GLN  76          2HE2      GLN  76  -6.549  -1.659 -11.380
  615    H    SER  77           H        SER  77  -5.333   1.025  -6.188
  616    HA   SER  77           HA       SER  77  -7.694   1.728  -5.119
  617   1HB   SER  77          1HB       SER  77  -6.184  -0.026  -4.222
  618   2HB   SER  77          2HB       SER  77  -5.083   1.202  -3.631
  619    HG   SER  77           HG       SER  77  -6.853   0.187  -2.146
  620    H    PHE  78           H        PHE  78  -4.484   3.316  -4.462
  621    HA   PHE  78           HA       PHE  78  -5.998   5.716  -3.711
  622   1HB   PHE  78          1HB       PHE  78  -3.754   5.990  -2.249
  623   2HB   PHE  78          2HB       PHE  78  -5.069   5.002  -1.644
  624    HD1  PHE  78           1HD      PHE  78  -4.770   2.695  -1.255
  625    HD2  PHE  78           2HD      PHE  78  -1.819   4.851  -3.411
  626    HE1  PHE  78           1HE      PHE  78  -3.221   0.726  -1.103
  627    HE2  PHE  78           2HE      PHE  78  -0.269   2.882  -3.259
  628    HZ   PHE  78           HZ       PHE  78  -0.989   0.843  -2.107
  629    H    GLU  79           H        GLU  79  -5.274   7.663  -4.570
  630    HA   GLU  79           HA       GLU  79  -2.684   7.703  -5.809
  631   1HB   GLU  79          1HB       GLU  79  -4.085   6.832  -7.632
  632   2HB   GLU  79          2HB       GLU  79  -5.244   8.128  -7.411
  633   1HG   GLU  79          1HG       GLU  79  -3.645   9.807  -8.135
  634   2HG   GLU  79          2HG       GLU  79  -2.316   8.666  -8.069
  635    H    THR  80           H        THR  80  -2.635   9.148  -3.807
  636    HA   THR  80           HA       THR  80  -2.459  11.205  -2.973
  637    HB   THR  80           HB       THR  80  -2.086  12.939  -4.501
  638    HG1  THR  80           1HG      THR  80  -3.663  13.326  -6.135
  639   1HG2  THR  80          1HG2      THR  80  -1.067  12.049  -6.390
  640   2HG2  THR  80          2HG2      THR  80  -1.319  10.515  -5.524
  641   3HG2  THR  80          3HG2      THR  80  -2.471  11.027  -6.781
  642    H    GLY  81           H        GLY  81  -5.419  10.883  -5.028
  643   1HA   GLY  81          1HA       GLY  81  -7.243  10.885  -2.988
  644   2HA   GLY  81          2HA       GLY  81  -6.956  12.583  -3.309
  645    H    HIS  82           H        HIS  82  -7.398  13.463  -5.469
  646    HA   HIS  82           HA       HIS  82  -8.385  11.930  -7.552
  647   1HB   HIS  82          1HB       HIS  82 -10.286  12.267  -5.441
  648   2HB   HIS  82          2HB       HIS  82 -10.821  13.226  -6.807
  649    HD1  HIS  82           1HD      HIS  82 -10.085  11.467  -9.192
  650    HD2  HIS  82           2HD      HIS  82 -11.724   9.955  -5.639
  651    HE1  HIS  82           1HE      HIS  82 -11.168   9.237  -9.797
  652    H    CYS  83           H        CYS  83  -9.465  13.392  -9.257
  653    HA   CYS  83           HA       CYS  83  -9.444  16.157  -8.922
  654   1HB   CYS  83          1HB       CYS  83  -6.843  15.268  -9.043
  655   2HB   CYS  83          2HB       CYS  83  -7.171  15.625 -10.727
  656    HG   CYS  83           HG       CYS  83  -6.222  17.528  -8.638
  657    H    LEU  84           H        LEU  84 -10.657  16.986 -10.638
