*HEADER    RNA BINDING PROTEIN                     27-JUN-17   5XV9              
*TITLE     SOLUTION STRUCTURE OF COLD SHOCK PROTEIN FROM COLWELLIA               
*TITLE    2 PSYCHRERYTHRAEA                                                      
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: COLD-SHOCK DNA-BINDING DOMAIN FAMILY PROTEIN;              
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: COLWELLIA PSYCHRERYTHRAEA (STRAIN 34H / ATCC    
*SOURCE   3 BAA-681);                                                            
*SOURCE   4 ORGANISM_COMMON: VIBRIO PSYCHROERYTHUS;                              
*SOURCE   5 ORGANISM_TAXID: 167879;                                              
*SOURCE   6 STRAIN: 34H / ATCC BAA-681;                                          
*SOURCE   7 GENE: CPS_0718;                                                      
*SOURCE   8 EXPRESSION_SYSTEM: ESCHERICHIA COLI BL21(DE3);                       
*SOURCE   9 EXPRESSION_SYSTEM_TAXID: 469008;                                     
*SOURCE  10 EXPRESSION_SYSTEM_STRAIN: BL21(DE3)                                  
*KEYWDS    COLD-SHOCK PROTEIN, PSYCHROPHILE, NMR SPECTROSCOPY, SOLUTION          
*KEYWDS   2 STRUCTURE, RNA BINDING PROTEIN                                       
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    Y.LEE,Y.KIM                                                           
*REVDAT   1   04-JUL-18 5XV9    0                                                
# Restraints file 1: final.upl
   7  LYS    HE   17  PHE   HB2   6.20 #  
  29  VAL   HG1   65  VAL    HB   7.30 #  
  34  ILE   HG2   43  LEU    HG   8.50 #  
  29  VAL   HG1   33  GLU   HB2   7.40 #  
  53  VAL   HG2   60  PRO   HB2   4.80 #  
  31  HIS   HB2   34  ILE   HD1   8.70 #  
  48  THR   HG2   68  VAL   HG2   6.90 #  
  49  VAL     H   68  VAL   HG2   7.30 #  
  29  VAL    HB   43  LEU   HD1  10.10 #  
  50  GLU    HG   68  VAL   HG2   8.00 #  
  20  PRO   HG2   26  ASP     H   4.90 #  
  53  VAL   HG1   61  CYS     H   7.10 #  
   3  LYS    HE   48  THR   HG2   6.60 #  
  29  VAL   HG1   31  HIS     H   6.40 #  
  53  VAL   HG2   61  CYS     H   6.60 #  
  18  ILE  HG12   29  VAL   HG2   7.60 #  
  52  GLU     H   62  ALA    HB   5.10 #  
   4  GLY   HA3   49  VAL   HG2   6.60 #  
  31  HIS     H   34  ILE   HD1   9.50 #  
  29  VAL   HG1   33  GLU   HB3   7.20 #  
  31  HIS     H   34  ILE   HG2   7.00 #  
  34  ILE   HG2   36  SER     H   7.90 #  
  18  ILE     H   29  VAL   HG2   6.50 #  
   9  PHE    HE   42  THR    HB   7.90 #  
  50  GLU    HG   68  VAL   HG1   8.10 #  
  34  ILE   HD1   42  THR    HA   8.80 #  
   6  VAL   HG1   43  LEU   HD1   8.40 #  
  18  ILE    HA   29  VAL   HG2   7.50 #  
  31  HIS    HA   34  ILE   HG2   5.05 #  
 10  ASN      O  15  PHE      N    3.30 #ENDURANCE 0.000000 #FLIPPED
  18  ILE   HD1   29  VAL   HG2   6.60 #  
   6  VAL   HG2    9  PHE     H   6.70 #  
  18  ILE   HD1   65  VAL    HG   7.20 #  
  31  HIS   HB3   34  ILE   HD1   9.20 #  
  49  VAL    HA   68  VAL   HG1   6.60 #  
   6  VAL   HG2    8  TRP     H   5.60 #  
   6  VAL   HG2    9  PHE   HB3   6.60 #  
  43  LEU   HD2   47  GLN    HA   7.00 #  
   6  VAL   HG2   17  PHE     H   7.00 #  
   5  ILE     H   18  ILE   HG2   7.20 #  
   9  PHE    HE   29  VAL   HG1   6.60 #  
   5  ILE   HG2   48  THR     H   5.70 #  
   3  LYS    HA   49  VAL     H   4.90 #  
  43  LEU   HD1   49  VAL   HG1   5.80 #  
  48  THR   HG2   68  VAL     H   6.00 #  
   7  LYS    HG   17  PHE   HB3   5.90 #  
  10  ASN     H   15  PHE     O   2.40 #  
   3  LYS    HE   50  GLU    HG   7.00 #  
  54  GLY     H   62  ALA    HA   3.85 #  
  47  GLN     H   47  GLN   HG3   4.40 #  
  51  TYR   HB2   65  VAL    HG   6.60 #  
  43  LEU   HD2   66  VAL     H   7.20 #  
  18  ILE   HD1   51  TYR   HB2   6.20 #  
  18  ILE   HG2   27  LEU   HB3   4.74 #  
   5  ILE   HG2   19  THR     H   6.60 #  
  53  VAL    HA   62  ALA     H   5.20 #  
   4  GLY     H   48  THR   HG2   5.50 #  
  29  VAL   HG1   33  GLU     H   8.00 #  
  65  VAL     H   66  VAL    HG   6.70 #  
   6  VAL   HG2   47  GLN     H   4.70 #  
  50  GLU   HB2   66  VAL    HG   5.46 #  
  53  VAL   HG2   55  GLN     H   6.60 #  
 52  GLU      O  63  ASN      H    2.20 #ENDURANCE 0.000000 #FLIPPED
   6  VAL   HG1   47  GLN   HG3   6.90 #  
  31  HIS    HA   34  ILE    HB   5.93 #  
  4  GLY      O  49  VAL      H    2.30 #ENDURANCE 0.000000 #FLIPPED
  43  LEU   HD2   44  ALA     H   5.50 #  
  18  ILE   HD1   62  ALA    HB   6.60 #  
  55  GLN    HG   59  GLY     H   7.80 #  
  50  GLU    HG   66  VAL     H   5.80 #  
  29  VAL    HB   62  ALA     H   5.70 #  
   6  VAL    HB   43  LEU   HD2   6.60 #  
   7  LYS    HG    8  TRP     H   4.80 #  
   5  ILE     H   19  THR    HA   5.10 #  
  51  TYR   HB3   53  VAL    HA   6.90 #  
  48  THR     H   68  VAL   HG2   7.00 #  
  48  THR   HG2   68  VAL    HA   6.90 #  
  8  TRP      O  17  PHE      H    2.20 #ENDURANCE 0.000000 #FLIPPED
   6  VAL     H   47  GLN   HB2   5.40 #  
   9  PHE     N   44  ALA     O   3.50 #  
   5  ILE    HA   18  ILE    HB   6.50 #  
   9  PHE     H   44  ALA     O   3.00 #  
  23  GLY     H   24  SER   HB3   5.60 #  
   5  ILE   HG2   46  GLY   HA3   6.50 #  
  49  VAL   HG2   68  VAL     H   6.40 #  
   6  VAL   HG1   43  LEU   HB2   6.60 #  
  54  GLY     H   55  GLN    HA   4.80 #  
   3  LYS   HG3   50  GLU    HA   4.70 #  
  50  GLU   HB2   66  VAL     H   4.64 #  
   6  VAL   HG1   47  GLN   HG2   6.70 #  
   6  VAL     H   46  GLY     H   4.30 #  
   9  PHE    HE   42  THR   HG2   9.10 #  
  44  ALA    HA   46  GLY     H   5.70 #  
   6  VAL   HG1   47  GLN   HB2   5.90 #  
   3  LYS   HG3   50  GLU    HG   6.60 #  
   2  SER   HB3   51  TYR     H   5.17 #  
  56  GLY     H   61  CYS     H   5.02 #  
   6  VAL   HG1   47  GLN     H   4.90 #  
  43  LEU   HB2   47  GLN   HG3   5.70 #  
  40  TYR   HB3   42  THR     H   5.80 #  
  55  GLN    HA   60  PRO   HB2   4.80 #  
  14  GLY   HA2   31  HIS     H   3.90 #  
  20  PRO   HB3   22  ASP     H   3.90 #  
   5  ILE     H   19  THR    HB   3.50 #  
   9  PHE   HB2   29  VAL   HG2   9.20 #  
 50  GLU      O  66  VAL      H    2.30 #ENDURANCE 0.000000 #FLIPPED
  20  PRO   HB3   23  GLY     H   4.40 #  
   3  LYS   HB2   49  VAL     H   6.00 #  
  49  VAL   HG2   66  VAL     H   5.70 #  
 10  ASN      O  15  PHE      H    2.50 #ENDURANCE 0.000000 #FLIPPED
   9  PHE    HE   42  THR    HA   6.60 #  
  44  ALA    HB   47  GLN   HB3   6.60 #  
   4  GLY   HA3   21  GLU     H   6.60 #  
   6  VAL     H   47  GLN   HB3   6.60 #  
   7  LYS    HA   47  GLN     H   6.60 #  
   4  GLY   HA2   21  GLU     H   6.60 #  
   5  ILE     H   21  GLU     H   6.60 #  
  20  PRO    HA   22  ASP     H   6.60 #  
   5  ILE    HA   48  THR    HA   6.60 #  
  12  ASP    HA   14  GLY     H   6.60 #  
  20  PRO   HG3   23  GLY     H   6.80 #  
   6  VAL     H   49  VAL     H   6.60 #  
   6  VAL    HA   49  VAL   HG2   6.60 #  
   6  VAL    HB   49  VAL     H   6.60 #  
  10  ASN     H   15  PHE     H   6.80 #  
   4  GLY   HA3   49  VAL     H   6.60 #  
  47  GLN   HG3   49  VAL   HG1   6.60 #  
   4  GLY     H   49  VAL     H   6.60 #  
   5  ILE    HA   49  VAL   HG2   6.60 #  
  55  GLN    HA   60  PRO    HA   6.80 #  
   3  LYS   HB3   50  GLU    HA   6.60 #  
  54  GLY     H   60  PRO    HA   6.80 #  
   3  LYS    HA   51  TYR     H   6.60 #  
   3  LYS   HB3   51  TYR     H   6.60 #  
  20  PRO   HB2   24  SER     H   6.60 #  
  20  PRO    HA   24  SER     H   6.60 #  
  54  GLY     H   61  CYS    HA   6.80 #  
  22  ASP    HA   24  SER     H   6.60 #  
   5  ILE    HA    6  VAL   HG1   6.60 #  
  20  PRO   HD3   26  ASP    HA   6.60 #  
  53  VAL   HG2   60  PRO   HB3   6.60 #  
  27  LEU   HB3   61  CYS    HA   6.60 #  
  28  PHE   HB3   61  CYS    HA   6.60 #  
  18  ILE     H   26  ASP     H   6.60 #  
  13  LYS   HG2   15  PHE     H   6.60 #  
  28  PHE   HB2   61  CYS    HA   6.60 #  
  29  VAL    HA   61  CYS   HB3   6.60 #  
  13  LYS     H   15  PHE     H   6.60 #  
  29  VAL    HA   61  CYS   HB2   6.60 #  
  18  ILE    HA   26  ASP    HB   5.90 #  
  55  GLN    HA   61  CYS     H   6.60 #  
  51  TYR   HB2   62  ALA    HB   6.60 #  
  29  VAL    HB   62  ALA    HB   6.60 #  
  28  PHE     H   62  ALA     H   6.60 #  
  30  HIS     H   62  ALA     H   6.60 #  
  52  GLU     H   62  ALA    HA   6.60 #  
   9  PHE   HB2   47  GLN   HG2   5.50 #  
  52  GLU   HB2   63  ASN  HD22   6.60 #  
  52  GLU   HB3   63  ASN  HD22   6.60 #  
  52  GLU   HB3   63  ASN     H   6.60 #  
  52  GLU   HB3   63  ASN  HD21   6.60 #  
  52  GLU   HB2   63  ASN  HD21   6.60 #  
  19  THR    HA   26  ASP     H   6.60 #  
  52  GLU   HB3   63  ASN   HB3   6.60 #  
  53  VAL    HA   63  ASN     H   6.60 #  
  52  GLU   HB3   63  ASN   HB2   6.60 #  
  51  TYR    HA   63  ASN     H   6.60 #  
  51  TYR   HB2   63  ASN     H   6.60 #  
  54  GLY     H   63  ASN     H   6.60 #  
  51  TYR   HB2   65  VAL    HA   6.60 #  
  51  TYR   HB3   65  VAL    HA   6.60 #  
  18  ILE   HG2   27  LEU     H   6.60 #  
  54  GLY     H   61  CYS   HB2   6.80 #  
  49  VAL    HB   65  VAL    HG   6.60 #  
  51  TYR    HA   65  VAL    HA   6.60 #  
  51  TYR   HB3   65  VAL    HG   6.60 #  
   9  PHE    HE   43  LEU   HD1   5.40 #  
  18  ILE   HG2   27  LEU   HB2   6.60 #  
  17  PHE    HA   27  LEU     H   6.60 #  
  17  PHE   HB3   27  LEU     H   6.60 #  
  49  VAL    HB   67  ALA    HB   6.60 #  
  20  PRO   HD3   27  LEU     H   6.60 #  
  47  GLN  HE21   67  ALA    HB   6.60 #  
  18  ILE     H   27  LEU     H   6.60 #  
  47  GLN   HG3   67  ALA    HB   6.60 #  
  50  GLU     H   67  ALA     H   6.60 #  
  19  THR    HA   27  LEU     H   6.60 #  
  47  GLN   HG2   67  ALA    HB   6.60 #  
  47  GLN  HE21   67  ALA     H   6.60 #  
  49  VAL    HB   67  ALA     H   6.60 #  
  49  VAL    HA   67  ALA    HB   6.60 #  
  17  PHE   HB2   27  LEU     H   6.60 #  
  49  VAL   HG1   67  ALA    HA   6.60 #  
  49  VAL   HG1   67  ALA     H   6.60 #  
  49  VAL   HG1   67  ALA    HB   6.60 #  
  49  VAL    HA   67  ALA    HA   6.60 #  
  13  LYS   HG3   15  PHE     H   6.60 #  
  10  ASN     H   16  GLY    HA   6.80 #  
 28  PHE      O  62  ALA      H    2.20 #ENDURANCE 0.000000 #FLIPPED
  48  THR     H   68  VAL     H   6.60 #  
  49  VAL    HA   68  VAL   HG2   6.60 #  
   5  ILE     H   19  THR     O   2.20 #  
  33  GLU   HG2   63  ASN    HA   6.80 #  
  20  PRO   HD2   24  SER     H   4.30 #  
   9  PHE   HB2   16  GLY    HA   6.60 #  
   9  PHE    HA   16  GLY    HA   6.60 #  
  34  ILE    HA   65  VAL    HB   6.80 #  
  50  GLU     H   66  VAL    HB   6.80 #  
   6  VAL   HG1   17  PHE     H   6.43 #  
  30  HIS     H   33  GLU     H   6.43 #  
  64  LYS   HB3   66  VAL     H   5.50 #  
  19  THR   HG2   23  GLY     H   6.40 #  
  18  ILE     H   26  ASP    HA   6.80 #  
   6  VAL   HG2   48  THR     H   6.40 #  
  43  LEU    HA   48  THR     H   6.50 #  
  30  HIS     H   33  GLU   HG3   6.36 #  
  49  VAL    HB   67  ALA    HA   6.80 #  
  47  GLN  HE22   67  ALA    HA   6.80 #  
  55  GLN     H   56  GLY     H   4.50 #  
  53  VAL    HA   60  PRO   HG3   6.30 #  
  18  ILE     H   19  THR    HA   6.20 #  
   4  GLY   HA2   49  VAL     H   6.18 #  
  15  PHE     H   31  HIS     H   6.16 #  
  20  PRO   HD3   25  LYS     H   6.14 #  
  30  HIS     H   33  GLU   HB2   6.13 #  
  10  ASN   HB2   11  SER     H   6.12 #  
   4  GLY     H   51  TYR     H   6.12 #  
  30  HIS    HA   30  HIS   HB2   6.10 #  
  30  HIS   HB3   31  HIS     H   6.10 #  
  50  GLU     H   67  ALA    HA   6.80 #  
   5  ILE    HA    5  ILE  HG13   6.10 #  
  15  PHE    HA   29  VAL     H   6.10 #  
  30  HIS   HB2   30  HIS   HD2   6.10 #  
  21  GLU     H   23  GLY     H   6.09 #  
  29  VAL    HB   29  VAL     H   6.07 #  
   2  SER   HB2   51  TYR     H   6.01 #  
   9  PHE   HB3   43  LEU    HG   6.80 #  
  40  TYR   HB2   42  THR     H   6.00 #  
  16  GLY     H   28  PHE    HA   6.80 #  
  18  ILE  HG12   18  ILE  HG13   6.00 #  
   8  TRP     H   17  PHE   HB2   6.80 #  
  26  ASP    HA   27  LEU     H   5.99 #  
  26  ASP    HA   26  ASP    HB   5.99 #  
   9  PHE   HB3    9  PHE     H   5.99 #  
  31  HIS   HB2   32  SER     H   5.97 #  
   5  ILE  HG12    5  ILE  HG13   5.94 #  
  27  LEU     H   28  PHE     H   5.94 #  
  10  ASN    HA   13  LYS     H   5.94 #  
   5  ILE     H   18  ILE    HA   6.80 #  
   9  PHE    HE   43  LEU    HG   5.93 #  
  54  GLY     H   60  PRO   HB2   5.91 #  
  13  LYS   HG2   13  LYS   HG3   5.91 #  
   6  VAL   HG2   47  GLN    HA   5.90 #  
  16  GLY     H   29  VAL    HB   6.80 #  
   5  ILE   HG2   19  THR    HB   5.90 #  
  43  LEU   HD1   49  VAL    HB   7.20 #  
  30  HIS   HB3   33  GLU   HG2   5.90 #  
   7  LYS    HA   18  ILE    HA   6.80 #  
   5  ILE    HB   19  THR    HB   5.90 #  
  50  GLU   HB2   50  GLU    HG   5.89 #  
  58  LYS    HG   58  LYS   HB3   5.88 #  
  47  GLN   HB2   47  GLN    HA   5.85 #  
   6  VAL    HA   18  ILE    HA   5.85 #  
  28  PHE   HB2   62  ALA     H   5.85 #  
  32  SER     H   34  ILE     H   5.84 #  
  15  PHE   HB3   30  HIS    HA   5.83 #  
  50  GLU   HB2   50  GLU    HA   5.82 #  
  49  VAL     H   68  VAL     H   5.80 #  
   6  VAL    HB   47  GLN   HB3   6.80 #  
  18  ILE  HG12   29  VAL    HB   6.70 #  
   9  PHE     H   16  GLY    HA   5.80 #  
  31  HIS   HB2   31  HIS   HD2   5.80 #  
  50  GLU    HG   68  VAL     H   6.60 #  
   8  TRP     H   18  ILE    HA   6.80 #  
  20  PRO   HG3   27  LEU     H   5.79 #  
  15  PHE   HB2   28  PHE   HB3   5.79 #  
  33  GLU   HG3   64  LYS     H   5.79 #  
  47  GLN   HB3   47  GLN     H   5.79 #  
   7  LYS     H   17  PHE     H   6.60 #  
  62  ALA     H   63  ASN     H   5.77 #  
  57  GLN   HG3   59  GLY     H   5.77 #  
   3  LYS   HG2   50  GLU    HA   5.74 #  
  50  GLU   HB3   51  TYR     H   5.74 #  
  28  PHE     H   61  CYS   HB2   5.73 #  
  43  LEU     H   44  ALA     H   5.72 #  
   5  ILE    HA   48  THR     H   5.71 #  
   3  LYS   HG2    3  LYS    HA   5.71 #  
   5  ILE   HG2   47  GLN    HA   6.60 #  
   4  GLY   HA3    6  VAL     H   5.70 #  
  15  PHE   HB3   29  VAL     H   6.60 #  
  14  GLY   HA3   31  HIS     H   6.60 #  
  14  GLY   HA3   31  HIS   HB3   6.60 #  
  30  HIS   HB3   32  SER     H   6.60 #  
   6  VAL   HG1    8  TRP     H   5.68 #  
  49  VAL    HA   66  VAL     H   5.66 #  
  65  VAL    HB   66  VAL     H   5.65 #  
  58  LYS    HG   58  LYS   HD2   5.65 #  
   8  TRP     H    9  PHE     H   5.64 #  
  55  GLN   HB3   55  GLN    HG   5.63 #  
  52  GLU   HB2   63  ASN     H   5.62 #  
   3  LYS    HA   50  GLU   HB2   5.62 #  
  30  HIS   HB2   30  HIS   HB3   5.62 #  
  30  HIS   HB3   33  GLU     H   6.60 #  
  30  HIS   HB2   33  GLU     H   6.60 #  
  20  PRO   HB3   25  LYS     H   5.60 #  
  17  PHE    HA   29  VAL   HG2   6.90 #  
  30  HIS   HB3   33  GLU   HG3   6.60 #  
  30  HIS   HB2   32  SER     H   5.60 #  
   5  ILE   HG2   46  GLY     H   7.30 #  
  22  ASP   HB2   23  GLY     H   5.59 #  
  13  LYS   HG2   13  LYS   HB2   5.59 #  
  13  LYS   HD2   13  LYS   HD3   5.58 #  
   6  VAL     H   19  THR    HB   5.58 #  
  28  PHE   HB3   29  VAL     H   5.57 #  
  42  THR    HB   43  LEU     H   5.56 #  
  50  GLU   HB3   50  GLU     H   5.56 #  
  30  HIS     H   33  GLU   HB3   5.55 #  
  56  GLY   HA3   57  GLN     H   5.54 #  
  17  PHE   HB3   26  ASP    HB   5.54 #  
  18  ILE  HG13   18  ILE    HB   5.54 #  
  45  ASP    HA   46  GLY     H   5.52 #  
  55  GLN    HG   56  GLY     H   5.52 #  
  45  ASP   HB3   45  ASP    HA   5.52 #  
   6  VAL   HG2   45  ASP     H   8.20 #  
  27  LEU   HB3   28  PHE     H   5.51 #  
  20  PRO    HA   25  LYS     H   7.60 #  
  25  LYS     H   26  ASP     H   5.50 #  
   7  LYS   HB3   17  PHE   HB2   6.60 #  
   6  VAL   HG1   45  ASP     H   6.60 #  
  16  GLY     H   29  VAL   HG2   6.10 #  
   8  TRP   HB3   17  PHE     H   6.60 #  
  20  PRO   HB3   20  PRO   HB2   5.50 #  
   5  ILE  HG12    5  ILE    HA   5.50 #  
  12  ASP    HA   13  LYS     H   5.50 #  
  25  LYS    HG   25  LYS     H   5.48 #  
  20  PRO    HA   20  PRO   HB3   5.47 #  
  20  PRO    HA   20  PRO   HG2   5.47 #  
  52  GLU   HB2   52  GLU   HG2   5.47 #  
  52  GLU   HB2   52  GLU   HG3   5.47 #  
   3  LYS   HG3    4  GLY     H   5.47 #  
  20  PRO   HD2   20  PRO   HD3   5.46 #  
   8  TRP   HB2   17  PHE     H   6.60 #  
  12  ASP   HB3   12  ASP   HB2   5.45 #  
   3  LYS     H   21  GLU   HG2   5.44 #  
  13  LYS   HB3   14  GLY     H   5.42 #  
  42  THR   HG2   43  LEU     H   5.42 #  
   6  VAL     H   47  GLN    HA   5.42 #  
   6  VAL     H   46  GLY   HA2   5.42 #  
  18  ILE     H   29  VAL    HB   5.42 #  
  18  ILE     H   18  ILE    HA   5.42 #  
  55  GLN   HB2   56  GLY     H   5.42 #  
   7  LYS   HB3   18  ILE     H   5.42 #  
  10  ASN  HD21   13  LYS   HG3   5.42 #  
  28  PHE     H   61  CYS   HB3   5.41 #  
  18  ILE     H   27  LEU     O   2.20 #  
   6  VAL   HG1   18  ILE  HG13   5.90 #  
  44  ALA    HB   47  GLN     H   5.40 #  
   5  ILE   HG2   46  GLY   HA2   5.40 #  
   9  PHE    HE   11  SER    HA   6.60 #  
   3  LYS   HB3    3  LYS   HG3   5.40 #  
   5  ILE    HA   48  THR    HB   6.80 #  
  15  PHE   HB2   15  PHE   HB3   5.39 #  
   6  VAL    HA   18  ILE    HB   5.38 #  
  28  PHE   HB2   28  PHE   HB3   5.38 #  
  28  PHE   HB3   62  ALA     H   5.37 #  
  47  GLN   HG3   68  VAL     H   5.37 #  
  18  ILE     H   28  PHE    HA   5.37 #  
  10  ASN    HA   12  ASP     H   6.60 #  
  18  ILE     H   20  PRO   HD3   5.37 #  
  51  TYR   HB3   62  ALA    HB   5.36 #  
  43  LEU    HG   44  ALA     H   5.36 #  
   8  TRP    HA   45  ASP    HA   5.36 #  
   7  LYS    HA    7  LYS     H   5.36 #  
  19  THR    HA   26  ASP    HA   5.36 #  
   7  LYS     H    7  LYS    HA   5.35 #  
  47  GLN  HE21   68  VAL     H   5.35 #  
   7  LYS   HB3   17  PHE     H   5.33 #  
  29  VAL     H   29  VAL    HA   5.32 #  
  29  VAL     H   30  HIS    HA   5.32 #  
  28  PHE    HA   28  PHE   HB2   5.32 #  
  17  PHE   HB2   18  ILE     H   5.32 #  
  43  LEU   HB2   47  GLN   HG2   5.31 #  
   6  VAL    HA    6  VAL    HB   5.30 #  
  10  ASN   HB3   13  LYS     H   6.60 #  
   6  VAL   HG1   18  ILE    HA   6.60 #  
  65  VAL     H   66  VAL     H   5.30 #  
  12  ASP   HB2   14  GLY     H   5.30 #  
  51  TYR   HB3   66  VAL     H   5.29 #  
  57  GLN    HA   57  GLN   HG2   5.27 #  
  48  THR    HA   48  THR    HB   5.27 #  
   4  GLY     H   20  PRO    HA   5.26 #  
  14  GLY   HA2   15  PHE     H   5.26 #  
  13  LYS   HG3   13  LYS     H   5.25 #  
  33  GLU    HA   64  LYS     H   5.24 #  
   7  LYS   HB2    8  TRP     H   5.23 #  
  32  SER     H   33  GLU     H   5.23 #  
  58  LYS   HB3   59  GLY     H   5.22 #  
  28  PHE     H   28  PHE    HA   5.21 #  
  61  CYS   HB3   62  ALA     H   5.21 #  
  20  PRO   HB2   23  GLY     H   5.21 #  
  11  SER     H   12  ASP     H   5.21 #  
   6  VAL    HA   18  ILE   HG2   6.60 #  
  47  GLN   HG2   48  THR     H   5.20 #  
  47  GLN   HG3   48  THR     H   5.20 #  
  29  VAL    HB   30  HIS     H   5.20 #  
   6  VAL    HB   43  LEU   HB2   6.60 #  
  10  ASN   HB3   15  PHE     H   5.20 #  
   3  LYS   HB3    4  GLY     H   5.18 #  
  57  GLN    HA   58  LYS     H   5.18 #  
  20  PRO   HG2   20  PRO   HB2   5.18 #  
  63  ASN    HA   65  VAL     H   5.18 #  
   5  ILE  HG12   48  THR    HA   6.80 #  
  24  SER   HB2   24  SER    HA   5.15 #  
  13  LYS    HA   13  LYS   HB3   5.15 #  
  49  VAL     H   49  VAL    HA   5.14 #  
  16  GLY     H   29  VAL    HA   5.14 #  
  16  GLY     H   30  HIS    HA   5.14 #  
  45  ASP   HB2   46  GLY     H   5.14 #  
  50  GLU   HB3   66  VAL     H   5.14 #  
  20  PRO   HG2   25  LYS     H   5.13 #  
  15  PHE   HB2   28  PHE    HA   5.12 #  
  31  HIS    HA   31  HIS   HB2   5.11 #  
  50  GLU   HB3   50  GLU   HB2   5.11 #  
  43  LEU    HA   43  LEU   HB3   5.11 #  
  43  LEU    HA   43  LEU     H   5.11 #  
  32  SER     H   32  SER    HA   5.11 #  
   5  ILE    HB    5  ILE  HG13   5.10 #  
  62  ALA     H   62  ALA    HA   5.10 #  
  56  GLY     H   57  GLN   HG3   6.00 #  
  53  VAL    HA   53  VAL    HB   5.10 #  
  46  GLY   HA3   47  GLN     H   5.10 #  
  50  GLU     H   68  VAL     H   5.10 #  
  49  VAL   HG1   68  VAL     H   4.60 #  
  11  SER   HB3   12  ASP     H   5.09 #  
  13  LYS   HB2   15  PHE     H   5.08 #  
  49  VAL     H   50  GLU     H   5.08 #  
  22  ASP   HB2   24  SER     H   5.07 #  
  47  GLN  HE22   48  THR     H   5.07 #  
   6  VAL    HA   18  ILE  HG12   5.06 #  
  17  PHE   HB2   17  PHE    HA   5.06 #  
   7  LYS    HG   26  ASP    HB   7.40 #  
   8  TRP     H    8  TRP    HA   5.05 #  
  27  LEU    HG   27  LEU     H   5.04 #  
  52  GLU   HB3   52  GLU    HA   5.04 #  
   9  PHE     H   45  ASP    HA   5.04 #  
  55  GLN   HB2   55  GLN   HB3   5.04 #  
  20  PRO   HG3   24  SER     H   5.03 #  
  18  ILE     H   27  LEU   HB2   5.03 #  
  57  GLN   HB3   58  LYS     H   5.03 #  
  11  SER     H   13  LYS     H   6.60 #  
  51  TYR    HA   66  VAL     H   5.02 #  
   5  ILE    HB   19  THR     H   5.02 #  
  55  GLN    HA   55  GLN    HG   5.00 #  
  49  VAL    HA   67  ALA     H   5.00 #  
  31  HIS   HD2   42  THR    HA   4.99 #  
   7  LYS   HB2    7  LYS   HB3   4.97 #  
  21  GLU    HA   22  ASP     H   4.97 #  
   7  LYS   HB2    7  LYS    HG   4.97 #  
  18  ILE  HG13   18  ILE    HA   4.96 #  
   5  ILE     H    5  ILE    HA   4.96 #  
   6  VAL   HG2    7  LYS     H   4.93 #  
   7  LYS    HG    7  LYS    HE   4.92 #  
  22  ASP    HA   23  GLY     H   4.92 #  
  31  HIS    HA   31  HIS   HD2   4.92 #  
   6  VAL    HA    8  TRP     H   4.91 #  
  65  VAL     H   65  VAL    HA   4.91 #  
  56  GLY     H   59  GLY     H   4.90 #  
  18  ILE   HD1   29  VAL    HB   6.30 #  
  34  ILE    HB   66  VAL     H   5.70 #  
  22  ASP   HB3   22  ASP    HA   4.90 #  
  15  PHE     H   15  PHE    HA   4.90 #  
  47  GLN   HB3   47  GLN   HB2   4.89 #  
  18  ILE  HG12   18  ILE   HD1   4.88 #  
  18  ILE   HG2   19  THR     H   4.88 #  
  19  THR    HA   20  PRO   HD2   4.88 #  
  43  LEU   HB2   44  ALA     H   4.88 #  
  19  THR   HG2   20  PRO   HD2   4.87 #  
  17  PHE     H   17  PHE    HA   4.86 #  
  20  PRO   HB2   20  PRO   HD3   4.86 #  
  13  LYS   HG3   13  LYS    HA   4.86 #  
  43  LEU   HB3   44  ALA     H   4.86 #  
  29  VAL   HG1   30  HIS     H   4.85 #  
  31  HIS   HB2   31  HIS   HB3   4.85 #  
   2  SER    HA    2  SER   HB2   4.85 #  
  43  LEU   HD1   43  LEU   HB2   4.85 #  
  13  LYS    HA   14  GLY     H   4.84 #  
  64  LYS   HB2   65  VAL     H   4.38 #  
   7  LYS    HA    8  TRP     H   4.84 #  
  12  ASP   HB3   13  LYS     H   4.84 #  
  14  GLY   HA3   15  PHE     H   4.82 #  
  10  ASN   HB2   13  LYS     H   4.81 #  
   5  ILE     H    6  VAL     H   4.81 #  
  20  PRO   HD2   27  LEU     H   4.80 #  
   9  PHE   HB3   43  LEU     H   6.60 #  
   9  PHE   HB2   43  LEU     H   6.60 #  
  20  PRO   HB2   20  PRO   HD2   4.80 #  
   5  ILE  HG13   19  THR    HA   4.80 #  
  17  PHE     H   18  ILE    HA   4.80 #  
   9  PHE   HB3   43  LEU   HB3   6.60 #  
  22  ASP    HA   22  ASP   HB2   4.79 #  
   5  ILE  HG12   19  THR    HB   4.79 #  
   3  LYS   HB2    4  GLY     H   4.78 #  
  27  LEU   HB3   27  LEU    HA   4.78 #  
  33  GLU   HB3   64  LYS     H   4.76 #  
  15  PHE   HB2   29  VAL     H   4.75 #  
   6  VAL   HG2   46  GLY     H   5.40 #  
  17  PHE    HA   29  VAL    HB   4.74 #  
  12  ASP   HB2   13  LYS     H   4.72 #  
  13  LYS     H   13  LYS    HA   4.72 #  
  61  CYS   HB2   62  ALA     H   4.70 #  
   6  VAL   HG2   45  ASP    HA   6.50 #  
   7  LYS    HA   19  THR     H   6.60 #  
   6  VAL     H   48  THR    HA   6.80 #  
  58  LYS    HA   59  GLY     H   4.69 #  
  65  VAL    HG   66  VAL     H   4.68 #  
  31  HIS     H   31  HIS    HA   4.68 #  
  27  LEU   HB3   62  ALA     H   4.67 #  
  48  THR   HG2   49  VAL     H   4.66 #  
   6  VAL    HB   44  ALA     H   4.65 #  
  44  ALA     H   47  GLN   HG3   4.65 #  
   8  TRP   HB2   45  ASP     H   6.60 #  
   7  LYS     H   19  THR     H   4.64 #  
  57  GLN    HA   59  GLY     H   4.63 #  
   6  VAL    HA   19  THR     H   4.62 #  
   7  LYS     H    8  TRP     H   4.62 #  
  54  GLY     H   54  GLY   HA2   4.62 #  
  29  VAL    HA   62  ALA     H   4.62 #  
  23  GLY     H   24  SER     H   4.62 #  
  13  LYS   HB3   15  PHE     H   4.61 #  
  57  GLN   HB3   57  GLN    HA   4.61 #  
  55  GLN   HB2   55  GLN     H   4.61 #  
  21  GLU   HB3   22  ASP     H   4.60 #  
  18  ILE    HA   20  PRO   HD3   5.50 #  
   6  VAL   HG1   45  ASP    HA   6.60 #  
  64  LYS     H   65  VAL     H   4.58 #  
  52  GLU   HB3   52  GLU   HB2   4.57 #  
  22  ASP   HB3   24  SER     H   4.57 #  
  23  GLY   HA3   24  SER     H   4.57 #  
  63  ASN   HB2   64  LYS     H   4.57 #  
   7  LYS   HB3    7  LYS     H   4.57 #  
  15  PHE    HA   31  HIS     H   4.56 #  
  15  PHE   HB3   16  GLY     H   4.55 #  
  49  VAL    HB   66  VAL     H   4.55 #  
  67  ALA    HB   68  VAL     H   4.55 #  
   9  PHE   HB2   45  ASP     H   6.60 #  
  63  ASN    HA   64  LYS     H   4.54 #  
  10  ASN   HB2   15  PHE     H   4.53 #  
  68  VAL     H   68  VAL    HA   4.51 #  
   7  LYS   HB3   17  PHE   HB3   4.51 #  
   7  LYS    HA   46  GLY     H   6.60 #  
  21  GLU     H   22  ASP     H   4.49 #  
  51  TYR   HB2   52  GLU     H   4.48 #  
  17  PHE    HA   29  VAL     H   4.48 #  
  56  GLY     H   60  PRO    HA   4.47 #  
  24  SER     H   24  SER    HA   4.44 #  
  20  PRO   HD2   26  ASP    HA   4.44 #  
   4  GLY   HA2    5  ILE     H   4.43 #  
  21  GLU    HA   23  GLY     H   4.43 #  
  54  GLY     H   61  CYS     H   4.43 #  
   6  VAL   HG1   46  GLY     H   6.60 #  
   7  LYS    HA    7  LYS    HG   4.42 #  
   7  LYS    HA    7  LYS   HB3   4.42 #  
  46  GLY     H   47  GLN     H   4.42 #  
  11  SER   HB3   31  HIS   HB2   4.40 #  
  15  PHE    HA   29  VAL   HG2   7.40 #  
  22  ASP     H   22  ASP    HA   4.40 #  
   2  SER   HB3    3  LYS     H   4.40 #  
  15  PHE    HA   16  GLY     H   4.40 #  
  15  PHE   HB3   15  PHE    HA   4.39 #  
  50  GLU     H   66  VAL     H   4.39 #  
  17  PHE    HA   17  PHE   HB3   4.39 #  
   6  VAL    HB   46  GLY   HA2   6.60 #  
   7  LYS   HB3    8  TRP     H   4.37 #  
   6  VAL     H   47  GLN     H   4.37 #  
  51  TYR    HA   52  GLU     H   4.36 #  
  16  GLY     H   29  VAL     H   4.35 #  
   5  ILE     H   19  THR     H   4.35 #  
  24  SER   HB3   25  LYS     H   4.33 #  
   3  LYS   HG2    3  LYS   HG3   4.33 #  
  25  LYS     H   25  LYS    HA   4.32 #  
   5  ILE    HA   49  VAL     H   4.31 #  
  64  LYS     H   64  LYS    HA   4.30 #  
  52  GLU     H   63  ASN     H   4.30 #  
  61  CYS    HA   62  ALA     H   4.30 #  
  13  LYS     H   14  GLY     H   4.30 #  
  25  LYS   HB2   26  ASP     H   4.28 #  
  48  THR    HB   48  THR     H   4.28 #  
  45  ASP    HA   47  GLN     H   4.27 #  
   6  VAL    HB   45  ASP    HA   4.27 #  
  14  GLY     H   14  GLY   HA3   4.26 #  
  30  HIS    HA   31  HIS     H   4.26 #  
  14  GLY     H   15  PHE     H   4.26 #  
  29  VAL    HA   30  HIS     H   4.24 #  
  30  HIS     H   30  HIS    HA   4.24 #  
  17  PHE    HA   28  PHE    HA   4.22 #  
   6  VAL    HA    7  LYS     H   4.21 #  
   5  ILE  HG13   19  THR    HB   6.60 #  
   6  VAL    HB   46  GLY   HA3   6.60 #  
  43  LEU    HA   47  GLN  HE22   6.60 #  
  47  GLN     H   47  GLN    HA   4.20 #  
  22  ASP     H   23  GLY     H   4.19 #  
  20  PRO   HB2   22  ASP     H   4.19 #  
  28  PHE     H   61  CYS    HA   4.18 #  
  66  VAL     H   66  VAL    HA   4.18 #  
  64  LYS    HA   65  VAL     H   4.16 #  
  51  TYR   HB3   51  TYR    HA   4.15 #  
   6  VAL    HA   18  ILE  HG13   4.13 #  
   7  LYS     H   18  ILE  HG13   4.11 #  
  43  LEU    HA   47  GLN  HE21   6.60 #  
   4  GLY   HA3    5  ILE     H   4.10 #  
  18  ILE    HA   19  THR     H   4.09 #  
  28  PHE    HA   29  VAL     H   4.09 #  
  17  PHE    HA   18  ILE     H   4.08 #  
  65  VAL    HA   66  VAL     H   4.08 #  
  14  GLY   HA2   31  HIS   HB2   4.04 #  
   5  ILE   HG2   21  GLU    HA   6.80 #  
   7  LYS     H   18  ILE    HA   3.96 #  
   8  TRP     H   17  PHE     H   3.96 #  
  24  SER    HA   25  LYS     H   3.95 #  
  24  SER   HB2   25  LYS     H   3.95 #  
  48  THR    HA   49  VAL     H   3.91 #  
  27  LEU    HA   28  PHE     H   3.90 #  
   6  VAL   HG1   47  GLN   HB3   6.60 #  
  43  LEU    HA   44  ALA     H   3.88 #  
  55  GLN    HA   56  GLY     H   3.85 #  
  10  ASN  HD21   13  LYS   HD3   6.60 #  
  12  ASP     H   13  LYS     H   3.80 #  
  47  GLN    HA   48  THR     H   3.79 #  
   3  LYS    HA    4  GLY     H   3.79 #  
   6  VAL    HB   46  GLY     H   3.79 #  
  19  THR    HA   20  PRO   HD3   3.76 #  
  49  VAL    HA   68  VAL     H   3.73 #  
  15  PHE   HB2   30  HIS    HA   3.66 #  
  67  ALA    HA   68  VAL     H   3.65 #  
   9  PHE   HB2    9  PHE   HB3   3.62 #  
   4  GLY     H   50  GLU    HA   3.60 #  
   8  TRP     H   17  PHE     O   2.20 #  
   5  ILE    HA   47  GLN     H   6.60 #  
  25  LYS    HA   26  ASP     H   3.47 #  
  34  ILE    HA   65  VAL     H   3.47 #  
 48  THR      O  68  VAL      N    3.30 #ENDURANCE 0.000000 #FLIPPED
 10  ASN      O  14  GLY      N    3.30 #ENDURANCE 0.000000 #FLIPPED
  10  ASN     N   15  PHE     O   3.30 #  
  49  VAL   HG2   67  ALA     H   7.60 #  
 28  PHE      O  62  ALA      N    3.30 #ENDURANCE 0.000000 #FLIPPED
 52  GLU      O  63  ASN      N    3.30 #ENDURANCE 0.000000 #FLIPPED
   6  VAL     N   47  GLN     O   3.30 #  
  2  SER      O  51  TYR      N    3.30 #ENDURANCE 0.000000 #FLIPPED
  18  ILE     N   27  LEU     O   3.30 #  
  16  GLY     N   29  VAL     O   3.30 #  
   8  TRP     N   17  PHE     O   3.30 #  
  52  GLU     N   63  ASN     O   3.30 #  
 50  GLU      O  66  VAL      N    3.30 #ENDURANCE 0.000000 #FLIPPED
 16  GLY      O  29  VAL      N    3.30 #ENDURANCE 0.000000 #FLIPPED
  54  GLY     N   61  CYS     O   3.30 #  
 54  GLY      O  61  CYS      N    3.30 #ENDURANCE 0.000000 #FLIPPED
  5  ILE      O  19  THR      N    3.30 #ENDURANCE 0.000000 #FLIPPED
  8  TRP      O  17  PHE      N    3.30 #ENDURANCE 0.000000 #FLIPPED
  50  GLU     N   66  VAL     O   3.30 #  
   5  ILE     N   19  THR     O   3.30 #  
   7  LYS     N   17  PHE     O   3.30 #  
  4  GLY      O  49  VAL      N    3.30 #ENDURANCE 0.000000 #FLIPPED
   4  GLY     N   49  VAL     O   3.30 #  
  21  GLU   HG3   24  SER     H   6.60 #  
   6  VAL    HB   47  GLN     H   3.22 #  
  47  GLN   HG2   68  VAL     H   5.37 #  
 54  GLY      O  61  CYS      H    2.30 #ENDURANCE 0.000000 #FLIPPED
   5  ILE     H   20  PRO    HA   6.80 #  
   4  GLY     H   49  VAL     O   2.30 #  
   4  GLY   HA3   20  PRO    HA   6.60 #  
   5  ILE  HG13   21  GLU     H   5.60 #  
   7  LYS     H   17  PHE     O   2.20 #  
  50  GLU     H   66  VAL     O   2.20 #  
   6  VAL   HG1   47  GLN    HA   7.10 #  
 16  GLY      O  29  VAL      H    2.20 #ENDURANCE 0.000000 #FLIPPED
  52  GLU     H   63  ASN     O   2.20 #  
  44  ALA    HB   47  GLN   HB2   6.60 #  
  18  ILE    HA   26  ASP    HA   5.30 #  
  44  ALA     H   47  GLN   HB2   6.60 #  
   6  VAL     H   47  GLN     O   2.20 #  
  54  GLY     H   61  CYS     O   2.20 #  
  44  ALA     H   47  GLN   HG2   6.60 #  
  16  GLY     H   29  VAL     O   2.20 #  
 10  ASN      O  14  GLY      H    2.20 #ENDURANCE 0.000000 #FLIPPED
  35  GLN     H   65  VAL     H   4.42 #  
  2  SER      O  51  TYR      H    2.20 #ENDURANCE 0.000000 #FLIPPED
 48  THR      O  68  VAL      H    2.20 #ENDURANCE 0.000000 #FLIPPED
  5  ILE      O  19  THR      H    2.20 #ENDURANCE 0.000000 #FLIPPED
  44  ALA     H   47  GLN     H   6.60 #  
# Restraints file 2: final.aco
   3 LYS PHI -190.661  -72.857
   3 LYS PSI   91.674  203.166
   4 GLY PHI -184.804 -132.740
   4 GLY PSI -172.920  206.421
   5 ILE PHI -148.082 -108.082
   5 ILE PSI  117.494  157.494
   6 VAL PHI  -89.147  -49.147
   6 VAL PSI  100.606  140.606
   7 LYS PHI -108.321  -68.321
   7 LYS PSI  -61.608  -21.608
   8 TRP PHI -178.385 -126.957
   8 TRP PSI  121.833  171.497
   9 PHE PHI -166.353 -106.993
   9 PHE PSI  104.691  147.403
  10 ASN PHI -140.840  -65.368
  10 ASN PSI   85.351  125.351
  11 SER PHI  -87.234  -47.234
  11 SER PSI  -50.618  -10.618
  12 ASP PHI  -88.467  -48.467
  12 ASP PSI  -61.291  -21.291
  13 LYS PHI -114.860  -74.796
  13 LYS PSI  -32.238    8.550
  14 GLY PHI   52.968   92.968
  14 GLY PSI    8.628   50.208
  15 PHE PHI -175.134 -111.218
  15 PHE PSI  129.922  177.286
  16 GLY PHI -190.702 -134.738
  16 GLY PSI -179.900  198.423
  17 PHE PHI -159.761 -101.361
  17 PHE PSI  120.235  165.363
  18 ILE PHI -147.325  -95.453
  18 ILE PSI  107.610  147.610
  19 THR PHI -150.202  -76.494
  19 THR PSI   96.544  162.004
  20 PRO PSI  125.480  165.480
  21 GLU PHI  -82.785  -42.785
  21 GLU PSI  -42.973   -2.973
  22 ASP PHI -106.428  -66.428
  22 ASP PSI  -19.155   20.845
  23 GLY PHI   70.297  110.297
  23 GLY PSI  -22.836   18.132
  24 SER PHI -102.059  -42.059
  24 SER PSI  115.986  188.970
  26 ASP PHI  -99.522  -39.522
  26 ASP PSI  109.151  173.267
  27 LEU PHI -141.492  -93.676
  27 LEU PSI  106.762  160.122
  28 PHE PHI -129.110  -53.690
  28 PHE PSI  109.928  149.928
  29 VAL PHI -145.473 -101.657
  29 VAL PSI  110.607  154.135
  30 HIS PHI -136.563  -45.015
  30 HIS PSI  110.310  175.870
  31 HIS PHI  -77.737  -37.737
  31 HIS PSI  -53.287  -13.287
  32 SER PHI  -88.795  -48.795
  32 SER PSI  -38.394    1.606
  33 GLU PHI -111.971  -71.971
  33 GLU PSI  -24.103   15.897
  41 ALA PHI  -95.563  -45.659
  41 ALA PSI  120.393  160.393
  43 LEU PHI -152.831 -112.831
  43 LEU PSI  125.096  167.976
  44 ALA PHI -144.937  -55.157
  44 ALA PSI -171.120  206.702
  45 ASP PHI  -84.660  -32.855
  45 ASP PSI  112.921  152.921
  46 GLY PHI   74.280  114.280
  46 GLY PSI  -32.913    7.087
  47 GLN PHI  -88.738  -48.738
  47 GLN PSI  118.200  158.200
  48 THR PHI -112.602  -60.578
  48 THR PSI  109.764  149.764
  49 VAL PHI -154.521 -114.521
  49 VAL PSI  138.678  178.678
  50 GLU PHI -145.757  -86.553
  50 GLU PSI  118.617  176.457
  51 TYR PHI -173.723 -122.963
  51 TYR PSI  137.619  181.231
  52 GLU PHI -144.901  -91.685
  52 GLU PSI  113.409  153.913
  53 VAL PHI -100.353  -39.805
  53 VAL PSI  109.142  149.142
  55 GLN PHI -136.061  -28.427
  55 GLN PSI   69.545  192.407
  57 GLN PHI  -81.817  -41.817
  57 GLN PSI  -49.398   -9.398
  58 LYS PHI -109.733  -69.733
  58 LYS PSI  -20.438   20.898
  60 PRO PSI  119.125  159.125
  61 CYS PHI -180.165  -91.001
  61 CYS PSI  115.768  180.848
  62 ALA PHI -161.052  -88.152
  62 ALA PSI  108.577  156.753
  63 ASN PHI -156.707  -96.223
  63 ASN PSI  126.722  187.590
  64 LYS PHI   34.813   74.813
  64 LYS PSI   25.882   65.882
  65 VAL PHI  -96.352  -56.352
  65 VAL PSI  106.776  146.776
  66 VAL PHI -151.817 -101.685
  66 VAL PSI  100.815  160.571
  67 ALA PHI -106.607  -56.439
  67 ALA PSI  100.637  152.653
# Restraints file 3: summed.lol
  10  ASN     H   15  PHE     H   1.80 #  
  13  LYS   HB3   15  PHE     H   1.80 #  
  31  HIS    HA   34  ILE   HG2   1.80 #  
  14  GLY   HA3   15  PHE     H   1.80 #  
  14  GLY     H   15  PHE     H   1.80 #  
  14  GLY   HA2   15  PHE     H   1.80 #  
  31  HIS   HB2   34  ILE   HD1   1.80 #  
  13  LYS   HB2   15  PHE     H   1.80 #  
  31  HIS    HA   34  ILE    HB   1.80 #  
  31  HIS   HB3   34  ILE   HD1   1.80 #  
  20  PRO    HA   20  PRO   HB3   1.80 #  
   7  LYS    HG    8  TRP     H   1.80 #  
  34  ILE   HG2   36  SER   HB3   1.80 #  
  34  ILE   HG2   36  SER     H   1.80 #  
  40  TYR   HB2   42  THR     H   1.80 #  
  40  TYR   HB3   42  THR     H   1.80 #  
   9  PHE    HE   42  THR    HB   1.80 #  
   9  PHE    HE   42  THR    HA   1.80 #  
  20  PRO   HB2   20  PRO   HD3   1.80 #  
  20  PRO   HB2   20  PRO   HD2   1.80 #  
  20  PRO   HG2   20  PRO   HB2   1.80 #  
  20  PRO   HD2   20  PRO   HD3   1.80 #  
  20  PRO   HB3   20  PRO   HB2   1.80 #  
  31  HIS   HD2   42  THR    HA   1.80 #  
   9  PHE    HE   42  THR   HG2   1.80 #  
  34  ILE   HD1   42  THR    HA   1.80 #  
   4  GLY     H   20  PRO    HA   1.80 #  
  13  LYS   HG2   15  PHE     H   1.80 #  
   9  PHE   HB3   43  LEU   HB3   1.80 #  
  18  ILE     H   20  PRO   HD3   1.80 #  
   6  VAL   HG1   43  LEU   HD1   1.80 #  
   6  VAL   HG1   43  LEU   HB2   1.80 #  
   4  GLY   HA3   20  PRO    HA   1.80 #  
   6  VAL    HB   43  LEU   HB2   1.80 #  
   6  VAL   HG1    8  TRP     H   1.80 #  
  34  ILE   HG2   43  LEU    HG   1.80 #  
   2  SER    HA    2  SER   HB2   1.80 #  
   9  PHE   HB3   43  LEU    HG   1.80 #  
  18  ILE    HA   20  PRO   HD3   1.80 #  
  13  LYS     H   15  PHE     H   1.80 #  
  13  LYS   HG3   15  PHE     H   1.80 #  
  15  PHE   HB2   15  PHE   HB3   1.80 #  
  42  THR   HG2   43  LEU     H   1.80 #  
  42  THR    HB   43  LEU     H   1.80 #  
   5  ILE     H   20  PRO    HA   1.80 #  
  15  PHE   HB3   15  PHE    HA   1.80 #  
   3  LYS     H   21  GLU   HG2   1.80 #  
  43  LEU    HA   43  LEU   HB3   1.80 #  
  43  LEU    HA   43  LEU     H   1.80 #  
  43  LEU   HD1   43  LEU   HB2   1.80 #  
  15  PHE     H   15  PHE    HA   1.80 #  
  10  ASN   HB2   15  PHE     H   1.80 #  
   5  ILE  HG13   21  GLU     H   1.80 #  
  29  VAL    HB   43  LEU   HD1   1.80 #  
   6  VAL    HB   43  LEU   HD2   1.80 #  
  10  ASN   HB3   15  PHE     H   1.80 #  
   7  LYS    HA    8  TRP     H   1.80 #  
   9  PHE    HE   43  LEU   HD1   1.80 #  
   9  PHE    HE   43  LEU    HG   1.80 #  
   9  PHE   HB3   43  LEU     H   1.80 #  
   6  VAL    HA    8  TRP     H   1.80 #  
   9  PHE   HB2   43  LEU     H   1.80 #  
   6  VAL    HB   44  ALA     H   1.80 #  
  43  LEU   HB2   44  ALA     H   1.80 #  
  43  LEU    HA   44  ALA     H   1.80 #  
  43  LEU   HB3   44  ALA     H   1.80 #  
  43  LEU    HG   44  ALA     H   1.80 #  
  43  LEU     H   44  ALA     H   1.80 #  
   9  PHE     N   44  ALA     O   1.80 #  
   9  PHE     H   44  ALA     O   1.80 #  
   5  ILE   HG2   21  GLU    HA   1.80 #  
   4  GLY   HA3   21  GLU     H   1.80 #  
   4  GLY   HA2   21  GLU     H   1.80 #  
  4  GLY      O  49  VAL      N    1.80 #ENDURANCE 0.000000 #FLIPPED
   5  ILE     H   21  GLU     H   1.80 #  
   3  LYS   HB3    3  LYS   HG3   1.80 #  
   5  ILE    HA    6  VAL   HG1   1.80 #  
  43  LEU   HD2   44  ALA     H   1.80 #  
  10  ASN     H   15  PHE     O   1.80 #  
  22  ASP     H   22  ASP    HA   1.80 #  
  22  ASP    HA   22  ASP   HB2   1.80 #  
  22  ASP   HB3   22  ASP    HA   1.80 #  
   2  SER   HB3    3  LYS     H   1.80 #  
   9  PHE   HB2   45  ASP     H   1.80 #  
   6  VAL   HG1   45  ASP    HA   1.80 #  
   6  VAL    HB   45  ASP    HA   1.80 #  
   6  VAL    HA    6  VAL    HB   1.80 #  
  45  ASP   HB3   45  ASP    HA   1.80 #  
  20  PRO   HB2   22  ASP     H   1.80 #  
  20  PRO   HB3   22  ASP     H   1.80 #  
   6  VAL   HG2   45  ASP    HA   1.80 #  
  20  PRO    HA   22  ASP     H   1.80 #  
   9  PHE     H   45  ASP    HA   1.80 #  
  2  SER      O  51  TYR      H    1.80 #ENDURANCE 0.000000 #FLIPPED
   9  PHE   HB2    9  PHE   HB3   1.80 #  
   8  TRP    HA   45  ASP    HA   1.80 #  
   6  VAL   HG2   45  ASP     H   1.80 #  
   6  VAL   HG1   45  ASP     H   1.80 #  
  29  VAL   HG1   33  GLU   HB2   1.80 #  
   9  PHE   HB3    9  PHE     H   1.80 #  
   6  VAL     H   46  GLY     H   1.80 #  
   6  VAL   HG2    9  PHE     H   1.80 #  
  21  GLU    HA   22  ASP     H   1.80 #  
   6  VAL     H   46  GLY   HA2   1.80 #  
  21  GLU   HB3   22  ASP     H   1.80 #  
   5  ILE   HG2   46  GLY   HA3   1.80 #  
  21  GLU     H   22  ASP     H   1.80 #  
   5  ILE   HG2   46  GLY     H   1.80 #  
   6  VAL   HG2    9  PHE   HB3   1.80 #  
  44  ALA    HA   46  GLY     H   1.80 #  
  10  ASN     N   15  PHE     O   1.80 #  
  22  ASP     H   23  GLY     H   1.80 #  
  22  ASP    HA   23  GLY     H   1.80 #  
   7  LYS    HA   46  GLY     H   1.80 #  
  45  ASP   HB2   46  GLY     H   1.80 #  
  45  ASP    HA   46  GLY     H   1.80 #  
   6  VAL    HB   46  GLY     H   1.80 #  
   5  ILE     H    6  VAL     H   1.80 #  
  22  ASP   HB2   23  GLY     H   1.80 #  
   9  PHE     H   16  GLY    HA   1.80 #  
   6  VAL   HG2   46  GLY     H   1.80 #  
   5  ILE   HG2   46  GLY   HA2   1.80 #  
   6  VAL    HB   46  GLY   HA2   1.80 #  
   6  VAL    HB   46  GLY   HA3   1.80 #  
   6  VAL   HG1   46  GLY     H   1.80 #  
  21  GLU     H   23  GLY     H   1.80 #  
  21  GLU    HA   23  GLY     H   1.80 #  
  20  PRO   HB3   23  GLY     H   1.80 #  
   6  VAL   HG2   47  GLN    HA   1.80 #  
   6  VAL   HG1   47  GLN   HG3   1.80 #  
  20  PRO   HB2   23  GLY     H   1.80 #  
  20  PRO   HG3   23  GLY     H   1.80 #  
   9  PHE   HB2   16  GLY    HA   1.80 #  
   9  PHE    HA   16  GLY    HA   1.80 #  
   6  VAL   HG1   47  GLN     H   1.80 #  
   6  VAL     H   47  GLN   HB2   1.80 #  
   6  VAL     H   47  GLN    HA   1.80 #  
   6  VAL   HG2   47  GLN     H   1.80 #  