  658    HA   LEU  84           HA       LEU  84 -11.159  15.105 -12.828
  659   1HB   LEU  84          1HB       LEU  84 -12.808  17.121 -11.381
  660   2HB   LEU  84          2HB       LEU  84 -13.148  16.850 -13.079
  661    HG   LEU  84           HG       LEU  84 -14.625  15.443 -11.930
  662   1HD1  LEU  84          1HD1      LEU  84 -12.453  13.434 -12.424
  663   2HD1  LEU  84          2HD1      LEU  84 -14.186  13.367 -12.826
  664   3HD1  LEU  84          3HD1      LEU  84 -13.091  14.402 -13.774
  665   1HD2  LEU  84          1HD2      LEU  84 -12.762  13.860 -10.318
  666   2HD2  LEU  84          2HD2      LEU  84 -12.839  15.572  -9.837
  667   3HD2  LEU  84          3HD2      LEU  84 -14.326  14.594  -9.887
  668    H    ASN  85           H        ASN  85  -8.714  16.498 -12.882
  669    HA   ASN  85           HA       ASN  85  -9.045  17.827 -15.345
  670   1HB   ASN  85          1HB       ASN  85  -9.403  19.533 -13.221
  671   2HB   ASN  85          2HB       ASN  85  -7.658  19.616 -13.367
  672   1HD2  ASN  85          1HD2      ASN  85 -10.543  20.866 -14.395
  673   2HD2  ASN  85          2HD2      ASN  85 -10.055  21.663 -15.853
  674    H    GLU  86           H        GLU  86  -6.742  18.615 -16.117
  675    HA   GLU  86           HA       GLU  86  -4.779  16.845 -14.887
  676   1HB   GLU  86          1HB       GLU  86  -5.044  17.858 -17.748
  677   2HB   GLU  86          2HB       GLU  86  -3.629  17.005 -17.165
  678   1HG   GLU  86          1HG       GLU  86  -5.554  15.276 -16.306
  679   2HG   GLU  86          2HG       GLU  86  -6.399  15.969 -17.676
  680    H    THR  87           H        THR  87  -5.516  19.617 -14.013
  681    HA   THR  87           HA       THR  87  -3.577  21.442 -14.939
  682    HB   THR  87           HB       THR  87  -4.283  22.548 -12.660
  683    HG1  THR  87           1HG      THR  87  -4.934  20.347 -11.855
  684   1HG2  THR  87          1HG2      THR  87  -6.816  22.602 -13.514
  685   2HG2  THR  87          2HG2      THR  87  -5.547  23.425 -14.452
  686   3HG2  THR  87          3HG2      THR  87  -6.125  21.818 -14.955
  687    H    ASN  88           H        ASN  88  -1.691  19.956 -15.023
  688    HA   ASN  88           HA       ASN  88   0.214  19.247 -14.267
  689   1HB   ASN  88          1HB       ASN  88   0.488  21.646 -13.590
  690   2HB   ASN  88          2HB       ASN  88  -0.241  21.297 -12.035
  691   1HD2  ASN  88          1HD2      ASN  88   1.581  21.959 -10.930
  692   2HD2  ASN  88          2HD2      ASN  88   3.034  21.021 -10.838
  693    H    VAL  89           H        VAL  89  -2.064  17.715 -13.451
  694    HA   VAL  89           HA       VAL  89  -1.646  17.110 -10.636
  695    HB   VAL  89           HB       VAL  89  -3.597  15.718 -12.432
  696   1HG1  VAL  89          1HG1      VAL  89  -4.005  14.812 -10.412
  697   2HG1  VAL  89          2HG1      VAL  89  -3.168  16.123  -9.546
  698   3HG1  VAL  89          3HG1      VAL  89  -4.855  16.338 -10.071
  699   1HG2  VAL  89          1HG2      VAL  89  -5.110  17.766 -11.468
  700   2HG2  VAL  89          2HG2      VAL  89  -3.573  18.607 -11.785
  701   3HG2  VAL  89          3HG2      VAL  89  -4.394  17.727 -13.097
  702    H    THR  90           H        THR  90   0.591  16.613 -12.336
  703    HA   THR  90           HA       THR  90   0.508  13.700 -12.687
  704    HB   THR  90           HB       THR  90   1.177  15.288 -14.593
  705    HG1  THR  90           1HG      THR  90   2.755  13.715 -15.122
  706   1HG2  THR  90          1HG2      THR  90   3.103  16.573 -14.472
  707   2HG2  THR  90          2HG2      THR  90   2.731  16.584 -12.732
  708   3HG2  THR  90          3HG2      THR  90   3.913  15.423 -13.381
  709    H    LYS  91           H        LYS  91   1.704  12.312 -11.484
  710    HA   LYS  91           HA       LYS  91   4.028  12.708 -10.227
  711   1HB   LYS  91          1HB       LYS  91   1.945  14.248  -8.858
  712   2HB   LYS  91          2HB       LYS  91   2.768  13.128  -7.792
  713   1HG   LYS  91          1HG       LYS  91   4.878  14.127  -8.133
  714   2HG   LYS  91          2HG       LYS  91   4.427  14.799  -9.688
  715   1HD   LYS  91          1HD       LYS  91   4.197  16.752  -8.511
  716   2HD   LYS  91          2HD       LYS  91   2.626  16.101  -8.089
  717   1HE   LYS  91          1HE       LYS  91   3.619  15.080  -6.018
  718   2HE   LYS  91          2HE       LYS  91   5.175  15.770  -6.435
  719   1HZ   LYS  91          1HZ       LYS  91   2.954  17.604  -6.377
  720   2HZ   LYS  91          2HZ       LYS  91   3.424  17.006  -4.932
  721   3HZ   LYS  91          3HZ       LYS  91   4.492  17.812  -5.868
  722    H    ASP  92           H        ASP  92   4.115  10.504 -10.765
  723    HA   ASP  92           HA       ASP  92   2.114   8.748  -9.831
  724   1HB   ASP  92          1HB       ASP  92   4.769   8.520 -11.230
  725   2HB   ASP  92          2HB       ASP  92   4.172   7.081 -10.428
  726    H    VAL  93           H        VAL  93   2.459   9.734  -7.486
  727    HA   VAL  93           HA       VAL  93   4.299   7.950  -6.091
  728    HB   VAL  93           HB       VAL  93   4.633  10.101  -4.574
  729   1HG1  VAL  93          1HG1      VAL  93   6.138   8.818  -6.714
  730   2HG1  VAL  93          2HG1      VAL  93   6.584  10.531  -6.526
  731   3HG1  VAL  93          3HG1      VAL  93   6.690   9.426  -5.135
  732   1HG2  VAL  93          1HG2      VAL  93   4.511  11.358  -7.327
  733   2HG2  VAL  93          2HG2      VAL  93   3.175  11.462  -6.155
  734   3HG2  VAL  93          3HG2      VAL  93   4.764  12.156  -5.756
  735    H    VAL  94           H        VAL  94   3.716   7.732  -3.754
  736    HA   VAL  94           HA       VAL  94   1.093   8.709  -3.041
  737    HB   VAL  94           HB       VAL  94   1.676   5.752  -3.297
  738   1HG1  VAL  94          1HG1      VAL  94  -1.088   6.598  -2.769
  739   2HG1  VAL  94          2HG1      VAL  94  -0.119   5.305  -2.022
  740   3HG1  VAL  94          3HG1      VAL  94   0.040   6.982  -1.446
  741   1HG2  VAL  94          1HG2      VAL  94  -0.084   7.623  -4.902
  742   2HG2  VAL  94          2HG2      VAL  94   1.240   6.583  -5.481
  743   3HG2  VAL  94          3HG2      VAL  94  -0.281   5.853  -4.914
  744    H    CYS  95           H        CYS  95   0.748   8.672  -0.764
  745    HA   CYS  95           HA       CYS  95   3.179   8.650   0.707