 16  GLY      O  29  VAL      H    1.80 #ENDURANCE 0.000000 #FLIPPED
  2  SER      O  51  TYR      N    1.80 #ENDURANCE 0.000000 #FLIPPED
   4  GLY   HA3    6  VAL     H   1.80 #  
  19  THR   HG2   23  GLY     H   1.80 #  
   9  PHE   HB2   47  GLN   HG2   1.80 #  
 16  GLY      O  29  VAL      N    1.80 #ENDURANCE 0.000000 #FLIPPED
   8  TRP     H    9  PHE     H   1.80 #  
  43  LEU   HD2   47  GLN    HA   1.80 #  
  43  LEU   HB2   47  GLN   HG3   1.80 #  
  43  LEU    HA   47  GLN  HE22   1.80 #  
  43  LEU    HA   47  GLN  HE21   1.80 #  
   6  VAL    HB   47  GLN   HB3   1.80 #  
   6  VAL     H   47  GLN     O   1.80 #  
   6  VAL     N   47  GLN     O   1.80 #  
   6  VAL    HB   47  GLN     H   1.80 #  
  10  ASN     H   16  GLY    HA   1.80 #  
  20  PRO   HG3   24  SER     H   1.80 #  
  15  PHE   HB3   16  GLY     H   1.80 #  
  43  LEU   HB2   47  GLN   HG2   1.80 #  
  15  PHE    HA   16  GLY     H   1.80 #  
   7  LYS   HB2    7  LYS   HB3   1.80 #  
  23  GLY     H   24  SER   HB3   1.80 #  
  23  GLY     H   24  SER     H   1.80 #  
  23  GLY   HA3   24  SER     H   1.80 #  
   5  ILE    HA   47  GLN     H   1.80 #  
 10  ASN      O  14  GLY      H    1.80 #ENDURANCE 0.000000 #FLIPPED
 10  ASN      O  14  GLY      N    1.80 #ENDURANCE 0.000000 #FLIPPED
  24  SER     H   24  SER    HA   1.80 #  
  44  ALA    HB   47  GLN     H   1.80 #  
   6  VAL     H   47  GLN     H   1.80 #  
  44  ALA     H   47  GLN   HG3   1.80 #  
  44  ALA     H   47  GLN     H   1.80 #  
  44  ALA    HB   47  GLN   HB3   1.80 #  
  44  ALA    HB   47  GLN   HB2   1.80 #  
  44  ALA     H   47  GLN   HB2   1.80 #  
  44  ALA     H   47  GLN   HG2   1.80 #  
  24  SER   HB2   24  SER    HA   1.80 #  
   7  LYS    HA   47  GLN     H   1.80 #  
   7  LYS   HB2    7  LYS    HG   1.80 #  
  20  PRO   HB2   24  SER     H   1.80 #  
  45  ASP    HA   47  GLN     H   1.80 #  
   7  LYS   HB3   17  PHE     H   1.80 #  
 10  ASN      O  15  PHE      H    1.80 #ENDURANCE 0.000000 #FLIPPED
   5  ILE   HG2   47  GLN    HA   1.80 #  
   3  LYS   HG2    3  LYS   HG3   1.80 #  
  21  GLU   HG3   24  SER     H   1.80 #  
  46  GLY   HA3   47  GLN     H   1.80 #  
  46  GLY     H   47  GLN     H   1.80 #  
  20  PRO    HA   24  SER     H   1.80 #  
  22  ASP   HB3   24  SER     H   1.80 #  
  22  ASP   HB2   24  SER     H   1.80 #  
  22  ASP    HA   24  SER     H   1.80 #  
   6  VAL   HG1   17  PHE     H   1.80 #  
  47  GLN     H   47  GLN   HG3   1.80 #  
  47  GLN     H   47  GLN    HA   1.80 #  
  47  GLN   HB3   47  GLN   HB2   1.80 #  
  47  GLN   HB2   47  GLN    HA   1.80 #  
  47  GLN   HB3   47  GLN     H   1.80 #  
  20  PRO   HD2   24  SER     H   1.80 #  
  24  SER    HA   25  LYS     H   1.80 #  
   6  VAL   HG2   17  PHE     H   1.80 #  
   6  VAL   HG1   47  GLN    HA   1.80 #  
 10  ASN      O  15  PHE      N    1.80 #ENDURANCE 0.000000 #FLIPPED
   6  VAL     H   47  GLN   HB3   1.80 #  
   6  VAL   HG1   47  GLN   HG2   1.80 #  
   6  VAL   HG1   47  GLN   HB2   1.80 #  
   7  LYS     H    7  LYS    HA   1.80 #  
  25  LYS     H   25  LYS    HA   1.80 #  
  25  LYS    HG   25  LYS     H   1.80 #  
   6  VAL   HG1   47  GLN   HB3   1.80 #  
   5  ILE    HA   48  THR    HA   1.80 #  
  20  PRO   HB3   25  LYS     H   1.80 #  
   7  LYS    HA    7  LYS   HB3   1.80 #  
   9  PHE    HE   11  SER    HA   1.80 #  
  20  PRO   HD3   25  LYS     H   1.80 #  
  20  PRO   HG2   25  LYS     H   1.80 #  
   5  ILE    HA   48  THR     H   1.80 #  
   3  LYS    HE   48  THR   HG2   1.80 #  
   6  VAL   HG2   48  THR     H   1.80 #  
  47  GLN    HA   48  THR     H   1.80 #  
  47  GLN   HG2   48  THR     H   1.80 #  
  47  GLN   HG3   48  THR     H   1.80 #  
   5  ILE   HG2   48  THR     H   1.80 #  
   6  VAL     H   48  THR    HA   1.80 #  
   7  LYS    HE   17  PHE   HB2   1.80 #  
  47  GLN  HE22   48  THR     H   1.80 #  
   7  LYS    HA    7  LYS     H   1.80 #  
  10  ASN   HB2   11  SER     H   1.80 #  
  48  THR    HB   48  THR     H   1.80 #  
  48  THR    HA   48  THR    HB   1.80 #  
  20  PRO    HA   25  LYS     H   1.80 #  
   4  GLY     H   48  THR   HG2   1.80 #  
  10  ASN    HA   12  ASP     H   1.80 #  
  24  SER   HB2   25  LYS     H   1.80 #  
  24  SER   HB3   25  LYS     H   1.80 #  
  20  PRO   HG2   26  ASP     H   1.80 #  
   7  LYS    HG    7  LYS    HE   1.80 #  
   7  LYS    HA    7  LYS    HG   1.80 #  
   5  ILE    HA   48  THR    HB   1.80 #  
   5  ILE  HG12   48  THR    HA   1.80 #  
   7  LYS   HB3    7  LYS     H   1.80 #  
  43  LEU    HA   48  THR     H   1.80 #  
   7  LYS    HG   26  ASP    HB   1.80 #  
  17  PHE   HB3   26  ASP    HB   1.80 #  
 48  THR      O  68  VAL      H    1.80 #ENDURANCE 0.000000 #FLIPPED
 48  THR      O  68  VAL      N    1.80 #ENDURANCE 0.000000 #FLIPPED
  20  PRO   HD2   26  ASP    HA   1.80 #  
   6  VAL     H   49  VAL     H   1.80 #  
   6  VAL    HA   49  VAL   HG2   1.80 #  
  47  GLN   HG3   49  VAL   HG1   1.80 #  
   4  GLY     H   49  VAL     O   1.80 #  
   6  VAL    HB   49  VAL     H   1.80 #  
   4  GLY   HA2   49  VAL     H   1.80 #  
  11  SER   HB3   12  ASP     H   1.80 #  
   4  GLY   HA3   49  VAL     H   1.80 #  
   4  GLY     H   49  VAL     H   1.80 #  
  43  LEU   HD1   49  VAL   HG1   1.80 #  
  11  SER     H   12  ASP     H   1.80 #  
  43  LEU   HD1   49  VAL    HB   1.80 #  
   3  LYS    HA   49  VAL     H   1.80 #  
   8  TRP   HB2   45  ASP     H   1.80 #  
  17  PHE   HB2   17  PHE    HA   1.80 #  
  17  PHE    HA   17  PHE   HB3   1.80 #  
  25  LYS    HA   26  ASP     H   1.80 #  
  48  THR    HA   49  VAL     H   1.80 #  
  48  THR   HG2   49  VAL     H   1.80 #  
  25  LYS     H   26  ASP     H   1.80 #  
  25  LYS   HB2   26  ASP     H   1.80 #  
  17  PHE     H   17  PHE    HA   1.80 #  
   5  ILE    HA   49  VAL     H   1.80 #  
  12  ASP   HB3   12  ASP   HB2   1.80 #  
  49  VAL     H   49  VAL    HA   1.80 #  
  26  ASP    HA   26  ASP    HB   1.80 #  
   3  LYS   HB2   49  VAL     H   1.80 #  
  19  THR    HA   26  ASP    HA   1.80 #  
   7  LYS    HG   17  PHE   HB3   1.80 #  
   4  GLY     N   49  VAL     O   1.80 #  
  19  THR    HA   26  ASP     H   1.80 #  
  20  PRO   HD3   26  ASP    HA   1.80 #  
   5  ILE    HA   49  VAL   HG2   1.80 #  
  18  ILE    HA   26  ASP    HB   1.80 #  
   8  TRP     H   17  PHE     O   1.80 #  
   4  GLY   HA3   49  VAL   HG2   1.80 #  
  18  ILE     H   26  ASP    HA   1.80 #  
   3  LYS    HE   50  GLU    HG   1.80 #  
  18  ILE    HA   26  ASP    HA   1.80 #  
   3  LYS   HG3   50  GLU    HA   1.80 #  
  49  VAL     H   50  GLU     H   1.80 #  
  18  ILE     H   26  ASP     H   1.80 #  
   8  TRP     N   17  PHE     O   1.80 #  
   8  TRP     H   17  PHE     H   1.80 #  
   8  TRP   HB3   17  PHE     H   1.80 #  
  50  GLU   HB2   50  GLU    HA   1.80 #  
  50  GLU   HB3   50  GLU     H   1.80 #  
  50  GLU   HB2   50  GLU    HG   1.80 #  
  50  GLU   HB3   50  GLU   HB2   1.80 #  
   3  LYS   HG2   50  GLU    HA   1.80 #  
   3  LYS    HA   50  GLU   HB2   1.80 #  
  18  ILE   HG2   27  LEU     H   1.80 #  
   3  LYS   HB3   50  GLU    HA   1.80 #  
  18  ILE   HG2   27  LEU   HB2   1.80 #  
   4  GLY     H   50  GLU    HA   1.80 #  
   8  TRP   HB2   17  PHE     H   1.80 #  
   5  ILE     H    5  ILE    HA   1.80 #  
   6  VAL    HA    7  LYS     H   1.80 #  
 50  GLU      O  66  VAL      N    1.80 #ENDURANCE 0.000000 #FLIPPED
 50  GLU      O  66  VAL      H    1.80 #ENDURANCE 0.000000 #FLIPPED
   8  TRP     H   17  PHE   HB2   1.80 #  
  19  THR    HA   27  LEU     H   1.80 #  
   6  VAL   HG2    7  LYS     H   1.80 #  
   7  LYS   HB3   17  PHE   HB3   1.80 #  
   3  LYS   HG3   50  GLU    HG   1.80 #  
   3  LYS    HA   51  TYR     H   1.80 #  
  18  ILE   HD1   51  TYR   HB2   1.80 #  
   7  LYS     H   17  PHE     H   1.80 #  
  51  TYR   HB3   51  TYR    HA   1.80 #  
  18  ILE     H   27  LEU   HB2   1.80 #  
  17  PHE   HB2   27  LEU     H   1.80 #  
   2  SER   HB2   51  TYR     H   1.80 #  
  17  PHE    HA   27  LEU     H   1.80 #  
   7  LYS   HB3   17  PHE   HB2   1.80 #  
   4  GLY     H   51  TYR     H   1.80 #  
   2  SER   HB3   51  TYR     H   1.80 #  
   7  LYS     H   17  PHE     O   1.80 #  
   7  LYS     N   17  PHE     O   1.80 #  
  50  GLU   HB3   51  TYR     H   1.80 #  
  17  PHE   HB3   27  LEU     H   1.80 #  
   3  LYS   HB3   51  TYR     H   1.80 #  
  26  ASP    HA   27  LEU     H   1.80 #  
  13  LYS     H   13  LYS    HA   1.80 #  
  51  TYR   HB2   52  GLU     H   1.80 #  
  51  TYR    HA   52  GLU     H   1.80 #  
  13  LYS   HG3   13  LYS    HA   1.80 #  
  27  LEU    HG   27  LEU     H   1.80 #  
 52  GLU      O  63  ASN      H    1.80 #ENDURANCE 0.000000 #FLIPPED
 52  GLU      O  63  ASN      N    1.80 #ENDURANCE 0.000000 #FLIPPED
  27  LEU   HB3   27  LEU    HA   1.80 #  
   7  LYS    HA   18  ILE    HA   1.80 #  
  20  PRO   HD2   27  LEU     H   1.80 #  
  18  ILE     N   27  LEU     O   1.80 #  
  52  GLU   HB3   52  GLU   HB2   1.80 #  
  52  GLU   HB2   52  GLU   HG2   1.80 #  
  52  GLU   HB2   52  GLU   HG3   1.80 #  
  52  GLU   HB3   52  GLU    HA   1.80 #  
  51  TYR   HB3   53  VAL    HA   1.80 #  
   7  LYS     H   18  ILE    HA   1.80 #  
  13  LYS   HG3   13  LYS     H   1.80 #  
  53  VAL    HA   53  VAL    HB   1.80 #  
 54  GLY      O  61  CYS      H    1.80 #ENDURANCE 0.000000 #FLIPPED
  18  ILE     H   27  LEU     O   1.80 #  
  20  PRO   HG3   27  LEU     H   1.80 #  
  54  GLY     H   54  GLY   HA2   1.80 #  
 54  GLY      O  61  CYS      N    1.80 #ENDURANCE 0.000000 #FLIPPED
  13  LYS   HG2   13  LYS   HG3   1.80 #  
  18  ILE   HG2   27  LEU   HB3   1.80 #  
  18  ILE     H   27  LEU     H   1.80 #  
   6  VAL    HA   18  ILE  HG13   1.80 #  
  20  PRO   HD3   27  LEU     H   1.80 #  
  55  GLN   HB2   55  GLN   HB3   1.80 #  
  55  GLN   HB2   55  GLN     H   1.80 #  
  55  GLN   HB3   55  GLN    HG   1.80 #  
  55  GLN    HA   55  GLN    HG   1.80 #  
  53  VAL   HG2   55  GLN  HE21   1.80 #  
  16  GLY     H   28  PHE    HA   1.80 #  
  27  LEU   HB3   28  PHE     H   1.80 #  
  27  LEU    HA   28  PHE     H   1.80 #  
  54  GLY     H   55  GLN    HA   1.80 #  
  53  VAL   HG2   55  GLN     H   1.80 #  
  55  GLN    HG   56  GLY     H   1.80 #  
  55  GLN   HB2   56  GLY     H   1.80 #  
  27  LEU     H   28  PHE     H   1.80 #  
  13  LYS   HG2   13  LYS   HB2   1.80 #  
  55  GLN     H   56  GLY     H   1.80 #  
  13  LYS    HA   13  LYS   HB3   1.80 #  
  13  LYS   HD2   13  LYS   HD3   1.80 #  
  55  GLN    HA   56  GLY     H   1.80 #  
  28  PHE     H   28  PHE    HA   1.80 #  
  28  PHE    HA   28  PHE   HB2   1.80 #  
  57  GLN   HB3   57  GLN    HA   1.80 #  
  57  GLN    HA   57  GLN   HG2   1.80 #  
  28  PHE   HB2   28  PHE   HB3   1.80 #  
   5  ILE    HA    5  ILE  HG13   1.80 #  
  56  GLY     H   57  GLN   HG3   1.80 #  
  56  GLY   HA3   57  GLN     H   1.80 #  
   8  TRP     H   18  ILE    HA   1.80 #  
  15  PHE   HB2   28  PHE    HA   1.80 #  
  58  LYS    HG   58  LYS   HB3   1.80 #  
  58  LYS    HG   58  LYS   HD2   1.80 #  
  15  PHE   HB2   28  PHE   HB3   1.80 #  
  17  PHE    HA   28  PHE    HA   1.80 #  
  57  GLN    HA   58  LYS     H   1.80 #  
  57  GLN   HB3   58  LYS     H   1.80 #  
  58  LYS    HA   59  GLY     H   1.80 #  
  57  GLN   HG3   59  GLY     H   1.80 #  
  57  GLN    HA   59  GLY     H   1.80 #  
  58  LYS   HB3   59  GLY     H   1.80 #  
  55  GLN    HG   59  GLY     H   1.80 #  
  10  ASN   HB3   13  LYS     H   1.80 #  
  18  ILE     H   28  PHE    HA   1.80 #  
   7  LYS     H   18  ILE  HG13   1.80 #  
  56  GLY     H   59  GLY     H   1.80 #  
  17  PHE     H   18  ILE    HA   1.80 #  
   6  VAL    HA   18  ILE  HG12   1.80 #  
   7  LYS   HB3   18  ILE     H   1.80 #  
  54  GLY     H   60  PRO   HB2   1.80 #  
  17  PHE   HB2   18  ILE     H   1.80 #  
  17  PHE    HA   18  ILE     H   1.80 #  
  53  VAL    HA   60  PRO   HG3   1.80 #  
  54  GLY     H   60  PRO    HA   1.80 #  
  53  VAL   HG2   60  PRO   HB3   1.80 #  
  56  GLY     H   60  PRO    HA   1.80 #  
  55  GLN    HA   60  PRO   HB2   1.80 #  
 28  PHE      O  62  ALA      H    1.80 #ENDURANCE 0.000000 #FLIPPED
  10  ASN  HD21   13  LYS   HG3   1.80 #  
 28  PHE      O  62  ALA      N    1.80 #ENDURANCE 0.000000 #FLIPPED
  53  VAL   HG2   60  PRO   HB2   1.80 #  
   5  ILE    HB    5  ILE  HG13   1.80 #  
   9  PHE    HE   29  VAL   HG1   1.80 #  
   5  ILE  HG12    5  ILE    HA   1.80 #  
  55  GLN    HA   60  PRO    HA   1.80 #  
  28  PHE   HB2   61  CYS    HA   1.80 #  
  27  LEU   HB3   61  CYS    HA   1.80 #  
  53  VAL   HG1   61  CYS     H   1.80 #  
   9  PHE   HB2   29  VAL   HG2   1.80 #  
  53  VAL   HG2   61  CYS     H   1.80 #  
  28  PHE     H   61  CYS   HB3   1.80 #  
   5  ILE  HG12    5  ILE  HG13   1.80 #  
   3  LYS   HB2    4  GLY     H   1.80 #  
  11  SER     H   13  LYS     H   1.80 #  
  55  GLN    HA   61  CYS     H   1.80 #  
  18  ILE  HG13   18  ILE    HB   1.80 #  
  18  ILE  HG12   18  ILE   HD1   1.80 #  
  18  ILE     H   18  ILE    HA   1.80 #  
  18  ILE  HG13   18  ILE    HA   1.80 #  
  18  ILE  HG12   18  ILE  HG13   1.80 #  
   6  VAL   HG1   18  ILE    HA   1.80 #  
   3  LYS    HA    4  GLY     H   1.80 #  
  28  PHE     H   61  CYS   HB2   1.80 #  
  54  GLY     H   61  CYS     H   1.80 #  
   6  VAL    HA   18  ILE   HG2   1.80 #  
   6  VAL    HA   18  ILE    HA   1.80 #  
   5  ILE     H   18  ILE    HA   1.80 #  
  10  ASN    HA   13  LYS     H   1.80 #  
  56  GLY     H   61  CYS     H   1.80 #  
  54  GLY     H   61  CYS    HA   1.80 #  
  54  GLY     H   61  CYS   HB2   1.80 #  
  54  GLY     H   61  CYS     O   1.80 #  
  54  GLY     N   61  CYS     O   1.80 #  
   6  VAL    HA   18  ILE    HB   1.80 #  
  28  PHE     H   61  CYS    HA   1.80 #  
  5  ILE      O  19  THR      H    1.80 #ENDURANCE 0.000000 #FLIPPED
  28  PHE   HB3   61  CYS    HA   1.80 #  
  29  VAL    HA   61  CYS   HB3   1.80 #  
  29  VAL    HA   61  CYS   HB2   1.80 #  
  52  GLU     H   62  ALA    HB   1.80 #  
  52  GLU     H   62  ALA    HA   1.80 #  
   5  ILE     H   18  ILE   HG2   1.80 #  
  28  PHE   HB3   62  ALA     H   1.80 #  
  5  ILE      O  19  THR      N    1.80 #ENDURANCE 0.000000 #FLIPPED
  17  PHE    HA   29  VAL     H   1.80 #  
  29  VAL    HB   62  ALA    HB   1.80 #  
  54  GLY     H   62  ALA    HA   1.80 #  
  28  PHE   HB2   62  ALA     H   1.80 #  
  10  ASN   HB2   13  LYS     H   1.80 #  
  17  PHE    HA   29  VAL    HB   1.80 #  
   5  ILE    HA   18  ILE    HB   1.80 #  
  28  PHE     H   62  ALA     H   1.80 #  
   6  VAL   HG2    8  TRP     H   1.80 #  
  17  PHE    HA   29  VAL   HG2   1.80 #  
  28  PHE    HA   29  VAL     H   1.80 #  
  16  GLY     H   29  VAL   HG2   1.80 #  
  61  CYS   HB3   62  ALA     H   1.80 #  
  61  CYS   HB2   62  ALA     H   1.80 #  
  61  CYS    HA   62  ALA     H   1.80 #  
  18  ILE   HD1   29  VAL   HG2   1.80 #  
  29  VAL    HB   62  ALA     H   1.80 #  
  28  PHE   HB3   29  VAL     H   1.80 #  
   7  LYS     H    8  TRP     H   1.80 #  
  18  ILE  HG12   29  VAL    HB   1.80 #  
  62  ALA     H   62  ALA    HA   1.80 #  
  51  TYR   HB3   62  ALA    HB   1.80 #  
  51  TYR   HB2   62  ALA    HB   1.80 #  
   6  VAL   HG1   18  ILE  HG13   1.80 #  
  18  ILE    HA   29  VAL   HG2   1.80 #  
  53  VAL    HA   62  ALA     H   1.80 #  
  30  HIS     H   62  ALA     H   1.80 #  
  27  LEU   HB3   62  ALA     H   1.80 #  
  18  ILE   HD1   29  VAL    HB   1.80 #  
  16  GLY     H   29  VAL     H   1.80 #  
  18  ILE   HD1   62  ALA    HB   1.80 #  
  29  VAL    HA   62  ALA     H   1.80 #  
  29  VAL     H   29  VAL    HA   1.80 #  
  29  VAL    HB   29  VAL     H   1.80 #  
  16  GLY     H   29  VAL    HA   1.80 #  
  52  GLU     N   63  ASN     O   1.80 #  
  15  PHE    HA   29  VAL   HG2   1.80 #  
  16  GLY     H   29  VAL    HB   1.80 #  
  18  ILE     H   29  VAL   HG2   1.80 #  
  54  GLY     H   63  ASN     H   1.80 #  
  16  GLY     H   29  VAL     O   1.80 #  
  16  GLY     N   29  VAL     O   1.80 #  
  18  ILE  HG12   29  VAL   HG2   1.80 #  
  15  PHE    HA   29  VAL     H   1.80 #  
  15  PHE   HB2   29  VAL     H   1.80 #  
  15  PHE   HB3   29  VAL     H   1.80 #  
  33  GLU   HG2   63  ASN    HA   1.80 #  
  10  ASN  HD21   13  LYS   HD3   1.80 #  
  18  ILE     H   29  VAL    HB   1.80 #  
  52  GLU     H   63  ASN     O   1.80 #  
  12  ASP     H   13  LYS     H   1.80 #  
  51  TYR    HA   63  ASN     H   1.80 #  
  52  GLU     H   63  ASN     H   1.80 #  
  52  GLU   HB2   63  ASN     H   1.80 #  
  62  ALA     H   63  ASN     H   1.80 #  
  52  GLU   HB2   63  ASN  HD22   1.80 #  
  52  GLU   HB3   63  ASN  HD22   1.80 #  
  53  VAL    HA   63  ASN     H   1.80 #  
  52  GLU   HB3   63  ASN     H   1.80 #  
  52  GLU   HB3   63  ASN  HD21   1.80 #  
  29  VAL    HB   30  HIS     H   1.80 #  
  52  GLU   HB2   63  ASN  HD21   1.80 #  
   7  LYS    HA   19  THR     H   1.80 #  
  52  GLU   HB3   63  ASN   HB3   1.80 #  
  52  GLU   HB3   63  ASN   HB2   1.80 #  
  51  TYR   HB2   63  ASN     H   1.80 #  
  12  ASP   HB2   13  LYS     H   1.80 #  
  63  ASN    HA   64  LYS     H   1.80 #  
  63  ASN   HB2   64  LYS     H   1.80 #  
  12  ASP   HB3   13  LYS     H   1.80 #  
  64  LYS     H   64  LYS    HA   1.80 #  
  33  GLU   HB3   64  LYS     H   1.80 #  
  33  GLU   HG3   64  LYS     H   1.80 #  
  33  GLU    HA   64  LYS     H   1.80 #  
  12  ASP    HA   13  LYS     H   1.80 #  
  30  HIS     H   30  HIS    HA   1.80 #  
  30  HIS   HB2   30  HIS   HD2   1.80 #  
  30  HIS    HA   30  HIS   HB2   1.80 #  
  30  HIS   HB2   30  HIS   HB3   1.80 #  
  51  TYR   HB3   65  VAL    HG   1.80 #  
   5  ILE     H   19  THR     H   1.80 #  
  51  TYR   HB2   65  VAL    HG   1.80 #  
  34  ILE    HA   65  VAL     H   1.80 #  
   7  LYS   HB3    8  TRP     H   1.80 #  
   5  ILE    HB   19  THR     H   1.80 #  
  51  TYR   HB2   65  VAL    HA   1.80 #  
  51  TYR   HB3   65  VAL    HA   1.80 #  
  15  PHE   HB2   30  HIS    HA   1.80 #  
  34  ILE    HA   65  VAL    HB   1.80 #  
   7  LYS   HB2    8  TRP     H   1.80 #  
  63  ASN    HA   65  VAL     H   1.80 #  
  35  GLN     H   65  VAL     H   1.80 #  
   5  ILE    HB   19  THR    HB   1.80 #  
   3  LYS   HB3    4  GLY     H   1.80 #  
  16  GLY     H   30  HIS    HA   1.80 #  
  15  PHE   HB3   30  HIS    HA   1.80 #  
  29  VAL    HA   30  HIS     H   1.80 #  
  64  LYS   HB2   65  VAL     H   1.80 #  
  18  ILE   HD1   65  VAL    HG   1.80 #  
  64  LYS     H   65  VAL     H   1.80 #  
  64  LYS    HA   65  VAL     H   1.80 #  
  29  VAL   HG1   30  HIS     H   1.80 #  
  65  VAL     H   65  VAL    HA   1.80 #  
  29  VAL     H   30  HIS    HA   1.80 #  
  14  GLY   HA2   31  HIS   HB2   1.80 #  
  49  VAL    HB   65  VAL    HG   1.80 #  
   5  ILE     H   19  THR     O   1.80 #  
   8  TRP     H    8  TRP    HA   1.80 #  
  29  VAL   HG1   65  VAL    HB   1.80 #  
  30  HIS    HA   31  HIS     H   1.80 #  
  51  TYR    HA   65  VAL    HA   1.80 #  
  12  ASP    HA   14  GLY     H   1.80 #  
  11  SER   HB3   31  HIS   HB2   1.80 #  
  15  PHE    HA   31  HIS     H   1.80 #  
  30  HIS   HB3   31  HIS     H   1.80 #  
   5  ILE     N   19  THR     O   1.80 #  
   6  VAL    HA   19  THR     H   1.80 #  
  34  ILE    HB   66  VAL     H   1.80 #  
  49  VAL   HG2   66  VAL     H   1.80 #  
   5  ILE  HG13   19  THR    HB   1.80 #  
  18  ILE    HA   19  THR     H   1.80 #  
  18  ILE   HG2   19  THR     H   1.80 #  
  31  HIS     H   31  HIS    HA   1.80 #  
  31  HIS   HB2   31  HIS   HB3   1.80 #  
  31  HIS    HA   31  HIS   HB2   1.80 #  
  50  GLU   HB2   66  VAL    HG   1.80 #  
  31  HIS    HA   31  HIS   HD2   1.80 #  
  31  HIS   HB2   31  HIS   HD2   1.80 #  
  50  GLU   HB2   66  VAL     H   1.80 #  
  64  LYS   HB3   66  VAL     H   1.80 #  
  50  GLU     H   66  VAL     O   1.80 #  
  50  GLU     H   66  VAL     H   1.80 #  
  50  GLU   HB3   66  VAL     H   1.80 #  
   5  ILE   HG2   19  THR    HB   1.80 #  
  51  TYR    HA   66  VAL     H   1.80 #  
  29  VAL   HG1   31  HIS     H   1.80 #  
  13  LYS     H   14  GLY     H   1.80 #  
  15  PHE     H   31  HIS     H   1.80 #  
  18  ILE     H   19  THR    HA   1.80 #  
  65  VAL     H   66  VAL    HG   1.80 #  
  51  TYR   HB3   66  VAL     H   1.80 #  
  65  VAL    HG   66  VAL     H   1.80 #  
  65  VAL     H   66  VAL     H   1.80 #  
  65  VAL    HA   66  VAL     H   1.80 #  
  65  VAL    HB   66  VAL     H   1.80 #  
  50  GLU    HG   66  VAL     H   1.80 #  
  49  VAL    HA   66  VAL     H   1.80 #  
  49  VAL    HB   66  VAL     H   1.80 #  
  13  LYS   HB3   14  GLY     H   1.80 #  
  14  GLY     H   14  GLY   HA3   1.80 #  
  66  VAL     H   66  VAL    HA   1.80 #  
   5  ILE     H   19  THR    HA   1.80 #  
  43  LEU   HD2   66  VAL     H   1.80 #  
  50  GLU     H   66  VAL    HB   1.80 #  
  50  GLU     N   66  VAL     O   1.80 #  
  47  GLN  HE21   67  ALA    HB   1.80 #  
  49  VAL   HG2   67  ALA     H   1.80 #  
  49  VAL    HA   67  ALA     H   1.80 #  
  50  GLU     H   67  ALA     H   1.80 #  
  47  GLN  HE22   67  ALA    HA   1.80 #  
  14  GLY   HA2   31  HIS     H   1.80 #  
  49  VAL    HB   67  ALA     H   1.80 #  
  49  VAL    HA   67  ALA    HB   1.80 #  
  49  VAL   HG1   67  ALA    HA   1.80 #  
  49  VAL   HG1   67  ALA     H   1.80 #  
  49  VAL   HG1   67  ALA    HB   1.80 #  
  49  VAL    HA   67  ALA    HA   1.80 #  
  50  GLU     H   67  ALA    HA   1.80 #  
  8  TRP      O  17  PHE      N    1.80 #ENDURANCE 0.000000 #FLIPPED
  14  GLY   HA3   31  HIS     H   1.80 #  
  14  GLY   HA3   31  HIS   HB3   1.80 #  
  49  VAL    HB   67  ALA    HB   1.80 #  
  49  VAL    HB   67  ALA    HA   1.80 #  
  30  HIS   HB2   32  SER     H   1.80 #  
  31  HIS   HB2   32  SER     H   1.80 #  
   5  ILE     H   19  THR    HB   1.80 #  
  32  SER     H   32  SER    HA   1.80 #  
  30  HIS   HB3   32  SER     H   1.80 #  
   3  LYS   HG3    4  GLY     H   1.80 #  
  47  GLN   HG3   67  ALA    HB   1.80 #  
   5  ILE  HG13   19  THR    HA   1.80 #  
  47  GLN   HG2   67  ALA    HB   1.80 #  
   5  ILE   HG2   19  THR     H   1.80 #  
   5  ILE  HG12   19  THR    HB   1.80 #  
   6  VAL     H   19  THR    HB   1.80 #  
  30  HIS   HB3   33  GLU   HG2   1.80 #  
   4  GLY   HA3    5  ILE     H   1.80 #  
  30  HIS     H   33  GLU     H   1.80 #  
  47  GLN  HE21   67  ALA     H   1.80 #  
  50  GLU    HG   68  VAL   HG2   1.80 #  
  49  VAL    HA   68  VAL     H   1.80 #  
  50  GLU    HG   68  VAL     H   1.80 #  
  50  GLU     H   68  VAL     H   1.80 #  
  30  HIS   HB3   33  GLU     H   1.80 #  
  30  HIS   HB2   33  GLU     H   1.80 #  
  8  TRP      O  17  PHE      H    1.80 #ENDURANCE 0.000000 #FLIPPED
   4  GLY   HA2    5  ILE     H   1.80 #  
  49  VAL     H   68  VAL     H   1.80 #  
  30  HIS   HB3   33  GLU   HG3   1.80 #  
  13  LYS    HA   14  GLY     H   1.80 #  
  32  SER     H   33  GLU     H   1.80 #  
  49  VAL    HA   68  VAL   HG2   1.80 #  
  48  THR     H   68  VAL   HG2   1.80 #  
  48  THR   HG2   68  VAL   HG2   1.80 #  
   7  LYS     H   19  THR     H   1.80 #  
  48  THR   HG2   68  VAL     H   1.80 #  
  48  THR   HG2   68  VAL    HA   1.80 #  
  48  THR     H   68  VAL     H   1.80 #  
   3  LYS    HE   68  VAL   HG2   1.80 #  
  30  HIS     H   33  GLU   HB3   1.80 #  
  30  HIS     H   33  GLU   HB2   1.80 #  
  12  ASP   HB2   14  GLY     H   1.80 #  
  29  VAL   HG1   33  GLU     H   1.80 #  
  47  GLN   HG3   68  VAL     H   1.80 #  
  4  GLY      O  49  VAL      H    1.80 #ENDURANCE 0.000000 #FLIPPED
  47  GLN  HE21   68  VAL     H   1.80 #  
  49  VAL   HG1   68  VAL     H   1.80 #  
  49  VAL     H   68  VAL   HG2   1.80 #  
  47  GLN   HG2   68  VAL     H   1.80 #  
  19  THR    HA   20  PRO   HD3   1.80 #  
  49  VAL    HA   68  VAL   HG1   1.80 #  
  30  HIS     H   33  GLU   HG3   1.80 #  
  29  VAL   HG1   33  GLU   HB3   1.80 #  
  20  PRO    HA   20  PRO   HG2   1.80 #  
  49  VAL   HG2   68  VAL     H   1.80 #  
  19  THR   HG2   20  PRO   HD2   1.80 #  
  19  THR    HA   20  PRO   HD2   1.80 #  
  67  ALA    HB   68  VAL     H   1.80 #  
  67  ALA    HA   68  VAL     H   1.80 #  
  31  HIS     H   34  ILE   HD1   1.80 #  
  32  SER     H   34  ILE     H   1.80 #  
  50  GLU    HG   68  VAL   HG1   1.80 #  
  31  HIS     H   34  ILE   HG2   1.80 #  
   3  LYS   HG2    3  LYS    HA   1.80 #  
  68  VAL     H   68  VAL    HA   1.80 #  
# Restraints file 4: summed.rdc
#Tensor Magnitude Rhombicity Residue         
      1    4.19      0.456     100         
#First atom             Second atom              RDC    Error    Weight      Tensor    
3 LYS N 3 LYS H -3.66 0.25 1.00E+00 1
4 GLY N 4 GLY H  0.36 0.25 1.00E+00 1
5 ILE N 5 ILE H -5.96 0.25 1.00E+00 1
6 VAL N 6 VAL H -4.69 0.25 1.00E+00 1
7 LYS N 7 LYS H  1.72 0.25 1.00E+00 1
8 TRP N 8 TRP H  4.34 0.25 1.00E+00 1
9 PHE N 9 PHE H  0.00 0.25 1.00E+00 1
10 ASN N 10 ASN H  1.00 0.25 1.00E+00 1
11 SER N 11 SER H -4.88 0.25 1.00E+00 1
12 ASP N 12 ASP H -0.09 0.25 1.00E+00 1
13 LYS N 13 LYS H -0.99 0.25 1.00E+00 1
14 GLY N 14 GLY H -1.39 0.25 1.00E+00 1
15 PHE N 15 PHE H 10.00 0.25 1.00E+00 1
16 GLY N 16 GLY H  5.56 0.25 1.00E+00 1
17 PHE  N 17 PHE H  3.32 0.25 1.00E+00 1
18 ILE N 18 ILE H -1.26 0.25 1.00E+00 1
19 THR N 19 THR H -6.20 0.25 1.00E+00 1
21 GLU N 21 GLU H  1.22 0.25 1.00E+00 1
#22 ASP N 22 ASP H  1.37 0.25 1.00E+00 1
#23 GLY N 23 GLY H -5.85 0.25 1.00E+00 1
#24 SER N 24 SER H  5.16 0.25 1.00E+00 1
25 LYS N 25 LYS H  0.51 0.25 1.00E+00 1
26 ASP N 26 ASP H  4.63 0.25 1.00E+00 1
27 LEU N 27 LEU H -5.41 0.25 1.00E+00 1
28 PHE N 28 PHE H -1.43 0.25 1.00E+00 1
29 VAL N 29 VAL H 11.38 0.25 1.00E+00 1
30 HIS N 30 HIS H  9.38 0.25 1.00E+00 1
31 HIS N 31 HIS H  1.96 0.25 1.00E+00 1
32 SER N 32 SER H  0.09 0.25 1.00E+00 1
#33 GLU N 33 GLU H  2.99 0.25 1.00E+00 1
#34 ILE N 34 ILE H  2.14 0.25 1.00E+00 1
#35 GLN N 35 GLN H -3.96 0.25 1.00E+00 1
#36 SER N 36 SER H  0.17 0.25 1.00E+00 1
#37 GLY N 37 GLY H -0.58 0.25 1.00E+00 1
#38 GLY N 38 GLY H -0.05 0.25 1.00E+00 1
#39 GLU N 39 GLU H -0.46 0.25 1.00E+00 1
#40 TYR N 40 TYR H -0.80 0.25 1.00E+00 1
#41 ALA N 41 ALA H  1.31 0.25 1.00E+00 1
42 THR N 42 THR H -2.01 0.25 1.00E+00 1
43 LEU N 43 LEU H  2.79 0.25 1.00E+00 1
44 ALA N 44 ALA H  3.25 0.25 1.00E+00 1
45 ASP N 45 ASP H  3.44 0.25 1.00E+00 1
46 GLY N 46 GLY H -2.45 0.25 1.00E+00 1
47 GLN N 47 GLN H  1.31 0.25 1.00E+00 1
48 THR N 48 THR H -5.79 0.25 1.00E+00 1
49 VAL N 49 VAL H -3.83 0.25 1.00E+00 1
50 GLU N 50 GLU H -1.98 0.25 1.00E+00 1
51 TYR N 51 TYR H -0.77 0.25 1.00E+00 1
52 GLU N 52 GLU H  0.05 0.25 1.00E+00 1
53 VAL N 53 VAL H  0.88 0.25 1.00E+00 1
54 GLY N 54 GLY H  5.72 0.25 1.00E+00 1
55 GLN N 55 GLN H  3.78 0.25 1.00E+00 1
#56 GLY N 56 GLY H -0.32 0.25 1.00E+00 1
#57 GLN N 57 GLN H -7.37 0.25 1.00E+00 1
#58 LYS N 58 LYS H -4.10 0.25 1.00E+00 1
59 GLY N 59 GLY H  1.51 0.25 1.00E+00 1
61 CYS N 61 CYS H  6.89 0.25 1.00E+00 1
62 ALA N 62 ALA H  3.29 0.25 1.00E+00 1
63 ASN N 63 ASN H  2.39 0.25 1.00E+00 1
64 LYS N 64 LYS H -0.83 0.25 1.00E+00 1
65 VAL N 65 VAL H -1.10 0.25 1.00E+00 1
66 VAL N 66 VAL H -5.97 0.25 1.00E+00 1
67 ALA N 67 ALA H -2.06 0.25 1.00E+00 1
68 VAL N 68 VAL H  1.12 0.25 1.00E+00 1

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   MET   1           HT1      MET   1  -3.885  11.489   1.651
    2    H2   MET   1           HT2      MET   1  -4.364  12.284   0.228
    3    H3   MET   1           HT3      MET   1  -5.099  10.819   0.675
    4    HA   MET   1           HA       MET   1  -5.251  13.275   2.326
    5    HB2  MET   1           HB2      MET   1  -6.973  12.275   0.059
    6    HB3  MET   1           HB3      MET   1  -7.686  13.218   1.365
    7    HG2  MET   1           HG2      MET   1  -5.291  14.127  -0.255
    8    HG3  MET   1           HG3      MET   1  -6.952  14.602  -0.607
    9    HE1  MET   1           HE1      MET   1  -4.659  16.509  -0.222
   10    HE2  MET   1           HE2      MET   1  -5.179  17.742   0.924
   11    HE3  MET   1           HE3      MET   1  -6.274  17.219  -0.353
   12    H    SER   2           H        SER   2  -6.968  10.306   1.321
   13    HA   SER   2           HA       SER   2  -8.331   9.977   3.802
   14    HB2  SER   2           HB2      SER   2  -7.796   8.013   1.564
   15    HB3  SER   2           HB3      SER   2  -8.892   7.726   2.913
   16    HG   SER   2           HG       SER   2 -10.210   8.598   1.459
   17    H    LYS   3           H        LYS   3  -7.997   8.425   5.425
   18    HA   LYS   3           HA       LYS   3  -5.572   6.836   5.469
   19    HB2  LYS   3           HB2      LYS   3  -4.646   7.874   7.492
   20    HB3  LYS   3           HB3      LYS   3  -4.718   9.033   6.169
   21    HG2  LYS   3           HG2      LYS   3  -6.819   9.958   7.091
   22    HG3  LYS   3           HG3      LYS   3  -6.732   8.804   8.423
   23    HD2  LYS   3           HD2      LYS   3  -4.573   9.768   9.126
   24    HD3  LYS   3           HD3      LYS   3  -4.655  10.924   7.796
   25    HE2  LYS   3           HE2      LYS   3  -6.744  11.852   8.723
   26    HE3  LYS   3           HE3      LYS   3  -6.671  10.694  10.052
   27    HZ1  LYS   3           HZ1      LYS   3  -5.759  12.961  10.537
   28    HZ2  LYS   3           HZ2      LYS   3  -4.490  12.612   9.463
   29    HZ3  LYS   3           HZ3      LYS   3  -4.703  11.674  10.863
   30    H    GLY   4           H        GLY   4  -5.670   5.164   6.914
   31    HA2  GLY   4           HA2      GLY   4  -7.985   5.038   8.739
   32    HA3  GLY   4           HA3      GLY   4  -7.713   3.741   7.580
   33    H    ILE   5           H        ILE   5  -7.639   2.409   9.543
   34    HA   ILE   5           HA       ILE   5  -4.940   2.457  10.770
   35    HB   ILE   5           HB       ILE   5  -6.034   1.237  12.713
   36   HG12  ILE   5          HG12      ILE   5  -8.617   2.426  11.665
   37   HG13  ILE   5          HG13      ILE   5  -8.165   0.767  11.288
   38   HG21  ILE   5          HG21      ILE   5  -5.385   3.599  12.838
   39   HG22  ILE   5          HG22      ILE   5  -6.897   3.337  13.707
   40   HG23  ILE   5          HG23      ILE   5  -6.917   4.075  12.105
   41   HD11  ILE   5          HD11      ILE   5  -8.142   0.159  13.615
   42   HD12  ILE   5          HD12      ILE   5  -9.636   1.053  13.346
   43   HD13  ILE   5          HD13      ILE   5  -8.262   1.845  14.117
   44    H    VAL   6           H        VAL   6  -3.724   0.743  10.478
   45    HA   VAL   6           HA       VAL   6  -4.557  -1.333   8.733
   46    HB   VAL   6           HB       VAL   6  -2.055  -1.127  10.427
   47   HG11  VAL   6          HG11      VAL   6  -1.160  -2.640   8.542
   48   HG12  VAL   6          HG12      VAL   6  -2.850  -2.949   8.146
   49   HG13  VAL   6          HG13      VAL   6  -2.220  -3.397   9.731
   50   HG21  VAL   6          HG21      VAL   6  -1.018  -0.111   8.525
   51   HG22  VAL   6          HG22      VAL   6  -2.551   0.735   8.733
   52   HG23  VAL   6          HG23      VAL   6  -2.387  -0.496   7.481
   53    H    LYS   7           H        LYS   7  -5.566  -3.169   9.167
   54    HA   LYS   7           HA       LYS   7  -6.321  -3.937  11.807
   55    HB2  LYS   7           HB2      LYS   7  -7.632  -4.535   9.764
   56    HB3  LYS   7           HB3      LYS   7  -6.329  -5.623   9.281
   57    HG2  LYS   7           HG2      LYS   7  -6.631  -6.919  11.360
   58    HG3  LYS   7           HG3      LYS   7  -7.921  -5.825  11.858
   59    HD2  LYS   7           HD2      LYS   7  -9.230  -6.446   9.864
   60    HD3  LYS   7           HD3      LYS   7  -7.944  -7.541   9.358
   61    HE2  LYS   7           HE2      LYS   7  -8.229  -8.846  11.429
   62    HE3  LYS   7           HE3      LYS   7  -9.506  -7.748  11.949
   63    HZ1  LYS   7           HZ1      LYS   7  -9.611  -9.237   9.390
   64    HZ2  LYS   7           HZ2      LYS   7 -10.875  -8.413  10.170
   65    HZ3  LYS   7           HZ3      LYS   7 -10.256  -9.850  10.833
   66    H    TRP   8           H        TRP   8  -3.926  -5.142   9.468
   67    HA   TRP   8           HA       TRP   8  -2.056  -5.786  11.502
   68    HB2  TRP   8           HB2      TRP   8  -1.971  -8.200  11.301
   69    HB3  TRP   8           HB3      TRP   8  -3.566  -7.702  11.843
   70    HD1  TRP   8           HD1      TRP   8  -5.591  -7.957  10.122
   71    HE1  TRP   8           HE1      TRP   8  -5.883  -9.450   8.042
   72    HE3  TRP   8           HE3      TRP   8  -0.724  -9.241   9.271
   73    HZ2  TRP   8           HZ2      TRP   8  -4.264 -10.992   6.257
   74    HZ3  TRP   8           HZ3      TRP   8  -0.128 -10.724   7.377
   75    HH2  TRP   8           HH2      TRP   8  -1.891 -11.600   5.871
   76    H    PHE   9           H        PHE   9  -0.050  -5.801  10.725
   77    HA   PHE   9           HA       PHE   9   0.271  -5.973   7.771
   78    HB2  PHE   9           HB2      PHE   9   0.623  -3.678   8.758
   79    HB3  PHE   9           HB3      PHE   9   1.989  -4.343   9.654
   80    HD1  PHE   9           HD1      PHE   9   0.726  -3.361   6.351
   81    HD2  PHE   9           HD2      PHE   9   3.994  -5.162   8.478
   82    HE1  PHE   9           HE1      PHE   9   2.167  -3.113   4.348
   83    HE2  PHE   9           HE2      PHE   9   5.436  -4.910   6.477
   84    HZ   PHE   9           HZ       PHE   9   4.522  -3.886   4.412
   85    H    ASN  10           H        ASN  10   1.619  -7.502   7.036
   86    HA   ASN  10           HA       ASN  10   3.689  -8.565   8.860
   87    HB2  ASN  10           HB2      ASN  10   1.728 -10.156   7.206
   88    HB3  ASN  10           HB3      ASN  10   3.237 -10.838   7.807
   89   HD21  ASN  10          HD21      ASN  10   0.696 -11.849   8.663
   90   HD22  ASN  10          HD22      ASN  10   0.502 -11.488  10.310
   91    H    SER  11           H        SER  11   5.423  -7.642   7.912
   92    HA   SER  11           HA       SER  11   5.817  -7.293   5.144
   93    HB2  SER  11           HB2      SER  11   8.128  -6.788   5.744
   94    HB3  SER  11           HB3      SER  11   7.024  -6.023   6.883
   95    HG   SER  11           HG       SER  11   8.970  -7.779   7.362
   96    H    ASP  12           H        ASP  12   6.495 -10.002   7.297
   97    HA   ASP  12           HA       ASP  12   8.346 -11.406   5.699
   98    HB2  ASP  12           HB2      ASP  12   6.235 -12.384   7.637
   99    HB3  ASP  12           HB3      ASP  12   7.402 -13.455   6.867
  100    H    LYS  13           H        LYS  13   4.806 -11.416   5.774
  101    HA   LYS  13           HA       LYS  13   4.519 -13.251   3.575
  102    HB2  LYS  13           HB2      LYS  13   2.582 -11.365   4.940
  103    HB3  LYS  13           HB3      LYS  13   2.127 -12.478   3.651
  104    HG2  LYS  13           HG2      LYS  13   2.925 -14.382   5.001
  105    HG3  LYS  13           HG3      LYS  13   3.375 -13.271   6.297
  106    HD2  LYS  13           HD2      LYS  13   1.026 -12.549   6.504
  107    HD3  LYS  13           HD3      LYS  13   0.571 -13.658   5.207
  108    HE2  LYS  13           HE2      LYS  13   1.361 -15.566   6.553
  109    HE3  LYS  13           HE3      LYS  13   1.825 -14.463   7.849
  110    HZ1  LYS  13           HZ1      LYS  13  -0.932 -14.525   6.790
  111    HZ2  LYS  13           HZ2      LYS  13  -0.380 -13.914   8.276
  112    HZ3  LYS  13           HZ3      LYS  13  -0.434 -15.592   8.011
  113    H    GLY  14           H        GLY  14   4.888  -9.815   3.995
  114    HA2  GLY  14           HA2      GLY  14   5.625  -8.305   2.344
  115    HA3  GLY  14           HA3      GLY  14   5.109  -9.438   1.104
  116    H    PHE  15           H        PHE  15   2.672  -9.056   3.449
  117    HA   PHE  15           HA       PHE  15   1.499  -6.663   2.320
  118    HB2  PHE  15           HB2      PHE  15  -0.537  -7.750   1.449
  119    HB3  PHE  15           HB3      PHE  15   0.909  -8.229   0.558
  120    HD1  PHE  15           HD1      PHE  15  -1.654  -9.317   2.987
  121    HD2  PHE  15           HD2      PHE  15   1.776 -10.497   0.683
  122    HE1  PHE  15           HE1      PHE  15  -2.161 -11.700   3.451
  123    HE2  PHE  15           HE2      PHE  15   1.269 -12.879   1.150
  124    HZ   PHE  15           HZ       PHE  15  -0.699 -13.481   2.533
  125    H    GLY  16           H        GLY  16  -0.819  -6.408   3.109
  126    HA2  GLY  16           HA2      GLY  16  -1.516  -7.691   5.596
  127    HA3  GLY  16           HA3      GLY  16  -0.942  -6.035   5.795
  128    H    PHE  17           H        PHE  17  -3.413  -6.386   6.609
  129    HA   PHE  17           HA       PHE  17  -5.136  -5.341   4.438
  130    HB2  PHE  17           HB2      PHE  17  -5.831  -7.119   6.784
  131    HB3  PHE  17           HB3      PHE  17  -7.043  -6.275   5.820
  132    HD1  PHE  17           HD1      PHE  17  -4.231  -8.698   5.619
  133    HD2  PHE  17           HD2      PHE  17  -7.729  -7.123   3.702
  134    HE1  PHE  17           HE1      PHE  17  -4.120 -10.516   3.935
  135    HE2  PHE  17           HE2      PHE  17  -7.619  -8.933   2.010
  136    HZ   PHE  17           HZ       PHE  17  -5.814 -10.630   2.126
  137    H    ILE  18           H        ILE  18  -6.290  -3.502   4.859
  138    HA   ILE  18           HA       ILE  18  -5.804  -2.255   7.487
  139    HB   ILE  18           HB       ILE  18  -4.575  -1.134   5.682
  140   HG12  ILE  18          HG12      ILE  18  -6.888   0.646   6.475
  141   HG13  ILE  18          HG13      ILE  18  -5.678   0.121   7.647
  142   HG21  ILE  18          HG21      ILE  18  -5.905   0.094   3.935
  143   HG22  ILE  18          HG22      ILE  18  -7.338  -0.777   4.481
  144   HG23  ILE  18          HG23      ILE  18  -5.982  -1.661   3.779
  145   HD11  ILE  18          HD11      ILE  18  -5.077   1.592   5.062
  146   HD12  ILE  18          HD12      ILE  18  -3.896   1.106   6.276
  147   HD13  ILE  18          HD13      ILE  18  -5.106   2.328   6.664
  148    H    THR  19           H        THR  19  -7.389  -1.133   8.492
  149    HA   THR  19           HA       THR  19 -10.114  -1.797   7.658
  150    HB   THR  19           HB       THR  19  -9.091  -0.781  10.313
  151    HG1  THR  19           HG1      THR  19  -8.677  -2.784  10.732
  152   HG21  THR  19          HG21      THR  19 -11.774  -1.802   9.366
  153   HG22  THR  19          HG22      THR  19 -11.416  -0.252  10.127
  154   HG23  THR  19          HG23      THR  19 -11.334  -1.739  11.073
  155    HA   PRO  20           HA       PRO  20 -10.117   2.575   6.202
  156    HB2  PRO  20           HB2      PRO  20 -12.989   1.817   5.818
  157    HB3  PRO  20           HB3      PRO  20 -11.899   2.683   4.717
  158    HG2  PRO  20           HG2      PRO  20 -12.469   0.171   4.258
  159    HG3  PRO  20           HG3      PRO  20 -10.797   0.742   4.081
  160    HD2  PRO  20           HD2      PRO  20 -12.011  -0.849   6.324
  161    HD3  PRO  20           HD3      PRO  20 -10.409  -1.006   5.567
  162    H    GLU  21           H        GLU  21 -10.462   4.348   7.359
  163    HA   GLU  21           HA       GLU  21 -11.495   4.351   9.966
  164    HB2  GLU  21           HB2      GLU  21  -9.855   5.993   9.146
  165    HB3  GLU  21           HB3      GLU  21 -11.064   6.666   8.054
  166    HG2  GLU  21           HG2      GLU  21 -10.942   8.062  10.043
  167    HG3  GLU  21           HG3      GLU  21 -12.489   7.213  10.017
  168    H    ASP  22           H        ASP  22 -12.947   5.315   6.876
  169    HA   ASP  22           HA       ASP  22 -15.332   6.419   7.919
  170    HB2  ASP  22           HB2      ASP  22 -14.660   5.224   5.229
  171    HB3  ASP  22           HB3      ASP  22 -16.216   5.963   5.584
  172    H    GLY  23           H        GLY  23 -14.305   3.153   7.702
  173    HA2  GLY  23           HA2      GLY  23 -15.495   1.402   8.824
  174    HA3  GLY  23           HA3      GLY  23 -17.002   2.233   8.453
  175    H    SER  24           H        SER  24 -14.880   2.266   5.810
  176    HA   SER  24           HA       SER  24 -16.576   0.578   4.234
  177    HB2  SER  24           HB2      SER  24 -13.872   1.795   3.639
  178    HB3  SER  24           HB3      SER  24 -14.878   0.966   2.461
  179    HG   SER  24           HG       SER  24 -15.076   3.485   3.477
  180    H    LYS  25           H        LYS  25 -15.637  -1.238   2.906
  181    HA   LYS  25           HA       LYS  25 -14.753  -3.319   4.594
  182    HB2  LYS  25           HB2      LYS  25 -14.814  -3.104   1.576
  183    HB3  LYS  25           HB3      LYS  25 -14.470  -4.593   2.457
  184    HG2  LYS  25           HG2      LYS  25 -16.654  -4.494   3.551
  185    HG3  LYS  25           HG3      LYS  25 -16.998  -2.948   2.778
  186    HD2  LYS  25           HD2      LYS  25 -18.134  -4.604   1.474
  187    HD3  LYS  25           HD3      LYS  25 -16.712  -4.141   0.542
  188    HE2  LYS  25           HE2      LYS  25 -15.506  -6.120   1.341
  189    HE3  LYS  25           HE3      LYS  25 -16.877  -6.568   2.357
  190    HZ1  LYS  25           HZ1      LYS  25 -17.128  -7.833   0.435