  746   1HB   CYS  95          1HB       CYS  95   1.055  10.161   0.991
  747   2HB   CYS  95          2HB       CYS  95   0.458   8.846   1.983
  748    HG   CYS  95           HG       CYS  95   3.267   8.873   2.948
  749    H    LEU  96           H        LEU  96   4.081   6.848   1.644
  750    HA   LEU  96           HA       LEU  96   2.628   4.391   1.632
  751   1HB   LEU  96          1HB       LEU  96   4.748   3.559   2.733
  752   2HB   LEU  96          2HB       LEU  96   4.872   4.188   1.101
  753    HG   LEU  96           HG       LEU  96   6.657   4.803   2.911
  754   1HD1  LEU  96          1HD1      LEU  96   7.285   5.931   1.102
  755   2HD1  LEU  96          2HD1      LEU  96   5.601   6.192   0.589
  756   3HD1  LEU  96          3HD1      LEU  96   6.364   7.314   1.741
  757   1HD2  LEU  96          1HD2      LEU  96   6.254   6.679   4.269
  758   2HD2  LEU  96          2HD2      LEU  96   4.727   7.063   3.439
  759   3HD2  LEU  96          3HD2      LEU  96   4.832   5.631   4.490
  760    H    ASN  97           H        ASN  97   2.853   7.090   3.755
  761    HA   ASN  97           HA       ASN  97   2.594   5.631   6.158
  762   1HB   ASN  97          1HB       ASN  97   3.313   8.182   5.627
  763   2HB   ASN  97          2HB       ASN  97   1.604   8.479   5.882
  764   1HD2  ASN  97          1HD2      ASN  97   4.145   9.084   7.402
  765   2HD2  ASN  97          2HD2      ASN  97   3.845   8.576   9.031
  766    H    ASP  98           H        ASP  98   0.404   7.505   3.946
  767    HA   ASP  98           HA       ASP  98  -1.889   7.239   5.433
  768   1HB   ASP  98          1HB       ASP  98  -1.327   7.559   2.468
  769   2HB   ASP  98          2HB       ASP  98  -2.980   7.382   3.024
  770    H    VAL  99           H        VAL  99  -0.177   5.046   3.196
  771    HA   VAL  99           HA       VAL  99  -2.358   3.245   2.857
  772    HB   VAL  99           HB       VAL  99   0.601   2.806   2.424
  773   1HG1  VAL  99          1HG1      VAL  99  -1.728   1.525   0.970
  774   2HG1  VAL  99          2HG1      VAL  99  -0.011   1.056   0.937
  775   3HG1  VAL  99          3HG1      VAL  99  -0.974   0.807   2.414
  776   1HG2  VAL  99          1HG2      VAL  99  -0.909   3.412   0.024
  777   2HG2  VAL  99          2HG2      VAL  99  -1.025   4.743   1.200
  778   3HG2  VAL  99          3HG2      VAL  99   0.571   4.171   0.658
  779    H    SER 100           H        SER 100   0.312   3.690   5.170
  780    HA   SER 100           HA       SER 100   0.271   1.142   6.243
  781   1HB   SER 100          1HB       SER 100   2.029   2.899   6.635
  782   2HB   SER 100          2HB       SER 100   0.903   3.773   7.654
  783    HG   SER 100           HG       SER 100   1.104   2.296   9.250
  784    H    CYS 101           H        CYS 101  -1.973   3.823   6.467
  785    HA   CYS 101           HA       CYS 101  -3.095   3.064   8.966
  786   1HB   CYS 101          1HB       CYS 101  -3.146   5.389   7.913
  787   2HB   CYS 101          2HB       CYS 101  -4.399   4.789   6.845
  788    HG   CYS 101           HG       CYS 101  -5.655   3.653   9.123
  789    H    TYR 102           H        TYR 102  -4.134   2.863   5.480