  191    HZ2  LYS  25           HZ2      LYS  25 -16.703  -6.549  -0.593
  192    HZ3  LYS  25           HZ3      LYS  25 -18.201  -6.540   0.206
  193    H    ASP  26           H        ASP  26 -12.774  -4.455   4.662
  194    HA   ASP  26           HA       ASP  26 -10.460  -2.928   4.807
  195    HB2  ASP  26           HB2      ASP  26 -10.858  -5.904   4.535
  196    HB3  ASP  26           HB3      ASP  26  -9.282  -5.174   4.804
  197    H    LEU  27           H        LEU  27  -8.709  -2.594   3.528
  198    HA   LEU  27           HA       LEU  27  -8.985  -3.335   0.675
  199    HB2  LEU  27           HB2      LEU  27  -7.614  -0.926   1.905
  200    HB3  LEU  27           HB3      LEU  27  -7.678  -1.296   0.184
  201    HG   LEU  27           HG       LEU  27 -10.146  -0.885   1.905
  202   HD11  LEU  27          HD11      LEU  27  -8.698   1.162   1.724
  203   HD12  LEU  27          HD12      LEU  27 -10.277   1.348   0.959
  204   HD13  LEU  27          HD13      LEU  27  -8.846   1.055  -0.030
  205   HD21  LEU  27          HD21      LEU  27 -10.607  -2.180  -0.100
  206   HD22  LEU  27          HD22      LEU  27  -9.672  -1.061  -1.091
  207   HD23  LEU  27          HD23      LEU  27 -11.194  -0.538  -0.368
  208    H    PHE  28           H        PHE  28  -7.168  -4.024  -0.447
  209    HA   PHE  28           HA       PHE  28  -5.173  -5.419   1.098
  210    HB2  PHE  28           HB2      PHE  28  -5.559  -5.006  -1.875
  211    HB3  PHE  28           HB3      PHE  28  -4.271  -5.994  -1.184
  212    HD1  PHE  28           HD1      PHE  28  -7.925  -5.665  -1.627
  213    HD2  PHE  28           HD2      PHE  28  -4.735  -8.140  -0.161
  214    HE1  PHE  28           HE1      PHE  28  -9.495  -7.575  -1.437
  215    HE2  PHE  28           HE2      PHE  28  -6.306 -10.049   0.032
  216    HZ   PHE  28           HZ       PHE  28  -8.686  -9.767  -0.606
  217    H    VAL  29           H        VAL  29  -3.191  -4.757   1.636
  218    HA   VAL  29           HA       VAL  29  -2.009  -2.436   0.252
  219    HB   VAL  29           HB       VAL  29  -2.135  -2.899   3.247
  220   HG11  VAL  29          HG11      VAL  29   0.031  -1.963   2.767
  221   HG12  VAL  29          HG12      VAL  29  -0.984  -0.628   3.313
  222   HG13  VAL  29          HG13      VAL  29  -0.654  -0.839   1.593
  223   HG21  VAL  29          HG21      VAL  29  -4.163  -1.932   2.021
  224   HG22  VAL  29          HG22      VAL  29  -3.144  -0.540   1.661
  225   HG23  VAL  29          HG23      VAL  29  -3.506  -0.955   3.335
  226    H    HIS  30           H        HIS  30   0.071  -2.749  -0.348
  227    HA   HIS  30           HA       HIS  30   1.438  -5.185   0.628
  228    HB2  HIS  30           HB2      HIS  30   1.797  -3.649  -1.957
  229    HB3  HIS  30           HB3      HIS  30   2.755  -5.051  -1.473
  230    HD2  HIS  30           HD2      HIS  30  -0.518  -4.331  -3.309
  231    HE1  HIS  30           HE1      HIS  30  -0.723  -8.380  -2.131
  232    HE2  HIS  30           HE2      HIS  30  -1.797  -6.592  -3.580
  233    H    HIS  31           H        HIS  31   3.613  -5.106   1.184
  234    HA   HIS  31           HA       HIS  31   4.494  -2.811   2.575
  235    HB2  HIS  31           HB2      HIS  31   5.218  -5.150   3.063
  236    HB3  HIS  31           HB3      HIS  31   6.170  -5.133   1.578
  237    HD2  HIS  31           HD2      HIS  31   6.365  -3.723   5.223
  238    HE1  HIS  31           HE1      HIS  31   9.840  -2.471   3.180
  239    HE2  HIS  31           HE2      HIS  31   8.704  -2.587   5.448
  240    H    SER  32           H        SER  32   5.507  -4.170  -0.545
  241    HA   SER  32           HA       SER  32   7.493  -2.267  -1.147
  242    HB2  SER  32           HB2      SER  32   7.357  -3.115  -3.427
  243    HB3  SER  32           HB3      SER  32   7.285  -4.444  -2.274
  244    HG   SER  32           HG       SER  32   5.679  -4.507  -3.979
  245    H    GLU  33           H        GLU  33   4.051  -1.959  -1.288
  246    HA   GLU  33           HA       GLU  33   4.061   0.132  -3.295
  247    HB2  GLU  33           HB2      GLU  33   1.885  -1.013  -1.548
  248    HB3  GLU  33           HB3      GLU  33   1.616   0.297  -2.694
  249    HG2  GLU  33           HG2      GLU  33   2.713  -2.442  -3.403
  250    HG3  GLU  33           HG3      GLU  33   1.055  -1.914  -3.671
  251    H    ILE  34           H        ILE  34   5.022   0.246  -0.124
  252    HA   ILE  34           HA       ILE  34   3.620   2.535   0.825
  253    HB   ILE  34           HB       ILE  34   5.346   2.723   2.538
  254   HG12  ILE  34          HG12      ILE  34   6.881   0.540   1.079
  255   HG13  ILE  34          HG13      ILE  34   7.280   2.244   0.937
  256   HG21  ILE  34          HG21      ILE  34   5.340   0.219   3.278
  257   HG22  ILE  34          HG22      ILE  34   4.356  -0.044   1.838
  258   HG23  ILE  34          HG23      ILE  34   3.795   1.046   3.102
  259   HD11  ILE  34          HD11      ILE  34   7.767   2.410   3.290
  260   HD12  ILE  34          HD12      ILE  34   8.625   0.996   2.678
  261   HD13  ILE  34          HD13      ILE  34   7.131   0.793   3.591
  262    H    GLN  35           H        GLN  35   4.357   4.709   1.025
  263    HA   GLN  35           HA       GLN  35   6.433   5.510  -0.927
  264    HB2  GLN  35           HB2      GLN  35   4.132   5.887  -1.842
  265    HB3  GLN  35           HB3      GLN  35   3.801   6.944  -0.472
  266    HG2  GLN  35           HG2      GLN  35   5.686   8.399  -1.143
  267    HG3  GLN  35           HG3      GLN  35   6.000   7.348  -2.523
  268   HE21  GLN  35          HE21      GLN  35   5.126   8.197  -4.409
  269   HE22  GLN  35          HE22      GLN  35   3.683   9.085  -4.502
  270    H    SER  36           H        SER  36   8.008   6.009   0.525
  271    HA   SER  36           HA       SER  36   7.651   8.410   2.111
  272    HB2  SER  36           HB2      SER  36   6.873   6.700   3.688
  273    HB3  SER  36           HB3      SER  36   8.360   5.785   3.446
  274    HG   SER  36           HG       SER  36   9.352   7.111   4.741
  275    H    GLY  37           H        GLY  37   9.562   9.471   2.490
  276    HA2  GLY  37           HA2      GLY  37  11.773   8.919   0.828
  277    HA3  GLY  37           HA3      GLY  37  11.756  10.075   2.156
  278    H    GLY  38           H        GLY  38  11.194   8.307   4.273
  279    HA2  GLY  38           HA2      GLY  38  13.814   7.285   4.820
  280    HA3  GLY  38           HA3      GLY  38  12.402   7.145   5.861
  281    H    GLU  39           H        GLU  39  14.498   5.179   5.048
  282    HA   GLU  39           HA       GLU  39  12.878   3.155   3.651
  283    HB2  GLU  39           HB2      GLU  39  15.834   3.278   4.277
  284    HB3  GLU  39           HB3      GLU  39  15.041   1.903   3.509
  285    HG2  GLU  39           HG2      GLU  39  15.835   3.159   1.682
  286    HG3  GLU  39           HG3      GLU  39  14.146   3.632   1.793
  287    H    TYR  40           H        TYR  40  13.291   4.078   6.779
  288    HA   TYR  40           HA       TYR  40  13.497   1.351   7.875
  289    HB2  TYR  40           HB2      TYR  40  13.579   4.048   9.237
  290    HB3  TYR  40           HB3      TYR  40  13.710   2.498  10.064
  291    HD1  TYR  40           HD1      TYR  40  15.399   4.903   7.863
  292    HD2  TYR  40           HD2      TYR  40  15.680   1.052   9.745
  293    HE1  TYR  40           HE1      TYR  40  17.829   4.837   7.367
  294    HE2  TYR  40           HE2      TYR  40  18.108   0.986   9.248
  295    HH   TYR  40           HH       TYR  40  19.948   3.139   8.791
  296    H    ALA  41           H        ALA  41  11.027   3.045   6.674
  297    HA   ALA  41           HA       ALA  41   9.125   3.294   8.717
  298    HB1  ALA  41           HB1      ALA  41   8.945   2.867   5.749
  299    HB2  ALA  41           HB2      ALA  41   8.508   4.289   6.696
  300    HB3  ALA  41           HB3      ALA  41   7.484   2.852   6.738
  301    H    THR  42           H        THR  42   7.894   1.897   9.799
  302    HA   THR  42           HA       THR  42   7.836  -0.935   8.928
  303    HB   THR  42           HB       THR  42   7.899  -1.599  11.303
  304    HG1  THR  42           HG1      THR  42   8.309   1.177  11.699
  305   HG21  THR  42          HG21      THR  42  10.006  -1.251   9.861
  306   HG22  THR  42          HG22      THR  42  10.232  -1.321  11.609
  307   HG23  THR  42          HG23      THR  42  10.239   0.236  10.781
  308    H    LEU  43           H        LEU  43   5.987  -2.156   9.706
  309    HA   LEU  43           HA       LEU  43   3.671  -0.573  10.578
  310    HB2  LEU  43           HB2      LEU  43   3.865  -2.164   8.033
  311    HB3  LEU  43           HB3      LEU  43   2.324  -1.987   8.854
  312    HG   LEU  43           HG       LEU  43   3.055   0.612   8.839
  313   HD11  LEU  43          HD11      LEU  43   4.168  -0.236   6.167
  314   HD12  LEU  43          HD12      LEU  43   5.224  -0.201   7.573
  315   HD13  LEU  43          HD13      LEU  43   4.410   1.270   7.051
  316   HD21  LEU  43          HD21      LEU  43   1.846   0.749   6.553
  317   HD22  LEU  43          HD22      LEU  43   0.974  -0.011   7.883
  318   HD23  LEU  43          HD23      LEU  43   1.740  -1.009   6.649
  319    H    ALA  44           H        ALA  44   2.124  -1.783  11.694
  320    HA   ALA  44           HA       ALA  44   2.555  -4.652  12.085
  321    HB1  ALA  44           HB1      ALA  44   3.059  -4.558  14.345
  322    HB2  ALA  44           HB2      ALA  44   2.287  -2.987  14.560
  323    HB3  ALA  44           HB3      ALA  44   3.869  -3.094  13.786
  324    H    ASP  45           H        ASP  45   0.774  -4.693  14.456
  325    HA   ASP  45           HA       ASP  45  -1.760  -4.514  13.051
  326    HB2  ASP  45           HB2      ASP  45  -1.173  -6.497  14.432
  327    HB3  ASP  45           HB3      ASP  45  -1.133  -5.466  15.856
  328    H    GLY  46           H        GLY  46  -2.774  -2.609  12.997
  329    HA2  GLY  46           HA2      GLY  46  -4.155  -1.006  14.120
  330    HA3  GLY  46           HA3      GLY  46  -3.096  -1.114  15.517
  331    H    GLN  47           H        GLN  47  -1.046  -0.980  12.941
  332    HA   GLN  47           HA       GLN  47  -0.067   1.589  13.474
  333    HB2  GLN  47           HB2      GLN  47   1.179  -0.282  12.394
  334    HB3  GLN  47           HB3      GLN  47   0.239  -0.025  10.929
  335    HG2  GLN  47           HG2      GLN  47   2.409   1.099  10.762
  336    HG3  GLN  47           HG3      GLN  47   1.112   2.281  10.784
  337   HE21  GLN  47          HE21      GLN  47   1.704   4.043  12.063
  338   HE22  GLN  47          HE22      GLN  47   2.595   3.945  13.504
  339    H    THR  48           H        THR  48  -0.679   3.562  12.837
  340    HA   THR  48           HA       THR  48  -2.995   3.856  11.090
  341    HB   THR  48           HB       THR  48  -1.378   5.954  12.576
  342    HG1  THR  48           HG1      THR  48  -2.571   5.477  14.238
  343   HG21  THR  48          HG21      THR  48  -3.163   7.457  12.128
  344   HG22  THR  48          HG22      THR  48  -4.228   6.159  11.591
  345   HG23  THR  48          HG23      THR  48  -2.865   6.654  10.587
  346    H    VAL  49           H        VAL  49  -2.908   4.423   9.001
  347    HA   VAL  49           HA       VAL  49  -0.465   5.693   7.962
  348    HB   VAL  49           HB       VAL  49  -0.417   4.152   6.028
  349   HG11  VAL  49          HG11      VAL  49   0.691   2.371   7.172
  350   HG12  VAL  49          HG12      VAL  49  -0.288   2.599   8.621
  351   HG13  VAL  49          HG13      VAL  49   0.918   3.805   8.172
  352   HG21  VAL  49          HG21      VAL  49  -2.682   3.343   5.941
  353   HG22  VAL  49          HG22      VAL  49  -2.599   2.751   7.600
  354   HG23  VAL  49          HG23      VAL  49  -1.668   1.954   6.332
  355    H    GLU  50           H        GLU  50  -0.703   6.476   5.743
  356    HA   GLU  50           HA       GLU  50  -3.447   7.478   5.240
  357    HB2  GLU  50           HB2      GLU  50  -0.783   8.648   4.354
  358    HB3  GLU  50           HB3      GLU  50  -2.373   9.338   4.031
  359    HG2  GLU  50           HG2      GLU  50  -2.748   9.594   6.465
  360    HG3  GLU  50           HG3      GLU  50  -1.149   8.925   6.776
  361    H    TYR  51           H        TYR  51  -4.354   7.014   3.241
  362    HA   TYR  51           HA       TYR  51  -2.674   6.013   1.086
  363    HB2  TYR  51           HB2      TYR  51  -3.870   3.874   0.868
  364    HB3  TYR  51           HB3      TYR  51  -3.019   3.983   2.403
  365    HD1  TYR  51           HD1      TYR  51  -6.318   4.015   0.761
  366    HD2  TYR  51           HD2      TYR  51  -4.236   4.197   4.514
  367    HE1  TYR  51           HE1      TYR  51  -8.448   3.613   1.963
  368    HE2  TYR  51           HE2      TYR  51  -6.367   3.794   5.715
  369    HH   TYR  51           HH       TYR  51  -8.785   4.081   5.311
  370    H    GLU  52           H        GLU  52  -3.892   5.462  -0.852
  371    HA   GLU  52           HA       GLU  52  -6.331   7.115  -1.136
  372    HB2  GLU  52           HB2      GLU  52  -4.097   6.532  -3.097
  373    HB3  GLU  52           HB3      GLU  52  -5.634   7.264  -3.566
  374    HG2  GLU  52           HG2      GLU  52  -5.254   9.153  -2.102
  375    HG3  GLU  52           HG3      GLU  52  -3.828   8.390  -1.408
  376    H    VAL  53           H        VAL  53  -8.114   6.116  -1.920
  377    HA   VAL  53           HA       VAL  53  -7.956   3.224  -2.365
  378    HB   VAL  53           HB       VAL  53 -10.370   5.059  -2.141
  379   HG11  VAL  53          HG11      VAL  53 -11.704   3.074  -1.981
  380   HG12  VAL  53          HG12      VAL  53 -10.277   2.043  -1.889
  381   HG13  VAL  53          HG13      VAL  53 -10.678   2.860  -3.399
  382   HG21  VAL  53          HG21      VAL  53  -8.998   3.247  -0.132
  383   HG22  VAL  53          HG22      VAL  53 -10.588   3.966   0.118
  384   HG23  VAL  53          HG23      VAL  53  -9.168   4.999  -0.034
  385    H    GLY  54           H        GLY  54  -7.687   2.483  -4.371
  386    HA2  GLY  54           HA2      GLY  54  -8.872   3.993  -6.631
  387    HA3  GLY  54           HA3      GLY  54  -7.290   3.224  -6.731
  388    H    GLN  55           H        GLN  55 -10.431   2.883  -7.572
  389    HA   GLN  55           HA       GLN  55 -11.155   0.266  -7.026
  390    HB2  GLN  55           HB2      GLN  55 -11.745   2.010  -9.422
  391    HB3  GLN  55           HB3      GLN  55 -12.503   0.436  -9.161
  392    HG2  GLN  55           HG2      GLN  55 -13.465   1.173  -7.069
  393    HG3  GLN  55           HG3      GLN  55 -12.565   2.685  -7.132
  394   HE21  GLN  55          HE21      GLN  55 -15.553   2.254  -7.093
  395   HE22  GLN  55          HE22      GLN  55 -16.131   3.040  -8.481
  396    H    GLY  56           H        GLY  56 -11.061  -1.641  -8.218
  397    HA2  GLY  56           HA2      GLY  56  -9.111  -1.879 -10.386
  398    HA3  GLY  56           HA3      GLY  56  -8.822  -2.815  -8.919
  399    H    GLN  57           H        GLN  57  -9.088  -4.335 -11.052
  400    HA   GLN  57           HA       GLN  57 -11.713  -4.988 -11.872
  401    HB2  GLN  57           HB2      GLN  57  -9.178  -6.637 -11.882
  402    HB3  GLN  57           HB3      GLN  57 -10.674  -7.104 -12.690
  403    HG2  GLN  57           HG2      GLN  57  -9.785  -5.990 -14.474
  404    HG3  GLN  57           HG3      GLN  57 -10.370  -4.550 -13.638
  405   HE21  GLN  57          HE21      GLN  57  -7.950  -4.852 -15.406
  406   HE22  GLN  57          HE22      GLN  57  -6.638  -4.350 -14.453
  407    H    LYS  58           H        LYS  58  -9.631  -6.289  -9.313
  408    HA   LYS  58           HA       LYS  58 -11.659  -8.202  -8.468
  409    HB2  LYS  58           HB2      LYS  58  -8.970  -7.434  -7.311
  410    HB3  LYS  58           HB3      LYS  58 -10.021  -8.674  -6.627
  411    HG2  LYS  58           HG2      LYS  58  -9.962  -9.906  -8.766
  412    HG3  LYS  58           HG3      LYS  58  -8.899  -8.672  -9.445
  413    HD2  LYS  58           HD2      LYS  58  -7.199  -9.172  -7.745
  414    HD3  LYS  58           HD3      LYS  58  -8.261 -10.377  -7.019
  415    HE2  LYS  58           HE2      LYS  58  -6.645 -11.491  -8.476
  416    HE3  LYS  58           HE3      LYS  58  -8.258 -11.634  -9.169
  417    HZ1  LYS  58           HZ1      LYS  58  -6.347 -10.918 -10.686
  418    HZ2  LYS  58           HZ2      LYS  58  -6.478  -9.406  -9.923
  419    HZ3  LYS  58           HZ3      LYS  58  -7.800 -10.048 -10.775
  420    H    GLY  59           H        GLY  59 -10.700  -4.955  -7.749
  421    HA2  GLY  59           HA2      GLY  59 -12.808  -3.941  -6.494
  422    HA3  GLY  59           HA3      GLY  59 -12.099  -4.877  -5.180
  423    HA   PRO  60           HA       PRO  60  -9.986  -0.642  -5.544
  424    HB2  PRO  60           HB2      PRO  60 -10.633   0.381  -3.110
  425    HB3  PRO  60           HB3      PRO  60 -11.666   0.575  -4.539
  426    HG2  PRO  60           HG2      PRO  60 -11.902  -1.362  -2.285
  427    HG3  PRO  60           HG3      PRO  60 -13.160  -0.410  -3.090
  428    HD2  PRO  60           HD2      PRO  60 -12.732  -3.041  -3.663
  429    HD3  PRO  60           HD3      PRO  60 -13.323  -1.883  -4.876
  430    H    CYS  61           H        CYS  61  -8.035  -0.060  -4.593
  431    HA   CYS  61           HA       CYS  61  -6.981  -1.818  -2.462
  432    HB2  CYS  61           HB2      CYS  61  -5.513  -0.890  -4.946
  433    HB3  CYS  61           HB3      CYS  61  -4.808  -1.823  -3.625
  434    HG   CYS  61           HG       CYS  61  -6.899  -3.583  -4.324
  435    H    ALA  62           H        ALA  62  -4.865  -0.810  -1.548
  436    HA   ALA  62           HA       ALA  62  -5.263   2.128  -1.328
  437    HB1  ALA  62           HB1      ALA  62  -5.634   1.642   0.851
  438    HB2  ALA  62           HB2      ALA  62  -3.884   1.453   0.946
  439    HB3  ALA  62           HB3      ALA  62  -4.915   0.040   0.717
  440    H    ASN  63           H        ASN  63  -3.620   3.352  -1.994
  441    HA   ASN  63           HA       ASN  63  -0.929   2.127  -2.231
  442    HB2  ASN  63           HB2      ASN  63  -2.217   4.129  -4.101
  443    HB3  ASN  63           HB3      ASN  63  -0.598   3.449  -4.262
  444   HD21  ASN  63          HD21      ASN  63  -3.453   3.156  -5.720
  445   HD22  ASN  63          HD22      ASN  63  -3.498   1.488  -6.027
  446    H    LYS  64           H        LYS  64   0.840   3.751  -2.329
  447    HA   LYS  64           HA       LYS  64   2.044   5.451  -1.376
  448    HB2  LYS  64           HB2      LYS  64  -0.620   6.873  -1.588
  449    HB3  LYS  64           HB3      LYS  64   0.899   7.664  -1.167
  450    HG2  LYS  64           HG2      LYS  64   1.878   6.923  -3.312
  451    HG3  LYS  64           HG3      LYS  64   0.353   6.142  -3.735
  452    HD2  LYS  64           HD2      LYS  64  -0.800   8.320  -3.619
  453    HD3  LYS  64           HD3      LYS  64   0.724   9.104  -3.200
  454    HE2  LYS  64           HE2      LYS  64   1.697   8.374  -5.344
  455    HE3  LYS  64           HE3      LYS  64   0.179   7.580  -5.765
  456    HZ1  LYS  64           HZ1      LYS  64   0.656   9.976  -6.588
  457    HZ2  LYS  64           HZ2      LYS  64   0.167  10.424  -5.023
  458    HZ3  LYS  64           HZ3      LYS  64  -0.896   9.571  -6.038
  459    H    VAL  65           H        VAL  65   1.667   3.645   0.408
  460    HA   VAL  65           HA       VAL  65   0.169   4.463   2.724
  461    HB   VAL  65           HB       VAL  65   2.321   2.348   2.433
  462   HG11  VAL  65          HG11      VAL  65   0.231   2.742   4.596
  463   HG12  VAL  65          HG12      VAL  65   1.960   3.033   4.782
  464   HG13  VAL  65          HG13      VAL  65   1.369   1.397   4.496
  465   HG21  VAL  65          HG21      VAL  65  -0.667   1.908   2.548
  466   HG22  VAL  65          HG22      VAL  65   0.591   0.782   2.036
  467   HG23  VAL  65          HG23      VAL  65   0.175   2.156   1.017
  468    H    VAL  66           H        VAL  66   0.748   5.935   4.105
  469    HA   VAL  66           HA       VAL  66   3.620   6.542   4.539
  470    HB   VAL  66           HB       VAL  66   1.284   8.483   4.635
  471   HG11  VAL  66          HG11      VAL  66   3.149  10.187   4.819
  472   HG12  VAL  66          HG12      VAL  66   4.256   8.845   5.109
  473   HG13  VAL  66          HG13      VAL  66   2.944   9.168   6.244
  474   HG21  VAL  66          HG21      VAL  66   3.529   8.077   2.642
  475   HG22  VAL  66          HG22      VAL  66   2.532   9.530   2.693
  476   HG23  VAL  66          HG23      VAL  66   1.795   7.967   2.337
  477    H    ALA  67           H        ALA  67   4.283   6.117   6.546
  478    HA   ALA  67           HA       ALA  67   2.490   5.260   8.596
  479    HB1  ALA  67           HB1      ALA  67   4.639   5.390  10.008
  480    HB2  ALA  67           HB2      ALA  67   5.449   5.823   8.502
  481    HB3  ALA  67           HB3      ALA  67   4.628   4.268   8.647
  482    H    VAL  68           H        VAL  68   1.651   6.321  10.295
  483    HA   VAL  68           HA       VAL  68   2.582   9.033  10.929
  484    HB   VAL  68           HB       VAL  68   0.247   9.875  11.006
  485   HG11  VAL  68          HG11      VAL  68  -0.058  10.003   8.533
  486   HG12  VAL  68          HG12      VAL  68   1.180   8.761   8.346
  487   HG13  VAL  68          HG13      VAL  68   1.601  10.330   9.034
  488   HG21  VAL  68          HG21      VAL  68  -1.569   8.614  10.029
  489   HG22  VAL  68          HG22      VAL  68  -0.801   7.576  11.231
  490   HG23  VAL  68          HG23      VAL  68  -0.473   7.331   9.515
  Start of MODEL    2
    1    H1   MET   1           HT1      MET   1  -6.160  14.094   2.609
    2    H2   MET   1           HT2      MET   1  -7.585  13.479   1.921
    3    H3   MET   1           HT3      MET   1  -6.363  14.110   0.926
    4    HA   MET   1           HA       MET   1  -6.095  11.824   0.722
    5    HB2  MET   1           HB2      MET   1  -4.266  12.908   2.881
    6    HB3  MET   1           HB3      MET   1  -4.004  11.361   2.076
    7    HG2  MET   1           HG2      MET   1  -3.835  12.457  -0.087
    8    HG3  MET   1           HG3      MET   1  -4.254  14.013   0.630
    9    HE1  MET   1           HE1      MET   1  -0.394  11.596   1.136
   10    HE2  MET   1           HE2      MET   1  -1.813  11.198   0.170
   11    HE3  MET   1           HE3      MET   1  -1.891  11.081   1.926
   12    H    SER   2           H        SER   2  -7.141  10.043   1.300
   13    HA   SER   2           HA       SER   2  -8.475   9.758   3.805
   14    HB2  SER   2           HB2      SER   2  -7.952   7.754   1.600
   15    HB3  SER   2           HB3      SER   2  -9.017   7.476   2.974
   16    HG   SER   2           HG       SER   2  -9.579   8.681   0.701
   17    H    LYS   3           H        LYS   3  -8.113   8.209   5.436
   18    HA   LYS   3           HA       LYS   3  -5.676   6.651   5.510
   19    HB2  LYS   3           HB2      LYS   3  -4.708   7.772   7.468
   20    HB3  LYS   3           HB3      LYS   3  -4.809   8.874   6.099
   21    HG2  LYS   3           HG2      LYS   3  -6.889   9.841   7.025
   22    HG3  LYS   3           HG3      LYS   3  -6.776   8.743   8.404
   23    HD2  LYS   3           HD2      LYS   3  -4.603   9.736   9.021
   24    HD3  LYS   3           HD3      LYS   3  -4.712  10.831   7.644
   25    HE2  LYS   3           HE2      LYS   3  -6.779  11.803   8.569
   26    HE3  LYS   3           HE3      LYS   3  -6.681  10.704   9.946
   27    HZ1  LYS   3           HZ1      LYS   3  -4.400  11.688  10.325
   28    HZ2  LYS   3           HZ2      LYS   3  -5.724  12.697  10.666
   29    HZ3  LYS   3           HZ3      LYS   3  -4.841  12.908   9.229
   30    H    GLY   4           H        GLY   4  -5.692   5.087   7.130
   31    HA2  GLY   4           HA2      GLY   4  -7.938   5.060   9.024
   32    HA3  GLY   4           HA3      GLY   4  -7.822   3.740   7.866
   33    H    ILE   5           H        ILE   5  -7.693   2.438   9.862
   34    HA   ILE   5           HA       ILE   5  -4.934   2.380  10.945
   35    HB   ILE   5           HB       ILE   5  -5.962   1.139  12.899
   36   HG12  ILE   5          HG12      ILE   5  -8.584   2.322  11.942
   37   HG13  ILE   5          HG13      ILE   5  -8.136   0.661  11.567
   38   HG21  ILE   5          HG21      ILE   5  -6.796   3.996  12.321
   39   HG22  ILE   5          HG22      ILE   5  -5.317   3.463  13.122
   40   HG23  ILE   5          HG23      ILE   5  -6.877   3.247  13.917
   41   HD11  ILE   5          HD11      ILE   5  -8.180   1.778  14.383
   42   HD12  ILE   5          HD12      ILE   5  -8.012   0.088  13.909
   43   HD13  ILE   5          HD13      ILE   5  -9.543   0.928  13.656
   44    H    VAL   6           H        VAL   6  -3.755   0.672  10.534
   45    HA   VAL   6           HA       VAL   6  -4.650  -1.344   8.766
   46    HB   VAL   6           HB       VAL   6  -2.114  -1.219  10.423
   47   HG11  VAL   6          HG11      VAL   6  -1.280  -2.715   8.487
   48   HG12  VAL   6          HG12      VAL   6  -2.984  -3.004   8.139
   49   HG13  VAL   6          HG13      VAL   6  -2.312  -3.477   9.699
   50   HG21  VAL   6          HG21      VAL   6  -1.102  -0.171   8.535
   51   HG22  VAL   6          HG22      VAL   6  -2.638   0.669   8.746
   52   HG23  VAL   6          HG23      VAL   6  -2.471  -0.554   7.488
   53    H    LYS   7           H        LYS   7  -5.752  -3.088   9.165
   54    HA   LYS   7           HA       LYS   7  -6.478  -3.984  11.768
   55    HB2  LYS   7           HB2      LYS   7  -7.877  -4.350   9.736
   56    HB3  LYS   7           HB3      LYS   7  -6.660  -5.468   9.123
   57    HG2  LYS   7           HG2      LYS   7  -6.989  -6.920  11.088
   58    HG3  LYS   7           HG3      LYS   7  -8.191  -5.796  11.725
   59    HD2  LYS   7           HD2      LYS   7  -9.593  -6.150   9.727
   60    HD3  LYS   7           HD3      LYS   7  -8.396  -7.276   9.087
   61    HE2  LYS   7           HE2      LYS   7  -8.713  -8.739  11.044
   62    HE3  LYS   7           HE3      LYS   7  -9.902  -7.612  11.697
   63    HZ1  LYS   7           HZ1      LYS   7 -10.219  -8.733   8.987
   64    HZ2  LYS   7           HZ2      LYS   7 -11.402  -8.095  10.025
   65    HZ3  LYS   7           HZ3      LYS   7 -10.719  -9.617  10.346
   66    H    TRP   8           H        TRP   8  -4.216  -5.166   9.302
   67    HA   TRP   8           HA       TRP   8  -2.456  -6.291  11.297
   68    HB2  TRP   8           HB2      TRP   8  -4.349  -8.011  10.844
   69    HB3  TRP   8           HB3      TRP   8  -3.587  -8.221   9.270
   70    HD1  TRP   8           HD1      TRP   8  -1.272  -9.457   9.172
   71    HE1  TRP   8           HE1      TRP   8   0.054 -10.839  10.899
   72    HE3  TRP   8           HE3      TRP   8  -3.802  -8.212  13.428
   73    HZ2  TRP   8           HZ2      TRP   8   0.042 -11.351  13.712
   74    HZ3  TRP   8           HZ3      TRP   8  -3.129  -9.164  15.615
   75    HH2  TRP   8           HH2      TRP   8  -1.212 -10.731  15.763
   76    H    PHE   9           H        PHE   9  -0.431  -5.952  10.549
   77    HA   PHE   9           HA       PHE   9  -0.065  -5.679   7.612
   78    HB2  PHE   9           HB2      PHE   9   0.466  -3.677   9.096
   79    HB3  PHE   9           HB3      PHE   9   1.802  -4.629   9.748
   80    HD1  PHE   9           HD1      PHE   9   0.583  -2.707   6.903
   81    HD2  PHE   9           HD2      PHE   9   3.623  -5.440   8.225
   82    HE1  PHE   9           HE1      PHE   9   1.962  -2.128   4.926
   83    HE2  PHE   9           HE2      PHE   9   5.006  -4.855   6.250
   84    HZ   PHE   9           HZ       PHE   9   4.173  -3.200   4.601
   85    H    ASN  10           H        ASN  10   0.989  -7.305   6.629
   86    HA   ASN  10           HA       ASN  10   2.951  -8.864   8.215
   87    HB2  ASN  10           HB2      ASN  10   0.922  -9.823   6.197
   88    HB3  ASN  10           HB3      ASN  10   2.302 -10.797   6.695
   89   HD21  ASN  10          HD21      ASN  10  -0.514 -11.461   7.211
   90   HD22  ASN  10          HD22      ASN  10  -0.707 -11.492   8.897
   91    H    SER  11           H        SER  11   4.747  -7.706   7.488
   92    HA   SER  11           HA       SER  11   5.296  -7.043   4.812
   93    HB2  SER  11           HB2      SER  11   7.591  -6.704   5.581
   94    HB3  SER  11           HB3      SER  11   6.453  -6.048   6.755
   95    HG   SER  11           HG       SER  11   7.828  -7.259   7.939
   96    H    ASP  12           H        ASP  12   5.802 -10.004   6.648
   97    HA   ASP  12           HA       ASP  12   7.680 -11.286   4.987
   98    HB2  ASP  12           HB2      ASP  12   6.971 -12.138   7.209
   99    HB3  ASP  12           HB3      ASP  12   5.398 -12.555   6.527
  100    H    LYS  13           H        LYS  13   4.136 -11.270   4.929
  101    HA   LYS  13           HA       LYS  13   3.937 -12.802   2.499
  102    HB2  LYS  13           HB2      LYS  13   1.898 -11.083   3.943
  103    HB3  LYS  13           HB3      LYS  13   1.542 -12.165   2.602
  104    HG2  LYS  13           HG2      LYS  13   2.808 -13.098   5.192
  105    HG3  LYS  13           HG3      LYS  13   1.069 -13.134   4.895
  106    HD2  LYS  13           HD2      LYS  13   1.468 -14.571   2.897
  107    HD3  LYS  13           HD3      LYS  13   3.192 -14.586   3.278
  108    HE2  LYS  13           HE2      LYS  13   2.702 -15.604   5.471
  109    HE3  LYS  13           HE3      LYS  13   0.981 -15.594   5.092
  110    HZ1  LYS  13           HZ1      LYS  13   3.024 -16.974   3.442
  111    HZ2  LYS  13           HZ2      LYS  13   1.337 -17.081   3.290
  112    HZ3  LYS  13           HZ3      LYS  13   2.114 -17.742   4.650
  113    H    GLY  14           H        GLY  14   4.449  -9.482   3.307
  114    HA2  GLY  14           HA2      GLY  14   5.158  -7.785   1.856
  115    HA3  GLY  14           HA3      GLY  14   4.626  -8.756   0.491
  116    H    PHE  15           H        PHE  15   2.188  -8.620   2.846
  117    HA   PHE  15           HA       PHE  15   1.051  -6.091   2.028
  118    HB2  PHE  15           HB2      PHE  15  -1.003  -7.039   1.047
  119    HB3  PHE  15           HB3      PHE  15   0.429  -7.423   0.093
  120    HD1  PHE  15           HD1      PHE  15  -2.122  -8.768   2.406
  121    HD2  PHE  15           HD2      PHE  15   1.249  -9.697  -0.089
  122    HE1  PHE  15           HE1      PHE  15  -2.665 -11.183   2.571
  123    HE2  PHE  15           HE2      PHE  15   0.709 -12.110   0.080
  124    HZ   PHE  15           HZ       PHE  15  -1.248 -12.853   1.409
  125    H    GLY  16           H        GLY  16  -1.289  -5.934   2.868
  126    HA2  GLY  16           HA2      GLY  16  -1.920  -7.500   5.211
  127    HA3  GLY  16           HA3      GLY  16  -1.365  -5.868   5.579
  128    H    PHE  17           H        PHE  17  -3.798  -6.329   6.419
  129    HA   PHE  17           HA       PHE  17  -5.636  -5.186   4.396
  130    HB2  PHE  17           HB2      PHE  17  -6.236  -6.920   6.811
  131    HB3  PHE  17           HB3      PHE  17  -7.459  -6.168   5.788
  132    HD1  PHE  17           HD1      PHE  17  -4.841  -8.753   5.976
  133    HD2  PHE  17           HD2      PHE  17  -7.869  -6.956   3.518
  134    HE1  PHE  17           HE1      PHE  17  -4.695 -10.662   4.400
  135    HE2  PHE  17           HE2      PHE  17  -7.723  -8.864   1.943
  136    HZ   PHE  17           HZ       PHE  17  -6.136 -10.717   2.381
  137    H    ILE  18           H        ILE  18  -6.596  -3.250   4.875
  138    HA   ILE  18           HA       ILE  18  -6.038  -2.140   7.547
  139    HB   ILE  18           HB       ILE  18  -4.820  -0.987   5.755
  140   HG12  ILE  18          HG12      ILE  18  -7.048   0.835   6.694
  141   HG13  ILE  18          HG13      ILE  18  -5.831   0.209   7.811
  142   HG21  ILE  18          HG21      ILE  18  -6.170  -1.290   3.828
  143   HG22  ILE  18          HG22      ILE  18  -6.282   0.434   4.175
  144   HG23  ILE  18          HG23      ILE  18  -7.603  -0.644   4.627
  145   HD11  ILE  18          HD11      ILE  18  -5.117   1.659   5.251
  146   HD12  ILE  18          HD12      ILE  18  -4.053   1.256   6.598
  147   HD13  ILE  18          HD13      ILE  18  -5.304   2.482   6.801
  148    H    THR  19           H        THR  19  -7.569  -1.048   8.658
  149    HA   THR  19           HA       THR  19 -10.331  -1.582   7.851
  150    HB   THR  19           HB       THR  19  -9.204  -0.760  10.534
  151    HG1  THR  19           HG1      THR  19  -8.816  -2.792  10.782
  152   HG21  THR  19          HG21      THR  19 -11.392  -1.406  11.411
  153   HG22  THR  19          HG22      THR  19 -11.930  -1.877   9.798
  154   HG23  THR  19          HG23      THR  19 -11.607  -0.180  10.160
  155    HA   PRO  20           HA       PRO  20 -10.306   2.897   6.725
  156    HB2  PRO  20           HB2      PRO  20 -13.197   2.202   6.343
  157    HB3  PRO  20           HB3      PRO  20 -12.117   3.127   5.282
  158    HG2  PRO  20           HG2      PRO  20 -12.742   0.663   4.658
  159    HG3  PRO  20           HG3      PRO  20 -11.066   1.219   4.479
  160    HD2  PRO  20           HD2      PRO  20 -12.255  -0.507   6.634
  161    HD3  PRO  20           HD3      PRO  20 -10.675  -0.645   5.823
  162    H    GLU  21           H        GLU  21 -10.573   4.548   8.142
  163    HA   GLU  21           HA       GLU  21 -11.713   4.171  10.709
  164    HB2  GLU  21           HB2      GLU  21 -11.297   6.577  11.029
  165    HB3  GLU  21           HB3      GLU  21  -9.902   5.776  10.309
  166    HG2  GLU  21           HG2      GLU  21 -10.649   6.543   8.061
  167    HG3  GLU  21           HG3      GLU  21 -11.995   7.388   8.813
  168    H    ASP  22           H        ASP  22 -13.023   5.363   7.700
  169    HA   ASP  22           HA       ASP  22 -15.338   6.648   8.774
  170    HB2  ASP  22           HB2      ASP  22 -14.666   5.588   6.028
  171    HB3  ASP  22           HB3      ASP  22 -16.181   6.404   6.394
  172    H    GLY  23           H        GLY  23 -14.511   3.338   8.240
  173    HA2  GLY  23           HA2      GLY  23 -15.829   1.595   9.267
  174    HA3  GLY  23           HA3      GLY  23 -17.273   2.530   8.901
  175    H    SER  24           H        SER  24 -15.102   2.608   6.304
  176    HA   SER  24           HA       SER  24 -16.820   1.062   4.615
  177    HB2  SER  24           HB2      SER  24 -14.087   2.264   4.124
  178    HB3  SER  24           HB3      SER  24 -15.102   1.536   2.886
  179    HG   SER  24           HG       SER  24 -16.538   3.150   3.095
  180    H    LYS  25           H        LYS  25 -15.875  -0.662   3.177
  181    HA   LYS  25           HA       LYS  25 -15.015  -2.859   4.741
  182    HB2  LYS  25           HB2      LYS  25 -15.027  -2.517   1.730
  183    HB3  LYS  25           HB3      LYS  25 -14.826  -4.048   2.576
  184    HG2  LYS  25           HG2      LYS  25 -17.250  -2.263   2.935
  185    HG3  LYS  25           HG3      LYS  25 -17.186  -3.581   1.768
  186    HD2  LYS  25           HD2      LYS  25 -16.675  -5.160   3.642
  187    HD3  LYS  25           HD3      LYS  25 -16.881  -3.826   4.778
  188    HE2  LYS  25           HE2      LYS  25 -19.008  -4.756   2.829
  189    HE3  LYS  25           HE3      LYS  25 -18.945  -5.215   4.530
  190    HZ1  LYS  25           HZ1      LYS  25 -20.396  -3.368   4.335
  191    HZ2  LYS  25           HZ2      LYS  25 -19.276  -2.489   3.410
  192    HZ3  LYS  25           HZ3      LYS  25 -18.968  -2.796   5.052
  193    H    ASP  26           H        ASP  26 -13.055  -4.026   4.695
  194    HA   ASP  26           HA       ASP  26 -10.727  -2.516   4.892
  195    HB2  ASP  26           HB2      ASP  26 -11.104  -5.481   4.461
  196    HB3  ASP  26           HB3      ASP  26  -9.559  -4.731   4.867
  197    H    LEU  27           H        LEU  27  -8.970  -2.192   3.620
  198    HA   LEU  27           HA       LEU  27  -9.271  -2.805   0.737
  199    HB2  LEU  27           HB2      LEU  27  -7.920  -0.434   2.061
  200    HB3  LEU  27           HB3      LEU  27  -7.965  -0.741   0.327
  201    HG   LEU  27           HG       LEU  27 -10.463  -0.444   2.022
  202   HD11  LEU  27          HD11      LEU  27 -10.572   1.838   0.898
  203   HD12  LEU  27          HD12      LEU  27  -8.886   1.597   0.436
  204   HD13  LEU  27          HD13      LEU  27  -9.331   1.667   2.141
  205   HD21  LEU  27          HD21      LEU  27  -9.907  -0.449  -0.963
  206   HD22  LEU  27          HD22      LEU  27 -11.447   0.050  -0.265
  207   HD23  LEU  27          HD23      LEU  27 -10.884  -1.608  -0.059
  208    H    PHE  28           H        PHE  28  -7.386  -3.365  -0.429
  209    HA   PHE  28           HA       PHE  28  -5.404  -4.805   1.117
  210    HB2  PHE  28           HB2      PHE  28  -5.812  -4.390  -1.851
  211    HB3  PHE  28           HB3      PHE  28  -4.479  -5.332  -1.181
  212    HD1  PHE  28           HD1      PHE  28  -8.146  -5.146  -1.597
  213    HD2  PHE  28           HD2      PHE  28  -4.854  -7.488  -0.139
  214    HE1  PHE  28           HE1      PHE  28  -9.639  -7.116  -1.389
  215    HE2  PHE  28           HE2      PHE  28  -6.347  -9.457   0.071
  216    HZ   PHE  28           HZ       PHE  28  -8.739  -9.270  -0.555
  217    H    VAL  29           H        VAL  29  -3.381  -4.165   1.601
  218    HA   VAL  29           HA       VAL  29  -2.278  -1.772   0.267
  219    HB   VAL  29           HB       VAL  29  -2.271  -2.304   3.251
  220   HG11  VAL  29          HG11      VAL  29  -0.188  -1.243   2.684
  221   HG12  VAL  29          HG12      VAL  29  -1.241   0.022   3.315
  222   HG13  VAL  29          HG13      VAL  29  -0.990  -0.130   1.575
  223   HG21  VAL  29          HG21      VAL  29  -3.740  -0.439   3.459
  224   HG22  VAL  29          HG22      VAL  29  -4.413  -1.426   2.161
  225   HG23  VAL  29          HG23      VAL  29  -3.498   0.031   1.778
  226    H    HIS  30           H        HIS  30  -0.167  -1.963  -0.307
  227    HA   HIS  30           HA       HIS  30   1.236  -4.438   0.498
  228    HB2  HIS  30           HB2      HIS  30   1.497  -2.707  -1.963
  229    HB3  HIS  30           HB3      HIS  30   2.590  -4.038  -1.581
  230    HD2  HIS  30           HD2      HIS  30   1.564  -6.587  -2.146
  231    HE1  HIS  30           HE1      HIS  30  -2.300  -5.341  -3.306
  232    HE2  HIS  30           HE2      HIS  30  -0.719  -7.325  -3.176
  233    H    HIS  31           H        HIS  31   3.384  -4.373   1.090
  234    HA   HIS  31           HA       HIS  31   4.234  -2.169   2.652
  235    HB2  HIS  31           HB2      HIS  31   4.923  -4.548   3.016
  236    HB3  HIS  31           HB3      HIS  31   5.937  -4.433   1.579
  237    HD2  HIS  31           HD2      HIS  31   6.035  -3.374   5.331
  238    HE1  HIS  31           HE1      HIS  31   9.497  -1.816   3.490
  239    HE2  HIS  31           HE2      HIS  31   8.335  -2.206   5.712
  240    H    SER  32           H        SER  32   5.260  -3.332  -0.534
  241    HA   SER  32           HA       SER  32   7.344  -1.530  -1.003
  242    HB2  SER  32           HB2      SER  32   5.504  -2.934  -2.937
  243    HB3  SER  32           HB3      SER  32   6.952  -2.054  -3.418
  244    HG   SER  32           HG       SER  32   6.670  -4.480  -2.101
  245    H    GLU  33           H        GLU  33   3.939  -0.908  -1.053
  246    HA   GLU  33           HA       GLU  33   3.926   1.235  -2.927
  247    HB2  GLU  33           HB2      GLU  33   2.039   0.457  -0.707
  248    HB3  GLU  33           HB3      GLU  33   1.739   1.818  -1.789
  249    HG2  GLU  33           HG2      GLU  33   1.737   0.380  -3.722
  250    HG3  GLU  33           HG3      GLU  33   2.303  -0.988  -2.775
  251    H    ILE  34           H        ILE  34   4.812   1.090   0.455
  252    HA   ILE  34           HA       ILE  34   4.405   3.787   1.147
  253    HB   ILE  34           HB       ILE  34   4.865   2.006   2.789
  254   HG12  ILE  34          HG12      ILE  34   7.039   4.101   3.010
  255   HG13  ILE  34          HG13      ILE  34   5.338   4.510   3.197
  256   HG21  ILE  34          HG21      ILE  34   6.831   0.810   2.907
  257   HG22  ILE  34          HG22      ILE  34   7.821   2.146   2.323
  258   HG23  ILE  34          HG23      ILE  34   6.892   1.177   1.184
  259   HD11  ILE  34          HD11      ILE  34   6.670   3.931   5.339
  260   HD12  ILE  34          HD12      ILE  34   6.580   2.260   4.781
  261   HD13  ILE  34          HD13      ILE  34   5.100   3.158   5.122
  262    H    GLN  35           H        GLN  35   5.548   5.615   0.876
  263    HA   GLN  35           HA       GLN  35   8.139   5.476  -0.539
  264    HB2  GLN  35           HB2      GLN  35   5.814   7.312  -1.167
  265    HB3  GLN  35           HB3      GLN  35   7.431   7.479  -1.847
  266    HG2  GLN  35           HG2      GLN  35   7.263   5.213  -2.811
  267    HG3  GLN  35           HG3      GLN  35   5.645   5.045  -2.134
  268   HE21  GLN  35          HE21      GLN  35   4.349   5.091  -4.015
  269   HE22  GLN  35          HE22      GLN  35   4.363   6.363  -5.140
  270    H    SER  36           H        SER  36   9.540   7.267  -0.173
  271    HA   SER  36           HA       SER  36  10.613   8.807   1.147
  272    HB2  SER  36           HB2      SER  36   8.672  10.202   0.370
  273    HB3  SER  36           HB3      SER  36   7.815   9.748   1.840
  274    HG   SER  36           HG       SER  36   8.878  11.310   2.746
  275    H    GLY  37           H        GLY  37  10.096   9.899   3.635
  276    HA2  GLY  37           HA2      GLY  37   9.863   9.439   5.907
  277    HA3  GLY  37           HA3      GLY  37   9.238   7.845   5.495
  278    H    GLY  38           H        GLY  38  10.613   7.031   7.210
  279    HA2  GLY  38           HA2      GLY  38  13.450   7.264   7.164
  280    HA3  GLY  38           HA3      GLY  38  12.524   6.060   8.058
  281    H    GLU  39           H        GLU  39  14.956   5.472   6.788
  282    HA   GLU  39           HA       GLU  39  14.733   4.394   4.198
  283    HB2  GLU  39           HB2      GLU  39  16.884   4.815   5.368
  284    HB3  GLU  39           HB3      GLU  39  16.532   3.476   6.459
  285    HG2  GLU  39           HG2      GLU  39  16.511   1.909   4.575
  286    HG3  GLU  39           HG3      GLU  39  16.773   3.235   3.444
  287    H    TYR  40           H        TYR  40  14.216   2.938   7.401
  288    HA   TYR  40           HA       TYR  40  12.963   0.603   6.072
  289    HB2  TYR  40           HB2      TYR  40  14.338   0.765   8.764
  290    HB3  TYR  40           HB3      TYR  40  13.480  -0.650   8.158
  291    HD1  TYR  40           HD1      TYR  40  16.509   1.388   7.901
  292    HD2  TYR  40           HD2      TYR  40  14.328  -1.889   6.184
  293    HE1  TYR  40           HE1      TYR  40  18.541   0.681   6.666
  294    HE2  TYR  40           HE2      TYR  40  16.358  -2.596   4.950
  295    HH   TYR  40           HH       TYR  40  18.692  -0.983   4.175
  296    H    ALA  41           H        ALA  41  10.825   0.740   6.155
  297    HA   ALA  41           HA       ALA  41   9.524   2.149   8.382
  298    HB1  ALA  41           HB1      ALA  41   8.035   1.021   6.043
  299    HB2  ALA  41           HB2      ALA  41   9.018   2.468   5.822
  300    HB3  ALA  41           HB3      ALA  41   7.699   2.468   6.992
  301    H    THR  42           H        THR  42   8.465   1.107   9.956
  302    HA   THR  42           HA       THR  42   8.052  -1.808   9.671
  303    HB   THR  42           HB       THR  42   8.392  -0.149  12.192
  304    HG1  THR  42           HG1      THR  42  10.418  -1.074  12.239
  305   HG21  THR  42          HG21      THR  42   7.026  -2.124  12.615
  306   HG22  THR  42          HG22      THR  42   8.643  -2.401  13.263
  307   HG23  THR  42          HG23      THR  42   8.168  -3.140  11.735
  308    H    LEU  43           H        LEU  43   6.054  -2.601   9.801
  309    HA   LEU  43           HA       LEU  43   3.891  -0.964  10.934
  310    HB2  LEU  43           HB2      LEU  43   3.821  -2.288   8.212
  311    HB3  LEU  43           HB3      LEU  43   2.409  -1.642   9.040
  312    HG   LEU  43           HG       LEU  43   3.985   0.552   9.188
  313   HD11  LEU  43          HD11      LEU  43   4.812  -0.643   6.530
  314   HD12  LEU  43          HD12      LEU  43   5.837  -0.729   7.961
  315   HD13  LEU  43          HD13      LEU  43   5.399   0.838   7.286
  316   HD21  LEU  43          HD21      LEU  43   2.904   1.331   7.061
  317   HD22  LEU  43          HD22      LEU  43   1.776   0.558   8.173
  318   HD23  LEU  43          HD23      LEU  43   2.373  -0.327   6.770
  319    H    ALA  44           H        ALA  44   2.223  -2.163  11.862
  320    HA   ALA  44           HA       ALA  44   2.354  -5.088  11.755
  321    HB1  ALA  44           HB1      ALA  44   2.364  -3.706  14.438
  322    HB2  ALA  44           HB2      ALA  44   3.866  -4.134  13.621
  323    HB3  ALA  44           HB3      ALA  44   2.716  -5.394  14.070
  324    H    ASP  45           H        ASP  45   0.579  -5.174  14.228
  325    HA   ASP  45           HA       ASP  45  -1.932  -4.714  12.844
  326    HB2  ASP  45           HB2      ASP  45  -1.546  -6.793  14.123
  327    HB3  ASP  45           HB3      ASP  45  -1.354  -5.850  15.593
  328    H    GLY  46           H        GLY  46  -2.758  -2.707  12.890
  329    HA2  GLY  46           HA2      GLY  46  -4.038  -1.103  14.156
  330    HA3  GLY  46           HA3      GLY  46  -2.914  -1.314  15.488
  331    H    GLN  47           H        GLN  47  -1.090  -1.166  12.693
  332    HA   GLN  47           HA       GLN  47   0.053   1.348  13.302
  333    HB2  GLN  47           HB2      GLN  47   1.186  -0.527  12.081
  334    HB3  GLN  47           HB3      GLN  47   0.183  -0.160  10.678
  335    HG2  GLN  47           HG2      GLN  47   2.354   0.931  10.435
  336    HG3  GLN  47           HG3      GLN  47   1.103   2.147  10.655
  337   HE21  GLN  47          HE21      GLN  47   1.890   3.784  11.985
  338   HE22  GLN  47          HE22      GLN  47   2.857   3.543  13.358
  339    H    THR  48           H        THR  48  -0.511   3.361  12.733
  340    HA   THR  48           HA       THR  48  -2.895   3.771  11.094
  341    HB   THR  48           HB       THR  48  -1.168   5.776  12.587
  342    HG1  THR  48           HG1      THR  48  -2.359   5.323  14.266
  343   HG21  THR  48          HG21      THR  48  -3.997   6.031  11.520
  344   HG22  THR  48          HG22      THR  48  -2.575   6.719  10.738
  345   HG23  THR  48          HG23      THR  48  -3.062   7.286  12.335
  346    H    VAL  49           H        VAL  49  -2.845   4.312   8.997
  347    HA   VAL  49           HA       VAL  49  -0.450   5.638   7.917
  348    HB   VAL  49           HB       VAL  49  -0.391   4.108   5.974
  349   HG11  VAL  49          HG11      VAL  49   0.758   2.325   7.096
  350   HG12  VAL  49          HG12      VAL  49  -0.178   2.570   8.572
  351   HG13  VAL  49          HG13      VAL  49   1.005   3.777   8.066
  352   HG21  VAL  49          HG21      VAL  49  -2.481   2.607   7.579
  353   HG22  VAL  49          HG22      VAL  49  -1.582   1.895   6.240
  354   HG23  VAL  49          HG23      VAL  49  -2.657   3.261   5.951
  355    H    GLU  50           H        GLU  50  -0.774   6.347   5.638
  356    HA   GLU  50           HA       GLU  50  -3.548   7.307   5.232
  357    HB2  GLU  50           HB2      GLU  50  -0.949   8.547   4.262
  358    HB3  GLU  50           HB3      GLU  50  -2.565   9.196   4.003
  359    HG2  GLU  50           HG2      GLU  50  -2.853   9.439   6.449
  360    HG3  GLU  50           HG3      GLU  50  -1.231   8.806   6.700
  361    H    TYR  51           H        TYR  51  -4.486   6.873   3.245
  362    HA   TYR  51           HA       TYR  51  -2.861   5.870   1.046
  363    HB2  TYR  51           HB2      TYR  51  -4.112   3.754   0.850
  364    HB3  TYR  51           HB3      TYR  51  -3.215   3.836   2.359
  365    HD1  TYR  51           HD1      TYR  51  -6.551   3.894   0.812
  366    HD2  TYR  51           HD2      TYR  51  -4.375   4.132   4.508
  367    HE1  TYR  51           HE1      TYR  51  -8.659   3.558   2.075
  368    HE2  TYR  51           HE2      TYR  51  -6.482   3.793   5.771
  369    HH   TYR  51           HH       TYR  51  -8.901   4.104   5.424
  370    H    GLU  52           H        GLU  52  -4.110   5.420  -0.895
  371    HA   GLU  52           HA       GLU  52  -6.636   6.958  -1.027
  372    HB2  GLU  52           HB2      GLU  52  -4.381   6.851  -3.044
  373    HB3  GLU  52           HB3      GLU  52  -5.966   7.550  -3.370
  374    HG2  GLU  52           HG2      GLU  52  -5.661   9.136  -1.508
  375    HG3  GLU  52           HG3      GLU  52  -4.085   8.433  -1.161
  376    H    VAL  53           H        VAL  53  -8.308   5.906  -1.906
  377    HA   VAL  53           HA       VAL  53  -8.251   3.133  -2.354
  378    HB   VAL  53           HB       VAL  53 -10.279   4.396  -1.715
  379   HG11  VAL  53          HG11      VAL  53 -11.498   5.742  -3.314
  380   HG12  VAL  53          HG12      VAL  53 -10.341   5.355  -4.588
  381   HG13  VAL  53          HG13      VAL  53  -9.848   6.357  -3.223
  382   HG21  VAL  53          HG21      VAL  53 -10.611   2.956  -4.364
  383   HG22  VAL  53          HG22      VAL  53 -11.855   3.183  -3.135
  384   HG23  VAL  53          HG23      VAL  53 -10.460   2.157  -2.799
  385    H    GLY  54           H        GLY  54  -8.488   1.914  -4.236
  386    HA2  GLY  54           HA2      GLY  54  -7.947   3.178  -6.828
  387    HA3  GLY  54           HA3      GLY  54  -6.809   1.958  -6.254
  388    H    GLN  55           H        GLN  55  -8.206   1.569  -8.624
  389    HA   GLN  55           HA       GLN  55 -10.399  -0.279  -7.974
  390    HB2  GLN  55           HB2      GLN  55  -9.474   0.953 -10.575
  391    HB3  GLN  55           HB3      GLN  55 -10.744  -0.271 -10.471
  392    HG2  GLN  55           HG2      GLN  55 -12.102   1.160  -9.075
  393    HG3  GLN  55           HG3      GLN  55 -10.802   2.339  -8.932
  394   HE21  GLN  55          HE21      GLN  55 -13.570   2.680 -10.101
  395   HE22  GLN  55          HE22      GLN  55 -13.314   3.236 -11.683
  396    H    GLY  56           H        GLY  56 -10.328  -2.424  -8.379
  397    HA2  GLY  56           HA2      GLY  56  -8.024  -3.585  -9.783
  398    HA3  GLY  56           HA3      GLY  56  -8.309  -4.085  -8.118
  399    H    GLN  57           H        GLN  57  -8.382  -5.761 -10.475
  400    HA   GLN  57           HA       GLN  57 -11.011  -6.300 -11.358
  401    HB2  GLN  57           HB2      GLN  57  -8.536  -8.027 -11.230
  402    HB3  GLN  57           HB3      GLN  57 -10.040  -8.540 -11.996
  403    HG2  GLN  57           HG2      GLN  57  -9.954  -6.579 -13.489
  404    HG3  GLN  57           HG3      GLN  57  -8.453  -6.063 -12.721
  405   HE21  GLN  57          HE21      GLN  57  -6.953  -6.403 -14.418
  406   HE22  GLN  57          HE22      GLN  57  -6.707  -7.906 -15.169
  407    H    LYS  58           H        LYS  58  -9.094  -7.648  -8.689
  408    HA   LYS  58           HA       LYS  58 -11.255  -9.427  -7.888
  409    HB2  LYS  58           HB2      LYS  58  -8.540  -8.854  -6.689
  410    HB3  LYS  58           HB3      LYS  58  -9.684 -10.025  -6.031
  411    HG2  LYS  58           HG2      LYS  58  -9.681 -11.237  -8.185
  412    HG3  LYS  58           HG3      LYS  58  -8.527 -10.074  -8.834
  413    HD2  LYS  58           HD2      LYS  58  -6.891 -10.711  -7.112
  414    HD3  LYS  58           HD3      LYS  58  -8.047 -11.850  -6.421
  415    HE2  LYS  58           HE2      LYS  58  -6.485 -13.052  -7.869
  416    HE3  LYS  58           HE3      LYS  58  -8.094 -13.072  -8.591
  417    HZ1  LYS  58           HZ1      LYS  58  -6.235 -10.908  -9.291
  418    HZ2  LYS  58           HZ2      LYS  58  -7.492 -11.590 -10.210
  419    HZ3  LYS  58           HZ3      LYS  58  -6.029 -12.432 -10.009
  420    H    GLY  59           H        GLY  59 -10.139  -6.243  -7.128
  421    HA2  GLY  59           HA2      GLY  59 -12.323  -5.349  -5.746
  422    HA3  GLY  59           HA3      GLY  59 -11.309  -6.067  -4.498
  423    HA   PRO  60           HA       PRO  60  -9.825  -1.684  -5.566
  424    HB2  PRO  60           HB2      PRO  60 -10.392  -0.392  -3.251
  425    HB3  PRO  60           HB3      PRO  60 -11.576  -0.553  -4.566
  426    HG2  PRO  60           HG2      PRO  60 -11.303  -2.160  -2.065
  427    HG3  PRO  60           HG3      PRO  60 -12.758  -1.473  -2.809
  428    HD2  PRO  60           HD2      PRO  60 -12.067  -4.092  -3.116
  429    HD3  PRO  60           HD3      PRO  60 -12.918  -3.182  -4.385
  430    H    CYS  61           H        CYS  61  -7.936  -0.700  -4.821
  431    HA   CYS  61           HA       CYS  61  -6.469  -2.098  -2.665
  432    HB2  CYS  61           HB2      CYS  61  -5.352  -1.073  -5.289
  433    HB3  CYS  61           HB3      CYS  61  -4.410  -1.793  -3.984
  434    HG   CYS  61           HG       CYS  61  -5.410  -3.473  -6.030
  435    H    ALA  62           H        ALA  62  -4.529  -0.686  -1.942
  436    HA   ALA  62           HA       ALA  62  -5.300   2.166  -1.953
  437    HB1  ALA  62           HB1      ALA  62  -5.072   0.339   0.299
  438    HB2  ALA  62           HB2      ALA  62  -5.687   1.990   0.257
  439    HB3  ALA  62           HB3      ALA  62  -3.962   1.700   0.471
  440    H    ASN  63           H        ASN  63  -3.629   3.616  -2.206
  441    HA   ASN  63           HA       ASN  63  -0.885   2.517  -2.350
  442    HB2  ASN  63           HB2      ASN  63  -0.486   3.943  -4.334
  443    HB3  ASN  63           HB3      ASN  63  -1.723   2.724  -4.631
  444   HD21  ASN  63          HD21      ASN  63  -3.255   3.702  -5.972
  445   HD22  ASN  63          HD22      ASN  63  -3.925   5.239  -5.708
  446    H    LYS  64           H        LYS  64   0.677   4.545  -2.675
  447    HA   LYS  64           HA       LYS  64   1.683   6.310  -1.612
  448    HB2  LYS  64           HB2      LYS  64  -1.189   7.272  -1.507
  449    HB3  LYS  64           HB3      LYS  64   0.209   8.269  -1.100
  450    HG2  LYS  64           HG2      LYS  64   1.124   7.909  -3.365
  451    HG3  LYS  64           HG3      LYS  64  -0.275   6.915  -3.773
  452    HD2  LYS  64           HD2      LYS  64  -1.763   8.840  -3.366
  453    HD3  LYS  64           HD3      LYS  64  -0.365   9.837  -2.963
  454    HE2  LYS  64           HE2      LYS  64   0.548   9.483  -5.224
  455    HE3  LYS  64           HE3      LYS  64  -0.841   8.476  -5.631
  456    HZ1  LYS  64           HZ1      LYS  64  -1.011  10.834  -6.365
  457    HZ2  LYS  64           HZ2      LYS  64  -1.063  11.293  -4.731
  458    HZ3  LYS  64           HZ3      LYS  64  -2.292  10.317  -5.382
  459    H    VAL  65           H        VAL  65   1.523   4.172  -0.049
  460    HA   VAL  65           HA       VAL  65   0.167   4.575   2.434
  461    HB   VAL  65           HB       VAL  65   2.491   2.747   1.742
  462   HG11  VAL  65          HG11      VAL  65   0.564   2.691   4.090
  463   HG12  VAL  65          HG12      VAL  65   2.276   3.101   4.177
  464   HG13  VAL  65          HG13      VAL  65   1.781   1.466   3.737
  465   HG21  VAL  65          HG21      VAL  65   0.374   2.406   0.424
  466   HG22  VAL  65          HG22      VAL  65  -0.474   2.136   1.946
  467   HG23  VAL  65          HG23      VAL  65   0.801   1.028   1.440
  468    H    VAL  66           H        VAL  66   0.683   5.950   3.947
  469    HA   VAL  66           HA       VAL  66   3.520   6.719   4.349
  470    HB   VAL  66           HB       VAL  66   1.107   8.551   4.563
  471   HG11  VAL  66          HG11      VAL  66   4.067   9.100   4.942
  472   HG12  VAL  66          HG12      VAL  66   2.840   9.118   6.210
  473   HG13  VAL  66          HG13      VAL  66   2.800  10.327   4.926
  474   HG21  VAL  66          HG21      VAL  66   3.404   8.481   2.579
  475   HG22  VAL  66          HG22      VAL  66   2.157   9.726   2.647
  476   HG23  VAL  66          HG23      VAL  66   1.725   8.069   2.230
  477    H    ALA  67           H        ALA  67   4.237   6.248   6.323
  478    HA   ALA  67           HA       ALA  67   2.478   5.245   8.360
  479    HB1  ALA  67           HB1      ALA  67   4.773   4.374   8.028
  480    HB2  ALA  67           HB2      ALA  67   4.513   4.951   9.674
  481    HB3  ALA  67           HB3      ALA  67   5.420   5.937   8.528
  482    H    VAL  68           H        VAL  68   1.667   6.242  10.107
  483    HA   VAL  68           HA       VAL  68   2.737   8.780  11.037
  484    HB   VAL  68           HB       VAL  68   1.204   9.452   9.217
  485   HG11  VAL  68          HG11      VAL  68  -0.315   7.473   9.388
  486   HG12  VAL  68          HG12      VAL  68  -1.182   9.009   9.352
  487   HG13  VAL  68          HG13      VAL  68  -0.973   8.150  10.879
  488   HG21  VAL  68          HG21      VAL  68  -0.064  10.091  11.891
  489   HG22  VAL  68          HG22      VAL  68   0.008  11.113  10.456
  490   HG23  VAL  68          HG23      VAL  68   1.475  10.785  11.379
  Start of MODEL    3
    1    H1   MET   1           HT1      MET   1  -8.454  13.514   0.746
    2    H2   MET   1           HT2      MET   1  -7.084  14.252   0.064
    3    H3   MET   1           HT3      MET   1  -7.458  14.496   1.703
    4    HA   MET   1           HA       MET   1  -6.333  12.120   0.382
    5    HB2  MET   1           HB2      MET   1  -5.731  13.749   2.862
    6    HB3  MET   1           HB3      MET   1  -4.936  12.214   2.508
    7    HG2  MET   1           HG2      MET   1  -4.120  13.111   0.368
    8    HG3  MET   1           HG3      MET   1  -4.944  14.638   0.683
    9    HE1  MET   1           HE1      MET   1  -1.190  15.526   1.053
   10    HE2  MET   1           HE2      MET   1  -2.666  15.666   0.100
   11    HE3  MET   1           HE3      MET   1  -1.743  14.165   0.066
   12    H    SER   2           H        SER   2  -6.011  10.309   2.091
   13    HA   SER   2           HA       SER   2  -8.279   9.975   3.902
   14    HB2  SER   2           HB2      SER   2  -9.155   9.135   1.774
   15    HB3  SER   2           HB3      SER   2  -7.754   8.083   1.597
   16    HG   SER   2           HG       SER   2 -10.015   7.751   3.064
   17    H    LYS   3           H        LYS   3  -7.923   8.454   5.508
   18    HA   LYS   3           HA       LYS   3  -5.570   6.757   5.471
   19    HB2  LYS   3           HB2      LYS   3  -4.575   7.731   7.506
   20    HB3  LYS   3           HB3      LYS   3  -4.583   8.888   6.179
   21    HG2  LYS   3           HG2      LYS   3  -6.639   9.921   7.113
   22    HG3  LYS   3           HG3      LYS   3  -6.584   8.778   8.458
   23    HD2  LYS   3           HD2      LYS   3  -4.408   9.652   9.157
   24    HD3  LYS   3           HD3      LYS   3  -4.380  10.744   7.772
   25    HE2  LYS   3           HE2      LYS   3  -5.107  11.968   9.758
   26    HE3  LYS   3           HE3      LYS   3  -6.450  11.834   8.626
   27    HZ1  LYS   3           HZ1      LYS   3  -6.054   9.840  10.767
   28    HZ2  LYS   3           HZ2      LYS   3  -7.471  10.207   9.903
   29    HZ3  LYS   3           HZ3      LYS   3  -6.879  11.292  11.069
   30    H    GLY   4           H        GLY   4  -5.707   5.066   6.890
   31    HA2  GLY   4           HA2      GLY   4  -7.992   5.004   8.761
   32    HA3  GLY   4           HA3      GLY   4  -7.742   3.690   7.615
   33    H    ILE   5           H        ILE   5  -7.646   2.360   9.591
   34    HA   ILE   5           HA       ILE   5  -4.928   2.430  10.777
   35    HB   ILE   5           HB       ILE   5  -5.956   1.256  12.762
   36   HG12  ILE   5          HG12      ILE   5  -8.595   2.312  11.708
   37   HG13  ILE   5          HG13      ILE   5  -8.087   0.651  11.422
   38   HG21  ILE   5          HG21      ILE   5  -6.912   4.050  12.070
   39   HG22  ILE   5          HG22      ILE   5  -5.386   3.626  12.847
   40   HG23  ILE   5          HG23      ILE   5  -6.912   3.365  13.694
   41   HD11  ILE   5          HD11      ILE   5  -9.535   0.921  13.458
   42   HD12  ILE   5          HD12      ILE   5  -8.264   1.915  14.172
   43   HD13  ILE   5          HD13      ILE   5  -7.957   0.218  13.808
   44    H    VAL   6           H        VAL   6  -3.720   0.707  10.521
   45    HA   VAL   6           HA       VAL   6  -4.551  -1.381   8.785
   46    HB   VAL   6           HB       VAL   6  -2.045  -1.148  10.480
   47   HG11  VAL   6          HG11      VAL   6  -1.143  -2.705   8.644
   48   HG12  VAL   6          HG12      VAL   6  -2.828  -3.014   8.226
   49   HG13  VAL   6          HG13      VAL   6  -2.226  -3.439   9.827
   50   HG21  VAL   6          HG21      VAL   6  -2.383  -0.587   7.521
   51   HG22  VAL   6          HG22      VAL   6  -1.012  -0.177   8.552
   52   HG23  VAL   6          HG23      VAL   6  -2.547   0.673   8.743
   53    H    LYS   7           H        LYS   7  -5.622  -3.140   9.245
   54    HA   LYS   7           HA       LYS   7  -6.370  -3.924  11.880
   55    HB2  LYS   7           HB2      LYS   7  -7.722  -4.447   9.852
   56    HB3  LYS   7           HB3      LYS   7  -6.454  -5.545   9.311
   57    HG2  LYS   7           HG2      LYS   7  -6.760  -6.916  11.335
   58    HG3  LYS   7           HG3      LYS   7  -8.008  -5.810  11.905
   59    HD2  LYS   7           HD2      LYS   7  -9.392  -6.317   9.943
   60    HD3  LYS   7           HD3      LYS   7  -8.133  -7.380   9.314
   61    HE2  LYS   7           HE2      LYS   7  -9.847  -8.718  10.435
   62    HE3  LYS   7           HE3      LYS   7  -8.341  -8.793  11.352
   63    HZ1  LYS   7           HZ1      LYS   7 -10.370  -6.748  11.981
   64    HZ2  LYS   7           HZ2      LYS   7  -9.163  -7.404  12.982
   65    HZ3  LYS   7           HZ3      LYS   7 -10.535  -8.324  12.585
   66    H    TRP   8           H        TRP   8  -4.046  -5.157   9.509
   67    HA   TRP   8           HA       TRP   8  -2.248  -6.095  11.560
   68    HB2  TRP   8           HB2      TRP   8  -4.067  -7.908  11.252
   69    HB3  TRP   8           HB3      TRP   8  -3.339  -8.189   9.672
   70    HD1  TRP   8           HD1      TRP   8  -0.589  -8.720   9.770
   71    HE1  TRP   8           HE1      TRP   8   0.680 -10.171  11.482
   72    HE3  TRP   8           HE3      TRP   8  -3.996  -8.785  13.573
   73    HZ2  TRP   8           HZ2      TRP   8   0.298 -11.228  14.114
   74    HZ3  TRP   8           HZ3      TRP   8  -3.521 -10.022  15.666
   75    HH2  TRP   8           HH2      TRP   8  -1.380 -11.244  15.941
   76    H    PHE   9           H        PHE   9  -0.232  -5.754  10.775
   77    HA   PHE   9           HA       PHE   9   0.082  -5.573   7.826
   78    HB2  PHE   9           HB2      PHE   9   0.651  -3.554   9.286
   79    HB3  PHE   9           HB3      PHE   9   2.010  -4.505   9.897
   80    HD1  PHE   9           HD1      PHE   9   0.628  -2.701   7.028
   81    HD2  PHE   9           HD2      PHE   9   3.834  -5.222   8.375
   82    HE1  PHE   9           HE1      PHE   9   1.933  -2.123   5.000
   83    HE2  PHE   9           HE2      PHE   9   5.138  -4.640   6.348
   84    HZ   PHE   9           HZ       PHE   9   4.190  -3.093   4.661
   85    H    ASN  10           H        ASN  10   1.019  -7.288   6.885
   86    HA   ASN  10           HA       ASN  10   2.934  -8.897   8.480
   87    HB2  ASN  10           HB2      ASN  10   1.232  -9.776   6.134
   88    HB3  ASN  10           HB3      ASN  10   2.333 -10.796   7.055
   89   HD21  ASN  10          HD21      ASN  10   1.748 -11.252   9.335
   90   HD22  ASN  10          HD22      ASN  10   0.131 -11.118   9.834
   91    H    SER  11           H        SER  11   4.716  -7.513   7.879
   92    HA   SER  11           HA       SER  11   5.436  -6.883   5.241
   93    HB2  SER  11           HB2      SER  11   7.651  -6.421   6.167
   94    HB3  SER  11           HB3      SER  11   6.401  -5.795   7.235
   95    HG   SER  11           HG       SER  11   8.305  -7.607   7.739
   96    H    ASP  12           H        ASP  12   6.042  -9.753   7.205
   97    HA   ASP  12           HA       ASP  12   8.056 -10.947   5.638
   98    HB2  ASP  12           HB2      ASP  12   5.881 -12.155   7.361
   99    HB3  ASP  12           HB3      ASP  12   7.144 -13.115   6.595
  100    H    LYS  13           H        LYS  13   4.522 -11.105   5.447
  101    HA   LYS  13           HA       LYS  13   4.494 -12.830   3.138
  102    HB2  LYS  13           HB2      LYS  13   2.311 -11.124   4.369
  103    HB3  LYS  13           HB3      LYS  13   2.071 -12.330   3.110
  104    HG2  LYS  13           HG2      LYS  13   3.296 -12.984   5.801
  105    HG3  LYS  13           HG3      LYS  13   1.568 -13.126   5.470
  106    HD2  LYS  13           HD2      LYS  13   2.071 -14.702   3.615
  107    HD3  LYS  13           HD3      LYS  13   3.790 -14.590   4.003
  108    HE2  LYS  13           HE2      LYS  13   2.857 -16.587   5.054
  109    HE3  LYS  13           HE3      LYS  13   3.289 -15.418   6.302
  110    HZ1  LYS  13           HZ1      LYS  13   0.571 -15.421   5.179
  111    HZ2  LYS  13           HZ2      LYS  13   1.103 -14.897   6.705
  112    HZ3  LYS  13           HZ3      LYS  13   0.987 -16.559   6.366
  113    H    GLY  14           H        GLY  14   4.729  -9.427   3.715
  114    HA2  GLY  14           HA2      GLY  14   5.442  -7.820   2.148
  115    HA3  GLY  14           HA3      GLY  14   4.965  -8.902   0.847
  116    H    PHE  15           H        PHE  15   2.489  -8.720   3.155
  117    HA   PHE  15           HA       PHE  15   1.264  -6.292   2.169
  118    HB2  PHE  15           HB2      PHE  15  -0.740  -7.386   1.248
  119    HB3  PHE  15           HB3      PHE  15   0.707  -7.790   0.330
  120    HD1  PHE  15           HD1      PHE  15  -1.804  -9.045   2.735
  121    HD2  PHE  15           HD2      PHE  15   1.607 -10.041   0.322
  122    HE1  PHE  15           HE1      PHE  15  -2.261 -11.458   3.085
  123    HE2  PHE  15           HE2      PHE  15   1.153 -12.453   0.675
  124    HZ   PHE  15           HZ       PHE  15  -0.780 -13.162   2.056
  125    H    GLY  16           H        GLY  16  -1.064  -6.137   3.034
  126    HA2  GLY  16           HA2      GLY  16  -1.628  -7.602   5.461
  127    HA3  GLY  16           HA3      GLY  16  -1.123  -5.937   5.738
  128    H    PHE  17           H        PHE  17  -3.538  -6.461   6.625
  129    HA   PHE  17           HA       PHE  17  -5.426  -5.467   4.569
  130    HB2  PHE  17           HB2      PHE  17  -5.958  -7.106   7.066
  131    HB3  PHE  17           HB3      PHE  17  -7.208  -6.448   6.011
  132    HD1  PHE  17           HD1      PHE  17  -4.546  -8.960   6.351
  133    HD2  PHE  17           HD2      PHE  17  -7.540  -7.322   3.744
  134    HE1  PHE  17           HE1      PHE  17  -4.330 -10.932   4.863
  135    HE2  PHE  17           HE2      PHE  17  -7.324  -9.294   2.256
  136    HZ   PHE  17           HZ       PHE  17  -5.716 -11.099   2.815
  137    H    ILE  18           H        ILE  18  -6.413  -3.541   4.947
  138    HA   ILE  18           HA       ILE  18  -5.896  -2.278   7.560
  139    HB   ILE  18           HB       ILE  18  -4.711  -1.191   5.706
  140   HG12  ILE  18          HG12      ILE  18  -6.995   0.614   6.534
  141   HG13  ILE  18          HG13      ILE  18  -5.756   0.097   7.681
  142   HG21  ILE  18          HG21      ILE  18  -6.197   0.081   4.035
  143   HG22  ILE  18          HG22      ILE  18  -7.501  -0.986   4.556
  144   HG23  ILE  18          HG23      ILE  18  -6.058  -1.661   3.802
  145   HD11  ILE  18          HD11      ILE  18  -5.147   2.265   6.692
  146   HD12  ILE  18          HD12      ILE  18  -5.259   1.571   5.075
  147   HD13  ILE  18          HD13      ILE  18  -4.006   1.018   6.184
  148    H    THR  19           H        THR  19  -7.469  -1.181   8.611
  149    HA   THR  19           HA       THR  19 -10.207  -1.838   7.828
  150    HB   THR  19           HB       THR  19  -9.130  -0.818  10.460
  151    HG1  THR  19           HG1      THR  19  -9.178  -2.923  11.082
  152   HG21  THR  19          HG21      THR  19 -11.832  -1.896   9.612
  153   HG22  THR  19          HG22      THR  19 -11.479  -0.297  10.266
  154   HG23  THR  19          HG23      THR  19 -11.341  -1.722  11.298
  155    HA   PRO  20           HA       PRO  20 -10.314   2.565   6.450
  156    HB2  PRO  20           HB2      PRO  20 -13.175   1.768   6.063
  157    HB3  PRO  20           HB3      PRO  20 -12.098   2.647   4.959
  158    HG2  PRO  20           HG2      PRO  20 -12.657   0.133   4.490
  159    HG3  PRO  20           HG3      PRO  20 -10.995   0.717   4.296
  160    HD2  PRO  20           HD2      PRO  20 -12.172  -0.888   6.547
  161    HD3  PRO  20           HD3      PRO  20 -10.584  -1.051   5.761
  162    H    GLU  21           H        GLU  21 -10.633   4.272   7.797
  163    HA   GLU  21           HA       GLU  21 -11.837   3.981  10.348
  164    HB2  GLU  21           HB2      GLU  21 -11.448   6.387  10.597
  165    HB3  GLU  21           HB3      GLU  21 -10.035   5.599   9.900
  166    HG2  GLU  21           HG2      GLU  21 -10.780   6.299   7.635
  167    HG3  GLU  21           HG3      GLU  21 -12.159   7.120   8.353
  168    H    ASP  22           H        ASP  22 -13.085   5.006   7.257
  169    HA   ASP  22           HA       ASP  22 -15.441   6.319   8.194
  170    HB2  ASP  22           HB2      ASP  22 -14.691   5.101   5.534
  171    HB3  ASP  22           HB3      ASP  22 -16.221   5.924   5.813
  172    H    GLY  23           H        GLY  23 -14.566   2.992   7.884
  173    HA2  GLY  23           HA2      GLY  23 -15.893   1.302   8.986
  174    HA3  GLY  23           HA3      GLY  23 -17.338   2.193   8.522
  175    H    SER  24           H        SER  24 -15.096   2.134   5.984
  176    HA   SER  24           HA       SER  24 -16.747   0.446   4.362
  177    HB2  SER  24           HB2      SER  24 -14.041   1.694   3.844
  178    HB3  SER  24           HB3      SER  24 -15.002   0.849   2.638
  179    HG   SER  24           HG       SER  24 -15.998   2.670   2.380
  180    H    LYS  25           H        LYS  25 -15.752  -1.350   3.073
  181    HA   LYS  25           HA       LYS  25 -14.855  -3.405   4.797
  182    HB2  LYS  25           HB2      LYS  25 -14.648  -4.764   2.753
  183    HB3  LYS  25           HB3      LYS  25 -16.172  -3.879   2.786
  184    HG2  LYS  25           HG2      LYS  25 -15.195  -2.150   1.305
  185    HG3  LYS  25           HG3      LYS  25 -13.678  -3.050   1.263
  186    HD2  LYS  25           HD2      LYS  25 -14.849  -4.982   0.269
  187    HD3  LYS  25           HD3      LYS  25 -16.366  -4.083   0.308
  188    HE2  LYS  25           HE2      LYS  25 -15.399  -2.371  -1.179
  189    HE3  LYS  25           HE3      LYS  25 -13.878  -3.261  -1.216
  190    HZ1  LYS  25           HZ1      LYS  25 -15.223  -3.767  -3.148
  191    HZ2  LYS  25           HZ2      LYS  25 -16.506  -4.273  -2.156
  192    HZ3  LYS  25           HZ3      LYS  25 -15.050  -5.146  -2.176
  193    H    ASP  26           H        ASP  26 -12.870  -4.591   4.756
  194    HA   ASP  26           HA       ASP  26 -10.567  -3.017   4.940
  195    HB2  ASP  26           HB2      ASP  26 -10.944  -5.999   4.669
  196    HB3  ASP  26           HB3      ASP  26  -9.370  -5.258   4.929
  197    H    LEU  27           H        LEU  27  -8.808  -2.707   3.646
  198    HA   LEU  27           HA       LEU  27  -9.093  -3.482   0.801
  199    HB2  LEU  27           HB2      LEU  27  -7.856  -0.972   1.960
  200    HB3  LEU  27           HB3      LEU  27  -7.905  -1.388   0.250
  201    HG   LEU  27           HG       LEU  27 -10.386  -1.085   1.974
  202   HD11  LEU  27          HD11      LEU  27 -10.652   1.096   0.786
  203   HD12  LEU  27          HD12      LEU  27  -9.044   0.881   0.094
  204   HD13  LEU  27          HD13      LEU  27  -9.236   1.066   1.837
  205   HD21  LEU  27          HD21      LEU  27  -9.931  -1.260  -1.025
  206   HD22  LEU  27          HD22      LEU  27 -11.482  -0.878  -0.280
  207   HD23  LEU  27          HD23      LEU  27 -10.742  -2.458  -0.018
  208    H    PHE  28           H        PHE  28  -7.180  -3.973  -0.353
  209    HA   PHE  28           HA       PHE  28  -5.144  -5.271   1.243
  210    HB2  PHE  28           HB2      PHE  28  -5.543  -4.963  -1.738
  211    HB3  PHE  28           HB3      PHE  28  -4.187  -5.837  -1.025
  212    HD1  PHE  28           HD1      PHE  28  -7.829  -5.815  -1.563
  213    HD2  PHE  28           HD2      PHE  28  -4.522  -7.943   0.167
  214    HE1  PHE  28           HE1      PHE  28  -9.259  -7.824  -1.300
  215    HE2  PHE  28           HE2      PHE  28  -5.954  -9.951   0.432
  216    HZ   PHE  28           HZ       PHE  28  -8.321  -9.893  -0.303
  217    H    VAL  29           H        VAL  29  -3.163  -4.549   1.716
  218    HA   VAL  29           HA       VAL  29  -2.148  -2.122   0.363
  219    HB   VAL  29           HB       VAL  29  -2.107  -2.689   3.339
  220   HG11  VAL  29          HG11      VAL  29  -1.087  -0.252   1.855
  221   HG12  VAL  29          HG12      VAL  29  -0.048  -1.536   2.472
  222   HG13  VAL  29          HG13      VAL  29  -0.985  -0.548   3.591
  223   HG21  VAL  29          HG21      VAL  29  -3.394  -0.331   1.976
  224   HG22  VAL  29          HG22      VAL  29  -3.675  -0.947   3.602
  225   HG23  VAL  29          HG23      VAL  29  -4.275  -1.839   2.205
  226    H    HIS  30           H        HIS  30  -0.038  -2.250  -0.251
  227    HA   HIS  30           HA       HIS  30   1.482  -4.645   0.576
  228    HB2  HIS  30           HB2      HIS  30   1.639  -2.954  -1.923
  229    HB3  HIS  30           HB3      HIS  30   2.797  -4.225  -1.524
  230    HD2  HIS  30           HD2      HIS  30  -0.817  -3.888  -2.933
  231    HE1  HIS  30           HE1      HIS  30  -0.040  -8.007  -2.438
  232    HE2  HIS  30           HE2      HIS  30  -1.659  -6.312  -3.414
  233    H    HIS  31           H        HIS  31   3.583  -4.475   1.233
  234    HA   HIS  31           HA       HIS  31   4.330  -2.170   2.699
  235    HB2  HIS  31           HB2      HIS  31   5.068  -4.491   3.227
  236    HB3  HIS  31           HB3      HIS  31   6.109  -4.453   1.802
  237    HD2  HIS  31           HD2      HIS  31   6.075  -3.080   5.461
  238    HE1  HIS  31           HE1      HIS  31   9.598  -1.677   3.611
  239    HE2  HIS  31           HE2      HIS  31   8.358  -1.870   5.818
  240    H    SER  32           H        SER  32   5.554  -3.459  -0.385
  241    HA   SER  32           HA       SER  32   7.574  -1.557  -0.810
  242    HB2  SER  32           HB2      SER  32   7.555  -2.325  -3.125
  243    HB3  SER  32           HB3      SER  32   7.413  -3.689  -2.020
  244    HG   SER  32           HG       SER  32   5.304  -3.886  -2.524
  245    H    GLU  33           H        GLU  33   4.144  -1.226  -1.233
  246    HA   GLU  33           HA       GLU  33   4.206   0.819  -3.222
  247    HB2  GLU  33           HB2      GLU  33   2.087  -0.073  -1.273
  248    HB3  GLU  33           HB3      GLU  33   1.829   1.231  -2.430
  249    HG2  GLU  33           HG2      GLU  33   2.386  -0.289  -4.288
  250    HG3  GLU  33           HG3      GLU  33   2.667  -1.596  -3.142
  251    H    ILE  34           H        ILE  34   5.000   0.968   0.112
  252    HA   ILE  34           HA       ILE  34   3.985   3.462   0.852
  253    HB   ILE  34           HB       ILE  34   5.774   3.587   2.514
  254   HG12  ILE  34          HG12      ILE  34   6.974   1.125   1.200
  255   HG13  ILE  34          HG13      ILE  34   7.587   2.745   0.923
  256   HG21  ILE  34          HG21      ILE  34   3.977   2.159   3.131
  257   HG22  ILE  34          HG22      ILE  34   5.436   1.235   3.487
  258   HG23  ILE  34          HG23      ILE  34   4.506   0.885   2.031
  259   HD11  ILE  34          HD11      ILE  34   8.840   1.534   2.715
  260   HD12  ILE  34          HD12      ILE  34   7.349   1.458   3.657
  261   HD13  ILE  34          HD13      ILE  34   8.084   3.020   3.292
  262    H    GLN  35           H        GLN  35   4.542   5.545   0.537
  263    HA   GLN  35           HA       GLN  35   6.022   6.248  -1.780
  264    HB2  GLN  35           HB2      GLN  35   4.910   7.892   0.496
  265    HB3  GLN  35           HB3      GLN  35   5.711   8.602  -0.908
  266    HG2  GLN  35           HG2      GLN  35   3.343   6.724  -1.090
  267    HG3  GLN  35           HG3      GLN  35   3.200   8.481  -1.111
  268   HE21  GLN  35          HE21      GLN  35   3.337   5.868  -3.175
  269   HE22  GLN  35          HE22      GLN  35   3.982   6.634  -4.545
  270    H    SER  36           H        SER  36   6.788   6.374   1.683
  271    HA   SER  36           HA       SER  36   9.194   7.822   1.495
  272    HB2  SER  36           HB2      SER  36   8.305   5.740   3.500
  273    HB3  SER  36           HB3      SER  36   9.736   6.748   3.691
  274    HG   SER  36           HG       SER  36   7.987   7.722   4.714
  275    H    GLY  37           H        GLY  37   8.581   4.323   1.409
  276    HA2  GLY  37           HA2      GLY  37   9.855   2.560   0.657
  277    HA3  GLY  37           HA3      GLY  37  10.669   3.731  -0.373
  278    H    GLY  38           H        GLY  38  10.614   3.941   3.141
  279    HA2  GLY  38           HA2      GLY  38  13.546   3.707   3.161
  280    HA3  GLY  38           HA3      GLY  38  12.562   4.456   4.413
  281    H    GLU  39           H        GLU  39  14.628   2.203   4.288
  282    HA   GLU  39           HA       GLU  39  13.396  -0.241   4.993
  283    HB2  GLU  39           HB2      GLU  39  16.137   0.892   5.575
  284    HB3  GLU  39           HB3      GLU  39  15.655  -0.745   6.022
  285    HG2  GLU  39           HG2      GLU  39  15.227  -1.323   3.714
  286    HG3  GLU  39           HG3      GLU  39  15.463   0.344   3.202
  287    H    TYR  40           H        TYR  40  14.437   2.549   6.890
  288    HA   TYR  40           HA       TYR  40  14.184   1.471   9.471
  289    HB2  TYR  40           HB2      TYR  40  13.751   4.304   8.508
  290    HB3  TYR  40           HB3      TYR  40  13.893   3.831  10.199
  291    HD1  TYR  40           HD1      TYR  40  15.684   4.285   7.025
  292    HD2  TYR  40           HD2      TYR  40  16.026   2.998  11.110
  293    HE1  TYR  40           HE1      TYR  40  18.155   4.362   6.843
  294    HE2  TYR  40           HE2      TYR  40  18.498   3.077  10.927
  295    HH   TYR  40           HH       TYR  40  20.094   4.524   8.228
  296    H    ALA  41           H        ALA  41  11.796   2.978   7.332
  297    HA   ALA  41           HA       ALA  41   9.683   3.225   9.162
  298    HB1  ALA  41           HB1      ALA  41   9.639   4.263   6.942
  299    HB2  ALA  41           HB2      ALA  41   8.221   3.242   7.175
  300    HB3  ALA  41           HB3      ALA  41   9.567   2.671   6.188
  301    H    THR  42           H        THR  42   8.393   1.817  10.110
  302    HA   THR  42           HA       THR  42   8.165  -0.923   9.023
  303    HB   THR  42           HB       THR  42   8.223  -1.811  11.328
  304    HG1  THR  42           HG1      THR  42   8.971  -0.382  12.958
  305   HG21  THR  42          HG21      THR  42  10.579  -0.279  10.248
  306   HG22  THR  42          HG22      THR  42  10.303  -2.018  10.267
  307   HG23  THR  42          HG23      THR  42  10.710  -1.174  11.760
  308    H    LEU  43           H        LEU  43   6.288  -2.107   9.855
  309    HA   LEU  43           HA       LEU  43   4.106  -0.471  10.913
  310    HB2  LEU  43           HB2      LEU  43   3.843  -2.070   8.354
  311    HB3  LEU  43           HB3      LEU  43   2.531  -1.261   9.200
  312    HG   LEU  43           HG       LEU  43   4.192   0.859   8.937
  313   HD11  LEU  43          HD11      LEU  43   5.873  -0.656   7.724
  314   HD12  LEU  43          HD12      LEU  43   5.443   0.841   6.905
  315   HD13  LEU  43          HD13      LEU  43   4.728  -0.685   6.387
  316   HD21  LEU  43          HD21      LEU  43   2.951   1.418   6.825
  317   HD22  LEU  43          HD22      LEU  43   1.903   0.850   8.124
  318   HD23  LEU  43          HD23      LEU  43   2.334  -0.234   6.802
  319    H    ALA  44           H        ALA  44   2.414  -1.730  11.845
  320    HA   ALA  44           HA       ALA  44   2.843  -4.618  12.087
  321    HB1  ALA  44           HB1      ALA  44   2.584  -2.909  14.568
  322    HB2  ALA  44           HB2      ALA  44   4.154  -3.357  13.898
  323    HB3  ALA  44           HB3      ALA  44   3.045  -4.608  14.459
  324    H    ASP  45           H        ASP  45   0.960  -4.769  14.390
  325    HA   ASP  45           HA       ASP  45  -1.500  -4.589  12.865
  326    HB2  ASP  45           HB2      ASP  45  -1.001  -5.553  15.694
  327    HB3  ASP  45           HB3      ASP  45  -2.463  -5.809  14.748
  328    H    GLY  46           H        GLY  46  -2.546  -2.685  12.822
  329    HA2  GLY  46           HA2      GLY  46  -4.000  -1.145  13.954
  330    HA3  GLY  46           HA3      GLY  46  -2.955  -1.241  15.363
  331    H    GLN  47           H        GLN  47  -0.947  -1.002  12.710
  332    HA   GLN  47           HA       GLN  47  -0.006   1.574  13.326
  333    HB2  GLN  47           HB2      GLN  47   1.298  -0.186  12.142
  334    HB3  GLN  47           HB3      GLN  47   0.297   0.067  10.715