  790    HA   TYR 102           HA       TYR 102  -6.459   1.446   5.860
  791   1HB   TYR 102          1HB       TYR 102  -5.577   2.488   3.732
  792   2HB   TYR 102          2HB       TYR 102  -4.265   1.328   3.697
  793    HD1  TYR 102           1HD      TYR 102  -8.021   1.350   3.818
  794    HD2  TYR 102           2HD      TYR 102  -4.481  -0.501   2.286
  795    HE1  TYR 102           1HE      TYR 102  -9.442  -0.224   2.415
  796    HE2  TYR 102           2HE      TYR 102  -5.914  -2.069   0.889
  797    HH   TYR 102           HH       TYR 102  -9.453  -1.771   0.905
  798    H    PHE 103           H        PHE 103  -3.107   0.174   5.286
  799    HA   PHE 103           HA       PHE 103  -3.839  -2.511   5.316
  800   1HB   PHE 103          1HB       PHE 103  -1.351  -0.834   5.880
  801   2HB   PHE 103          2HB       PHE 103  -1.271  -2.563   6.149
  802    HD1  PHE 103           1HD      PHE 103   0.010  -0.490   4.022
  803    HD2  PHE 103           2HD      PHE 103  -2.917  -3.560   3.887
  804    HE1  PHE 103           1HE      PHE 103   0.495  -0.846   1.586
  805    HE2  PHE 103           2HE      PHE 103  -2.432  -3.916   1.451
  806    HZ   PHE 103           HZ       PHE 103  -0.731  -2.555   0.329
  807    H    SER 104           H        SER 104  -2.984  -0.216   7.945
  808    HA   SER 104           HA       SER 104  -2.608  -2.082   9.929
  809   1HB   SER 104          1HB       SER 104  -2.019   0.295  10.174
  810   2HB   SER 104          2HB       SER 104  -3.707   0.758  10.084
  811    HG   SER 104           HG       SER 104  -2.594  -0.957  12.137
  812    H    LEU 105           H        LEU 105  -5.549  -0.808   8.405
  813    HA   LEU 105           HA       LEU 105  -7.301  -1.689  10.476
  814   1HB   LEU 105          1HB       LEU 105  -7.432  -0.024   8.227
  815   2HB   LEU 105          2HB       LEU 105  -8.529  -1.345   7.879
  816    HG   LEU 105           HG       LEU 105  -8.958  -0.459  10.585
  817   1HD1  LEU 105          1HD1      LEU 105  -7.931   1.649   9.342
  818   2HD1  LEU 105          2HD1      LEU 105  -9.595   1.785   8.725
  819   3HD1  LEU 105          3HD1      LEU 105  -9.293   1.793  10.479
  820   1HD2  LEU 105          1HD2      LEU 105 -10.621  -1.664   9.355
  821   2HD2  LEU 105          2HD2      LEU 105 -11.255  -0.035   9.693
  822   3HD2  LEU 105          3HD2      LEU 105 -10.643  -0.433   8.069
  823    H    LEU 106           H        LEU 106  -6.135  -2.958   7.313
  824    HA   LEU 106           HA       LEU 106  -7.807  -5.102   7.047
  825   1HB   LEU 106          1HB       LEU 106  -5.248  -4.233   6.034
  826   2HB   LEU 106          2HB       LEU 106  -5.253  -5.971   6.260
  827    HG   LEU 106           HG       LEU 106  -7.599  -5.754   4.991
  828   1HD1  LEU 106          1HD1      LEU 106  -6.013  -3.467   3.798
  829   2HD1  LEU 106          2HD1      LEU 106  -7.620  -4.054   3.306
  830   3HD1  LEU 106          3HD1      LEU 106  -7.407  -3.263   4.887
  831   1HD2  LEU 106          1HD2      LEU 106  -5.681  -7.149   4.333
  832   2HD2  LEU 106          2HD2      LEU 106  -6.455  -6.362   2.936