  335    HG2  GLN  47           HG2      GLN  47   2.375   1.337  10.480
  336    HG3  GLN  47           HG3      GLN  47   1.026   2.444  10.661
  337   HE21  GLN  47          HE21      GLN  47   1.814   4.190  11.861
  338   HE22  GLN  47          HE22      GLN  47   2.707   4.045  13.298
  339    H    THR  48           H        THR  48  -0.591   3.560  12.697
  340    HA   THR  48           HA       THR  48  -2.975   3.882  11.046
  341    HB   THR  48           HB       THR  48  -1.265   5.962  12.453
  342    HG1  THR  48           HG1      THR  48  -2.153   4.884  14.066
  343   HG21  THR  48          HG21      THR  48  -3.294   7.376  12.217
  344   HG22  THR  48          HG22      THR  48  -4.058   6.094  11.276
  345   HG23  THR  48          HG23      THR  48  -2.629   6.916  10.650
  346    H    VAL  49           H        VAL  49  -2.893   4.277   8.920
  347    HA   VAL  49           HA       VAL  49  -0.480   5.555   7.799
  348    HB   VAL  49           HB       VAL  49  -0.487   3.962   5.905
  349   HG11  VAL  49          HG11      VAL  49   0.973   3.629   7.899
  350   HG12  VAL  49          HG12      VAL  49   0.532   2.107   7.120
  351   HG13  VAL  49          HG13      VAL  49  -0.276   2.603   8.608
  352   HG21  VAL  49          HG21      VAL  49  -2.863   3.256   6.072
  353   HG22  VAL  49          HG22      VAL  49  -2.503   2.438   7.592
  354   HG23  VAL  49          HG23      VAL  49  -1.773   1.869   6.092
  355    H    GLU  50           H        GLU  50  -0.769   6.318   5.593
  356    HA   GLU  50           HA       GLU  50  -3.514   7.316   5.138
  357    HB2  GLU  50           HB2      GLU  50  -1.665   9.000   5.598
  358    HB3  GLU  50           HB3      GLU  50  -0.926   8.480   4.080
  359    HG2  GLU  50           HG2      GLU  50  -3.016   9.057   2.884
  360    HG3  GLU  50           HG3      GLU  50  -3.713   9.615   4.402
  361    H    TYR  51           H        TYR  51  -4.500   6.736   3.239
  362    HA   TYR  51           HA       TYR  51  -2.874   5.741   1.020
  363    HB2  TYR  51           HB2      TYR  51  -4.136   3.639   0.846
  364    HB3  TYR  51           HB3      TYR  51  -3.275   3.740   2.375
  365    HD1  TYR  51           HD1      TYR  51  -6.575   3.841   0.748
  366    HD2  TYR  51           HD2      TYR  51  -4.479   4.047   4.490
  367    HE1  TYR  51           HE1      TYR  51  -8.716   3.537   1.963
  368    HE2  TYR  51           HE2      TYR  51  -6.620   3.741   5.704
  369    HH   TYR  51           HH       TYR  51  -9.380   2.616   4.310
  370    H    GLU  52           H        GLU  52  -4.101   5.277  -0.912
  371    HA   GLU  52           HA       GLU  52  -6.562   6.915  -1.134
  372    HB2  GLU  52           HB2      GLU  52  -4.227   6.568  -3.018
  373    HB3  GLU  52           HB3      GLU  52  -5.808   7.084  -3.607
  374    HG2  GLU  52           HG2      GLU  52  -4.498   9.069  -3.133
  375    HG3  GLU  52           HG3      GLU  52  -5.764   8.944  -1.919
  376    H    VAL  53           H        VAL  53  -8.317   5.922  -1.949
  377    HA   VAL  53           HA       VAL  53  -8.142   3.053  -2.480
  378    HB   VAL  53           HB       VAL  53 -10.540   4.901  -2.224
  379   HG11  VAL  53          HG11      VAL  53 -10.440   1.869  -2.191
  380   HG12  VAL  53          HG12      VAL  53 -10.968   2.830  -3.574
  381   HG13  VAL  53          HG13      VAL  53 -11.881   2.878  -2.065
  382   HG21  VAL  53          HG21      VAL  53  -9.285   4.692  -0.128
  383   HG22  VAL  53          HG22      VAL  53  -9.277   2.936  -0.289
  384   HG23  VAL  53          HG23      VAL  53 -10.796   3.787  -0.012
  385    H    GLY  54           H        GLY  54  -7.864   2.317  -4.468
  386    HA2  GLY  54           HA2      GLY  54  -9.038   3.816  -6.744
  387    HA3  GLY  54           HA3      GLY  54  -7.457   3.045  -6.835
  388    H    GLN  55           H        GLN  55 -10.687   2.679  -7.533
  389    HA   GLN  55           HA       GLN  55 -11.207  -0.030  -7.041
  390    HB2  GLN  55           HB2      GLN  55 -12.248   1.857  -9.159
  391    HB3  GLN  55           HB3      GLN  55 -12.873   0.222  -8.925
  392    HG2  GLN  55           HG2      GLN  55 -13.546   0.731  -6.660
  393    HG3  GLN  55           HG3      GLN  55 -12.744   2.298  -6.722
  394   HE21  GLN  55          HE21      GLN  55 -15.666   1.672  -6.286
  395   HE22  GLN  55          HE22      GLN  55 -16.486   2.527  -7.500
  396    H    GLY  56           H        GLY  56 -11.130  -1.842  -8.364
  397    HA2  GLY  56           HA2      GLY  56  -9.828  -1.830 -10.935
  398    HA3  GLY  56           HA3      GLY  56  -8.821  -2.494  -9.652
  399    H    GLN  57           H        GLN  57  -9.192  -4.308 -11.388
  400    HA   GLN  57           HA       GLN  57 -11.617  -5.746 -11.474
  401    HB2  GLN  57           HB2      GLN  57  -8.753  -6.583 -11.949
  402    HB3  GLN  57           HB3      GLN  57 -10.134  -7.644 -12.236
  403    HG2  GLN  57           HG2      GLN  57 -11.059  -6.118 -13.861
  404    HG3  GLN  57           HG3      GLN  57  -9.857  -4.890 -13.465
  405   HE21  GLN  57          HE21      GLN  57 -10.370  -6.274 -16.103
  406   HE22  GLN  57          HE22      GLN  57  -8.886  -6.973 -16.531
  407    H    LYS  58           H        LYS  58  -8.815  -5.971  -9.333
  408    HA   LYS  58           HA       LYS  58  -9.939  -8.230  -7.873
  409    HB2  LYS  58           HB2      LYS  58  -7.412  -6.615  -7.464
  410    HB3  LYS  58           HB3      LYS  58  -7.873  -8.014  -6.495
  411    HG2  LYS  58           HG2      LYS  58  -7.960  -9.380  -8.593
  412    HG3  LYS  58           HG3      LYS  58  -7.361  -7.983  -9.486
  413    HD2  LYS  58           HD2      LYS  58  -5.888  -9.175  -7.124
  414    HD3  LYS  58           HD3      LYS  58  -5.587  -9.674  -8.787
  415    HE2  LYS  58           HE2      LYS  58  -5.053  -7.313  -9.372
  416    HE3  LYS  58           HE3      LYS  58  -5.282  -6.863  -7.682
  417    HZ1  LYS  58           HZ1      LYS  58  -2.944  -7.267  -8.247
  418    HZ2  LYS  58           HZ2      LYS  58  -3.323  -8.874  -8.651
  419    HZ3  LYS  58           HZ3      LYS  58  -3.505  -8.332  -7.052
  420    H    GLY  59           H        GLY  59 -11.099  -5.353  -7.909
  421    HA2  GLY  59           HA2      GLY  59 -12.517  -4.336  -6.348
  422    HA3  GLY  59           HA3      GLY  59 -11.758  -5.283  -5.071
  423    HA   PRO  60           HA       PRO  60 -10.126  -0.736  -5.340
  424    HB2  PRO  60           HB2      PRO  60 -11.227  -0.652  -2.568
  425    HB3  PRO  60           HB3      PRO  60 -11.245   0.590  -3.832
  426    HG2  PRO  60           HG2      PRO  60 -13.444  -0.733  -3.239
  427    HG3  PRO  60           HG3      PRO  60 -13.038  -0.350  -4.923
  428    HD2  PRO  60           HD2      PRO  60 -12.751  -2.971  -3.469
  429    HD3  PRO  60           HD3      PRO  60 -13.311  -2.664  -5.130
  430    H    CYS  61           H        CYS  61  -8.123  -0.297  -4.638
  431    HA   CYS  61           HA       CYS  61  -6.963  -1.951  -2.473
  432    HB2  CYS  61           HB2      CYS  61  -5.615  -1.000  -5.017
  433    HB3  CYS  61           HB3      CYS  61  -4.833  -1.898  -3.716
  434    HG   CYS  61           HG       CYS  61  -6.429  -3.928  -4.261
  435    H    ALA  62           H        ALA  62  -4.865  -0.862  -1.634
  436    HA   ALA  62           HA       ALA  62  -5.325   2.064  -1.481
  437    HB1  ALA  62           HB1      ALA  62  -3.972   1.499   0.823
  438    HB2  ALA  62           HB2      ALA  62  -4.942   0.038   0.630
  439    HB3  ALA  62           HB3      ALA  62  -5.727   1.613   0.705
  440    H    ASN  63           H        ASN  63  -3.720   3.219  -2.310
  441    HA   ASN  63           HA       ASN  63  -1.000   2.034  -2.375
  442    HB2  ASN  63           HB2      ASN  63  -0.658   3.282  -4.498
  443    HB3  ASN  63           HB3      ASN  63  -1.919   2.057  -4.622
  444   HD21  ASN  63          HD21      ASN  63  -3.420   2.972  -6.059
  445   HD22  ASN  63          HD22      ASN  63  -4.099   4.517  -5.873
  446    H    LYS  64           H        LYS  64   0.672   3.841  -2.843
  447    HA   LYS  64           HA       LYS  64   1.818   5.631  -1.992
  448    HB2  LYS  64           HB2      LYS  64  -0.947   6.861  -2.075
  449    HB3  LYS  64           HB3      LYS  64   0.540   7.767  -1.803
  450    HG2  LYS  64           HG2      LYS  64   1.402   6.912  -3.994
  451    HG3  LYS  64           HG3      LYS  64  -0.157   6.138  -4.270
  452    HD2  LYS  64           HD2      LYS  64   0.128   9.107  -3.742
  453    HD3  LYS  64           HD3      LYS  64   0.143   8.420  -5.366
  454    HE2  LYS  64           HE2      LYS  64  -2.090   7.403  -4.922
  455    HE3  LYS  64           HE3      LYS  64  -2.106   8.182  -3.341
  456    HZ1  LYS  64           HZ1      LYS  64  -1.863   9.613  -5.930
  457    HZ2  LYS  64           HZ2      LYS  64  -1.998  10.322  -4.392
  458    HZ3  LYS  64           HZ3      LYS  64  -3.302   9.454  -5.048
  459    H    VAL  65           H        VAL  65   1.535   3.783  -0.168
  460    HA   VAL  65           HA       VAL  65   0.127   4.561   2.192
  461    HB   VAL  65           HB       VAL  65   2.362   2.542   1.821
  462   HG11  VAL  65          HG11      VAL  65   2.040   3.237   4.190
  463   HG12  VAL  65          HG12      VAL  65   1.566   1.560   3.922
  464   HG13  VAL  65          HG13      VAL  65   0.333   2.816   4.063
  465   HG21  VAL  65          HG21      VAL  65  -0.617   2.040   2.028
  466   HG22  VAL  65          HG22      VAL  65   0.644   0.899   1.559
  467   HG23  VAL  65          HG23      VAL  65   0.209   2.226   0.482
  468    H    VAL  66           H        VAL  66   0.651   6.096   3.509
  469    HA   VAL  66           HA       VAL  66   3.497   6.764   3.989
  470    HB   VAL  66           HB       VAL  66   1.151   8.697   3.908
  471   HG11  VAL  66          HG11      VAL  66   4.112   9.197   4.355
  472   HG12  VAL  66          HG12      VAL  66   2.857   9.320   5.588
  473   HG13  VAL  66          HG13      VAL  66   2.869  10.439   4.226
  474   HG21  VAL  66          HG21      VAL  66   2.138   9.580   1.899
  475   HG22  VAL  66          HG22      VAL  66   2.029   7.832   1.682
  476   HG23  VAL  66          HG23      VAL  66   3.574   8.577   2.093
  477    H    ALA  67           H        ALA  67   4.083   6.478   6.055
  478    HA   ALA  67           HA       ALA  67   2.340   5.494   8.025
  479    HB1  ALA  67           HB1      ALA  67   5.094   6.717   8.181
  480    HB2  ALA  67           HB2      ALA  67   4.654   5.011   8.267
  481    HB3  ALA  67           HB3      ALA  67   4.259   6.092   9.602
  482    H    VAL  68           H        VAL  68   0.877   6.469   9.231
  483    HA   VAL  68           HA       VAL  68  -0.346   8.084  10.314
  484    HB   VAL  68           HB       VAL  68   2.321   9.522  10.561
  485   HG11  VAL  68          HG11      VAL  68   0.508  10.999  11.148
  486   HG12  VAL  68          HG12      VAL  68   1.204  10.414  12.658
  487   HG13  VAL  68          HG13      VAL  68  -0.307   9.729  12.062
  488   HG21  VAL  68          HG21      VAL  68   2.369   8.409  12.824
  489   HG22  VAL  68          HG22      VAL  68   2.543   7.283  11.479
  490   HG23  VAL  68          HG23      VAL  68   0.997   7.426  12.314
  Start of MODEL    4
    1    H1   MET   1           HT1      MET   1  -5.689   9.628   0.413
    2    H2   MET   1           HT2      MET   1  -4.236  10.071   1.175
    3    H3   MET   1           HT3      MET   1  -4.644  10.733  -0.336
    4    HA   MET   1           HA       MET   1  -4.998  12.279   1.545
    5    HB2  MET   1           HB2      MET   1  -6.267  12.357  -0.645
    6    HB3  MET   1           HB3      MET   1  -7.553  11.449   0.145
    7    HG2  MET   1           HG2      MET   1  -8.099  13.812   0.267
    8    HG3  MET   1           HG3      MET   1  -7.681  13.252   1.886
    9    HE1  MET   1           HE1      MET   1  -5.296  15.950  -0.934
   10    HE2  MET   1           HE2      MET   1  -6.927  15.312  -1.132
   11    HE3  MET   1           HE3      MET   1  -5.540  14.242  -1.328
   12    H    SER   2           H        SER   2  -7.139   9.444   1.471
   13    HA   SER   2           HA       SER   2  -8.421  10.014   3.965
   14    HB2  SER   2           HB2      SER   2  -9.415   7.830   3.740
   15    HB3  SER   2           HB3      SER   2  -9.383   8.575   2.144
   16    HG   SER   2           HG       SER   2  -8.133   6.338   3.062
   17    H    LYS   3           H        LYS   3  -8.293   8.580   5.862
   18    HA   LYS   3           HA       LYS   3  -5.654   7.341   6.277
   19    HB2  LYS   3           HB2      LYS   3  -5.588   9.675   7.156
   20    HB3  LYS   3           HB3      LYS   3  -6.926   9.279   8.231
   21    HG2  LYS   3           HG2      LYS   3  -5.524   7.454   9.221
   22    HG3  LYS   3           HG3      LYS   3  -4.179   7.987   8.213
   23    HD2  LYS   3           HD2      LYS   3  -5.615   9.845  10.124
   24    HD3  LYS   3           HD3      LYS   3  -4.215   8.894  10.607
   25    HE2  LYS   3           HE2      LYS   3  -4.196  10.786   8.239
   26    HE3  LYS   3           HE3      LYS   3  -3.690  11.259   9.858
   27    HZ1  LYS   3           HZ1      LYS   3  -1.920  10.436   8.239
   28    HZ2  LYS   3           HZ2      LYS   3  -2.538   8.884   8.534
   29    HZ3  LYS   3           HZ3      LYS   3  -1.903   9.803   9.812
   30    H    GLY   4           H        GLY   4  -5.886   5.373   7.076
   31    HA2  GLY   4           HA2      GLY   4  -8.232   4.756   8.778
   32    HA3  GLY   4           HA3      GLY   4  -7.729   3.679   7.476
   33    H    ILE   5           H        ILE   5  -7.787   2.340   9.654
   34    HA   ILE   5           HA       ILE   5  -5.051   2.404  10.800
   35    HB   ILE   5           HB       ILE   5  -6.074   1.154  12.750
   36   HG12  ILE   5          HG12      ILE   5  -8.716   2.216  11.714
   37   HG13  ILE   5          HG13      ILE   5  -8.194   0.570  11.376
   38   HG21  ILE   5          HG21      ILE   5  -5.532   3.560  12.830
   39   HG22  ILE   5          HG22      ILE   5  -6.984   3.209  13.766
   40   HG23  ILE   5          HG23      ILE   5  -7.120   3.942  12.168
   41   HD11  ILE   5          HD11      ILE   5  -7.909   0.228  13.859
   42   HD12  ILE   5          HD12      ILE   5  -9.576   0.523  13.367
   43   HD13  ILE   5          HD13      ILE   5  -8.632   1.819  14.103
   44    H    VAL   6           H        VAL   6  -3.794   0.741  10.469
   45    HA   VAL   6           HA       VAL   6  -4.541  -1.333   8.701
   46    HB   VAL   6           HB       VAL   6  -2.096  -1.102  10.478
   47   HG11  VAL   6          HG11      VAL   6  -2.802  -2.943   8.183
   48   HG12  VAL   6          HG12      VAL   6  -2.181  -3.371   9.776
   49   HG13  VAL   6          HG13      VAL   6  -1.124  -2.594   8.600
   50   HG21  VAL   6          HG21      VAL   6  -2.341  -0.475   7.524
   51   HG22  VAL   6          HG22      VAL   6  -1.019  -0.062   8.615
   52   HG23  VAL   6          HG23      VAL   6  -2.576   0.752   8.768
   53    H    LYS   7           H        LYS   7  -5.599  -3.125   9.091
   54    HA   LYS   7           HA       LYS   7  -6.415  -3.955  11.690
   55    HB2  LYS   7           HB2      LYS   7  -7.684  -4.448   9.586
   56    HB3  LYS   7           HB3      LYS   7  -6.405  -5.570   9.121
   57    HG2  LYS   7           HG2      LYS   7  -6.833  -6.949  11.086
   58    HG3  LYS   7           HG3      LYS   7  -8.011  -5.786  11.688
   59    HD2  LYS   7           HD2      LYS   7  -9.283  -7.529  10.655
   60    HD3  LYS   7           HD3      LYS   7  -9.314  -6.176   9.526
   61    HE2  LYS   7           HE2      LYS   7  -7.513  -7.195   8.214
   62    HE3  LYS   7           HE3      LYS   7  -7.396  -8.524   9.365
   63    HZ1  LYS   7           HZ1      LYS   7  -8.732  -9.062   7.383
   64    HZ2  LYS   7           HZ2      LYS   7  -9.838  -7.847   7.817
   65    HZ3  LYS   7           HZ3      LYS   7  -9.614  -9.197   8.825
   66    H    TRP   8           H        TRP   8  -4.006  -5.145   9.371
   67    HA   TRP   8           HA       TRP   8  -2.277  -6.094  11.474
   68    HB2  TRP   8           HB2      TRP   8  -4.110  -7.900  11.067
   69    HB3  TRP   8           HB3      TRP   8  -3.268  -8.196   9.550
   70    HD1  TRP   8           HD1      TRP   8  -0.857  -9.277   9.658
   71    HE1  TRP   8           HE1      TRP   8   0.405 -10.515  11.535
   72    HE3  TRP   8           HE3      TRP   8  -3.758  -8.004  13.663
   73    HZ2  TRP   8           HZ2      TRP   8   0.205 -10.919  14.360
   74    HZ3  TRP   8           HZ3      TRP   8  -3.204  -8.833  15.932
   75    HH2  TRP   8           HH2      TRP   8  -1.228 -10.288  16.285
   76    H    PHE   9           H        PHE   9  -0.252  -5.709  10.762
   77    HA   PHE   9           HA       PHE   9   0.204  -5.617   7.825
   78    HB2  PHE   9           HB2      PHE   9   0.646  -3.519   9.186
   79    HB3  PHE   9           HB3      PHE   9   1.966  -4.399   9.957
   80    HD1  PHE   9           HD1      PHE   9   0.781  -2.826   6.866
   81    HD2  PHE   9           HD2      PHE   9   3.931  -5.134   8.656
   82    HE1  PHE   9           HE1      PHE   9   2.242  -2.339   4.923
   83    HE2  PHE   9           HE2      PHE   9   5.391  -4.643   6.712
   84    HZ   PHE   9           HZ       PHE   9   4.548  -3.247   4.847
   85    H    ASN  10           H        ASN  10   1.343  -7.255   6.961
   86    HA   ASN  10           HA       ASN  10   3.285  -8.678   8.693
   87    HB2  ASN  10           HB2      ASN  10   1.322  -9.819   6.703
   88    HB3  ASN  10           HB3      ASN  10   2.705 -10.725   7.308
   89   HD21  ASN  10          HD21      ASN  10  -0.089 -11.438   7.798
   90   HD22  ASN  10          HD22      ASN  10  -0.340 -11.341   9.474
   91    H    SER  11           H        SER  11   5.088  -7.570   7.927
   92    HA   SER  11           HA       SER  11   5.664  -7.053   5.221
   93    HB2  SER  11           HB2      SER  11   7.946  -6.647   6.000
   94    HB3  SER  11           HB3      SER  11   6.785  -5.927   7.110
   95    HG   SER  11           HG       SER  11   8.386  -7.112   8.221
   96    H    ASP  12           H        ASP  12   6.247  -9.881   7.256
   97    HA   ASP  12           HA       ASP  12   8.136 -11.215   5.645
   98    HB2  ASP  12           HB2      ASP  12   5.971 -12.275   7.480
   99    HB3  ASP  12           HB3      ASP  12   7.157 -13.312   6.694
  100    H    LYS  13           H        LYS  13   4.596 -11.205   5.606
  101    HA   LYS  13           HA       LYS  13   4.363 -12.964   3.341
  102    HB2  LYS  13           HB2      LYS  13   2.405 -11.102   4.706
  103    HB3  LYS  13           HB3      LYS  13   1.978 -12.160   3.363
  104    HG2  LYS  13           HG2      LYS  13   2.709 -14.123   4.667
  105    HG3  LYS  13           HG3      LYS  13   3.129 -13.066   6.016
  106    HD2  LYS  13           HD2      LYS  13   0.792 -12.336   6.201
  107    HD3  LYS  13           HD3      LYS  13   0.356 -13.340   4.815
  108    HE2  LYS  13           HE2      LYS  13  -0.207 -14.516   6.887
  109    HE3  LYS  13           HE3      LYS  13   1.115 -15.353   6.074
  110    HZ1  LYS  13           HZ1      LYS  13   2.622 -14.686   7.627
  111    HZ2  LYS  13           HZ2      LYS  13   1.239 -14.781   8.608
  112    HZ3  LYS  13           HZ3      LYS  13   1.773 -13.274   8.032
  113    H    GLY  14           H        GLY  14   4.767  -9.553   3.869
  114    HA2  GLY  14           HA2      GLY  14   5.568  -8.005   2.280
  115    HA3  GLY  14           HA3      GLY  14   5.051  -9.086   0.995
  116    H    PHE  15           H        PHE  15   2.582  -8.761   3.297
  117    HA   PHE  15           HA       PHE  15   1.457  -6.305   2.268
  118    HB2  PHE  15           HB2      PHE  15  -0.580  -7.335   1.334
  119    HB3  PHE  15           HB3      PHE  15   0.865  -7.790   0.435
  120    HD1  PHE  15           HD1      PHE  15  -1.714  -8.952   2.814
  121    HD2  PHE  15           HD2      PHE  15   1.694 -10.069   0.448
  122    HE1  PHE  15           HE1      PHE  15  -2.251 -11.347   3.171
  123    HE2  PHE  15           HE2      PHE  15   1.160 -12.463   0.810
  124    HZ   PHE  15           HZ       PHE  15  -0.812 -13.103   2.170
  125    H    GLY  16           H        GLY  16  -0.870  -6.060   3.073
  126    HA2  GLY  16           HA2      GLY  16  -1.524  -7.453   5.525
  127    HA3  GLY  16           HA3      GLY  16  -1.007  -5.783   5.755
  128    H    PHE  17           H        PHE  17  -3.468  -6.314   6.575
  129    HA   PHE  17           HA       PHE  17  -5.274  -5.316   4.449
  130    HB2  PHE  17           HB2      PHE  17  -5.895  -6.972   6.910
  131    HB3  PHE  17           HB3      PHE  17  -7.107  -6.303   5.822
  132    HD1  PHE  17           HD1      PHE  17  -4.450  -8.813   6.221
  133    HD2  PHE  17           HD2      PHE  17  -7.380  -7.170   3.547
  134    HE1  PHE  17           HE1      PHE  17  -4.189 -10.776   4.731
  135    HE2  PHE  17           HE2      PHE  17  -7.120  -9.133   2.056
  136    HZ   PHE  17           HZ       PHE  17  -5.524 -10.937   2.645
  137    H    ILE  18           H        ILE  18  -6.338  -3.414   4.826
  138    HA   ILE  18           HA       ILE  18  -5.880  -2.154   7.451
  139    HB   ILE  18           HB       ILE  18  -4.687  -1.032   5.621
  140   HG12  ILE  18          HG12      ILE  18  -7.020   0.719   6.423
  141   HG13  ILE  18          HG13      ILE  18  -5.784   0.227   7.583
  142   HG21  ILE  18          HG21      ILE  18  -7.466  -0.810   4.438
  143   HG22  ILE  18          HG22      ILE  18  -6.043  -1.560   3.713
  144   HG23  ILE  18          HG23      ILE  18  -6.115   0.192   3.906
  145   HD11  ILE  18          HD11      ILE  18  -5.280   2.439   6.548
  146   HD12  ILE  18          HD12      ILE  18  -5.226   1.659   4.967
  147   HD13  ILE  18          HD13      ILE  18  -4.040   1.236   6.199
  148    H    THR  19           H        THR  19  -7.489  -1.179   8.525
  149    HA   THR  19           HA       THR  19 -10.204  -1.838   7.665
  150    HB   THR  19           HB       THR  19  -9.180  -0.905  10.350
  151    HG1  THR  19           HG1      THR  19  -9.067  -2.994  10.860
  152   HG21  THR  19          HG21      THR  19 -11.373  -1.780  11.158
  153   HG22  THR  19          HG22      THR  19 -11.847  -2.063   9.483
  154   HG23  THR  19          HG23      THR  19 -11.559  -0.418  10.052
  155    HA   PRO  20           HA       PRO  20 -10.380   2.614   6.448
  156    HB2  PRO  20           HB2      PRO  20 -13.224   1.788   6.003
  157    HB3  PRO  20           HB3      PRO  20 -12.146   2.713   4.940
  158    HG2  PRO  20           HG2      PRO  20 -12.678   0.203   4.392
  159    HG3  PRO  20           HG3      PRO  20 -11.023   0.818   4.219
  160    HD2  PRO  20           HD2      PRO  20 -12.178  -0.880   6.413
  161    HD3  PRO  20           HD3      PRO  20 -10.584  -0.982   5.631
  162    H    GLU  21           H        GLU  21 -10.764   4.280   7.834
  163    HA   GLU  21           HA       GLU  21 -11.940   3.906  10.375
  164    HB2  GLU  21           HB2      GLU  21 -11.710   6.340  10.636
  165    HB3  GLU  21           HB3      GLU  21 -10.251   5.640   9.940
  166    HG2  GLU  21           HG2      GLU  21 -10.957   6.335   7.694
  167    HG3  GLU  21           HG3      GLU  21 -12.466   6.970   8.344
  168    H    ASP  22           H        ASP  22 -13.265   4.977   7.317
  169    HA   ASP  22           HA       ASP  22 -15.686   6.106   8.306
  170    HB2  ASP  22           HB2      ASP  22 -14.890   5.016   5.605
  171    HB3  ASP  22           HB3      ASP  22 -16.462   5.737   5.918
  172    H    GLY  23           H        GLY  23 -14.636   2.845   7.893
  173    HA2  GLY  23           HA2      GLY  23 -15.855   1.045   8.940
  174    HA3  GLY  23           HA3      GLY  23 -17.349   1.878   8.538
  175    H    SER  24           H        SER  24 -15.169   2.043   5.957
  176    HA   SER  24           HA       SER  24 -16.765   0.365   4.285
  177    HB2  SER  24           HB2      SER  24 -14.093   1.698   3.808
  178    HB3  SER  24           HB3      SER  24 -15.040   0.881   2.572
  179    HG   SER  24           HG       SER  24 -15.258   3.362   3.342
  180    H    LYS  25           H        LYS  25 -15.678  -1.318   2.884
  181    HA   LYS  25           HA       LYS  25 -14.774  -3.455   4.504
  182    HB2  LYS  25           HB2      LYS  25 -14.691  -3.145   1.489
  183    HB3  LYS  25           HB3      LYS  25 -14.451  -4.655   2.363
  184    HG2  LYS  25           HG2      LYS  25 -16.963  -2.980   2.621
  185    HG3  LYS  25           HG3      LYS  25 -16.800  -4.291   1.456
  186    HD2  LYS  25           HD2      LYS  25 -16.323  -5.865   3.319
  187    HD3  LYS  25           HD3      LYS  25 -16.550  -4.549   4.472
  188    HE2  LYS  25           HE2      LYS  25 -18.616  -5.837   4.303
  189    HE3  LYS  25           HE3      LYS  25 -18.867  -4.237   3.608
  190    HZ1  LYS  25           HZ1      LYS  25 -17.971  -6.404   1.851
  191    HZ2  LYS  25           HZ2      LYS  25 -18.942  -5.056   1.498
  192    HZ3  LYS  25           HZ3      LYS  25 -19.598  -6.381   2.335
  193    H    ASP  26           H        ASP  26 -12.770  -4.522   4.557
  194    HA   ASP  26           HA       ASP  26 -10.514  -2.903   4.790
  195    HB2  ASP  26           HB2      ASP  26 -10.809  -5.893   4.491
  196    HB3  ASP  26           HB3      ASP  26  -9.261  -5.113   4.797
  197    H    LEU  27           H        LEU  27  -8.723  -2.554   3.540
  198    HA   LEU  27           HA       LEU  27  -8.969  -3.258   0.673
  199    HB2  LEU  27           HB2      LEU  27  -7.678  -0.823   1.932
  200    HB3  LEU  27           HB3      LEU  27  -7.734  -1.174   0.207
  201    HG   LEU  27           HG       LEU  27 -10.212  -0.872   1.936
  202   HD11  LEU  27          HD11      LEU  27  -8.765   1.122   0.172
  203   HD12  LEU  27          HD12      LEU  27  -9.067   1.259   1.904
  204   HD13  LEU  27          HD13      LEU  27 -10.410   1.350   0.766
  205   HD21  LEU  27          HD21      LEU  27 -11.276  -0.528  -0.331
  206   HD22  LEU  27          HD22      LEU  27 -10.636  -2.153  -0.084
  207   HD23  LEU  27          HD23      LEU  27  -9.739  -0.991  -1.062
  208    H    PHE  28           H        PHE  28  -7.075  -3.768  -0.476
  209    HA   PHE  28           HA       PHE  28  -5.070  -5.154   1.088
  210    HB2  PHE  28           HB2      PHE  28  -5.482  -4.779  -1.883
  211    HB3  PHE  28           HB3      PHE  28  -4.139  -5.699  -1.200
  212    HD1  PHE  28           HD1      PHE  28  -7.809  -5.550  -1.616
  213    HD2  PHE  28           HD2      PHE  28  -4.495  -7.849  -0.139
  214    HE1  PHE  28           HE1      PHE  28  -9.285  -7.529  -1.385
  215    HE2  PHE  28           HE2      PHE  28  -5.971  -9.828   0.093
  216    HZ   PHE  28           HZ       PHE  28  -8.367  -9.669  -0.531
  217    H    VAL  29           H        VAL  29  -3.110  -4.446   1.629
  218    HA   VAL  29           HA       VAL  29  -1.970  -2.107   0.234
  219    HB   VAL  29           HB       VAL  29  -2.082  -2.526   3.235
  220   HG11  VAL  29          HG11      VAL  29  -1.010  -0.219   3.261
  221   HG12  VAL  29          HG12      VAL  29  -0.689  -0.437   1.541
  222   HG13  VAL  29          HG13      VAL  29   0.046  -1.523   2.720
  223   HG21  VAL  29          HG21      VAL  29  -3.526  -0.633   3.304
  224   HG22  VAL  29          HG22      VAL  29  -4.152  -1.649   2.006
  225   HG23  VAL  29          HG23      VAL  29  -3.187  -0.226   1.623
  226    H    HIS  30           H        HIS  30   0.152  -2.334  -0.283
  227    HA   HIS  30           HA       HIS  30   1.528  -4.771   0.670
  228    HB2  HIS  30           HB2      HIS  30   1.922  -3.162  -1.864
  229    HB3  HIS  30           HB3      HIS  30   2.909  -4.544  -1.391
  230    HD2  HIS  30           HD2      HIS  30  -0.346  -3.878  -3.281
  231    HE1  HIS  30           HE1      HIS  30  -0.447  -7.961  -2.211
  232    HE2  HIS  30           HE2      HIS  30  -1.546  -6.169  -3.636
  233    H    HIS  31           H        HIS  31   3.711  -4.687   1.228
  234    HA   HIS  31           HA       HIS  31   4.545  -2.434   2.731
  235    HB2  HIS  31           HB2      HIS  31   5.288  -4.808   3.111
  236    HB3  HIS  31           HB3      HIS  31   6.293  -4.670   1.669
  237    HD2  HIS  31           HD2      HIS  31   6.362  -3.598   5.408
  238    HE1  HIS  31           HE1      HIS  31   9.759  -1.909   3.561
  239    HE2  HIS  31           HE2      HIS  31   8.616  -2.339   5.787
  240    H    SER  32           H        SER  32   5.510  -3.671  -0.437
  241    HA   SER  32           HA       SER  32   7.442  -1.643  -0.980
  242    HB2  SER  32           HB2      SER  32   7.494  -2.578  -3.223
  243    HB3  SER  32           HB3      SER  32   7.468  -3.878  -2.034
  244    HG   SER  32           HG       SER  32   5.213  -4.034  -2.387
  245    H    GLU  33           H        GLU  33   4.083  -1.429  -0.904
  246    HA   GLU  33           HA       GLU  33   3.551   0.152  -3.199
  247    HB2  GLU  33           HB2      GLU  33   1.888  -1.081  -1.697
  248    HB3  GLU  33           HB3      GLU  33   2.026   0.291  -0.603
  249    HG2  GLU  33           HG2      GLU  33   0.119   0.636  -2.072
  250    HG3  GLU  33           HG3      GLU  33   1.373   1.805  -2.474
  251    H    ILE  34           H        ILE  34   4.859   0.957  -0.038
  252    HA   ILE  34           HA       ILE  34   4.311   3.766  -0.178
  253    HB   ILE  34           HB       ILE  34   4.732   2.620   1.964
  254   HG12  ILE  34          HG12      ILE  34   6.966   4.610   1.505
  255   HG13  ILE  34          HG13      ILE  34   5.276   5.106   1.535
  256   HG21  ILE  34          HG21      ILE  34   7.663   2.479   1.237
  257   HG22  ILE  34          HG22      ILE  34   6.577   1.133   0.898
  258   HG23  ILE  34          HG23      ILE  34   6.812   1.676   2.558
  259   HD11  ILE  34          HD11      ILE  34   6.872   3.823   3.763
  260   HD12  ILE  34          HD12      ILE  34   5.110   3.925   3.796
  261   HD13  ILE  34          HD13      ILE  34   6.080   5.399   3.769
  262    H    GLN  35           H        GLN  35   5.298   5.276  -1.322
  263    HA   GLN  35           HA       GLN  35   7.286   4.702  -3.240
  264    HB2  GLN  35           HB2      GLN  35   6.234   7.310  -2.145
  265    HB3  GLN  35           HB3      GLN  35   7.392   7.216  -3.471
  266    HG2  GLN  35           HG2      GLN  35   5.841   5.947  -4.824
  267    HG3  GLN  35           HG3      GLN  35   4.716   5.795  -3.477
  268   HE21  GLN  35          HE21      GLN  35   4.285   7.100  -6.162
  269   HE22  GLN  35          HE22      GLN  35   3.824   8.695  -5.811
  270    H    SER  36           H        SER  36   7.491   6.210  -0.027
  271    HA   SER  36           HA       SER  36  10.154   7.099  -0.178
  272    HB2  SER  36           HB2      SER  36   8.529   6.181   2.200
  273    HB3  SER  36           HB3      SER  36  10.096   6.976   2.322
  274    HG   SER  36           HG       SER  36   9.139   8.707   1.078
  275    H    GLY  37           H        GLY  37   8.825   4.003   0.971
  276    HA2  GLY  37           HA2      GLY  37   9.796   1.941   1.289
  277    HA3  GLY  37           HA3      GLY  37  10.950   2.425   0.052
  278    H    GLY  38           H        GLY  38  10.529   4.139   3.107
  279    HA2  GLY  38           HA2      GLY  38  13.287   4.157   3.706
  280    HA3  GLY  38           HA3      GLY  38  11.997   4.582   4.825
  281    H    GLU  39           H        GLU  39  14.572   2.816   4.816
  282    HA   GLU  39           HA       GLU  39  13.790   0.154   5.390
  283    HB2  GLU  39           HB2      GLU  39  16.108   0.825   4.814
  284    HB3  GLU  39           HB3      GLU  39  16.232   1.673   6.353
  285    HG2  GLU  39           HG2      GLU  39  17.267  -0.531   6.557
  286    HG3  GLU  39           HG3      GLU  39  15.811  -0.474   7.542
  287    H    TYR  40           H        TYR  40  14.308   3.009   7.427
  288    HA   TYR  40           HA       TYR  40  13.951   1.754   9.940
  289    HB2  TYR  40           HB2      TYR  40  13.479   4.616   9.086
  290    HB3  TYR  40           HB3      TYR  40  13.477   4.061  10.758
  291    HD1  TYR  40           HD1      TYR  40  15.547   4.736   7.798
  292    HD2  TYR  40           HD2      TYR  40  15.541   3.271  11.835
  293    HE1  TYR  40           HE1      TYR  40  18.018   4.915   7.864
  294    HE2  TYR  40           HE2      TYR  40  18.015   3.449  11.902
  295    HH   TYR  40           HH       TYR  40  19.893   3.511  10.366
  296    H    ALA  41           H        ALA  41  11.691   3.277   7.683
  297    HA   ALA  41           HA       ALA  41   9.415   3.363   9.297
  298    HB1  ALA  41           HB1      ALA  41   9.503   2.791   6.326
  299    HB2  ALA  41           HB2      ALA  41   9.616   4.400   7.040
  300    HB3  ALA  41           HB3      ALA  41   8.142   3.451   7.232
  301    H    THR  42           H        THR  42   8.105   1.889  10.096
  302    HA   THR  42           HA       THR  42   8.003  -0.800   8.912
  303    HB   THR  42           HB       THR  42   9.634  -0.934  10.738
  304    HG1  THR  42           HG1      THR  42   8.671  -2.792  10.803
  305   HG21  THR  42          HG21      THR  42   7.394  -0.082  12.590
  306   HG22  THR  42          HG22      THR  42   8.672   1.006  12.047
  307   HG23  THR  42          HG23      THR  42   9.073  -0.408  13.020
  308    H    LEU  43           H        LEU  43   6.138  -2.062   9.643
  309    HA   LEU  43           HA       LEU  43   3.936  -0.474  10.766
  310    HB2  LEU  43           HB2      LEU  43   3.873  -1.959   8.136
  311    HB3  LEU  43           HB3      LEU  43   2.418  -1.522   9.019
  312    HG   LEU  43           HG       LEU  43   3.612   0.901   9.015
  313   HD11  LEU  43          HD11      LEU  43   5.567  -0.214   7.698
  314   HD12  LEU  43          HD12      LEU  43   4.962   1.344   7.143
  315   HD13  LEU  43          HD13      LEU  43   4.478  -0.137   6.315
  316   HD21  LEU  43          HD21      LEU  43   2.356   1.355   6.841
  317   HD22  LEU  43          HD22      LEU  43   1.404   0.606   8.123
  318   HD23  LEU  43          HD23      LEU  43   2.003  -0.373   6.785
  319    H    ALA  44           H        ALA  44   2.293  -1.734  11.735
  320    HA   ALA  44           HA       ALA  44   2.704  -4.625  11.961
  321    HB1  ALA  44           HB1      ALA  44   3.058  -4.656  14.270
  322    HB2  ALA  44           HB2      ALA  44   2.378  -3.045  14.497
  323    HB3  ALA  44           HB3      ALA  44   3.982  -3.234  13.788
  324    H    ASP  45           H        ASP  45   0.835  -4.843  14.229
  325    HA   ASP  45           HA       ASP  45  -1.632  -4.543  12.731
  326    HB2  ASP  45           HB2      ASP  45  -2.628  -5.804  14.608
  327    HB3  ASP  45           HB3      ASP  45  -1.228  -6.625  13.932
  328    H    GLY  46           H        GLY  46  -2.691  -2.678  12.785
  329    HA2  GLY  46           HA2      GLY  46  -4.117  -1.155  13.968
  330    HA3  GLY  46           HA3      GLY  46  -3.068  -1.307  15.369
  331    H    GLN  47           H        GLN  47  -1.086  -1.009  12.703
  332    HA   GLN  47           HA       GLN  47  -0.107   1.539  13.392
  333    HB2  GLN  47           HB2      GLN  47   1.156  -0.253  12.199
  334    HB3  GLN  47           HB3      GLN  47   0.197   0.073  10.759
  335    HG2  GLN  47           HG2      GLN  47   2.341   1.248  10.629
  336    HG3  GLN  47           HG3      GLN  47   1.027   2.405  10.755
  337   HE21  GLN  47          HE21      GLN  47   1.677   4.099  12.093
  338   HE22  GLN  47          HE22      GLN  47   2.571   3.917  13.525
  339    H    THR  48           H        THR  48  -0.660   3.546  12.795
  340    HA   THR  48           HA       THR  48  -3.030   3.934  11.143
  341    HB   THR  48           HB       THR  48  -1.309   5.958  12.612
  342    HG1  THR  48           HG1      THR  48  -2.373   5.358  14.302
  343   HG21  THR  48          HG21      THR  48  -2.667   6.966  10.822
  344   HG22  THR  48          HG22      THR  48  -3.310   7.405  12.404
  345   HG23  THR  48          HG23      THR  48  -4.104   6.156  11.445
  346    H    VAL  49           H        VAL  49  -3.001   4.489   9.058
  347    HA   VAL  49           HA       VAL  49  -0.619   5.798   7.936
  348    HB   VAL  49           HB       VAL  49  -0.573   4.240   6.013
  349   HG11  VAL  49          HG11      VAL  49  -0.323   2.722   8.618
  350   HG12  VAL  49          HG12      VAL  49   0.832   3.959   8.120
  351   HG13  VAL  49          HG13      VAL  49   0.619   2.507   7.142
  352   HG21  VAL  49          HG21      VAL  49  -1.751   2.034   6.300
  353   HG22  VAL  49          HG22      VAL  49  -2.851   3.390   6.055
  354   HG23  VAL  49          HG23      VAL  49  -2.616   2.725   7.671
  355    H    GLU  50           H        GLU  50  -0.961   6.409   5.617
  356    HA   GLU  50           HA       GLU  50  -3.740   7.340   5.185
  357    HB2  GLU  50           HB2      GLU  50  -1.140   8.644   4.314
  358    HB3  GLU  50           HB3      GLU  50  -2.758   9.231   3.924
  359    HG2  GLU  50           HG2      GLU  50  -3.236   9.493   6.339
  360    HG3  GLU  50           HG3      GLU  50  -1.608   8.933   6.716
  361    H    TYR  51           H        TYR  51  -4.623   6.967   3.153
  362    HA   TYR  51           HA       TYR  51  -2.961   5.938   1.004
  363    HB2  TYR  51           HB2      TYR  51  -4.184   3.807   0.802
  364    HB3  TYR  51           HB3      TYR  51  -3.314   3.914   2.326
  365    HD1  TYR  51           HD1      TYR  51  -6.633   3.950   0.728
  366    HD2  TYR  51           HD2      TYR  51  -4.506   4.183   4.451
  367    HE1  TYR  51           HE1      TYR  51  -8.754   3.590   1.961
  368    HE2  TYR  51           HE2      TYR  51  -6.627   3.822   5.684
  369    HH   TYR  51           HH       TYR  51  -9.341   2.612   4.357
  370    H    GLU  52           H        GLU  52  -4.184   5.421  -0.945
  371    HA   GLU  52           HA       GLU  52  -6.654   7.040  -1.188
  372    HB2  GLU  52           HB2      GLU  52  -4.634   7.962  -2.397
  373    HB3  GLU  52           HB3      GLU  52  -4.628   6.494  -3.373
  374    HG2  GLU  52           HG2      GLU  52  -6.931   6.978  -4.122
  375    HG3  GLU  52           HG3      GLU  52  -6.937   8.447  -3.151
  376    H    VAL  53           H        VAL  53  -8.410   5.968  -1.895
  377    HA   VAL  53           HA       VAL  53  -8.171   3.113  -2.461
  378    HB   VAL  53           HB       VAL  53 -10.630   4.876  -2.183
  379   HG11  VAL  53          HG11      VAL  53 -11.846   2.743  -1.909
  380   HG12  VAL  53          HG12      VAL  53 -10.352   1.851  -2.200
  381   HG13  VAL  53          HG13      VAL  53 -11.065   2.822  -3.488
  382   HG21  VAL  53          HG21      VAL  53  -9.070   3.167  -0.237
  383   HG22  VAL  53          HG22      VAL  53 -10.768   3.556   0.043
  384   HG23  VAL  53          HG23      VAL  53  -9.570   4.847  -0.060
  385    H    GLY  54           H        GLY  54  -7.956   2.365  -4.450
  386    HA2  GLY  54           HA2      GLY  54  -9.142   3.886  -6.705
  387    HA3  GLY  54           HA3      GLY  54  -7.582   3.076  -6.820
  388    H    GLN  55           H        GLN  55 -10.867   2.788  -7.385
  389    HA   GLN  55           HA       GLN  55 -11.448   0.099  -6.921
  390    HB2  GLN  55           HB2      GLN  55 -13.105   1.852  -7.575
  391    HB3  GLN  55           HB3      GLN  55 -12.454   1.807  -9.215
  392    HG2  GLN  55           HG2      GLN  55 -13.026  -0.597  -9.368
  393    HG3  GLN  55           HG3      GLN  55 -13.698  -0.538  -7.739
  394   HE21  GLN  55          HE21      GLN  55 -15.936  -0.385  -7.807
  395   HE22  GLN  55          HE22      GLN  55 -16.820   0.482  -8.967
  396    H    GLY  56           H        GLY  56 -11.127  -1.757  -8.028
  397    HA2  GLY  56           HA2      GLY  56  -9.880  -1.754 -10.667
  398    HA3  GLY  56           HA3      GLY  56  -8.930  -2.448  -9.355
  399    H    GLN  57           H        GLN  57  -9.384  -4.175 -11.240
  400    HA   GLN  57           HA       GLN  57 -11.838  -5.565 -11.283
  401    HB2  GLN  57           HB2      GLN  57  -9.014  -6.420 -11.936
  402    HB3  GLN  57           HB3      GLN  57 -10.427  -7.444 -12.212
  403    HG2  GLN  57           HG2      GLN  57 -11.399  -5.820 -13.710
  404    HG3  GLN  57           HG3      GLN  57 -10.163  -4.632 -13.305
  405   HE21  GLN  57          HE21      GLN  57 -10.817  -5.862 -15.988
  406   HE22  GLN  57          HE22      GLN  57  -9.364  -6.558 -16.522