  833   3HD2  LEU 106          3HD2      LEU 106  -4.919  -5.730   3.576
  834    H    GLU 107           H        GLU 107  -4.578  -5.094   8.724
  835    HA   GLU 107           HA       GLU 107  -5.069  -7.664   9.778
  836   1HB   GLU 107          1HB       GLU 107  -2.943  -7.338  10.966
  837   2HB   GLU 107          2HB       GLU 107  -2.788  -6.815   9.301
  838   1HG   GLU 107          1HG       GLU 107  -3.125  -4.448   9.989
  839   2HG   GLU 107          2HG       GLU 107  -3.354  -4.948  11.653
  840    H    GLY 108           H        GLY 108  -5.590  -4.313  10.851
  841   1HA   GLY 108          1HA       GLY 108  -5.858  -4.720  13.600
  842   2HA   GLY 108          2HA       GLY 108  -6.611  -3.449  12.656
  843    H    GLY 109           H        GLY 109  -8.064  -5.374  10.856
  844   1HA   GLY 109          1HA       GLY 109 -10.219  -6.044  12.747
  845   2HA   GLY 109          2HA       GLY 109 -10.391  -5.733  11.031
  846    H    ARG 110           H        ARG 110  -8.232  -7.899  13.010
  847    HA   ARG 110           HA       ARG 110  -8.233  -9.883  11.082
  848   1HB   ARG 110          1HB       ARG 110  -7.182 -11.287  12.835
  849   2HB   ARG 110          2HB       ARG 110  -6.508  -9.670  12.869
  850   1HG   ARG 110          1HG       ARG 110  -8.750  -9.531  14.590
  851   2HG   ARG 110          2HG       ARG 110  -8.030 -11.090  14.940
  852   1HD   ARG 110          1HD       ARG 110  -6.099 -10.162  15.816
  853   2HD   ARG 110          2HD       ARG 110  -6.085  -8.835  14.672
  854    HE   ARG 110           HE       ARG 110  -7.281  -7.542  16.207
  855   1HH1  ARG 110          2HH2      ARG 110  -7.660 -10.938  17.044
  856   2HH1  ARG 110          1HH2      ARG 110  -8.509 -10.612  18.519
  857   1HH2  ARG 110          2HH1      ARG 110  -8.401  -7.111  18.152
  858   2HH2  ARG 110          1HH1      ARG 110  -8.933  -8.420  19.153
  859    HA   PRO 111           HA       PRO 111 -11.946 -11.992  11.974
  860   1HB   PRO 111          1HB       PRO 111 -11.402 -14.493  11.016
  861   2HB   PRO 111          2HB       PRO 111 -11.862 -13.152   9.986
  862   1HG   PRO 111          1HG       PRO 111  -9.193 -14.364  10.370
  863   2HG   PRO 111          2HG       PRO 111  -9.755 -13.336   9.067
  864   1HD   PRO 111          1HD       PRO 111  -8.076 -12.563  11.261
  865   2HD   PRO 111          2HD       PRO 111  -8.732 -11.511  10.022
  866    H    GLU 112           H        GLU 112 -13.097 -13.438  13.345
  867    HA   GLU 112           HA       GLU 112 -12.175 -13.600  15.809
  868   1HB   GLU 112          1HB       GLU 112 -13.752 -15.451  16.199
  869   2HB   GLU 112          2HB       GLU 112 -14.454 -14.267  15.116
  870   1HG   GLU 112          1HG       GLU 112 -13.811 -15.676  13.152
  871   2HG   GLU 112          2HG       GLU 112 -13.096 -16.858  14.231
  872    H    ASP 113           H        ASP 113 -11.392 -15.882  13.147
  873    HA   ASP 113           HA       ASP 113  -9.064 -16.664  14.582
  874   1HB   ASP 113          1HB       ASP 113 -11.251 -18.212  15.109
  875   2HB   ASP 113          2HB       ASP 113 -10.701 -18.999  13.643
  876    H    LYS 114           H        LYS 114  -7.517 -16.641  12.945
  877    HA   LYS 114           HA       LYS 114  -8.145 -16.414  10.267
  878   1HB   LYS 114          1HB       LYS 114  -5.614 -17.178  11.730
  879   2HB   LYS 114          2HB       LYS 114  -5.668 -17.060   9.983
  880   1HG   LYS 114          1HG       LYS 114  -5.253 -14.839  10.267
  881   2HG   LYS 114          2HG       LYS 114  -6.932 -14.703  10.751
  882   1HD   LYS 114          1HD       LYS 114  -6.407 -14.757  13.070
  883   2HD   LYS 114          2HD       LYS 114  -4.842 -15.497  12.800
  884   1HE   LYS 114          1HE       LYS 114  -3.993 -13.405  11.771
  885   2HE   LYS 114          2HE       LYS 114  -5.571 -12.660  11.928
  886   1HZ   LYS 114          1HZ       LYS 114  -3.592 -12.679  13.795
  887   2HZ   LYS 114          2HZ       LYS 114  -5.129 -12.174  14.017
  888   3HZ   LYS 114          3HZ       LYS 114  -4.710 -13.707  14.394
  889    H    LEU 115           H        LEU 115  -7.097 -18.065   8.564
  890    HA   LEU 115           HA       LEU 115  -8.597 -20.493   8.968
  891   1HB   LEU 115          1HB       LEU 115  -7.409 -19.010   6.711
  892   2HB   LEU 115          2HB       LEU 115  -7.384 -20.755   6.551
  893    HG   LEU 115           HG       LEU 115  -9.966 -19.510   7.374
  894   1HD1  LEU 115          1HD1      LEU 115  -9.723 -19.556   4.475
  895   2HD1  LEU 115          2HD1      LEU 115 -10.348 -18.286   5.555
  896   3HD1  LEU 115          3HD1      LEU 115  -8.602 -18.394   5.225
  897   1HD2  LEU 115          1HD2      LEU 115  -9.307 -21.720   5.409
  898   2HD2  LEU 115          2HD2      LEU 115  -9.681 -21.956   7.133
  899   3HD2  LEU 115          3HD2      LEU 115 -10.914 -21.285   6.038
  900    H    GLU 116           H        GLU 116  -7.358 -22.563   7.951
  901    HA   GLU 116           HA       GLU 116  -4.622 -22.604   8.808
  902   1HB   GLU 116          1HB       GLU 116  -6.172 -24.845   9.996
  903   2HB   GLU 116          2HB       GLU 116  -4.816 -23.951  10.654
  904   1HG   GLU 116          1HG       GLU 116  -6.356 -22.000  11.095
  905   2HG   GLU 116          2HG       GLU 116  -7.702 -22.956  10.508
  906    H    TRP 117           H        TRP 117  -3.439 -23.963   7.491
  907    HA   TRP 117           HA       TRP 117  -5.015 -25.696   5.720
  908   1HB   TRP 117          1HB       TRP 117  -2.198 -24.874   5.144
  909   2HB   TRP 117          2HB       TRP 117  -3.479 -25.335   4.040
  910    HD1  TRP 117           HD       TRP 117  -1.905 -22.277   5.570
  911    HE1  TRP 117           1HE      TRP 117  -3.102 -20.044   4.831
  912    HE3  TRP 117           3HE      TRP 117  -5.967 -24.523   3.493
  913    HZ2  TRP 117           2HZ      TRP 117  -5.558 -19.481   3.491
  914    HZ3  TRP 117           3HZ      TRP 117  -7.718 -23.060   2.491
  915    HH2  TRP 117           HH       TRP 117  -7.561 -20.621   2.467
  916    H    SER 118           H        SER 118  -5.060 -27.210   7.664
  917    HA   SER 118           HA       SER 118  -2.818 -28.970   7.418
  918   1HB   SER 118          1HB       SER 118  -2.269 -27.320   9.307
  919   2HB   SER 118          2HB       SER 118  -3.617 -28.004  10.194
  920    HG   SER 118           HG       SER 118  -2.235 -29.494  10.851