  407    H    LYS  58           H        LYS  58  -8.942  -5.949  -9.294
  408    HA   LYS  58           HA       LYS  58 -10.073  -8.242  -7.882
  409    HB2  LYS  58           HB2      LYS  58  -7.455  -6.772  -7.478
  410    HB3  LYS  58           HB3      LYS  58  -7.926  -8.262  -6.666
  411    HG2  LYS  58           HG2      LYS  58  -7.754  -8.006  -9.681
  412    HG3  LYS  58           HG3      LYS  58  -6.413  -8.570  -8.686
  413    HD2  LYS  58           HD2      LYS  58  -7.851 -10.398  -7.814
  414    HD3  LYS  58           HD3      LYS  58  -9.160  -9.851  -8.859
  415    HE2  LYS  58           HE2      LYS  58  -7.982 -11.696  -9.942
  416    HE3  LYS  58           HE3      LYS  58  -7.687 -10.206 -10.837
  417    HZ1  LYS  58           HZ1      LYS  58  -5.670 -11.566 -10.418
  418    HZ2  LYS  58           HZ2      LYS  58  -5.860 -11.271  -8.755
  419    HZ3  LYS  58           HZ3      LYS  58  -5.564  -9.981  -9.821
  420    H    GLY  59           H        GLY  59 -11.155  -5.379  -7.719
  421    HA2  GLY  59           HA2      GLY  59 -12.454  -4.439  -5.996
  422    HA3  GLY  59           HA3      GLY  59 -11.521  -5.360  -4.819
  423    HA   PRO  60           HA       PRO  60 -10.026  -0.766  -5.416
  424    HB2  PRO  60           HB2      PRO  60 -11.085  -0.500  -2.638
  425    HB3  PRO  60           HB3      PRO  60 -11.125   0.660  -3.979
  426    HG2  PRO  60           HG2      PRO  60 -13.311  -0.625  -3.275
  427    HG3  PRO  60           HG3      PRO  60 -12.928  -0.362  -4.986
  428    HD2  PRO  60           HD2      PRO  60 -12.614  -2.872  -3.351
  429    HD3  PRO  60           HD3      PRO  60 -13.195  -2.686  -5.024
  430    H    CYS  61           H        CYS  61  -8.011  -0.264  -4.777
  431    HA   CYS  61           HA       CYS  61  -6.782  -1.841  -2.591
  432    HB2  CYS  61           HB2      CYS  61  -5.495  -0.764  -5.116
  433    HB3  CYS  61           HB3      CYS  61  -4.659  -1.638  -3.833
  434    HG   CYS  61           HG       CYS  61  -6.992  -3.013  -5.396
  435    H    ALA  62           H        ALA  62  -4.775  -0.672  -1.686
  436    HA   ALA  62           HA       ALA  62  -5.354   2.231  -1.505
  437    HB1  ALA  62           HB1      ALA  62  -4.957   0.188   0.595
  438    HB2  ALA  62           HB2      ALA  62  -5.849   1.706   0.650
  439    HB3  ALA  62           HB3      ALA  62  -4.098   1.707   0.850
  440    H    ASN  63           H        ASN  63  -3.740   3.502  -2.151
  441    HA   ASN  63           HA       ASN  63  -0.982   2.406  -2.145
  442    HB2  ASN  63           HB2      ASN  63  -0.567   3.738  -4.186
  443    HB3  ASN  63           HB3      ASN  63  -1.821   2.527  -4.439
  444   HD21  ASN  63          HD21      ASN  63  -3.380   3.452  -5.778
  445   HD22  ASN  63          HD22      ASN  63  -4.011   5.016  -5.593
  446    H    LYS  64           H        LYS  64   0.590   4.433  -2.548
  447    HA   LYS  64           HA       LYS  64   1.571   6.260  -1.548
  448    HB2  LYS  64           HB2      LYS  64  -1.301   7.228  -1.315
  449    HB3  LYS  64           HB3      LYS  64   0.140   8.230  -1.164
  450    HG2  LYS  64           HG2      LYS  64  -0.464   6.617  -3.655
  451    HG3  LYS  64           HG3      LYS  64  -1.027   8.271  -3.444
  452    HD2  LYS  64           HD2      LYS  64   1.889   7.512  -3.163
  453    HD3  LYS  64           HD3      LYS  64   1.181   7.985  -4.705
  454    HE2  LYS  64           HE2      LYS  64   0.409  10.118  -3.631
  455    HE3  LYS  64           HE3      LYS  64   1.286   9.653  -2.174
  456    HZ1  LYS  64           HZ1      LYS  64   3.296   9.946  -3.170
  457    HZ2  LYS  64           HZ2      LYS  64   2.401  11.123  -4.008
  458    HZ3  LYS  64           HZ3      LYS  64   2.715   9.617  -4.730
  459    H    VAL  65           H        VAL  65   1.427   4.138   0.060
  460    HA   VAL  65           HA       VAL  65   0.063   4.584   2.534
  461    HB   VAL  65           HB       VAL  65   2.403   2.758   1.893
  462   HG11  VAL  65          HG11      VAL  65   0.430   2.669   4.199
  463   HG12  VAL  65          HG12      VAL  65   2.112   3.184   4.329
  464   HG13  VAL  65          HG13      VAL  65   1.732   1.516   3.899
  465   HG21  VAL  65          HG21      VAL  65   0.788   1.046   1.487
  466   HG22  VAL  65          HG22      VAL  65   0.224   2.451   0.584
  467   HG23  VAL  65          HG23      VAL  65  -0.527   2.034   2.123
  468    H    VAL  66           H        VAL  66   0.543   6.084   3.928
  469    HA   VAL  66           HA       VAL  66   3.379   6.837   4.377
  470    HB   VAL  66           HB       VAL  66   0.949   8.659   4.504
  471   HG11  VAL  66          HG11      VAL  66   2.669  10.454   4.803
  472   HG12  VAL  66          HG12      VAL  66   3.901   9.202   4.960
  473   HG13  VAL  66          HG13      VAL  66   2.612   9.326   6.158
  474   HG21  VAL  66          HG21      VAL  66   1.872   9.736   2.537
  475   HG22  VAL  66          HG22      VAL  66   1.737   8.011   2.197
  476   HG23  VAL  66          HG23      VAL  66   3.306   8.711   2.594
  477    H    ALA  67           H        ALA  67   4.062   6.389   6.363
  478    HA   ALA  67           HA       ALA  67   2.265   5.470   8.408
  479    HB1  ALA  67           HB1      ALA  67   5.243   5.996   8.391
  480    HB2  ALA  67           HB2      ALA  67   4.433   4.436   8.254
  481    HB3  ALA  67           HB3      ALA  67   4.375   5.329   9.773
  482    H    VAL  68           H        VAL  68   1.486   6.529  10.137
  483    HA   VAL  68           HA       VAL  68   2.568   9.167  10.848
  484    HB   VAL  68           HB       VAL  68  -0.391   8.694  10.340
  485   HG11  VAL  68          HG11      VAL  68  -0.514  11.172  10.675
  486   HG12  VAL  68          HG12      VAL  68   1.185  11.161  11.147
  487   HG13  VAL  68          HG13      VAL  68  -0.010  10.310  12.128
  488   HG21  VAL  68          HG21      VAL  68   1.736  10.165   8.753
  489   HG22  VAL  68          HG22      VAL  68   0.007  10.432   8.518
  490   HG23  VAL  68          HG23      VAL  68   0.705   8.845   8.201
  Start of MODEL    5
    1    H1   MET   1           HT1      MET   1  -8.884  14.173   1.622
    2    H2   MET   1           HT2      MET   1  -7.542  14.814   0.803
    3    H3   MET   1           HT3      MET   1  -7.513  14.653   2.495
    4    HA   MET   1           HA       MET   1  -7.436  12.507   0.457
    5    HB2  MET   1           HB2      MET   1  -5.606  13.411   2.696
    6    HB3  MET   1           HB3      MET   1  -5.393  11.893   1.823
    7    HG2  MET   1           HG2      MET   1  -5.149  13.083  -0.285
    8    HG3  MET   1           HG3      MET   1  -5.504  14.620   0.505
    9    HE1  MET   1           HE1      MET   1  -3.183  11.540   1.739
   10    HE2  MET   1           HE2      MET   1  -1.771  12.011   0.797
   11    HE3  MET   1           HE3      MET   1  -3.299  11.690  -0.020
   12    H    SER   2           H        SER   2  -6.886  10.374   1.773
   13    HA   SER   2           HA       SER   2  -8.834  10.113   3.987
   14    HB2  SER   2           HB2      SER   2  -8.338   8.165   1.724
   15    HB3  SER   2           HB3      SER   2  -9.377   7.863   3.113
   16    HG   SER   2           HG       SER   2  -9.774   9.447   0.886
   17    H    LYS   3           H        LYS   3  -8.372   8.520   5.549
   18    HA   LYS   3           HA       LYS   3  -5.857   7.068   5.463
   19    HB2  LYS   3           HB2      LYS   3  -4.929   8.099   7.487
   20    HB3  LYS   3           HB3      LYS   3  -5.119   9.290   6.206
   21    HG2  LYS   3           HG2      LYS   3  -7.235  10.058   7.226
   22    HG3  LYS   3           HG3      LYS   3  -7.036   8.869   8.516
   23    HD2  LYS   3           HD2      LYS   3  -4.913   9.940   9.179
   24    HD3  LYS   3           HD3      LYS   3  -5.110  11.129   7.892
   25    HE2  LYS   3           HE2      LYS   3  -7.213  11.903   8.919
   26    HE3  LYS   3           HE3      LYS   3  -7.027  10.709  10.205
   27    HZ1  LYS   3           HZ1      LYS   3  -6.184  12.735  11.031
   28    HZ2  LYS   3           HZ2      LYS   3  -5.288  13.037   9.621
   29    HZ3  LYS   3           HZ3      LYS   3  -4.828  11.785  10.671
   30    H    GLY   4           H        GLY   4  -5.867   5.301   6.755
   31    HA2  GLY   4           HA2      GLY   4  -8.096   4.982   8.677
   32    HA3  GLY   4           HA3      GLY   4  -7.771   3.747   7.464
   33    H    ILE   5           H        ILE   5  -7.641   2.459   9.533
   34    HA   ILE   5           HA       ILE   5  -4.878   2.568  10.606
   35    HB   ILE   5           HB       ILE   5  -5.821   1.364  12.614
   36   HG12  ILE   5          HG12      ILE   5  -8.511   2.367  11.643
   37   HG13  ILE   5          HG13      ILE   5  -7.979   0.717  11.336
   38   HG21  ILE   5          HG21      ILE   5  -5.335   3.836  12.477
   39   HG22  ILE   5          HG22      ILE   5  -6.569   3.405  13.659
   40   HG23  ILE   5          HG23      ILE   5  -7.040   4.091  12.103
   41   HD11  ILE   5          HD11      ILE   5  -7.694   0.349  13.759
   42   HD12  ILE   5          HD12      ILE   5  -9.345   0.854  13.397
   43   HD13  ILE   5          HD13      ILE   5  -8.197   2.011  14.074
   44    H    VAL   6           H        VAL   6  -3.639   0.887  10.286
   45    HA   VAL   6           HA       VAL   6  -4.462  -1.225   8.583
   46    HB   VAL   6           HB       VAL   6  -1.921  -0.950  10.218
   47   HG11  VAL   6          HG11      VAL   6  -2.034  -3.224   9.547
   48   HG12  VAL   6          HG12      VAL   6  -1.051  -2.455   8.301
   49   HG13  VAL   6          HG13      VAL   6  -2.748  -2.817   7.986
   50   HG21  VAL   6          HG21      VAL   6  -0.957   0.073   8.282
   51   HG22  VAL   6          HG22      VAL   6  -2.502   0.886   8.520
   52   HG23  VAL   6          HG23      VAL   6  -2.339  -0.352   7.275
   53    H    LYS   7           H        LYS   7  -5.494  -3.001   9.071
   54    HA   LYS   7           HA       LYS   7  -6.119  -3.804  11.736
   55    HB2  LYS   7           HB2      LYS   7  -7.559  -4.317   9.751
   56    HB3  LYS   7           HB3      LYS   7  -6.331  -5.460   9.203
   57    HG2  LYS   7           HG2      LYS   7  -6.572  -6.732  11.313
   58    HG3  LYS   7           HG3      LYS   7  -7.806  -5.597  11.856
   59    HD2  LYS   7           HD2      LYS   7  -8.066  -7.151   9.273
   60    HD3  LYS   7           HD3      LYS   7  -8.662  -7.770  10.812
   61    HE2  LYS   7           HE2      LYS   7 -10.026  -5.680  11.064
   62    HE3  LYS   7           HE3      LYS   7  -9.509  -5.197   9.449
   63    HZ1  LYS   7           HZ1      LYS   7 -10.431  -7.339   8.639
   64    HZ2  LYS   7           HZ2      LYS   7 -11.602  -6.279   9.264
   65    HZ3  LYS   7           HZ3      LYS   7 -11.075  -7.605  10.184
   66    H    TRP   8           H        TRP   8  -3.865  -4.994   9.266
   67    HA   TRP   8           HA       TRP   8  -2.024  -5.962  11.262
   68    HB2  TRP   8           HB2      TRP   8  -3.868  -7.765  10.968
   69    HB3  TRP   8           HB3      TRP   8  -3.145  -8.043   9.386
   70    HD1  TRP   8           HD1      TRP   8  -0.708  -9.084   9.302
   71    HE1  TRP   8           HE1      TRP   8   0.683 -10.363  11.055
   72    HE3  TRP   8           HE3      TRP   8  -3.357  -7.962  13.519
   73    HZ2  TRP   8           HZ2      TRP   8   0.671 -10.851  13.873
   74    HZ3  TRP   8           HZ3      TRP   8  -2.649  -8.849  15.722
   75    HH2  TRP   8           HH2      TRP   8  -0.639 -10.291  15.905
   76    H    PHE   9           H        PHE   9  -0.025  -5.641  10.449
   77    HA   PHE   9           HA       PHE   9   0.274  -5.579   7.488
   78    HB2  PHE   9           HB2      PHE   9   0.718  -3.421   8.795
   79    HB3  PHE   9           HB3      PHE   9   2.138  -4.239   9.454
   80    HD1  PHE   9           HD1      PHE   9   0.707  -2.579   6.557
   81    HD2  PHE   9           HD2      PHE   9   3.907  -5.122   7.879
   82    HE1  PHE   9           HE1      PHE   9   1.955  -2.088   4.473
   83    HE2  PHE   9           HE2      PHE   9   5.157  -4.625   5.795
   84    HZ   PHE   9           HZ       PHE   9   4.183  -3.111   4.093
   85    H    ASN  10           H        ASN  10   1.518  -7.129   6.597
   86    HA   ASN  10           HA       ASN  10   3.564  -8.435   8.296
   87    HB2  ASN  10           HB2      ASN  10   1.540  -9.745   6.483
   88    HB3  ASN  10           HB3      ASN  10   2.998 -10.566   7.031
   89   HD21  ASN  10          HD21      ASN  10   0.290 -11.395   7.741
   90   HD22  ASN  10          HD22      ASN  10   0.139 -11.227   9.422
   91    H    SER  11           H        SER  11   5.341  -7.453   7.418
   92    HA   SER  11           HA       SER  11   5.769  -6.924   4.691
   93    HB2  SER  11           HB2      SER  11   7.737  -7.335   6.952
   94    HB3  SER  11           HB3      SER  11   8.162  -6.718   5.358
   95    HG   SER  11           HG       SER  11   7.763  -4.955   6.609
   96    H    ASP  12           H        ASP  12   6.562  -9.732   6.710
   97    HA   ASP  12           HA       ASP  12   8.247 -11.099   4.931
   98    HB2  ASP  12           HB2      ASP  12   6.296 -12.125   7.006
   99    HB3  ASP  12           HB3      ASP  12   7.401 -13.175   6.123
  100    H    LYS  13           H        LYS  13   4.713 -11.106   5.242
  101    HA   LYS  13           HA       LYS  13   4.286 -12.935   3.059
  102    HB2  LYS  13           HB2      LYS  13   2.433 -11.027   4.509
  103    HB3  LYS  13           HB3      LYS  13   1.905 -12.170   3.271
  104    HG2  LYS  13           HG2      LYS  13   2.726 -14.048   4.603
  105    HG3  LYS  13           HG3      LYS  13   3.369 -12.941   5.816
  106    HD2  LYS  13           HD2      LYS  13   1.290 -13.669   6.708
  107    HD3  LYS  13           HD3      LYS  13   0.960 -12.064   6.051
  108    HE2  LYS  13           HE2      LYS  13  -0.827 -13.492   5.317
  109    HE3  LYS  13           HE3      LYS  13   0.207 -13.212   3.918
  110    HZ1  LYS  13           HZ1      LYS  13  -0.240 -15.649   5.436
  111    HZ2  LYS  13           HZ2      LYS  13   1.357 -15.376   4.927
  112    HZ3  LYS  13           HZ3      LYS  13   0.100 -15.444   3.787
  113    H    GLY  14           H        GLY  14   4.668  -9.505   3.478
  114    HA2  GLY  14           HA2      GLY  14   5.373  -7.995   1.810
  115    HA3  GLY  14           HA3      GLY  14   4.785  -9.104   0.582
  116    H    PHE  15           H        PHE  15   2.438  -8.732   3.003
  117    HA   PHE  15           HA       PHE  15   1.276  -6.285   2.005
  118    HB2  PHE  15           HB2      PHE  15  -0.780  -7.302   1.119
  119    HB3  PHE  15           HB3      PHE  15   0.638  -7.782   0.194
  120    HD1  PHE  15           HD1      PHE  15  -1.959  -8.894   2.552
  121    HD2  PHE  15           HD2      PHE  15   1.502 -10.068   0.294
  122    HE1  PHE  15           HE1      PHE  15  -2.512 -11.279   2.944
  123    HE2  PHE  15           HE2      PHE  15   0.949 -12.453   0.687
  124    HZ   PHE  15           HZ       PHE  15  -1.059 -13.058   2.011
  125    H    GLY  16           H        GLY  16  -1.025  -6.032   2.885
  126    HA2  GLY  16           HA2      GLY  16  -1.603  -7.423   5.358
  127    HA3  GLY  16           HA3      GLY  16  -1.074  -5.756   5.571
  128    H    PHE  17           H        PHE  17  -3.514  -6.303   6.469
  129    HA   PHE  17           HA       PHE  17  -5.392  -5.297   4.408
  130    HB2  PHE  17           HB2      PHE  17  -5.938  -6.913   6.916
  131    HB3  PHE  17           HB3      PHE  17  -7.178  -6.265   5.846
  132    HD1  PHE  17           HD1      PHE  17  -4.514  -8.771   6.223
  133    HD2  PHE  17           HD2      PHE  17  -7.521  -7.182   3.601
  134    HE1  PHE  17           HE1      PHE  17  -4.301 -10.769   4.770
  135    HE2  PHE  17           HE2      PHE  17  -7.311  -9.180   2.149
  136    HZ   PHE  17           HZ       PHE  17  -5.699 -10.973   2.732
  137    H    ILE  18           H        ILE  18  -6.389  -3.366   4.796
  138    HA   ILE  18           HA       ILE  18  -5.849  -2.108   7.408
  139    HB   ILE  18           HB       ILE  18  -4.679  -1.018   5.543
  140   HG12  ILE  18          HG12      ILE  18  -6.947   0.791   6.406
  141   HG13  ILE  18          HG13      ILE  18  -5.704   0.261   7.540
  142   HG21  ILE  18          HG21      ILE  18  -7.481  -0.806   4.426
  143   HG22  ILE  18          HG22      ILE  18  -6.040  -1.466   3.650
  144   HG23  ILE  18          HG23      ILE  18  -6.188   0.273   3.900
  145   HD11  ILE  18          HD11      ILE  18  -3.961   1.203   6.077
  146   HD12  ILE  18          HD12      ILE  18  -5.123   2.447   6.535
  147   HD13  ILE  18          HD13      ILE  18  -5.192   1.721   4.928
  148    H    THR  19           H        THR  19  -7.415  -1.113   8.522
  149    HA   THR  19           HA       THR  19 -10.160  -1.745   7.749
  150    HB   THR  19           HB       THR  19  -9.035  -0.761  10.377
  151    HG1  THR  19           HG1      THR  19  -9.219  -2.926  10.969
  152   HG21  THR  19          HG21      THR  19 -11.416  -0.256  10.166
  153   HG22  THR  19          HG22      THR  19 -11.212  -1.613  11.274
  154   HG23  THR  19          HG23      THR  19 -11.745  -1.900   9.617
  155    HA   PRO  20           HA       PRO  20 -10.341   2.687   6.472
  156    HB2  PRO  20           HB2      PRO  20 -13.198   1.880   6.077
  157    HB3  PRO  20           HB3      PRO  20 -12.125   2.775   4.985
  158    HG2  PRO  20           HG2      PRO  20 -12.691   0.263   4.484
  159    HG3  PRO  20           HG3      PRO  20 -11.030   0.855   4.280
  160    HD2  PRO  20           HD2      PRO  20 -12.178  -0.783   6.525
  161    HD3  PRO  20           HD3      PRO  20 -10.599  -0.934   5.714
  162    H    GLU  21           H        GLU  21 -10.683   4.358   7.859
  163    HA   GLU  21           HA       GLU  21 -11.841   3.998  10.414
  164    HB2  GLU  21           HB2      GLU  21 -11.558   6.428  10.675
  165    HB3  GLU  21           HB3      GLU  21 -10.116   5.688   9.986
  166    HG2  GLU  21           HG2      GLU  21 -10.838   6.379   7.725
  167    HG3  GLU  21           HG3      GLU  21 -12.285   7.113   8.411
  168    H    ASP  22           H        ASP  22 -13.159   5.112   7.368
  169    HA   ASP  22           HA       ASP  22 -15.546   6.297   8.357
  170    HB2  ASP  22           HB2      ASP  22 -14.572   6.623   6.061
  171    HB3  ASP  22           HB3      ASP  22 -15.139   5.003   5.657
  172    H    GLY  23           H        GLY  23 -14.573   3.004   7.953
  173    HA2  GLY  23           HA2      GLY  23 -15.816   1.248   9.057
  174    HA3  GLY  23           HA3      GLY  23 -17.299   2.106   8.655
  175    H    SER  24           H        SER  24 -15.134   2.178   6.053
  176    HA   SER  24           HA       SER  24 -16.784   0.501   4.426
  177    HB2  SER  24           HB2      SER  24 -14.104   1.797   3.892
  178    HB3  SER  24           HB3      SER  24 -15.073   0.972   2.681
  179    HG   SER  24           HG       SER  24 -16.087   2.793   2.487
  180    H    LYS  25           H        LYS  25 -15.727  -1.205   3.024
  181    HA   LYS  25           HA       LYS  25 -14.811  -3.333   4.658
  182    HB2  LYS  25           HB2      LYS  25 -14.788  -3.076   1.639
  183    HB3  LYS  25           HB3      LYS  25 -14.562  -4.572   2.538
  184    HG2  LYS  25           HG2      LYS  25 -17.044  -2.844   2.756
  185    HG3  LYS  25           HG3      LYS  25 -16.912  -4.223   1.671
  186    HD2  LYS  25           HD2      LYS  25 -16.441  -5.689   3.629
  187    HD3  LYS  25           HD3      LYS  25 -16.662  -4.301   4.695
  188    HE2  LYS  25           HE2      LYS  25 -18.973  -4.030   3.866
  189    HE3  LYS  25           HE3      LYS  25 -18.755  -5.422   2.806
  190    HZ1  LYS  25           HZ1      LYS  25 -18.095  -6.606   4.987
  191    HZ2  LYS  25           HZ2      LYS  25 -19.739  -6.351   4.648
  192    HZ3  LYS  25           HZ3      LYS  25 -18.928  -5.336   5.743
  193    H    ASP  26           H        ASP  26 -12.811  -4.440   4.629
  194    HA   ASP  26           HA       ASP  26 -10.538  -2.848   4.843
  195    HB2  ASP  26           HB2      ASP  26 -10.861  -5.823   4.450
  196    HB3  ASP  26           HB3      ASP  26  -9.302  -5.062   4.744
  197    H    LEU  27           H        LEU  27  -8.780  -2.458   3.568
  198    HA   LEU  27           HA       LEU  27  -9.082  -3.072   0.686
  199    HB2  LEU  27           HB2      LEU  27  -7.718  -0.702   1.998
  200    HB3  LEU  27           HB3      LEU  27  -7.822  -0.994   0.265
  201    HG   LEU  27           HG       LEU  27 -10.245  -0.680   2.073
  202   HD11  LEU  27          HD11      LEU  27  -8.762   1.311   0.335
  203   HD12  LEU  27          HD12      LEU  27  -9.097   1.430   2.062
  204   HD13  LEU  27          HD13      LEU  27 -10.415   1.569   0.899
  205   HD21  LEU  27          HD21      LEU  27 -10.806  -1.895   0.063
  206   HD22  LEU  27          HD22      LEU  27  -9.852  -0.797  -0.935
  207   HD23  LEU  27          HD23      LEU  27 -11.343  -0.233  -0.183
  208    H    PHE  28           H        PHE  28  -7.220  -3.622  -0.496
  209    HA   PHE  28           HA       PHE  28  -5.202  -5.032   1.035
  210    HB2  PHE  28           HB2      PHE  28  -5.690  -4.705  -1.930
  211    HB3  PHE  28           HB3      PHE  28  -4.348  -5.639  -1.264
  212    HD1  PHE  28           HD1      PHE  28  -8.011  -5.446  -1.644
  213    HD2  PHE  28           HD2      PHE  28  -4.728  -7.739  -0.089
  214    HE1  PHE  28           HE1      PHE  28  -9.517  -7.391  -1.330
  215    HE2  PHE  28           HE2      PHE  28  -6.235  -9.682   0.227
  216    HZ   PHE  28           HZ       PHE  28  -8.629  -9.509  -0.393
  217    H    VAL  29           H        VAL  29  -3.210  -4.356   1.501
  218    HA   VAL  29           HA       VAL  29  -2.076  -2.056   0.036
  219    HB   VAL  29           HB       VAL  29  -2.110  -2.420   3.045
  220   HG11  VAL  29          HG11      VAL  29  -1.022  -0.077   2.930
  221   HG12  VAL  29          HG12      VAL  29  -0.663  -0.468   1.248
  222   HG13  VAL  29          HG13      VAL  29   0.008  -1.455   2.543
  223   HG21  VAL  29          HG21      VAL  29  -3.217  -0.130   1.414
  224   HG22  VAL  29          HG22      VAL  29  -3.520  -0.500   3.112
  225   HG23  VAL  29          HG23      VAL  29  -4.196  -1.530   1.851
  226    H    HIS  30           H        HIS  30   0.034  -2.298  -0.521
  227    HA   HIS  30           HA       HIS  30   1.422  -4.736   0.428
  228    HB2  HIS  30           HB2      HIS  30   1.753  -3.217  -2.173
  229    HB3  HIS  30           HB3      HIS  30   2.676  -4.642  -1.700
  230    HD2  HIS  30           HD2      HIS  30  -0.591  -3.830  -3.500
  231    HE1  HIS  30           HE1      HIS  30  -0.894  -7.877  -2.344
  232    HE2  HIS  30           HE2      HIS  30  -1.931  -6.053  -3.773
  233    H    HIS  31           H        HIS  31   3.727  -4.628   0.676
  234    HA   HIS  31           HA       HIS  31   4.648  -2.369   2.126
  235    HB2  HIS  31           HB2      HIS  31   5.516  -4.716   2.394
  236    HB3  HIS  31           HB3      HIS  31   6.350  -4.527   0.849
  237    HD2  HIS  31           HD2      HIS  31   6.741  -3.381   4.573
  238    HE1  HIS  31           HE1      HIS  31   9.927  -1.693   2.371
  239    HE2  HIS  31           HE2      HIS  31   8.998  -2.078   4.704
  240    H    SER  32           H        SER  32   5.151  -3.476  -1.181
  241    HA   SER  32           HA       SER  32   7.065  -1.600  -2.013
  242    HB2  SER  32           HB2      SER  32   4.907  -3.022  -3.580
  243    HB3  SER  32           HB3      SER  32   6.203  -2.085  -4.314
  244    HG   SER  32           HG       SER  32   6.452  -4.493  -3.918
  245    H    GLU  33           H        GLU  33   3.543  -1.387  -1.840
  246    HA   GLU  33           HA       GLU  33   3.269   1.026  -3.315
  247    HB2  GLU  33           HB2      GLU  33   1.473  -0.321  -1.296
  248    HB3  GLU  33           HB3      GLU  33   1.010   1.115  -2.205
  249    HG2  GLU  33           HG2      GLU  33   1.846  -1.533  -3.427
  250    HG3  GLU  33           HG3      GLU  33   0.188  -0.960  -3.288
  251    H    ILE  34           H        ILE  34   4.115   0.416   0.038
  252    HA   ILE  34           HA       ILE  34   3.619   3.217   0.748
  253    HB   ILE  34           HB       ILE  34   2.933   1.527   2.388
  254   HG12  ILE  34          HG12      ILE  34   5.376   2.958   3.474
  255   HG13  ILE  34          HG13      ILE  34   3.876   3.796   3.098
  256   HG21  ILE  34          HG21      ILE  34   5.833   0.702   2.211
  257   HG22  ILE  34          HG22      ILE  34   4.392  -0.296   2.021
  258   HG23  ILE  34          HG23      ILE  34   4.841   0.306   3.615
  259   HD11  ILE  34          HD11      ILE  34   4.436   1.797   5.262
  260   HD12  ILE  34          HD12      ILE  34   2.798   1.906   4.617
  261   HD13  ILE  34          HD13      ILE  34   3.554   3.321   5.354
  262    H    GLN  35           H        GLN  35   5.135   4.706   1.112
  263    HA   GLN  35           HA       GLN  35   7.936   3.987   0.487
  264    HB2  GLN  35           HB2      GLN  35   6.772   5.493  -1.150
  265    HB3  GLN  35           HB3      GLN  35   6.584   6.676   0.143
  266    HG2  GLN  35           HG2      GLN  35   9.026   6.781   0.423
  267    HG3  GLN  35           HG3      GLN  35   9.233   5.569  -0.840
  268   HE21  GLN  35          HE21      GLN  35   9.973   8.583  -0.658
  269   HE22  GLN  35          HE22      GLN  35   9.360   9.224  -2.106
  270    H    SER  36           H        SER  36   9.535   4.635   1.854
  271    HA   SER  36           HA       SER  36   8.840   6.332   4.156
  272    HB2  SER  36           HB2      SER  36   9.933   4.788   5.695
  273    HB3  SER  36           HB3      SER  36   8.605   3.978   4.870
  274    HG   SER  36           HG       SER  36  11.323   3.542   4.742
  275    H    GLY  37           H        GLY  37  10.741   7.117   5.319
  276    HA2  GLY  37           HA2      GLY  37  12.659   8.266   3.619
  277    HA3  GLY  37           HA3      GLY  37  12.753   8.221   5.375
  278    H    GLY  38           H        GLY  38  12.803   5.398   5.696
  279    HA2  GLY  38           HA2      GLY  38  15.049   4.363   4.166
  280    HA3  GLY  38           HA3      GLY  38  15.398   4.716   5.854
  281    H    GLU  39           H        GLU  39  15.800   2.223   5.285
  282    HA   GLU  39           HA       GLU  39  13.604   0.448   5.284
  283    HB2  GLU  39           HB2      GLU  39  15.245  -1.277   5.856
  284    HB3  GLU  39           HB3      GLU  39  15.864  -0.216   4.593
  285    HG2  GLU  39           HG2      GLU  39  17.108   1.074   6.326
  286    HG3  GLU  39           HG3      GLU  39  16.537  -0.052   7.550
  287    H    TYR  40           H        TYR  40  14.840   2.391   7.812
  288    HA   TYR  40           HA       TYR  40  14.387   0.784  10.080
  289    HB2  TYR  40           HB2      TYR  40  14.175   3.781   9.736
  290    HB3  TYR  40           HB3      TYR  40  14.154   2.953  11.291
  291    HD1  TYR  40           HD1      TYR  40  16.221   3.942   8.422
  292    HD2  TYR  40           HD2      TYR  40  16.149   1.784  12.134
  293    HE1  TYR  40           HE1      TYR  40  18.700   3.871   8.428
  294    HE2  TYR  40           HE2      TYR  40  18.628   1.713  12.141
  295    HH   TYR  40           HH       TYR  40  20.477   1.876   9.994
  296    H    ALA  41           H        ALA  41  12.221   2.859   8.201
  297    HA   ALA  41           HA       ALA  41  10.009   2.840   9.925
  298    HB1  ALA  41           HB1      ALA  41  10.471   4.122   7.670
  299    HB2  ALA  41           HB2      ALA  41   8.819   3.764   8.172
  300    HB3  ALA  41           HB3      ALA  41   9.610   2.755   6.963
  301    H    THR  42           H        THR  42   8.584   1.363  10.467
  302    HA   THR  42           HA       THR  42   8.247  -1.054   8.804
  303    HB   THR  42           HB       THR  42   8.163  -2.434  10.853
  304    HG1  THR  42           HG1      THR  42   8.046  -1.465  12.684
  305   HG21  THR  42          HG21      THR  42  10.267  -2.525   9.806
  306   HG22  THR  42          HG22      THR  42  10.660  -2.106  11.472
  307   HG23  THR  42          HG23      THR  42  10.654  -0.858  10.228
  308    H    LEU  43           H        LEU  43   6.279  -2.307   9.491
  309    HA   LEU  43           HA       LEU  43   4.160  -0.619  10.629
  310    HB2  LEU  43           HB2      LEU  43   3.998  -2.053   7.970
  311    HB3  LEU  43           HB3      LEU  43   2.603  -1.415   8.829
  312    HG   LEU  43           HG       LEU  43   4.131   0.818   8.845
  313   HD11  LEU  43          HD11      LEU  43   4.873  -0.395   6.177
  314   HD12  LEU  43          HD12      LEU  43   5.943  -0.502   7.570
  315   HD13  LEU  43          HD13      LEU  43   5.497   1.074   6.926
  316   HD21  LEU  43          HD21      LEU  43   1.810   0.377   7.820
  317   HD22  LEU  43          HD22      LEU  43   2.663   0.061   6.308
  318   HD23  LEU  43          HD23      LEU  43   2.780   1.646   7.072
  319    H    ALA  44           H        ALA  44   2.481  -1.787  11.619
  320    HA   ALA  44           HA       ALA  44   2.671  -4.711  11.687
  321    HB1  ALA  44           HB1      ALA  44   2.583  -3.273  14.319
  322    HB2  ALA  44           HB2      ALA  44   4.135  -3.489  13.509
  323    HB3  ALA  44           HB3      ALA  44   3.168  -4.897  13.952
  324    H    ASP  45           H        ASP  45   0.910  -4.739  14.144
  325    HA   ASP  45           HA       ASP  45  -1.614  -4.369  12.764
  326    HB2  ASP  45           HB2      ASP  45  -1.170  -6.388  14.119
  327    HB3  ASP  45           HB3      ASP  45  -1.001  -5.383  15.550
  328    H    GLY  46           H        GLY  46  -2.486  -2.387  12.740
  329    HA2  GLY  46           HA2      GLY  46  -3.787  -0.754  13.950
  330    HA3  GLY  46           HA3      GLY  46  -2.642  -0.883  15.276
  331    H    GLN  47           H        GLN  47  -0.908  -0.824  12.402
  332    HA   GLN  47           HA       GLN  47   0.280   1.681  12.890
  333    HB2  GLN  47           HB2      GLN  47   1.296  -0.216  11.596
  334    HB3  GLN  47           HB3      GLN  47   0.201   0.166  10.267
  335    HG2  GLN  47           HG2      GLN  47   2.366   1.223   9.872
  336    HG3  GLN  47           HG3      GLN  47   1.151   2.457  10.175
  337   HE21  GLN  47          HE21      GLN  47   2.034   4.084  11.456
  338   HE22  GLN  47          HE22      GLN  47   3.100   3.831  12.753
  339    H    THR  48           H        THR  48  -0.307   3.691  12.373
  340    HA   THR  48           HA       THR  48  -2.801   4.143  10.926
  341    HB   THR  48           HB       THR  48  -0.921   6.114  12.267
  342    HG1  THR  48           HG1      THR  48  -1.827   4.640  13.721
  343   HG21  THR  48          HG21      THR  48  -3.005   7.546  12.282
  344   HG22  THR  48          HG22      THR  48  -3.751   6.363  11.209
  345   HG23  THR  48          HG23      THR  48  -2.333   7.264  10.676
  346    H    VAL  49           H        VAL  49  -2.925   4.692   8.831
  347    HA   VAL  49           HA       VAL  49  -0.604   5.969   7.548
  348    HB   VAL  49           HB       VAL  49  -0.767   4.450   5.602
  349   HG11  VAL  49          HG11      VAL  49   0.805   4.071   7.561
  350   HG12  VAL  49          HG12      VAL  49   0.434   2.633   6.609
  351   HG13  VAL  49          HG13      VAL  49  -0.357   2.890   8.163
  352   HG21  VAL  49          HG21      VAL  49  -3.129   3.736   5.965
  353   HG22  VAL  49          HG22      VAL  49  -2.615   2.834   7.391
  354   HG23  VAL  49          HG23      VAL  49  -2.039   2.360   5.793
  355    H    GLU  50           H        GLU  50  -1.075   6.791   5.383
  356    HA   GLU  50           HA       GLU  50  -3.876   7.737   5.137
  357    HB2  GLU  50           HB2      GLU  50  -1.325   9.068   4.143
  358    HB3  GLU  50           HB3      GLU  50  -2.960   9.710   3.987
  359    HG2  GLU  50           HG2      GLU  50  -3.144   9.800   6.461
  360    HG3  GLU  50           HG3      GLU  50  -1.497   9.195   6.596
  361    H    TYR  51           H        TYR  51  -4.902   7.023   3.299
  362    HA   TYR  51           HA       TYR  51  -3.276   6.301   0.964
  363    HB2  TYR  51           HB2      TYR  51  -4.352   4.102   0.752
  364    HB3  TYR  51           HB3      TYR  51  -3.442   4.230   2.251
  365    HD1  TYR  51           HD1      TYR  51  -6.806   4.087   0.755
  366    HD2  TYR  51           HD2      TYR  51  -4.577   4.347   4.419
  367    HE1  TYR  51           HE1      TYR  51  -8.854   3.546   2.043
  368    HE2  TYR  51           HE2      TYR  51  -6.626   3.804   5.704
  369    HH   TYR  51           HH       TYR  51  -9.194   4.073   5.265
  370    H    GLU  52           H        GLU  52  -4.525   5.763  -0.939
  371    HA   GLU  52           HA       GLU  52  -7.091   7.233  -1.060
  372    HB2  GLU  52           HB2      GLU  52  -5.147   8.280  -2.305
  373    HB3  GLU  52           HB3      GLU  52  -5.133   6.848  -3.336
  374    HG2  GLU  52           HG2      GLU  52  -6.458   8.562  -4.429
  375    HG3  GLU  52           HG3      GLU  52  -7.540   7.285  -3.882
  376    H    VAL  53           H        VAL  53  -8.806   6.106  -1.761
  377    HA   VAL  53           HA       VAL  53  -8.536   3.275  -2.263
  378    HB   VAL  53           HB       VAL  53 -10.386   4.192  -0.915
  379   HG11  VAL  53          HG11      VAL  53 -11.599   5.258  -3.467
  380   HG12  VAL  53          HG12      VAL  53 -10.623   6.275  -2.406
  381   HG13  VAL  53          HG13      VAL  53 -12.110   5.547  -1.804
  382   HG21  VAL  53          HG21      VAL  53 -11.329   2.880  -3.483
  383   HG22  VAL  53          HG22      VAL  53 -12.192   2.884  -1.945
  384   HG23  VAL  53          HG23      VAL  53 -10.655   2.028  -2.093
  385    H    GLY  54           H        GLY  54  -8.000   2.478  -4.136
  386    HA2  GLY  54           HA2      GLY  54  -8.814   3.828  -6.633
  387    HA3  GLY  54           HA3      GLY  54  -7.407   2.771  -6.471
  388    H    GLN  55           H        GLN  55  -8.611   1.742  -8.396
  389    HA   GLN  55           HA       GLN  55 -10.543  -0.239  -7.347
  390    HB2  GLN  55           HB2      GLN  55 -11.566  -0.298  -9.592
  391    HB3  GLN  55           HB3      GLN  55 -11.665   1.307  -8.871
  392    HG2  GLN  55           HG2      GLN  55  -9.268   0.757 -10.577
  393    HG3  GLN  55           HG3      GLN  55 -10.817   0.891 -11.403
  394   HE21  GLN  55          HE21      GLN  55 -10.404   2.968 -12.359
  395   HE22  GLN  55          HE22      GLN  55 -10.247   4.379 -11.431
  396    H    GLY  56           H        GLY  56 -10.543  -2.317  -8.366
  397    HA2  GLY  56           HA2      GLY  56  -8.302  -3.107 -10.029
  398    HA3  GLY  56           HA3      GLY  56  -8.258  -3.738  -8.383
  399    H    GLN  57           H        GLN  57  -8.383  -5.540 -10.394
  400    HA   GLN  57           HA       GLN  57 -10.954  -6.276 -11.292
  401    HB2  GLN  57           HB2      GLN  57  -8.425  -7.879 -10.890
  402    HB3  GLN  57           HB3      GLN  57  -9.878  -8.528 -11.654
  403    HG2  GLN  57           HG2      GLN  57  -9.800  -6.744 -13.344
  404    HG3  GLN  57           HG3      GLN  57  -8.364  -6.069 -12.574
  405   HE21  GLN  57          HE21      GLN  57  -6.767  -6.508 -14.153
  406   HE22  GLN  57          HE22      GLN  57  -6.413  -8.066 -14.726
  407    H    LYS  58           H        LYS  58  -9.091  -7.237  -8.426
  408    HA   LYS  58           HA       LYS  58 -11.162  -9.047  -7.503
  409    HB2  LYS  58           HB2      LYS  58  -8.604  -8.060  -6.229
  410    HB3  LYS  58           HB3      LYS  58  -9.691  -9.232  -5.482
  411    HG2  LYS  58           HG2      LYS  58  -9.428 -10.725  -7.430
  412    HG3  LYS  58           HG3      LYS  58  -8.335  -9.559  -8.177
  413    HD2  LYS  58           HD2      LYS  58  -6.785  -9.783  -6.270
  414    HD3  LYS  58           HD3      LYS  58  -7.876 -10.950  -5.521
  415    HE2  LYS  58           HE2      LYS  58  -7.617 -12.449  -7.462
  416    HE3  LYS  58           HE3      LYS  58  -6.534 -11.282  -8.221
  417    HZ1  LYS  58           HZ1      LYS  58  -4.926 -11.603  -6.571
  418    HZ2  LYS  58           HZ2      LYS  58  -5.471 -13.169  -6.942
  419    HZ3  LYS  58           HZ3      LYS  58  -6.008 -12.391  -5.530
  420    H    GLY  59           H        GLY  59 -10.395  -5.693  -7.120
  421    HA2  GLY  59           HA2      GLY  59 -12.646  -4.668  -6.156
  422    HA3  GLY  59           HA3      GLY  59 -11.998  -5.393  -4.687
  423    HA   PRO  60           HA       PRO  60 -10.300  -0.984  -5.400
  424    HB2  PRO  60           HB2      PRO  60 -11.168  -0.699  -2.569
  425    HB3  PRO  60           HB3      PRO  60 -11.323   0.443  -3.915
  426    HG2  PRO  60           HG2      PRO  60 -13.425  -0.871  -3.024
  427    HG3  PRO  60           HG3      PRO  60 -13.180  -0.605  -4.761
  428    HD2  PRO  60           HD2      PRO  60 -12.698  -3.108  -3.155
  429    HD3  PRO  60           HD3      PRO  60 -13.419  -2.937  -4.772
  430    H    CYS  61           H        CYS  61  -8.364  -0.209  -4.680
  431    HA   CYS  61           HA       CYS  61  -6.913  -1.809  -2.646
  432    HB2  CYS  61           HB2      CYS  61  -5.811  -0.683  -5.234
  433    HB3  CYS  61           HB3      CYS  61  -4.869  -1.511  -3.994
  434    HG   CYS  61           HG       CYS  61  -6.527  -3.626  -4.475
  435    H    ALA  62           H        ALA  62  -4.962  -0.567  -1.779
  436    HA   ALA  62           HA       ALA  62  -5.630   2.317  -1.577
  437    HB1  ALA  62           HB1      ALA  62  -5.934   1.799   0.613
  438    HB2  ALA  62           HB2      ALA  62  -4.171   1.804   0.680
  439    HB3  ALA  62           HB3      ALA  62  -5.043   0.285   0.481
  440    H    ASN  63           H        ASN  63  -4.091   3.674  -2.301
  441    HA   ASN  63           HA       ASN  63  -1.309   2.667  -2.482
  442    HB2  ASN  63           HB2      ASN  63  -1.084   4.014  -4.558
  443    HB3  ASN  63           HB3      ASN  63  -2.264   2.714  -4.718
  444   HD21  ASN  63          HD21      ASN  63  -3.857   3.575  -6.085
  445   HD22  ASN  63          HD22      ASN  63  -4.627   5.065  -5.835
  446    H    LYS  64           H        LYS  64   0.179   4.702  -2.974
  447    HA   LYS  64           HA       LYS  64   1.185   6.542  -2.028
  448    HB2  LYS  64           HB2      LYS  64  -1.700   7.474  -1.960
  449    HB3  LYS  64           HB3      LYS  64  -0.306   8.514  -1.667
  450    HG2  LYS  64           HG2      LYS  64   0.558   8.046  -3.911
  451    HG3  LYS  64           HG3      LYS  64  -0.764   6.916  -4.208
  452    HD2  LYS  64           HD2      LYS  64  -1.396   8.966  -5.273
  453    HD3  LYS  64           HD3      LYS  64  -2.359   8.864  -3.801
  454    HE2  LYS  64           HE2      LYS  64  -0.800  10.365  -2.645
  455    HE3  LYS  64           HE3      LYS  64   0.231  10.424  -4.075
  456    HZ1  LYS  64           HZ1      LYS  64  -1.377  11.581  -5.276
  457    HZ2  LYS  64           HZ2      LYS  64  -1.415  12.310  -3.741
  458    HZ3  LYS  64           HZ3      LYS  64  -2.618  11.196  -4.187
  459    H    VAL  65           H        VAL  65   0.930   4.462  -0.321
  460    HA   VAL  65           HA       VAL  65  -0.385   5.155   2.125
  461    HB   VAL  65           HB       VAL  65   1.731   3.056   1.582
  462   HG11  VAL  65          HG11      VAL  65   0.918   2.008   3.653
  463   HG12  VAL  65          HG12      VAL  65  -0.220   3.334   3.892
  464   HG13  VAL  65          HG13      VAL  65   1.516   3.632   3.987
  465   HG21  VAL  65          HG21      VAL  65  -1.258   2.672   1.857
  466   HG22  VAL  65          HG22      VAL  65  -0.064   1.522   1.258
  467   HG23  VAL  65          HG23      VAL  65  -0.482   2.936   0.295
  468    H    VAL  66           H        VAL  66   0.256   6.533   3.554
  469    HA   VAL  66           HA       VAL  66   3.144   7.151   3.857
  470    HB   VAL  66           HB       VAL  66   0.793   9.050   4.204
  471   HG11  VAL  66          HG11      VAL  66   2.593  10.773   4.452
  472   HG12  VAL  66          HG12      VAL  66   3.786   9.474   4.477
  473   HG13  VAL  66          HG13      VAL  66   2.590   9.595   5.765
  474   HG21  VAL  66          HG21      VAL  66   1.364   8.491   1.832
  475   HG22  VAL  66          HG22      VAL  66   3.013   9.039   2.133
  476   HG23  VAL  66          HG23      VAL  66   1.673  10.182   2.226
  477    H    ALA  67           H        ALA  67   3.920   6.556   5.781
  478    HA   ALA  67           HA       ALA  67   2.225   5.600   7.877
  479    HB1  ALA  67           HB1      ALA  67   4.394   5.402   9.137
  480    HB2  ALA  67           HB2      ALA  67   5.199   6.129   7.747
  481    HB3  ALA  67           HB3      ALA  67   4.379   4.577   7.580
  482    H    VAL  68           H        VAL  68   1.580   6.542   9.726
  483    HA   VAL  68           HA       VAL  68   1.056   8.194  11.233
  484    HB   VAL  68           HB       VAL  68   3.818   9.269  10.567
  485   HG11  VAL  68          HG11      VAL  68   3.689  10.205  12.862
  486   HG12  VAL  68          HG12      VAL  68   2.039   9.600  13.004
  487   HG13  VAL  68          HG13      VAL  68   2.419  10.854  11.824
  488   HG21  VAL  68          HG21      VAL  68   3.981   6.929  11.256
  489   HG22  VAL  68          HG22      VAL  68   2.915   7.230  12.629
  490   HG23  VAL  68          HG23      VAL  68   4.520   7.958  12.584
  Start of MODEL    6
    1    H1   MET   1           HT1      MET   1  -6.274  13.360   0.274
    2    H2   MET   1           HT2      MET   1  -7.612  13.116   1.291
    3    H3   MET   1           HT3      MET   1  -6.938  11.810   0.440
    4    HA   MET   1           HA       MET   1  -4.870  12.053   1.698
    5    HB2  MET   1           HB2      MET   1  -6.495  14.126   3.211
    6    HB3  MET   1           HB3      MET   1  -4.905  13.536   3.689
    7    HG2  MET   1           HG2      MET   1  -5.521  14.954   1.077
    8    HG3  MET   1           HG3      MET   1  -4.767  15.704   2.481
    9    HE1  MET   1           HE1      MET   1  -2.732  13.483   3.613
   10    HE2  MET   1           HE2      MET   1  -2.693  15.237   3.458
   11    HE3  MET   1           HE3      MET   1  -1.359  14.276   2.826
   12    H    SER   2           H        SER   2  -7.058  10.323   1.407
   13    HA   SER   2           HA       SER   2  -8.404   9.698   3.813
   14    HB2  SER   2           HB2      SER   2  -9.194   8.837   1.686
   15    HB3  SER   2           HB3      SER   2  -7.693   7.953   1.445
   16    HG   SER   2           HG       SER   2  -9.834   7.452   3.167
   17    H    LYS   3           H        LYS   3  -7.949   8.309   5.459
   18    HA   LYS   3           HA       LYS   3  -5.562   6.661   5.472
   19    HB2  LYS   3           HB2      LYS   3  -4.530   7.752   7.415
   20    HB3  LYS   3           HB3      LYS   3  -4.620   8.857   6.046
   21    HG2  LYS   3           HG2      LYS   3  -6.655   9.885   7.007
   22    HG3  LYS   3           HG3      LYS   3  -6.551   8.785   8.385
   23    HD2  LYS   3           HD2      LYS   3  -4.338   9.708   8.964
   24    HD3  LYS   3           HD3      LYS   3  -4.437  10.809   7.588
   25    HE2  LYS   3           HE2      LYS   3  -6.458  11.843   8.552
   26    HE3  LYS   3           HE3      LYS   3  -6.369  10.741   9.926
   27    HZ1  LYS   3           HZ1      LYS   3  -4.251  11.660  10.529
   28    HZ2  LYS   3           HZ2      LYS   3  -5.378  12.924  10.387
   29    HZ3  LYS   3           HZ3      LYS   3  -4.236  12.656   9.156
   30    H    GLY   4           H        GLY   4  -5.599   5.089   7.076
   31    HA2  GLY   4           HA2      GLY   4  -7.809   5.122   9.012
   32    HA3  GLY   4           HA3      GLY   4  -7.739   3.796   7.856
   33    H    ILE   5           H        ILE   5  -7.575   2.437   9.777
   34    HA   ILE   5           HA       ILE   5  -4.817   2.362  10.856
   35    HB   ILE   5           HB       ILE   5  -5.838   1.096  12.796
   36   HG12  ILE   5          HG12      ILE   5  -8.460   2.306  11.870
   37   HG13  ILE   5          HG13      ILE   5  -8.021   0.649  11.467
   38   HG21  ILE   5          HG21      ILE   5  -6.535   3.128  13.934
   39   HG22  ILE   5          HG22      ILE   5  -6.854   3.925  12.394
   40   HG23  ILE   5          HG23      ILE   5  -5.200   3.515  12.847
   41   HD11  ILE   5          HD11      ILE   5  -9.331   0.559  13.487
   42   HD12  ILE   5          HD12      ILE   5  -8.372   1.838  14.231
   43   HD13  ILE   5          HD13      ILE   5  -7.657   0.250  13.948
   44    H    VAL   6           H        VAL   6  -3.645   0.648  10.445
   45    HA   VAL   6           HA       VAL   6  -4.558  -1.333   8.639
   46    HB   VAL   6           HB       VAL   6  -2.024  -1.257  10.301
   47   HG11  VAL   6          HG11      VAL   6  -1.206  -2.716   8.322
   48   HG12  VAL   6          HG12      VAL   6  -2.915  -2.991   7.990
   49   HG13  VAL   6          HG13      VAL   6  -2.224  -3.493   9.532
   50   HG21  VAL   6          HG21      VAL   6  -2.521   0.673   8.668
   51   HG22  VAL   6          HG22      VAL   6  -2.365  -0.523   7.381
   52   HG23  VAL   6          HG23      VAL   6  -0.994  -0.180   8.438
   53    H    LYS   7           H        LYS   7  -5.647  -3.102   9.017
   54    HA   LYS   7           HA       LYS   7  -6.379  -4.000  11.620
   55    HB2  LYS   7           HB2      LYS   7  -7.770  -4.389   9.585
   56    HB3  LYS   7           HB3      LYS   7  -6.537  -5.498   8.983
   57    HG2  LYS   7           HG2      LYS   7  -6.854  -6.944  10.949
   58    HG3  LYS   7           HG3      LYS   7  -8.061  -5.825  11.589
   59    HD2  LYS   7           HD2      LYS   7  -9.488  -6.209   9.628
   60    HD3  LYS   7           HD3      LYS   7  -8.274  -7.289   8.941
   61    HE2  LYS   7           HE2      LYS   7 -10.018  -8.608  10.040
   62    HE3  LYS   7           HE3      LYS   7  -8.504  -8.769  10.928
   63    HZ1  LYS   7           HZ1      LYS   7 -10.381  -8.370  12.406
   64    HZ2  LYS   7           HZ2      LYS   7 -10.713  -6.903  11.614
   65    HZ3  LYS   7           HZ3      LYS   7  -9.264  -7.095  12.482
   66    H    TRP   8           H        TRP   8  -4.081  -5.139   9.169
   67    HA   TRP   8           HA       TRP   8  -2.287  -6.191  11.152
   68    HB2  TRP   8           HB2      TRP   8  -4.168  -7.959  10.809
   69    HB3  TRP   8           HB3      TRP   8  -3.415  -8.235   9.241
   70    HD1  TRP   8           HD1      TRP   8  -0.790  -8.998   9.287
   71    HE1  TRP   8           HE1      TRP   8   0.478 -10.420  11.023
   72    HE3  TRP   8           HE3      TRP   8  -3.985  -8.605  13.248
   73    HZ2  TRP   8           HZ2      TRP   8   0.173 -11.284  13.733
   74    HZ3  TRP   8           HZ3      TRP   8  -3.476  -9.738  15.391
   75    HH2  TRP   8           HH2      TRP   8  -1.403 -11.078  15.639
   76    H    PHE   9           H        PHE   9  -0.268  -5.957  10.351
   77    HA   PHE   9           HA       PHE   9   0.031  -5.777   7.396
   78    HB2  PHE   9           HB2      PHE   9   0.580  -3.698   8.732
   79    HB3  PHE   9           HB3      PHE   9   1.910  -4.604   9.455
   80    HD1  PHE   9           HD1      PHE   9   0.558  -3.226   6.296
   81    HD2  PHE   9           HD2      PHE   9   3.898  -5.153   8.190
   82    HE1  PHE   9           HE1      PHE   9   1.957  -2.755   4.305
   83    HE2  PHE   9           HE2      PHE   9   5.296  -4.680   6.196
   84    HZ   PHE   9           HZ       PHE   9   4.327  -3.483   4.256
   85    H    ASN  10           H        ASN  10   1.117  -7.383   6.438
   86    HA   ASN  10           HA       ASN  10   3.072  -8.926   8.050
   87    HB2  ASN  10           HB2      ASN  10   1.207  -9.956   5.900
   88    HB3  ASN  10           HB3      ASN  10   2.457 -10.906   6.700
   89   HD21  ASN  10          HD21      ASN  10  -0.748 -10.700   6.769
   90   HD22  ASN  10          HD22      ASN  10  -1.058 -10.868   8.430
   91    H    SER  11           H        SER  11   4.876  -7.768   7.335
   92    HA   SER  11           HA       SER  11   5.431  -7.088   4.665
   93    HB2  SER  11           HB2      SER  11   7.724  -6.746   5.445
   94    HB3  SER  11           HB3      SER  11   6.577  -6.089   6.607
   95    HG   SER  11           HG       SER  11   7.824  -8.642   6.729
   96    H    ASP  12           H        ASP  12   6.038 -10.039   6.516
   97    HA   ASP  12           HA       ASP  12   7.885 -11.275   4.782
   98    HB2  ASP  12           HB2      ASP  12   5.769 -12.439   6.609
   99    HB3  ASP  12           HB3      ASP  12   6.930 -13.431   5.732
  100    H    LYS  13           H        LYS  13   4.344 -11.263   4.833
  101    HA   LYS  13           HA       LYS  13   4.045 -12.896   2.484
  102    HB2  LYS  13           HB2      LYS  13   2.131 -11.092   3.983
  103    HB3  LYS  13           HB3      LYS  13   1.667 -12.090   2.608
  104    HG2  LYS  13           HG2      LYS  13   2.411 -14.110   3.809
  105    HG3  LYS  13           HG3      LYS  13   2.880 -13.115   5.191
  106    HD2  LYS  13           HD2      LYS  13   0.546 -12.356   5.443
  107    HD3  LYS  13           HD3      LYS  13   0.072 -13.349   4.061
  108    HE2  LYS  13           HE2      LYS  13   0.808 -15.374   5.259
  109    HE3  LYS  13           HE3      LYS  13   1.292 -14.388   6.640
  110    HZ1  LYS  13           HZ1      LYS  13  -0.892 -15.315   6.994
  111    HZ2  LYS  13           HZ2      LYS  13  -1.456 -14.640   5.539
  112    HZ3  LYS  13           HZ3      LYS  13  -1.009 -13.630   6.830
  113    H    GLY  14           H        GLY  14   4.423  -9.508   3.191
  114    HA2  GLY  14           HA2      GLY  14   5.192  -7.869   1.673
  115    HA3  GLY  14           HA3      GLY  14   4.657  -8.883   0.340
  116    H    PHE  15           H        PHE  15   2.236  -8.714   2.708
  117    HA   PHE  15           HA       PHE  15   1.058  -6.220   1.844
  118    HB2  PHE  15           HB2      PHE  15  -0.987  -7.225   0.894
  119    HB3  PHE  15           HB3      PHE  15   0.446  -7.603  -0.059
  120    HD1  PHE  15           HD1      PHE  15  -2.061  -8.946   2.303
  121    HD2  PHE  15           HD2      PHE  15   1.306  -9.864  -0.202
  122    HE1  PHE  15           HE1      PHE  15  -2.553 -11.366   2.531
  123    HE2  PHE  15           HE2      PHE  15   0.816 -12.284   0.030
  124    HZ   PHE  15           HZ       PHE  15  -1.112 -13.035   1.395
  125    H    GLY  16           H        GLY  16  -1.262  -6.059   2.711
  126    HA2  GLY  16           HA2      GLY  16  -1.889  -7.608   5.061
  127    HA3  GLY  16           HA3      GLY  16  -1.312  -5.984   5.429
  128    H    PHE  17           H        PHE  17  -3.744  -6.389   6.290
  129    HA   PHE  17           HA       PHE  17  -5.571  -5.226   4.266
  130    HB2  PHE  17           HB2      PHE  17  -6.202  -6.959   6.671
  131    HB3  PHE  17           HB3      PHE  17  -7.410  -6.186   5.647
  132    HD1  PHE  17           HD1      PHE  17  -4.877  -8.840   5.865
  133    HD2  PHE  17           HD2      PHE  17  -7.769  -6.922   3.336
  134    HE1  PHE  17           HE1      PHE  17  -4.748 -10.740   4.276
  135    HE2  PHE  17           HE2      PHE  17  -7.642  -8.822   1.748
  136    HZ   PHE  17           HZ       PHE  17  -6.130 -10.731   2.218
  137    H    ILE  18           H        ILE  18  -6.516  -3.294   4.740
  138    HA   ILE  18           HA       ILE  18  -5.929  -2.161   7.398
  139    HB   ILE  18           HB       ILE  18  -4.756  -1.010   5.584
  140   HG12  ILE  18          HG12      ILE  18  -7.005   0.791   6.509
  141   HG13  ILE  18          HG13      ILE  18  -5.761   0.212   7.620
  142   HG21  ILE  18          HG21      ILE  18  -7.555  -0.736   4.469
  143   HG22  ILE  18          HG22      ILE  18  -6.117  -1.374   3.672
  144   HG23  ILE  18          HG23      ILE  18  -6.254   0.356   3.986
  145   HD11  ILE  18          HD11      ILE  18  -4.017   1.235   6.295
  146   HD12  ILE  18          HD12      ILE  18  -5.248   2.458   6.604
  147   HD13  ILE  18          HD13      ILE  18  -5.165   1.668   5.031
  148    H    THR  19           H        THR  19  -7.447  -1.011   8.502
  149    HA   THR  19           HA       THR  19 -10.226  -1.559   7.739
  150    HB   THR  19           HB       THR  19  -9.075  -0.775  10.422
  151    HG1  THR  19           HG1      THR  19  -8.692  -2.811  10.656
  152   HG21  THR  19          HG21      THR  19 -11.322  -1.720  11.193
  153   HG22  THR  19          HG22      THR  19 -11.826  -1.645   9.505
  154   HG23  THR  19          HG23      THR  19 -11.389  -0.166  10.362
  155    HA   PRO  20           HA       PRO  20 -10.152   2.928   6.622
  156    HB2  PRO  20           HB2      PRO  20 -13.056   2.229   6.342
  157    HB3  PRO  20           HB3      PRO  20 -12.033   3.200   5.268
  158    HG2  PRO  20           HG2      PRO  20 -12.640   0.747   4.597
  159    HG3  PRO  20           HG3      PRO  20 -10.977   1.328   4.382
  160    HD2  PRO  20           HD2      PRO  20 -12.073  -0.492   6.501
  161    HD3  PRO  20           HD3      PRO  20 -10.501  -0.544   5.670
  162    H    GLU  21           H        GLU  21 -10.361   4.584   8.018
  163    HA   GLU  21           HA       GLU  21 -11.437   4.263  10.620
  164    HB2  GLU  21           HB2      GLU  21 -10.988   6.675  10.880
  165    HB3  GLU  21           HB3      GLU  21  -9.616   5.832  10.164
  166    HG2  GLU  21           HG2      GLU  21  -9.800   7.725   8.796
  167    HG3  GLU  21           HG3      GLU  21 -10.704   6.524   7.881
  168    H    ASP  22           H        ASP  22 -12.880   5.214   7.613
  169    HA   ASP  22           HA       ASP  22 -15.140   6.577   8.811
  170    HB2  ASP  22           HB2      ASP  22 -15.970   6.769   6.532
  171    HB3  ASP  22           HB3      ASP  22 -14.274   7.230   6.600
  172    H    GLY  23           H        GLY  23 -14.337   3.336   8.582
  173    HA2  GLY  23           HA2      GLY  23 -15.691   1.566   9.352
  174    HA3  GLY  23           HA3      GLY  23 -17.119   2.539   9.027
  175    H    SER  24           H        SER  24 -14.970   2.647   6.421
  176    HA   SER  24           HA       SER  24 -16.735   1.161   4.723
  177    HB2  SER  24           HB2      SER  24 -14.052   2.455   4.237
  178    HB3  SER  24           HB3      SER  24 -15.006   1.682   2.990
  179    HG   SER  24           HG       SER  24 -15.605   3.786   2.952
  180    H    LYS  25           H        LYS  25 -15.866  -0.537   3.242
  181    HA   LYS  25           HA       LYS  25 -14.962  -2.771   4.711
  182    HB2  LYS  25           HB2      LYS  25 -15.018  -2.343   1.711
  183    HB3  LYS  25           HB3      LYS  25 -14.808  -3.897   2.513
  184    HG2  LYS  25           HG2      LYS  25 -17.221  -2.120   2.965
  185    HG3  LYS  25           HG3      LYS  25 -17.178  -3.389   1.744
  186    HD2  LYS  25           HD2      LYS  25 -16.678  -5.055   3.522
  187    HD3  LYS  25           HD3      LYS  25 -16.797  -3.776   4.731
  188    HE2  LYS  25           HE2      LYS  25 -18.922  -4.968   4.615
  189    HE3  LYS  25           HE3      LYS  25 -19.137  -3.336   3.985
  190    HZ1  LYS  25           HZ1      LYS  25 -19.340  -4.081   1.854
  191    HZ2  LYS  25           HZ2      LYS  25 -20.009  -5.408   2.678
  192    HZ3  LYS  25           HZ3      LYS  25 -18.407  -5.473   2.117
  193    H    ASP  26           H        ASP  26 -12.997  -3.920   4.629
  194    HA   ASP  26           HA       ASP  26 -10.672  -2.382   4.775
  195    HB2  ASP  26           HB2      ASP  26  -9.477  -4.502   4.920
  196    HB3  ASP  26           HB3      ASP  26 -10.947  -4.560   5.884
  197    H    LEU  27           H        LEU  27  -8.780  -2.392   3.498
  198    HA   LEU  27           HA       LEU  27  -9.218  -2.941   0.622
  199    HB2  LEU  27           HB2      LEU  27  -7.790  -0.568   1.861
  200    HB3  LEU  27           HB3      LEU  27  -7.866  -0.919   0.137
  201    HG   LEU  27           HG       LEU  27 -10.329  -0.514   1.862
  202   HD11  LEU  27          HD11      LEU  27  -9.008   1.552   1.821
  203   HD12  LEU  27          HD12      LEU  27 -10.434   1.734   0.800
  204   HD13  LEU  27          HD13      LEU  27  -8.858   1.442   0.068
  205   HD21  LEU  27          HD21      LEU  27 -10.793  -1.756  -0.176
  206   HD22  LEU  27          HD22      LEU  27  -9.841  -0.621  -1.135
  207   HD23  LEU  27          HD23      LEU  27 -11.364  -0.103  -0.408
  208    H    PHE  28           H        PHE  28  -7.382  -3.553  -0.579
  209    HA   PHE  28           HA       PHE  28  -5.400  -5.036   0.916
  210    HB2  PHE  28           HB2      PHE  28  -5.815  -4.545  -2.042
  211    HB3  PHE  28           HB3      PHE  28  -4.498  -5.529  -1.399
  212    HD1  PHE  28           HD1      PHE  28  -8.159  -5.264  -1.814
  213    HD2  PHE  28           HD2      PHE  28  -4.918  -7.698  -0.394
  214    HE1  PHE  28           HE1      PHE  28  -9.691  -7.206  -1.649
  215    HE2  PHE  28           HE2      PHE  28  -6.450  -9.642  -0.228
  216    HZ   PHE  28           HZ       PHE  28  -8.837  -9.396  -0.855
  217    H    VAL  29           H        VAL  29  -3.363  -4.410   1.402
  218    HA   VAL  29           HA       VAL  29  -2.276  -1.987   0.111
  219    HB   VAL  29           HB       VAL  29  -2.282  -2.567   3.085
  220   HG11  VAL  29          HG11      VAL  29  -0.970  -0.404   1.431
  221   HG12  VAL  29          HG12      VAL  29  -0.202  -1.489   2.589
  222   HG13  VAL  29          HG13      VAL  29  -1.275  -0.209   3.158
  223   HG21  VAL  29          HG21      VAL  29  -3.766  -0.717   3.305
  224   HG22  VAL  29          HG22      VAL  29  -4.417  -1.676   1.976
  225   HG23  VAL  29          HG23      VAL  29  -3.498  -0.210   1.638
  226    H    HIS  30           H        HIS  30  -0.166  -2.116  -0.449
  227    HA   HIS  30           HA       HIS  30   1.300  -4.567   0.323
  228    HB2  HIS  30           HB2      HIS  30   1.463  -2.859  -2.168
  229    HB3  HIS  30           HB3      HIS  30   2.600  -4.158  -1.790
  230    HD2  HIS  30           HD2      HIS  30  -1.023  -3.732  -3.153
  231    HE1  HIS  30           HE1      HIS  30  -0.332  -7.871  -2.704
  232    HE2  HIS  30           HE2      HIS  30  -1.922  -6.132  -3.647
  233    H    HIS  31           H        HIS  31   3.461  -4.448   0.843
  234    HA   HIS  31           HA       HIS  31   4.292  -2.213   2.380
  235    HB2  HIS  31           HB2      HIS  31   5.026  -4.566   2.776
  236    HB3  HIS  31           HB3      HIS  31   6.010  -4.470   1.317
  237    HD2  HIS  31           HD2      HIS  31   6.138  -3.262   5.035
  238    HE1  HIS  31           HE1      HIS  31   9.595  -1.805   3.102
  239    HE2  HIS  31           HE2      HIS  31   8.445  -2.085   5.348
  240    H    SER  32           H        SER  32   5.311  -3.384  -0.813
  241    HA   SER  32           HA       SER  32   7.359  -1.521  -1.277
  242    HB2  SER  32           HB2      SER  32   5.615  -3.047  -3.209
  243    HB3  SER  32           HB3      SER  32   7.038  -2.121  -3.683
  244    HG   SER  32           HG       SER  32   6.856  -4.401  -2.019
  245    H    GLU  33           H        GLU  33   3.913  -1.101  -1.525
  246    HA   GLU  33           HA       GLU  33   3.929   1.050  -3.395
  247    HB2  GLU  33           HB2      GLU  33   1.889   0.117  -1.382
  248    HB3  GLU  33           HB3      GLU  33   1.604   1.470  -2.477
  249    HG2  GLU  33           HG2      GLU  33   2.036   0.006  -4.411
  250    HG3  GLU  33           HG3      GLU  33   2.338  -1.348  -3.326
  251    H    ILE  34           H        ILE  34   4.780   0.981  -0.057
  252    HA   ILE  34           HA       ILE  34   3.921   3.437   0.900
  253    HB   ILE  34           HB       ILE  34   5.825   3.421   2.427
  254   HG12  ILE  34          HG12      ILE  34   6.936   1.091   0.816
  255   HG13  ILE  34          HG13      ILE  34   7.520   2.738   0.653
  256   HG21  ILE  34          HG21      ILE  34   4.453   0.797   1.846
  257   HG22  ILE  34          HG22      ILE  34   4.141   1.945   3.146
  258   HG23  ILE  34          HG23      ILE  34   5.590   0.942   3.186
  259   HD11  ILE  34          HD11      ILE  34   8.226   2.793   2.966
  260   HD12  ILE  34          HD12      ILE  34   8.884   1.330   2.233
  261   HD13  ILE  34          HD13      ILE  34   7.469   1.231   3.281
  262    H    GLN  35           H        GLN  35   5.293   5.398   1.312
  263    HA   GLN  35           HA       GLN  35   6.232   6.461  -1.219
  264    HB2  GLN  35           HB2      GLN  35   5.894   7.660   1.536
  265    HB3  GLN  35           HB3      GLN  35   6.564   8.558   0.175
  266    HG2  GLN  35           HG2      GLN  35   3.866   7.179   0.110
  267    HG3  GLN  35           HG3      GLN  35   4.084   8.884   0.503
  268   HE21  GLN  35          HE21      GLN  35   3.336   6.893  -2.058
  269   HE22  GLN  35          HE22      GLN  35   3.873   7.870  -3.334
  270    H    SER  36           H        SER  36   8.314   7.742  -1.248
  271    HA   SER  36           HA       SER  36  10.495   6.041  -0.620
  272    HB2  SER  36           HB2      SER  36  11.896   7.810  -1.476
  273    HB3  SER  36           HB3      SER  36  10.447   7.737  -2.475
  274    HG   SER  36           HG       SER  36  11.367   9.723  -0.845
  275    H    GLY  37           H        GLY  37  12.265   6.454   0.817
  276    HA2  GLY  37           HA2      GLY  37  13.268   7.136   2.793
  277    HA3  GLY  37           HA3      GLY  37  12.069   8.422   2.915
  278    H    GLY  38           H        GLY  38  12.367   7.552   5.267
  279    HA2  GLY  38           HA2      GLY  38  11.328   6.590   7.086
  280    HA3  GLY  38           HA3      GLY  38   9.965   6.263   6.022
  281    H    GLU  39           H        GLU  39  13.264   5.065   5.584
  282    HA   GLU  39           HA       GLU  39  12.480   2.413   5.067
  283    HB2  GLU  39           HB2      GLU  39  15.134   3.598   5.896
  284    HB3  GLU  39           HB3      GLU  39  14.931   1.901   5.458
  285    HG2  GLU  39           HG2      GLU  39  14.166   2.493   3.243
  286    HG3  GLU  39           HG3      GLU  39  14.111   4.199   3.664
  287    H    TYR  40           H        TYR  40  13.582   3.992   8.040
  288    HA   TYR  40           HA       TYR  40  13.770   1.668   9.655
  289    HB2  TYR  40           HB2      TYR  40  13.203   4.545  10.392
  290    HB3  TYR  40           HB3      TYR  40  13.538   3.267  11.558
  291    HD1  TYR  40           HD1      TYR  40  14.959   5.427   8.950
  292    HD2  TYR  40           HD2      TYR  40  15.758   2.205  11.675
  293    HE1  TYR  40           HE1      TYR  40  17.393   5.733   8.596
  294    HE2  TYR  40           HE2      TYR  40  18.194   2.511  11.322
  295    HH   TYR  40           HH       TYR  40  19.486   4.195   8.804
  296    H    ALA  41           H        ALA  41  11.122   3.880   8.907
  297    HA   ALA  41           HA       ALA  41   9.247   3.092  10.797
  298    HB1  ALA  41           HB1      ALA  41   8.512   3.731   7.945
  299    HB2  ALA  41           HB2      ALA  41   9.099   4.969   9.053
  300    HB3  ALA  41           HB3      ALA  41   7.613   4.094   9.418
  301    H    THR  42           H        THR  42   7.942   1.430  11.064
  302    HA   THR  42           HA       THR  42   7.836  -0.686   8.993
  303    HB   THR  42           HB       THR  42   7.811  -2.360  10.799
  304    HG1  THR  42           HG1      THR  42   6.997  -1.176  12.477
  305   HG21  THR  42          HG21      THR  42   9.973  -1.484   9.737
  306   HG22  THR  42          HG22      THR  42  10.137  -2.311  11.286
  307   HG23  THR  42          HG23      THR  42  10.191  -0.549  11.216
  308    H    LEU  43           H        LEU  43   5.946  -2.221   9.440
  309    HA   LEU  43           HA       LEU  43   3.619  -0.773  10.538
  310    HB2  LEU  43           HB2      LEU  43   3.892  -2.076   7.839
  311    HB3  LEU  43           HB3      LEU  43   2.325  -1.975   8.631
  312    HG   LEU  43           HG       LEU  43   2.734   0.524   8.864
  313   HD11  LEU  43          HD11      LEU  43   4.388   1.199   6.820
  314   HD12  LEU  43          HD12      LEU  43   5.190  -0.273   7.361
  315   HD13  LEU  43          HD13      LEU  43   4.934   1.059   8.485
  316   HD21  LEU  43          HD21      LEU  43   1.175  -0.221   7.217
  317   HD22  LEU  43          HD22      LEU  43   2.458  -0.828   6.170
  318   HD23  LEU  43          HD23      LEU  43   2.239   0.909   6.379
  319    H    ALA  44           H        ALA  44   2.127  -2.052  11.589
  320    HA   ALA  44           HA       ALA  44   2.455  -4.963  11.592
  321    HB1  ALA  44           HB1      ALA  44   2.411  -3.477  14.218
  322    HB2  ALA  44           HB2      ALA  44   3.929  -3.835  13.396
  323    HB3  ALA  44           HB3      ALA  44   2.873  -5.152  13.911
  324    H    ASP  45           H        ASP  45   0.724  -5.155  14.046
  325    HA   ASP  45           HA       ASP  45  -1.827  -4.797  12.708
  326    HB2  ASP  45           HB2      ASP  45  -1.332  -6.875  13.940
  327    HB3  ASP  45           HB3      ASP  45  -1.137  -5.952  15.423
  328    H    GLY  46           H        GLY  46  -2.744  -2.830  12.790
  329    HA2  GLY  46           HA2      GLY  46  -4.069  -1.274  14.036
  330    HA3  GLY  46           HA3      GLY  46  -3.003  -1.510  15.412
  331    H    GLN  47           H        GLN  47  -1.074  -1.216  12.695
  332    HA   GLN  47           HA       GLN  47  -0.062   1.331  13.457
  333    HB2  GLN  47           HB2      GLN  47   1.258  -0.492  12.368
  334    HB3  GLN  47           HB3      GLN  47   0.389  -0.175  10.869
  335    HG2  GLN  47           HG2      GLN  47   2.550   0.988  10.868
  336    HG3  GLN  47           HG3      GLN  47   1.231   2.146  10.875
  337   HE21  GLN  47          HE21      GLN  47   1.792   3.869  12.217
  338   HE22  GLN  47          HE22      GLN  47   2.582   3.721  13.712
  339    H    THR  48           H        THR  48  -0.657   3.316  12.855
  340    HA   THR  48           HA       THR  48  -2.909   3.673  11.056
  341    HB   THR  48           HB       THR  48  -1.266   5.736  12.559
  342    HG1  THR  48           HG1      THR  48  -2.346   4.169  13.871
  343   HG21  THR  48          HG21      THR  48  -3.983   5.858  11.213
  344   HG22  THR  48          HG22      THR  48  -2.535   6.744  10.739
  345   HG23  THR  48          HG23      THR  48  -3.336   7.119  12.264
  346    H    VAL  49           H        VAL  49  -2.802   4.249   8.976
  347    HA   VAL  49           HA       VAL  49  -0.354   5.510   7.947
  348    HB   VAL  49           HB       VAL  49  -0.295   3.980   6.004
  349   HG11  VAL  49          HG11      VAL  49  -0.143   2.546   8.671
  350   HG12  VAL  49          HG12      VAL  49   1.119   3.589   8.014
  351   HG13  VAL  49          HG13      VAL  49   0.696   2.089   7.189
  352   HG21  VAL  49          HG21      VAL  49  -2.587   3.193   5.947
  353   HG22  VAL  49          HG22      VAL  49  -2.444   2.520   7.571
  354   HG23  VAL  49          HG23      VAL  49  -1.545   1.799   6.237
  355    H    GLU  50           H        GLU  50  -0.620   6.231   5.663
  356    HA   GLU  50           HA       GLU  50  -3.361   7.270   5.225
  357    HB2  GLU  50           HB2      GLU  50  -0.706   8.431   4.308
  358    HB3  GLU  50           HB3      GLU  50  -2.296   9.126   3.998
  359    HG2  GLU  50           HG2      GLU  50  -2.653   9.382   6.435
  360    HG3  GLU  50           HG3      GLU  50  -1.056   8.703   6.735
  361    H    TYR  51           H        TYR  51  -4.308   6.847   3.249
  362    HA   TYR  51           HA       TYR  51  -2.691   5.806   1.059
  363    HB2  TYR  51           HB2      TYR  51  -3.994   3.733   0.838
  364    HB3  TYR  51           HB3      TYR  51  -3.145   3.787   2.376
  365    HD1  TYR  51           HD1      TYR  51  -6.421   3.921   0.720
  366    HD2  TYR  51           HD2      TYR  51  -4.369   4.151   4.486
  367    HE1  TYR  51           HE1      TYR  51  -8.578   3.644   1.910
  368    HE2  TYR  51           HE2      TYR  51  -6.526   3.872   5.678
  369    HH   TYR  51           HH       TYR  51  -9.168   4.447   4.852
  370    H    GLU  52           H        GLU  52  -3.927   5.414  -0.900
  371    HA   GLU  52           HA       GLU  52  -6.385   7.050  -1.065
  372    HB2  GLU  52           HB2      GLU  52  -4.075   6.857  -3.011
  373    HB3  GLU  52           HB3      GLU  52  -5.642   7.553  -3.432
  374    HG2  GLU  52           HG2      GLU  52  -5.412   9.191  -1.605
  375    HG3  GLU  52           HG3      GLU  52  -3.856   8.491  -1.167
  376    H    VAL  53           H        VAL  53  -8.088   6.079  -1.966
  377    HA   VAL  53           HA       VAL  53  -8.140   3.299  -2.404
  378    HB   VAL  53           HB       VAL  53 -10.108   4.642  -1.741
  379   HG11  VAL  53          HG11      VAL  53  -9.582   6.569  -3.302
  380   HG12  VAL  53          HG12      VAL  53 -11.273   6.066  -3.285
  381   HG13  VAL  53          HG13      VAL  53 -10.222   5.582  -4.617
  382   HG21  VAL  53          HG21      VAL  53 -10.562   3.241  -4.393
  383   HG22  VAL  53          HG22      VAL  53 -11.742   3.467  -3.100
  384   HG23  VAL  53          HG23      VAL  53 -10.355   2.404  -2.854
  385    H    GLY  54           H        GLY  54  -8.430   2.090  -4.279
  386    HA2  GLY  54           HA2      GLY  54  -7.938   3.314  -6.891
  387    HA3  GLY  54           HA3      GLY  54  -6.756   2.133  -6.328
  388    H    GLN  55           H        GLN  55  -8.146   1.593  -8.639
  389    HA   GLN  55           HA       GLN  55 -10.337  -0.214  -7.897
  390    HB2  GLN  55           HB2      GLN  55 -10.816  -0.333 -10.304
  391    HB3  GLN  55           HB3      GLN  55 -10.780   1.337  -9.742
  392    HG2  GLN  55           HG2      GLN  55  -9.520   1.453 -11.710
  393    HG3  GLN  55           HG3      GLN  55  -8.264   1.261 -10.494
  394   HE21  GLN  55          HE21      GLN  55  -6.772   0.168 -11.917
  395   HE22  GLN  55          HE22      GLN  55  -7.072  -1.393 -12.511
  396    H    GLY  56           H        GLY  56 -10.408  -2.375  -8.566
  397    HA2  GLY  56           HA2      GLY  56  -8.123  -3.672  -9.766
  398    HA3  GLY  56           HA3      GLY  56  -8.297  -4.014  -8.047
  399    H    GLN  57           H        GLN  57  -8.498  -5.948 -10.142
  400    HA   GLN  57           HA       GLN  57 -11.169  -6.564 -10.848
  401    HB2  GLN  57           HB2      GLN  57  -8.691  -8.277 -10.620
  402    HB3  GLN  57           HB3      GLN  57 -10.232  -8.882 -11.230
  403    HG2  GLN  57           HG2      GLN  57 -10.226  -7.274 -13.034
  404    HG3  GLN  57           HG3      GLN  57  -8.816  -6.457 -12.365
  405   HE21  GLN  57          HE21      GLN  57  -9.123  -7.807 -15.043
  406   HE22  GLN  57          HE22      GLN  57  -7.892  -8.975 -15.098
  407    H    LYS  58           H        LYS  58  -9.140  -7.521  -8.117
  408    HA   LYS  58           HA       LYS  58 -11.276  -9.144  -6.963
  409    HB2  LYS  58           HB2      LYS  58  -9.620  -9.712  -5.231
  410    HB3  LYS  58           HB3      LYS  58  -8.980  -9.994  -6.849
  411    HG2  LYS  58           HG2      LYS  58  -7.798  -7.820  -6.757
  412    HG3  LYS  58           HG3      LYS  58  -8.425  -7.551  -5.131
  413    HD2  LYS  58           HD2      LYS  58  -7.280  -9.591  -4.348
  414    HD3  LYS  58           HD3      LYS  58  -6.652  -9.863  -5.974
  415    HE2  LYS  58           HE2      LYS  58  -5.462  -7.705  -5.880
  416    HE3  LYS  58           HE3      LYS  58  -6.091  -7.427  -4.256
  417    HZ1  LYS  58           HZ1      LYS  58  -4.570  -9.872  -4.903
  418    HZ2  LYS  58           HZ2      LYS  58  -4.841  -9.158  -3.385
  419    HZ3  LYS  58           HZ3      LYS  58  -3.772  -8.434  -4.490
  420    H    GLY  59           H        GLY  59 -11.395  -6.121  -7.227
  421    HA2  GLY  59           HA2      GLY  59 -12.881  -4.829  -5.798
  422    HA3  GLY  59           HA3      GLY  59 -12.076  -5.549  -4.403
  423    HA   PRO  60           HA       PRO  60 -10.006  -1.465  -5.701
  424    HB2  PRO  60           HB2      PRO  60 -10.628   0.097  -3.560
  425    HB3  PRO  60           HB3      PRO  60 -11.668  -0.030  -4.992
  426    HG2  PRO  60           HG2      PRO  60 -11.901  -1.414  -2.361
  427    HG3  PRO  60           HG3      PRO  60 -13.155  -0.639  -3.342
  428    HD2  PRO  60           HD2      PRO  60 -12.784  -3.338  -3.337
  429    HD3  PRO  60           HD3      PRO  60 -13.349  -2.461  -4.779
  430    H    CYS  61           H        CYS  61  -8.061  -0.679  -4.895
  431    HA   CYS  61           HA       CYS  61  -6.957  -2.088  -2.537
  432    HB2  CYS  61           HB2      CYS  61  -5.530  -1.206  -5.062
  433    HB3  CYS  61           HB3      CYS  61  -4.768  -1.977  -3.673
  434    HG   CYS  61           HG       CYS  61  -6.631  -3.986  -4.235
  435    H    ALA  62           H        ALA  62  -4.768  -0.786  -1.932
  436    HA   ALA  62           HA       ALA  62  -5.397   2.095  -1.858
  437    HB1  ALA  62           HB1      ALA  62  -5.139   0.209   0.390
  438    HB2  ALA  62           HB2      ALA  62  -5.897   1.799   0.335
  439    HB3  ALA  62           HB3      ALA  62  -4.155   1.663   0.557
  440    H    ASN  63           H        ASN  63  -3.611   3.447  -1.965
  441    HA   ASN  63           HA       ASN  63  -0.947   2.182  -2.120
  442    HB2  ASN  63           HB2      ASN  63  -0.448   3.522  -4.145
  443    HB3  ASN  63           HB3      ASN  63  -1.740   2.357  -4.418
  444   HD21  ASN  63          HD21      ASN  63  -3.216   3.359  -5.801
  445   HD22  ASN  63          HD22      ASN  63  -3.812   4.935  -5.597
  446    H    LYS  64           H        LYS  64   0.731   4.105  -2.490
  447    HA   LYS  64           HA       LYS  64   1.816   5.855  -1.487
  448    HB2  LYS  64           HB2      LYS  64  -1.000   6.973  -1.407
  449    HB3  LYS  64           HB3      LYS  64   0.457   7.905  -1.053
  450    HG2  LYS  64           HG2      LYS  64   1.324   7.412  -3.311
  451    HG3  LYS  64           HG3      LYS  64  -0.135   6.485  -3.668
  452    HD2  LYS  64           HD2      LYS  64  -1.509   8.503  -3.313
  453    HD3  LYS  64           HD3      LYS  64  -0.051   9.434  -2.960
  454    HE2  LYS  64           HE2      LYS  64   0.811   8.950  -5.218
  455    HE3  LYS  64           HE3      LYS  64  -0.642   8.015  -5.575
  456    HZ1  LYS  64           HZ1      LYS  64  -0.748  10.847  -4.722
  457    HZ2  LYS  64           HZ2      LYS  64  -1.977   9.921  -5.444
  458    HZ3  LYS  64           HZ3      LYS  64  -0.623  10.397  -6.352
  459    H    VAL  65           H        VAL  65   1.600   3.801   0.142
  460    HA   VAL  65           HA       VAL  65   0.245   4.334   2.610
  461    HB   VAL  65           HB       VAL  65   2.473   2.375   1.976
  462   HG11  VAL  65          HG11      VAL  65   0.543   2.501   4.318
  463   HG12  VAL  65          HG12      VAL  65   2.284   2.777   4.395
  464   HG13  VAL  65          HG13      VAL  65   1.664   1.176   3.996
  465   HG21  VAL  65          HG21      VAL  65  -0.487   1.817   2.239
  466   HG22  VAL  65          HG22      VAL  65   0.766   0.758   1.595
  467   HG23  VAL  65          HG23      VAL  65   0.269   2.187   0.689
  468    H    VAL  66           H        VAL  66   0.813   5.781   4.028
  469    HA   VAL  66           HA       VAL  66   3.686   6.388   4.459
  470    HB   VAL  66           HB       VAL  66   1.377   8.360   4.546
  471   HG11  VAL  66          HG11      VAL  66   3.030   8.993   6.193
  472   HG12  VAL  66          HG12      VAL  66   3.251  10.039   4.790
  473   HG13  VAL  66          HG13      VAL  66   4.347   8.685   5.061
  474   HG21  VAL  66          HG21      VAL  66   3.721   8.139   2.630
  475   HG22  VAL  66          HG22      VAL  66   2.467   9.380   2.594
  476   HG23  VAL  66          HG23      VAL  66   2.055   7.700   2.250
  477    H    ALA  67           H        ALA  67   4.333   5.958   6.467
  478    HA   ALA  67           HA       ALA  67   2.508   5.111   8.502
  479    HB1  ALA  67           HB1      ALA  67   5.346   5.847   9.104
  480    HB2  ALA  67           HB2      ALA  67   5.022   4.459   8.064
  481    HB3  ALA  67           HB3      ALA  67   4.388   4.497   9.710
  482    H    VAL  68           H        VAL  68   1.651   6.207  10.165
  483    HA   VAL  68           HA       VAL  68   2.396   9.059  10.476
  484    HB   VAL  68           HB       VAL  68  -0.248   7.735  11.174
  485   HG11  VAL  68          HG11      VAL  68   0.514  10.668  10.998
  486   HG12  VAL  68          HG12      VAL  68   0.370   9.766  12.507
  487   HG13  VAL  68          HG13      VAL  68  -1.050  10.016  11.490
  488   HG21  VAL  68          HG21      VAL  68  -1.149   8.862   9.202
  489   HG22  VAL  68          HG22      VAL  68   0.200   7.838   8.708
  490   HG23  VAL  68          HG23      VAL  68   0.423   9.581   8.857
  Start of MODEL    7
    1    H1   MET   1           HT1      MET   1  -6.417  13.823   2.710
    2    H2   MET   1           HT2      MET   1  -5.368  14.164   1.417
    3    H3   MET   1           HT3      MET   1  -4.738  13.723   2.932
    4    HA   MET   1           HA       MET   1  -6.078  12.040   0.916
    5    HB2  MET   1           HB2      MET   1  -3.541  11.858   2.566
    6    HB3  MET   1           HB3      MET   1  -4.129  10.557   1.529
    7    HG2  MET   1           HG2      MET   1  -4.026  12.043  -0.425
    8    HG3  MET   1           HG3      MET   1  -3.487  13.374   0.600
    9    HE1  MET   1           HE1      MET   1  -1.832  13.618  -1.186
   10    HE2  MET   1           HE2      MET   1  -1.751  12.097  -2.072
   11    HE3  MET   1           HE3      MET   1  -0.299  12.745  -1.312
   12    H    SER   2           H        SER   2  -6.806   9.957   1.563
   13    HA   SER   2           HA       SER   2  -8.282   9.915   3.996
   14    HB2  SER   2           HB2      SER   2  -7.636   7.694   2.045
   15    HB3  SER   2           HB3      SER   2  -8.800   7.569   3.359
   16    HG   SER   2           HG       SER   2  -8.861   9.189   1.047
   17    H    LYS   3           H        LYS   3  -8.021   8.577   5.816
   18    HA   LYS   3           HA       LYS   3  -5.436   7.228   6.163
   19    HB2  LYS   3           HB2      LYS   3  -5.183   9.567   6.999
   20    HB3  LYS   3           HB3      LYS   3  -6.492   9.267   8.140
   21    HG2  LYS   3           HG2      LYS   3  -5.157   7.372   9.094
   22    HG3  LYS   3           HG3      LYS   3  -3.832   7.808   8.013
   23    HD2  LYS   3           HD2      LYS   3  -5.054   9.773   9.964
   24    HD3  LYS   3           HD3      LYS   3  -3.683   8.749  10.383
   25    HE2  LYS   3           HE2      LYS   3  -2.421   9.693   8.457
   26    HE3  LYS   3           HE3      LYS   3  -3.780  10.762   8.113
   27    HZ1  LYS   3           HZ1      LYS   3  -1.996  10.754  10.467
   28    HZ2  LYS   3           HZ2      LYS   3  -3.521  11.502  10.516
   29    HZ3  LYS   3           HZ3      LYS   3  -2.346  12.033   9.410
   30    H    GLY   4           H        GLY   4  -5.722   5.309   7.053
   31    HA2  GLY   4           HA2      GLY   4  -8.041   4.850   8.833
   32    HA3  GLY   4           HA3      GLY   4  -7.636   3.716   7.546
   33    H    ILE   5           H        ILE   5  -7.636   2.349   9.654
   34    HA   ILE   5           HA       ILE   5  -4.881   2.363  10.755
   35    HB   ILE   5           HB       ILE   5  -5.876   1.150  12.735
   36   HG12  ILE   5          HG12      ILE   5  -8.530   2.231  11.748
   37   HG13  ILE   5          HG13      ILE   5  -8.035   0.574  11.426
   38   HG21  ILE   5          HG21      ILE   5  -6.812   3.243  13.726
   39   HG22  ILE   5          HG22      ILE   5  -6.836   3.960  12.115
   40   HG23  ILE   5          HG23      ILE   5  -5.301   3.517  12.861
   41   HD11  ILE   5          HD11      ILE   5  -9.360   0.550  13.443
   42   HD12  ILE   5          HD12      ILE   5  -8.425   1.875  14.134
   43   HD13  ILE   5          HD13      ILE   5  -7.681   0.291  13.918
   44    H    VAL   6           H        VAL   6  -3.670   0.658  10.413
   45    HA   VAL   6           HA       VAL   6  -4.527  -1.389   8.658
   46    HB   VAL   6           HB       VAL   6  -2.034  -1.253  10.375
   47   HG11  VAL   6          HG11      VAL   6  -2.203  -3.507   9.659
   48   HG12  VAL   6          HG12      VAL   6  -1.169  -2.757   8.444
   49   HG13  VAL   6          HG13      VAL   6  -2.872  -3.050   8.094
   50   HG21  VAL   6          HG21      VAL   6  -2.415  -0.531   7.451
   51   HG22  VAL   6          HG22      VAL   6  -0.958  -0.305   8.419
   52   HG23  VAL   6          HG23      VAL   6  -2.399   0.654   8.757
   53    H    LYS   7           H        LYS   7  -5.591  -3.185   9.073
   54    HA   LYS   7           HA       LYS   7  -6.397  -3.958  11.693
   55    HB2  LYS   7           HB2      LYS   7  -7.689  -4.468   9.605
   56    HB3  LYS   7           HB3      LYS   7  -6.436  -5.625   9.158
   57    HG2  LYS   7           HG2      LYS   7  -6.854  -6.875  11.260
   58    HG3  LYS   7           HG3      LYS   7  -8.133  -5.733  11.674
   59    HD2  LYS   7           HD2      LYS   7  -8.140  -7.325   9.098
   60    HD3  LYS   7           HD3      LYS   7  -8.901  -7.910  10.577
   61    HE2  LYS   7           HE2      LYS   7 -10.285  -5.835  10.647
   62    HE3  LYS   7           HE3      LYS   7  -9.573  -5.338   9.112
   63    HZ1  LYS   7           HZ1      LYS   7 -11.524  -6.399   8.497
   64    HZ2  LYS   7           HZ2      LYS   7 -11.364  -7.618   9.669
   65    HZ3  LYS   7           HZ3      LYS   7 -10.361  -7.616   8.297
   66    H    TRP   8           H        TRP   8  -4.038  -5.227   9.366
   67    HA   TRP   8           HA       TRP   8  -2.289  -6.152  11.458
   68    HB2  TRP   8           HB2      TRP   8  -4.144  -7.946  11.128
   69    HB3  TRP   8           HB3      TRP   8  -3.334  -8.285   9.601
   70    HD1  TRP   8           HD1      TRP   8  -0.955  -9.417   9.688
   71    HE1  TRP   8           HE1      TRP   8   0.338 -10.615  11.571
   72    HE3  TRP   8           HE3      TRP   8  -3.718  -7.953  13.724
   73    HZ2  TRP   8           HZ2      TRP   8   0.213 -10.916  14.413
   74    HZ3  TRP   8           HZ3      TRP   8  -3.113  -8.712  16.004
   75    HH2  TRP   8           HH2      TRP   8  -1.154 -10.191  16.354
   76    H    PHE   9           H        PHE   9  -0.280  -5.760  10.703
   77    HA   PHE   9           HA       PHE   9   0.127  -5.763   7.758
   78    HB2  PHE   9           HB2      PHE   9   0.608  -3.633   9.054
   79    HB3  PHE   9           HB3      PHE   9   1.935  -4.501   9.823
   80    HD1  PHE   9           HD1      PHE   9   0.678  -3.068   6.678
   81    HD2  PHE   9           HD2      PHE   9   3.897  -5.219   8.543
   82    HE1  PHE   9           HE1      PHE   9   2.108  -2.643   4.698
   83    HE2  PHE   9           HE2      PHE   9   5.327  -4.788   6.562
   84    HZ   PHE   9           HZ       PHE   9   4.433  -3.502   4.641
   85    H    ASN  10           H        ASN  10   1.236  -7.432   6.920
   86    HA   ASN  10           HA       ASN  10   3.199  -8.824   8.652
   87    HB2  ASN  10           HB2      ASN  10   1.188 -10.000   6.729
   88    HB3  ASN  10           HB3      ASN  10   2.580 -10.901   7.324
   89   HD21  ASN  10          HD21      ASN  10  -0.192 -11.605   7.895
   90   HD22  ASN  10          HD22      ASN  10  -0.412 -11.461   9.572
   91    H    SER  11           H        SER  11   4.990  -7.745   7.822
   92    HA   SER  11           HA       SER  11   5.522  -7.309   5.092
   93    HB2  SER  11           HB2      SER  11   7.818  -6.887   5.818
   94    HB3  SER  11           HB3      SER  11   6.679  -6.132   6.928
   95    HG   SER  11           HG       SER  11   8.433  -8.228   7.310
   96    H    ASP  12           H        ASP  12   6.122 -10.078   7.200
   97    HA   ASP  12           HA       ASP  12   7.979 -11.470   5.604
   98    HB2  ASP  12           HB2      ASP  12   5.837 -12.461   7.499
   99    HB3  ASP  12           HB3      ASP  12   7.004 -13.530   6.727
  100    H    LYS  13           H        LYS  13   4.437 -11.447   5.616
  101    HA   LYS  13           HA       LYS  13   4.168 -13.269   3.404
  102    HB2  LYS  13           HB2      LYS  13   2.229 -11.364   4.735
  103    HB3  LYS  13           HB3      LYS  13   1.785 -12.470   3.438
  104    HG2  LYS  13           HG2      LYS  13   2.534 -14.384   4.800
  105    HG3  LYS  13           HG3      LYS  13   2.978 -13.280   6.105
  106    HD2  LYS  13           HD2      LYS  13   0.635 -12.527   6.272
  107    HD3  LYS  13           HD3      LYS  13   0.188 -13.630   4.967
  108    HE2  LYS  13           HE2      LYS  13   0.930 -15.549   6.326
  109    HE3  LYS  13           HE3      LYS  13   1.386 -14.454   7.629
  110    HZ1  LYS  13           HZ1      LYS  13  -1.032 -13.656   7.448
  111    HZ2  LYS  13           HZ2      LYS  13  -0.724 -15.136   8.223
  112    HZ3  LYS  13           HZ3      LYS  13  -1.307 -15.114   6.627
  113    H    GLY  14           H        GLY  14   4.580  -9.845   3.834
  114    HA2  GLY  14           HA2      GLY  14   5.369  -8.348   2.190
  115    HA3  GLY  14           HA3      GLY  14   4.820  -9.457   0.943
  116    H    PHE  15           H        PHE  15   2.394  -9.053   3.280
  117    HA   PHE  15           HA       PHE  15   1.271  -6.616   2.202
  118    HB2  PHE  15           HB2      PHE  15  -0.790  -7.652   1.333
  119    HB3  PHE  15           HB3      PHE  15   0.636  -8.150   0.425
  120    HD1  PHE  15           HD1      PHE  15  -1.919  -9.213   2.874
  121    HD2  PHE  15           HD2      PHE  15   1.446 -10.436   0.499
  122    HE1  PHE  15           HE1      PHE  15  -2.475 -11.588   3.312
  123    HE2  PHE  15           HE2      PHE  15   0.890 -12.812   0.940
  124    HZ   PHE  15           HZ       PHE  15  -1.069 -13.389   2.345
  125    H    GLY  16           H        GLY  16  -1.035  -6.320   3.048
  126    HA2  GLY  16           HA2      GLY  16  -1.666  -7.640   5.545
  127    HA3  GLY  16           HA3      GLY  16  -1.115  -5.976   5.728
  128    H    PHE  17           H        PHE  17  -3.571  -6.430   6.607
  129    HA   PHE  17           HA       PHE  17  -5.392  -5.439   4.485
  130    HB2  PHE  17           HB2      PHE  17  -6.022  -7.040   6.983
  131    HB3  PHE  17           HB3      PHE  17  -7.229  -6.373   5.884
  132    HD1  PHE  17           HD1      PHE  17  -4.631  -8.933   6.336
  133    HD2  PHE  17           HD2      PHE  17  -7.507  -7.265   3.614
  134    HE1  PHE  17           HE1      PHE  17  -4.407 -10.927   4.878
  135    HE2  PHE  17           HE2      PHE  17  -7.283  -9.258   2.157
  136    HZ   PHE  17           HZ       PHE  17  -5.734 -11.090   2.788
  137    H    ILE  18           H        ILE  18  -6.434  -3.521   4.853
  138    HA   ILE  18           HA       ILE  18  -5.893  -2.218   7.442
  139    HB   ILE  18           HB       ILE  18  -4.751  -1.130   5.566
  140   HG12  ILE  18          HG12      ILE  18  -7.062   0.637   6.391
  141   HG13  ILE  18          HG13      ILE  18  -5.793   0.170   7.528
  142   HG21  ILE  18          HG21      ILE  18  -6.277   0.089   3.890
  143   HG22  ILE  18          HG22      ILE  18  -7.555  -0.994   4.439
  144   HG23  ILE  18          HG23      ILE  18  -6.106  -1.654   3.682
  145   HD11  ILE  18          HD11      ILE  18  -5.347   1.581   4.880
  146   HD12  ILE  18          HD12      ILE  18  -4.091   1.132   6.030
  147   HD13  ILE  18          HD13      ILE  18  -5.288   2.350   6.466
  148    H    THR  19           H        THR  19  -7.449  -1.061   8.476
  149    HA   THR  19           HA       THR  19 -10.207  -1.737   7.733
  150    HB   THR  19           HB       THR  19  -9.085  -0.862  10.399
  151    HG1  THR  19           HG1      THR  19  -8.633  -2.879  10.670
  152   HG21  THR  19          HG21      THR  19 -11.300  -1.862  11.191
  153   HG22  THR  19          HG22      THR  19 -11.806  -1.842   9.502
  154   HG23  THR  19          HG23      THR  19 -11.419  -0.330  10.325
  155    HA   PRO  20           HA       PRO  20 -10.306   2.743   6.568
  156    HB2  PRO  20           HB2      PRO  20 -13.177   1.949   6.209
  157    HB3  PRO  20           HB3      PRO  20 -12.139   2.906   5.136
  158    HG2  PRO  20           HG2      PRO  20 -12.684   0.416   4.529
  159    HG3  PRO  20           HG3      PRO  20 -11.033   1.035   4.326
  160    HD2  PRO  20           HD2      PRO  20 -12.123  -0.739   6.487
  161    HD3  PRO  20           HD3      PRO  20 -10.541  -0.795   5.672
  162    H    GLU  21           H        GLU  21 -10.588   4.378   8.014
  163    HA   GLU  21           HA       GLU  21 -11.716   3.981  10.573
  164    HB2  GLU  21           HB2      GLU  21 -11.399   6.399  10.888
  165    HB3  GLU  21           HB3      GLU  21  -9.979   5.662  10.151
  166    HG2  GLU  21           HG2      GLU  21 -10.719   6.425   7.928
  167    HG3  GLU  21           HG3      GLU  21 -12.168   7.126   8.638
  168    H    ASP  22           H        ASP  22 -13.078   5.161   7.576
  169    HA   ASP  22           HA       ASP  22 -15.430   6.356   8.642
  170    HB2  ASP  22           HB2      ASP  22 -14.750   5.262   5.911
  171    HB3  ASP  22           HB3      ASP  22 -16.288   6.037   6.275
  172    H    GLY  23           H        GLY  23 -14.500   3.066   8.167
  173    HA2  GLY  23           HA2      GLY  23 -15.747   1.298   9.238
  174    HA3  GLY  23           HA3      GLY  23 -17.226   2.183   8.883
  175    H    SER  24           H        SER  24 -15.099   2.284   6.248
  176    HA   SER  24           HA       SER  24 -16.802   0.661   4.620
  177    HB2  SER  24           HB2      SER  24 -14.122   1.943   4.048
  178    HB3  SER  24           HB3      SER  24 -15.133   1.155   2.846
  179    HG   SER  24           HG       SER  24 -15.279   3.598   3.381
  180    H    LYS  25           H        LYS  25 -15.846  -1.055   3.199
  181    HA   LYS  25           HA       LYS  25 -14.913  -3.211   4.764
  182    HB2  LYS  25           HB2      LYS  25 -15.035  -2.839   1.765
  183    HB3  LYS  25           HB3      LYS  25 -14.633  -4.364   2.555
  184    HG2  LYS  25           HG2      LYS  25 -16.814  -4.236   3.789
  185    HG3  LYS  25           HG3      LYS  25 -17.221  -2.809   2.840
  186    HD2  LYS  25           HD2      LYS  25 -16.500  -5.467   1.580
  187    HD3  LYS  25           HD3      LYS  25 -18.157  -5.006   1.958
  188    HE2  LYS  25           HE2      LYS  25 -17.893  -2.981   0.533
  189    HE3  LYS  25           HE3      LYS  25 -16.265  -3.514   0.112
  190    HZ1  LYS  25           HZ1      LYS  25 -18.771  -5.026  -0.405
  191    HZ2  LYS  25           HZ2      LYS  25 -17.201  -5.540  -0.809
  192    HZ3  LYS  25           HZ3      LYS  25 -17.872  -4.174  -1.565
  193    H    ASP  26           H        ASP  26 -12.924  -4.299   4.770
  194    HA   ASP  26           HA       ASP  26 -10.642  -2.713   4.902
  195    HB2  ASP  26           HB2      ASP  26  -9.390  -4.795   5.099
  196    HB3  ASP  26           HB3      ASP  26 -10.873  -4.885   6.041
  197    H    LEU  27           H        LEU  27  -8.745  -2.655   3.636
  198    HA   LEU  27           HA       LEU  27  -9.160  -3.233   0.762
  199    HB2  LEU  27           HB2      LEU  27  -7.718  -0.876   2.005
  200    HB3  LEU  27           HB3      LEU  27  -7.832  -1.209   0.280
  201    HG   LEU  27           HG       LEU  27 -10.252  -0.804   2.064
  202   HD11  LEU  27          HD11      LEU  27  -8.867   1.162   0.215
  203   HD12  LEU  27          HD12      LEU  27  -8.861   1.240   1.978
  204   HD13  LEU  27          HD13      LEU  27 -10.370   1.455   1.090
  205   HD21  LEU  27          HD21      LEU  27  -9.835  -0.904  -0.942
  206   HD22  LEU  27          HD22      LEU  27 -11.332  -0.361  -0.183
  207   HD23  LEU  27          HD23      LEU  27 -10.785  -2.023   0.036
  208    H    PHE  28           H        PHE  28  -7.343  -3.877  -0.431
  209    HA   PHE  28           HA       PHE  28  -5.361  -5.339   1.079
  210    HB2  PHE  28           HB2      PHE  28  -5.812  -4.929  -1.884
  211    HB3  PHE  28           HB3      PHE  28  -4.503  -5.915  -1.230
  212    HD1  PHE  28           HD1      PHE  28  -8.166  -5.596  -1.579
  213    HD2  PHE  28           HD2      PHE  28  -4.938  -8.045  -0.156
  214    HE1  PHE  28           HE1      PHE  28  -9.730  -7.503  -1.318
  215    HE2  PHE  28           HE2      PHE  28  -6.501  -9.952   0.107
  216    HZ   PHE  28           HZ       PHE  28  -8.896  -9.682  -0.474
  217    H    VAL  29           H        VAL  29  -3.376  -4.698   1.613
  218    HA   VAL  29           HA       VAL  29  -2.176  -2.383   0.226
  219    HB   VAL  29           HB       VAL  29  -2.251  -2.880   3.216
  220   HG11  VAL  29          HG11      VAL  29  -1.085  -0.620   3.289
  221   HG12  VAL  29          HG12      VAL  29  -0.801  -0.801   1.558
  222   HG13  VAL  29          HG13      VAL  29  -0.088  -1.948   2.692
  223   HG21  VAL  29          HG21      VAL  29  -4.296  -1.878   2.018
  224   HG22  VAL  29          HG22      VAL  29  -3.272  -0.475   1.716
  225   HG23  VAL  29          HG23      VAL  29  -3.631  -0.963   3.371
  226    H    HIS  30           H        HIS  30  -0.103  -2.692  -0.385
  227    HA   HIS  30           HA       HIS  30   1.248  -5.165   0.514
  228    HB2  HIS  30           HB2      HIS  30   1.590  -3.552  -2.027
  229    HB3  HIS  30           HB3      HIS  30   2.558  -4.962  -1.595
  230    HD2  HIS  30           HD2      HIS  30  -0.742  -4.197  -3.367
  231    HE1  HIS  30           HE1      HIS  30  -0.912  -8.284  -2.324
  232    HE2  HIS  30           HE2      HIS  30  -2.013  -6.454  -3.696
  233    H    HIS  31           H        HIS  31   3.433  -5.116   1.065
  234    HA   HIS  31           HA       HIS  31   4.337  -2.857   2.509
  235    HB2  HIS  31           HB2      HIS  31   5.065  -5.215   2.927
  236    HB3  HIS  31           HB3      HIS  31   6.013  -5.148   1.440
  237    HD2  HIS  31           HD2      HIS  31   6.240  -3.900   5.132
  238    HE1  HIS  31           HE1      HIS  31   9.648  -2.466   3.098
  239    HE2  HIS  31           HE2      HIS  31   8.558  -2.724   5.375
  240    H    SER  32           H        SER  32   5.304  -4.162  -0.650
  241    HA   SER  32           HA       SER  32   7.200  -2.117  -1.238
  242    HB2  SER  32           HB2      SER  32   7.212  -4.364  -2.287
  243    HB3  SER  32           HB3      SER  32   5.743  -3.941  -3.158
  244    HG   SER  32           HG       SER  32   8.348  -2.897  -3.399
  245    H    GLU  33           H        GLU  33   3.888  -1.835  -1.015
  246    HA   GLU  33           HA       GLU  33   3.266  -0.299  -3.330
  247    HB2  GLU  33           HB2      GLU  33   1.611  -1.477  -1.845
  248    HB3  GLU  33           HB3      GLU  33   1.881  -0.218  -0.643
  249    HG2  GLU  33           HG2      GLU  33  -0.089   0.342  -1.967
  250    HG3  GLU  33           HG3      GLU  33   1.196   1.491  -2.317
  251    H    ILE  34           H        ILE  34   4.696   0.507  -0.229
  252    HA   ILE  34           HA       ILE  34   4.208   3.322  -0.357
  253    HB   ILE  34           HB       ILE  34   4.684   2.152   1.765
  254   HG12  ILE  34          HG12      ILE  34   6.921   4.123   1.238
  255   HG13  ILE  34          HG13      ILE  34   5.237   4.636   1.331
  256   HG21  ILE  34          HG21      ILE  34   7.586   1.988   0.936
  257   HG22  ILE  34          HG22      ILE  34   6.477   0.653   0.631
  258   HG23  ILE  34          HG23      ILE  34   6.777   1.188   2.283
  259   HD11  ILE  34          HD11      ILE  34   6.915   3.353   3.494
  260   HD12  ILE  34          HD12      ILE  34   5.155   3.417   3.591
  261   HD13  ILE  34          HD13      ILE  34   6.090   4.911   3.537
  262    H    GLN  35           H        GLN  35   5.689   4.993  -0.830
  263    HA   GLN  35           HA       GLN  35   7.975   4.225  -2.546
  264    HB2  GLN  35           HB2      GLN  35   5.959   6.431  -3.028
  265    HB3  GLN  35           HB3      GLN  35   7.443   6.211  -3.955
  266    HG2  GLN  35           HG2      GLN  35   6.699   3.950  -4.612
  267    HG3  GLN  35           HG3      GLN  35   5.209   4.176  -3.695
  268   HE21  GLN  35          HE21      GLN  35   3.661   4.311  -5.372
  269   HE22  GLN  35          HE22      GLN  35   3.728   5.456  -6.625
  270    H    SER  36           H        SER  36   9.764   5.598  -2.496
  271    HA   SER  36           HA       SER  36  11.328   6.928  -1.470
  272    HB2  SER  36           HB2      SER  36   8.890   8.659  -0.980
  273    HB3  SER  36           HB3      SER  36  10.564   9.191  -0.838
  274    HG   SER  36           HG       SER  36   9.021   8.925  -3.036
  275    H    GLY  37           H        GLY  37  10.285   4.814   0.097
  276    HA2  GLY  37           HA2      GLY  37   9.628   5.672   2.749
  277    HA3  GLY  37           HA3      GLY  37  10.107   4.046   2.268
  278    H    GLY  38           H        GLY  38  10.970   5.310   4.651
  279    HA2  GLY  38           HA2      GLY  38  13.707   4.766   4.664
  280    HA3  GLY  38           HA3      GLY  38  13.534   6.504   4.441
  281    H    GLU  39           H        GLU  39  14.752   6.324   6.573
  282    HA   GLU  39           HA       GLU  39  14.823   6.618   8.847
  283    HB2  GLU  39           HB2      GLU  39  11.910   7.353   8.425
  284    HB3  GLU  39           HB3      GLU  39  12.848   7.696   9.879
  285    HG2  GLU  39           HG2      GLU  39  14.430   9.043   8.533
  286    HG3  GLU  39           HG3      GLU  39  13.466   8.720   7.092
  287    H    TYR  40           H        TYR  40  14.399   3.969   7.924
  288    HA   TYR  40           HA       TYR  40  13.809   1.874   8.659
  289    HB2  TYR  40           HB2      TYR  40  13.704   3.365  11.293
  290    HB3  TYR  40           HB3      TYR  40  13.678   1.610  11.137
  291    HD1  TYR  40           HD1      TYR  40  15.727   4.645  10.853
  292    HD2  TYR  40           HD2      TYR  40  15.652   0.382  10.326
  293    HE1  TYR  40           HE1      TYR  40  18.204   4.618  10.709
  294    HE2  TYR  40           HE2      TYR  40  18.128   0.356  10.183
  295    HH   TYR  40           HH       TYR  40  20.038   1.996  11.123
  296    H    ALA  41           H        ALA  41  11.700   3.455   7.580
  297    HA   ALA  41           HA       ALA  41   9.349   3.515   9.104
  298    HB1  ALA  41           HB1      ALA  41   9.450   4.663   6.984
  299    HB2  ALA  41           HB2      ALA  41   8.183   3.442   6.882
  300    HB3  ALA  41           HB3      ALA  41   9.750   3.150   6.127
  301    H    THR  42           H        THR  42   8.000   2.006   9.801
  302    HA   THR  42           HA       THR  42   7.942  -0.639   8.536
  303    HB   THR  42           HB       THR  42   9.572  -0.836  10.362
  304    HG1  THR  42           HG1      THR  42   7.120  -2.024  11.118
  305   HG21  THR  42          HG21      THR  42   7.298  -0.021  12.198
  306   HG22  THR  42          HG22      THR  42   8.657   1.021  11.768
  307   HG23  THR  42          HG23      THR  42   8.938  -0.463  12.683
  308    H    LEU  43           H        LEU  43   6.106  -1.973   9.368
  309    HA   LEU  43           HA       LEU  43   3.876  -0.391  10.441
  310    HB2  LEU  43           HB2      LEU  43   3.718  -2.069   7.931
  311    HB3  LEU  43           HB3      LEU  43   2.349  -1.313   8.726
  312    HG   LEU  43           HG       LEU  43   4.741   0.220   7.656
  313   HD11  LEU  43          HD11      LEU  43   3.097   0.884   5.838
  314   HD12  LEU  43          HD12      LEU  43   2.050  -0.412   6.416
  315   HD13  LEU  43          HD13      LEU  43   3.644  -0.791   5.767
  316   HD21  LEU  43          HD21      LEU  43   2.955   2.097   7.755
  317   HD22  LEU  43          HD22      LEU  43   3.631   1.551   9.288
  318   HD23  LEU  43          HD23      LEU  43   2.037   0.993   8.782
  319    H    ALA  44           H        ALA  44   2.268  -1.670  11.477
  320    HA   ALA  44           HA       ALA  44   2.764  -4.546  11.766
  321    HB1  ALA  44           HB1      ALA  44   2.452  -2.894  14.261
  322    HB2  ALA  44           HB2      ALA  44   4.045  -3.109  13.532
  323    HB3  ALA  44           HB3      ALA  44   3.129  -4.512  14.080
  324    H    ASP  45           H        ASP  45   0.962  -4.851  14.035
  325    HA   ASP  45           HA       ASP  45  -1.551  -4.598  12.607
  326    HB2  ASP  45           HB2      ASP  45  -2.460  -5.929  14.479
  327    HB3  ASP  45           HB3      ASP  45  -1.055  -6.697  13.750
  328    H    GLY  46           H        GLY  46  -2.714  -2.818  12.753
  329    HA2  GLY  46           HA2      GLY  46  -4.118  -1.321  13.968
  330    HA3  GLY  46           HA3      GLY  46  -3.062  -1.496  15.361
  331    H    GLN  47           H        GLN  47  -0.978  -1.137  12.862
  332    HA   GLN  47           HA       GLN  47  -0.115   1.441  13.555
  333    HB2  GLN  47           HB2      GLN  47   1.240  -0.364  12.480
  334    HB3  GLN  47           HB3      GLN  47   0.385  -0.056  10.972
  335    HG2  GLN  47           HG2      GLN  47   2.535   1.120  11.003
  336    HG3  GLN  47           HG3      GLN  47   1.207   2.267  10.980
  337   HE21  GLN  47          HE21      GLN  47   1.728   4.004  12.325
  338   HE22  GLN  47          HE22      GLN  47   2.499   3.870  13.831
  339    H    THR  48           H        THR  48  -0.655   3.427  12.881
  340    HA   THR  48           HA       THR  48  -2.945   3.764  11.124
  341    HB   THR  48           HB       THR  48  -1.230   5.848  12.513
  342    HG1  THR  48           HG1      THR  48  -3.646   4.561  13.253
  343   HG21  THR  48          HG21      THR  48  -2.970   7.393  12.050
  344   HG22  THR  48          HG22      THR  48  -4.096   6.114  11.598
  345   HG23  THR  48          HG23      THR  48  -2.750   6.520  10.533
  346    H    VAL  49           H        VAL  49  -2.876   4.274   9.029
  347    HA   VAL  49           HA       VAL  49  -0.429   5.442   7.892
  348    HB   VAL  49           HB       VAL  49  -0.457   3.835   6.008
  349   HG11  VAL  49          HG11      VAL  49   0.954   3.524   8.086
  350   HG12  VAL  49          HG12      VAL  49   0.609   2.037   7.200
  351   HG13  VAL  49          HG13      VAL  49  -0.283   2.411   8.674
  352   HG21  VAL  49          HG21      VAL  49  -1.747   1.698   6.352
  353   HG22  VAL  49          HG22      VAL  49  -2.773   3.100   6.058
  354   HG23  VAL  49          HG23      VAL  49  -2.583   2.476   7.696
  355    H    GLU  50           H        GLU  50  -0.735   6.109   5.600
  356    HA   GLU  50           HA       GLU  50  -3.484   7.131   5.165
  357    HB2  GLU  50           HB2      GLU  50  -0.839   8.316   4.260
  358    HB3  GLU  50           HB3      GLU  50  -2.433   8.971   3.888
  359    HG2  GLU  50           HG2      GLU  50  -2.872   9.259   6.306
  360    HG3  GLU  50           HG3      GLU  50  -1.264   8.633   6.666
  361    H    TYR  51           H        TYR  51  -4.405   6.797   3.147
  362    HA   TYR  51           HA       TYR  51  -2.812   5.649   0.996
  363    HB2  TYR  51           HB2      TYR  51  -4.188   3.615   0.813
  364    HB3  TYR  51           HB3      TYR  51  -3.325   3.673   2.346
  365    HD1  TYR  51           HD1      TYR  51  -6.615   3.914   0.712
  366    HD2  TYR  51           HD2      TYR  51  -4.514   4.081   4.454
  367    HE1  TYR  51           HE1      TYR  51  -8.768   3.733   1.928
  368    HE2  TYR  51           HE2      TYR  51  -6.668   3.897   5.671
  369    HH   TYR  51           HH       TYR  51  -9.242   2.770   4.690
  370    H    GLU  52           H        GLU  52  -4.070   5.216  -0.949
  371    HA   GLU  52           HA       GLU  52  -6.413   7.010  -1.203
  372    HB2  GLU  52           HB2      GLU  52  -4.300   6.331  -3.274
  373    HB3  GLU  52           HB3      GLU  52  -5.724   7.328  -3.563
  374    HG2  GLU  52           HG2      GLU  52  -3.549   7.950  -1.541
  375    HG3  GLU  52           HG3      GLU  52  -3.696   8.700  -3.127
  376    H    VAL  53           H        VAL  53  -8.244   6.095  -1.987
  377    HA   VAL  53           HA       VAL  53  -8.224   3.217  -2.473
  378    HB   VAL  53           HB       VAL  53 -10.526   5.198  -2.320
  379   HG11  VAL  53          HG11      VAL  53 -10.588   2.164  -2.221
  380   HG12  VAL  53          HG12      VAL  53 -11.021   3.118  -3.641
  381   HG13  VAL  53          HG13      VAL  53 -11.977   3.251  -2.165
  382   HG21  VAL  53          HG21      VAL  53 -10.852   4.400  -0.080
  383   HG22  VAL  53          HG22      VAL  53  -9.143   4.803  -0.219
  384   HG23  VAL  53          HG23      VAL  53  -9.660   3.119  -0.295
  385    H    GLY  54           H        GLY  54  -7.832   2.486  -4.446
  386    HA2  GLY  54           HA2      GLY  54  -8.962   3.941  -6.770
  387    HA3  GLY  54           HA3      GLY  54  -7.351   3.228  -6.806
  388    H    GLN  55           H        GLN  55 -10.501   2.745  -7.678
  389    HA   GLN  55           HA       GLN  55 -11.059   0.077  -7.135
  390    HB2  GLN  55           HB2      GLN  55 -11.796   1.781  -9.522
  391    HB3  GLN  55           HB3      GLN  55 -12.482   0.185  -9.200
  392    HG2  GLN  55           HG2      GLN  55 -13.293   0.977  -7.007
  393    HG3  GLN  55           HG3      GLN  55 -12.616   2.571  -7.333
  394   HE21  GLN  55          HE21      GLN  55 -14.497   3.832  -7.610
  395   HE22  GLN  55          HE22      GLN  55 -15.707   3.484  -8.749
  396    H    GLY  56           H        GLY  56 -10.675  -1.828  -8.159
  397    HA2  GLY  56           HA2      GLY  56  -8.812  -1.885 -10.433
  398    HA3  GLY  56           HA3      GLY  56  -8.421  -2.794  -8.974
  399    H    GLN  57           H        GLN  57  -8.498  -4.437 -10.896
  400    HA   GLN  57           HA       GLN  57 -10.971  -5.333 -11.915
  401    HB2  GLN  57           HB2      GLN  57  -8.319  -6.725 -11.511
  402    HB3  GLN  57           HB3      GLN  57  -9.684  -7.460 -12.355
  403    HG2  GLN  57           HG2      GLN  57  -9.703  -5.704 -14.007
  404    HG3  GLN  57           HG3      GLN  57  -8.518  -4.768 -13.098
  405   HE21  GLN  57          HE21      GLN  57  -8.319  -5.885 -15.900
  406   HE22  GLN  57          HE22      GLN  57  -6.925  -6.852 -15.893
  407    H    LYS  58           H        LYS  58  -9.122  -6.285  -9.034
  408    HA   LYS  58           HA       LYS  58 -11.116  -8.271  -8.277
  409    HB2  LYS  58           HB2      LYS  58  -8.598  -7.298  -6.915
  410    HB3  LYS  58           HB3      LYS  58  -9.643  -8.567  -6.275
  411    HG2  LYS  58           HG2      LYS  58  -9.306  -9.886  -8.333
  412    HG3  LYS  58           HG3      LYS  58  -8.258  -8.621  -8.975
  413    HD2  LYS  58           HD2      LYS  58  -6.713  -8.933  -7.077
  414    HD3  LYS  58           HD3      LYS  58  -7.758 -10.202  -6.436
  415    HE2  LYS  58           HE2      LYS  58  -7.424 -11.525  -8.489
  416    HE3  LYS  58           HE3      LYS  58  -6.385 -10.255  -9.139
  417    HZ1  LYS  58           HZ1      LYS  58  -5.013 -11.926  -8.172
  418    HZ2  LYS  58           HZ2      LYS  58  -5.897 -11.906  -6.722
  419    HZ3  LYS  58           HZ3      LYS  58  -4.950 -10.566  -7.162
  420    H    GLY  59           H        GLY  59 -10.418  -4.939  -7.628
  421    HA2  GLY  59           HA2      GLY  59 -12.651  -3.959  -6.648
  422    HA3  GLY  59           HA3      GLY  59 -12.128  -4.878  -5.240
  423    HA   PRO  60           HA       PRO  60 -10.248  -0.474  -5.292
  424    HB2  PRO  60           HB2      PRO  60 -11.294  -0.514  -2.503
  425    HB3  PRO  60           HB3      PRO  60 -11.335   0.786  -3.710
  426    HG2  PRO  60           HG2      PRO  60 -13.529  -0.554  -3.122
  427    HG3  PRO  60           HG3      PRO  60 -13.166  -0.096  -4.797
  428    HD2  PRO  60           HD2      PRO  60 -12.841  -2.780  -3.470
  429    HD3  PRO  60           HD3      PRO  60 -13.462  -2.398  -5.094
  430    H    CYS  61           H        CYS  61  -8.257  -0.026  -4.529
  431    HA   CYS  61           HA       CYS  61  -7.071  -1.798  -2.481
  432    HB2  CYS  61           HB2      CYS  61  -5.748  -0.804  -5.020
  433    HB3  CYS  61           HB3      CYS  61  -4.962  -1.746  -3.755
  434    HG   CYS  61           HG       CYS  61  -6.969  -3.581  -4.344
  435    H    ALA  62           H        ALA  62  -4.966  -0.769  -1.609
  436    HA   ALA  62           HA       ALA  62  -5.386   2.160  -1.367
  437    HB1  ALA  62           HB1      ALA  62  -5.692   1.669   0.818
  438    HB2  ALA  62           HB2      ALA  62  -3.941   1.471   0.868
  439    HB3  ALA  62           HB3      ALA  62  -4.985   0.066   0.655
  440    H    ASN  63           H        ASN  63  -3.796   3.377  -2.142
  441    HA   ASN  63           HA       ASN  63  -1.104   2.180  -2.463
  442    HB2  ASN  63           HB2      ASN  63  -2.476   4.246  -4.200
  443    HB3  ASN  63           HB3      ASN  63  -0.844   3.623  -4.436
  444   HD21  ASN  63          HD21      ASN  63  -3.587   3.339  -5.974
  445   HD22  ASN  63          HD22      ASN  63  -3.653   1.674  -6.297
  446    H    LYS  64           H        LYS  64   0.660   3.834  -2.568
  447    HA   LYS  64           HA       LYS  64   1.889   5.490  -1.568
  448    HB2  LYS  64           HB2      LYS  64  -0.793   6.895  -1.589
  449    HB3  LYS  64           HB3      LYS  64   0.740   7.677  -1.206
  450    HG2  LYS  64           HG2      LYS  64   1.612   7.048  -3.432
  451    HG3  LYS  64           HG3      LYS  64   0.071   6.283  -3.817
  452    HD2  LYS  64           HD2      LYS  64  -1.082   8.444  -3.549
  453    HD3  LYS  64           HD3      LYS  64   0.449   9.215  -3.136
  454    HE2  LYS  64           HE2      LYS  64  -0.051   9.616  -5.495
  455    HE3  LYS  64           HE3      LYS  64   1.349   8.554  -5.365
  456    HZ1  LYS  64           HZ1      LYS  64  -0.393   7.858  -7.006
  457    HZ2  LYS  64           HZ2      LYS  64  -1.417   7.540  -5.688
  458    HZ3  LYS  64           HZ3      LYS  64   0.037   6.679  -5.866
  459    H    VAL  65           H        VAL  65   1.599   3.580   0.114
  460    HA   VAL  65           HA       VAL  65   0.153   4.178   2.518
  461    HB   VAL  65           HB       VAL  65   2.423   2.218   2.036
  462   HG11  VAL  65          HG11      VAL  65   1.447   1.057   4.041
  463   HG12  VAL  65          HG12      VAL  65   0.412   2.462   4.296
  464   HG13  VAL  65          HG13      VAL  65   2.164   2.624   4.416
  465   HG21  VAL  65          HG21      VAL  65   0.268   1.977   0.655
  466   HG22  VAL  65          HG22      VAL  65  -0.540   1.613   2.179
  467   HG23  VAL  65          HG23      VAL  65   0.763   0.573   1.598
  468    H    VAL  66           H        VAL  66   0.683   5.675   3.922
  469    HA   VAL  66           HA       VAL  66   3.548   6.281   4.415
  470    HB   VAL  66           HB       VAL  66   1.252   8.273   4.366
  471   HG11  VAL  66          HG11      VAL  66   3.099   9.951   4.639
  472   HG12  VAL  66          HG12      VAL  66   4.215   8.616   4.926
  473   HG13  VAL  66          HG13      VAL  66   2.888   8.915   6.050
  474   HG21  VAL  66          HG21      VAL  66   3.657   7.979   2.536
  475   HG22  VAL  66          HG22      VAL  66   2.401   9.212   2.412
  476   HG23  VAL  66          HG23      VAL  66   2.005   7.519   2.116
  477    H    ALA  67           H        ALA  67   4.125   5.856   6.437
  478    HA   ALA  67           HA       ALA  67   2.212   5.168   8.461
  479    HB1  ALA  67           HB1      ALA  67   4.084   4.621   9.813
  480    HB2  ALA  67           HB2      ALA  67   5.154   5.680   8.893
  481    HB3  ALA  67           HB3      ALA  67   4.552   4.189   8.169
  482    H    VAL  68           H        VAL  68   1.515   6.325  10.184
  483    HA   VAL  68           HA       VAL  68   2.644   9.009  10.644
  484    HB   VAL  68           HB       VAL  68   0.356   9.934  10.905
  485   HG11  VAL  68          HG11      VAL  68   1.633  10.101   8.758
  486   HG12  VAL  68          HG12      VAL  68  -0.115  10.119   8.529
  487   HG13  VAL  68          HG13      VAL  68   0.802   8.651   8.196
  488   HG21  VAL  68          HG21      VAL  68  -0.615   7.388   9.578
  489   HG22  VAL  68          HG22      VAL  68  -1.589   8.703  10.234
  490   HG23  VAL  68          HG23      VAL  68  -0.700   7.637  11.322
  Start of MODEL    8
    1    H1   MET   1           HT1      MET   1  -7.636  12.894  -0.056
    2    H2   MET   1           HT2      MET   1  -7.918  11.254  -0.395
    3    H3   MET   1           HT3      MET   1  -6.588  12.049  -1.088
    4    HA   MET   1           HA       MET   1  -5.668  10.799   0.637
    5    HB2  MET   1           HB2      MET   1  -6.207  13.645   1.527
    6    HB3  MET   1           HB3      MET   1  -5.062  12.573   2.337
    7    HG2  MET   1           HG2      MET   1  -3.758  12.339   0.296
    8    HG3  MET   1           HG3      MET   1  -4.949  13.273  -0.611
    9    HE1  MET   1           HE1      MET   1  -3.443  13.783   3.041
   10    HE2  MET   1           HE2      MET   1  -2.031  14.741   2.602
   11    HE3  MET   1           HE3      MET   1  -2.215  13.113   1.958
   12    H    SER   2           H        SER   2  -5.929   9.652   2.508
   13    HA   SER   2           HA       SER   2  -8.088  10.255   4.363
   14    HB2  SER   2           HB2      SER   2  -9.213   8.123   4.109
   15    HB3  SER   2           HB3      SER   2  -9.181   8.939   2.548
   16    HG   SER   2           HG       SER   2  -7.814   7.487   1.808
   17    H    LYS   3           H        LYS   3  -8.065   8.784   6.242
   18    HA   LYS   3           HA       LYS   3  -5.463   7.437   6.640
   19    HB2  LYS   3           HB2      LYS   3  -6.845   9.320   8.558
   20    HB3  LYS   3           HB3      LYS   3  -5.490   8.285   8.994
   21    HG2  LYS   3           HG2      LYS   3  -4.101   9.355   7.283
   22    HG3  LYS   3           HG3      LYS   3  -5.450  10.394   6.815
   23    HD2  LYS   3           HD2      LYS   3  -5.497  11.348   9.094
   24    HD3  LYS   3           HD3      LYS   3  -4.142  10.316   9.552
   25    HE2  LYS   3           HE2      LYS   3  -2.738  11.383   7.828
   26    HE3  LYS   3           HE3      LYS   3  -4.091  12.413   7.361
   27    HZ1  LYS   3           HZ1      LYS   3  -2.901  13.723   8.826
   28    HZ2  LYS   3           HZ2      LYS   3  -2.529  12.430   9.862
   29    HZ3  LYS   3           HZ3      LYS   3  -4.103  13.067   9.825
   30    H    GLY   4           H        GLY   4  -5.700   5.416   7.249
   31    HA2  GLY   4           HA2      GLY   4  -8.100   4.637   8.807
   32    HA3  GLY   4           HA3      GLY   4  -7.530   3.670   7.447
   33    H    ILE   5           H        ILE   5  -7.748   2.402   9.828
   34    HA   ILE   5           HA       ILE   5  -4.990   2.322  10.902
   35    HB   ILE   5           HB       ILE   5  -6.043   1.076  12.841
   36   HG12  ILE   5          HG12      ILE   5  -8.652   2.240  11.827
   37   HG13  ILE   5          HG13      ILE   5  -8.192   0.578  11.481
   38   HG21  ILE   5          HG21      ILE   5  -5.420   3.478  12.907
   39   HG22  ILE   5          HG22      ILE   5  -6.837   3.138  13.901
   40   HG23  ILE   5          HG23      ILE   5  -7.030   3.898  12.322
   41   HD11  ILE   5          HD11      ILE   5  -8.501   1.811  14.235
   42   HD12  ILE   5          HD12      ILE   5  -7.950   0.163  13.927
   43   HD13  ILE   5          HD13      ILE   5  -9.591   0.642  13.490
   44    H    VAL   6           H        VAL   6  -3.763   0.695  10.394
   45    HA   VAL   6           HA       VAL   6  -4.588  -1.343   8.653
   46    HB   VAL   6           HB       VAL   6  -2.106  -1.206  10.382
   47   HG11  VAL   6          HG11      VAL   6  -1.207  -2.664   8.441
   48   HG12  VAL   6          HG12      VAL   6  -2.899  -2.971   8.059
   49   HG13  VAL   6          HG13      VAL   6  -2.247  -3.452   9.625
   50   HG21  VAL   6          HG21      VAL   6  -2.501   0.721   8.791
   51   HG22  VAL   6          HG22      VAL   6  -2.482  -0.446   7.468
   52   HG23  VAL   6          HG23      VAL   6  -1.039  -0.205   8.452
   53    H    LYS   7           H        LYS   7  -5.593  -3.210   9.008
   54    HA   LYS   7           HA       LYS   7  -6.408  -4.047  11.611
   55    HB2  LYS   7           HB2      LYS   7  -7.630  -4.611   9.482
   56    HB3  LYS   7           HB3      LYS   7  -6.312  -5.716   9.076
   57    HG2  LYS   7           HG2      LYS   7  -6.724  -6.933  11.220
   58    HG3  LYS   7           HG3      LYS   7  -8.098  -5.874  11.528
   59    HD2  LYS   7           HD2      LYS   7  -7.862  -7.533   9.008
   60    HD3  LYS   7           HD3      LYS   7  -8.654  -8.130  10.464
   61    HE2  LYS   7           HE2      LYS   7 -10.186  -6.166  10.403
   62    HE3  LYS   7           HE3      LYS   7  -9.428  -5.648   8.898
   63    HZ1  LYS   7           HZ1      LYS   7 -10.881  -8.195   9.363
   64    HZ2  LYS   7           HZ2      LYS   7 -10.052  -7.807   7.932
   65    HZ3  LYS   7           HZ3      LYS   7 -11.402  -6.892   8.411
   66    H    TRP   8           H        TRP   8  -3.969  -5.157   9.288
   67    HA   TRP   8           HA       TRP   8  -2.104  -5.806  11.320
   68    HB2  TRP   8           HB2      TRP   8  -1.955  -8.229  11.003
   69    HB3  TRP   8           HB3      TRP   8  -3.524  -7.767  11.645
   70    HD1  TRP   8           HD1      TRP   8  -5.634  -8.006  10.047
   71    HE1  TRP   8           HE1      TRP   8  -6.021  -9.403   7.917
   72    HE3  TRP   8           HE3      TRP   8  -0.801  -9.123   8.837
   73    HZ2  TRP   8           HZ2      TRP   8  -4.482 -10.811   5.959
   74    HZ3  TRP   8           HZ3      TRP   8  -0.292 -10.494   6.836
   75    HH2  TRP   8           HH2      TRP   8  -2.125 -11.338   5.397
   76    H    PHE   9           H        PHE   9  -0.097  -5.775  10.551
   77    HA   PHE   9           HA       PHE   9   0.234  -5.811   7.594
   78    HB2  PHE   9           HB2      PHE   9   0.628  -3.589   8.734
   79    HB3  PHE   9           HB3      PHE   9   1.986  -4.341   9.574
   80    HD1  PHE   9           HD1      PHE   9   0.699  -3.198   6.317
   81    HD2  PHE   9           HD2      PHE   9   3.997  -5.033   8.371
   82    HE1  PHE   9           HE1      PHE   9   2.136  -2.841   4.327
   83    HE2  PHE   9           HE2      PHE   9   5.433  -4.674   6.383
   84    HZ   PHE   9           HZ       PHE   9   4.504  -3.579   4.362
   85    H    ASN  10           H        ASN  10   1.534  -7.343   6.775
   86    HA   ASN  10           HA       ASN  10   3.581  -8.548   8.536
   87    HB2  ASN  10           HB2      ASN  10   1.591  -9.994   6.788
   88    HB3  ASN  10           HB3      ASN  10   3.075 -10.746   7.362
   89   HD21  ASN  10          HD21      ASN  10   0.498 -11.732   8.141
   90   HD22  ASN  10          HD22      ASN  10   0.303 -11.460   9.804
   91    H    SER  11           H        SER  11   5.318  -7.547   7.615
   92    HA   SER  11           HA       SER  11   5.712  -7.110   4.861
   93    HB2  SER  11           HB2      SER  11   8.030  -6.644   5.479
   94    HB3  SER  11           HB3      SER  11   6.929  -5.901   6.634
   95    HG   SER  11           HG       SER  11   8.419  -8.299   6.902
   96    H    ASP  12           H        ASP  12   6.458  -9.856   6.949
   97    HA   ASP  12           HA       ASP  12   8.261 -11.226   5.274
   98    HB2  ASP  12           HB2      ASP  12   6.215 -12.247   7.261
   99    HB3  ASP  12           HB3      ASP  12   7.368 -13.299   6.442
  100    H    LYS  13           H        LYS  13   4.724 -11.245   5.437
  101    HA   LYS  13           HA       LYS  13   4.388 -13.067   3.232
  102    HB2  LYS  13           HB2      LYS  13   2.474 -11.199   4.656
  103    HB3  LYS  13           HB3      LYS  13   1.991 -12.322   3.382
  104    HG2  LYS  13           HG2      LYS  13   2.802 -14.220   4.700
  105    HG3  LYS  13           HG3      LYS  13   3.391 -13.128   5.954
  106    HD2  LYS  13           HD2      LYS  13   1.292 -13.946   6.747
  107    HD3  LYS  13           HD3      LYS  13   0.975 -12.306   6.174
  108    HE2  LYS  13           HE2      LYS  13   0.114 -13.179   4.059
  109    HE3  LYS  13           HE3      LYS  13   0.505 -14.826   4.549
  110    HZ1  LYS  13           HZ1      LYS  13  -1.793 -14.448   4.973
  111    HZ2  LYS  13           HZ2      LYS  13  -1.471 -13.002   5.805
  112    HZ3  LYS  13           HZ3      LYS  13  -1.001 -14.492   6.473
  113    H    GLY  14           H        GLY  14   4.734  -9.634   3.687
  114    HA2  GLY  14           HA2      GLY  14   5.472  -8.113   2.042
  115    HA3  GLY  14           HA3      GLY  14   4.920  -9.221   0.795
  116    H    PHE  15           H        PHE  15   2.519  -8.849   3.172
  117    HA   PHE  15           HA       PHE  15   1.381  -6.403   2.149
  118    HB2  PHE  15           HB2      PHE  15  -0.655  -7.405   1.191
  119    HB3  PHE  15           HB3      PHE  15   0.794  -7.859   0.296
  120    HD1  PHE  15           HD1      PHE  15  -1.866  -9.034   2.550
  121    HD2  PHE  15           HD2      PHE  15   1.671 -10.141   0.378
  122    HE1  PHE  15           HE1      PHE  15  -2.417 -11.430   2.875
  123    HE2  PHE  15           HE2      PHE  15   1.122 -12.536   0.705
  124    HZ   PHE  15           HZ       PHE  15  -0.923 -13.181   1.951
  125    H    GLY  16           H        GLY  16  -0.982  -6.203   2.916
  126    HA2  GLY  16           HA2      GLY  16  -1.686  -7.593   5.338
  127    HA3  GLY  16           HA3      GLY  16  -1.106  -5.953   5.624
  128    H    PHE  17           H        PHE  17  -3.558  -6.273   6.430
  129    HA   PHE  17           HA       PHE  17  -5.285  -5.145   4.297
  130    HB2  PHE  17           HB2      PHE  17  -5.982  -7.011   6.572
  131    HB3  PHE  17           HB3      PHE  17  -7.197  -6.109   5.665
  132    HD1  PHE  17           HD1      PHE  17  -4.392  -8.527   5.286
  133    HD2  PHE  17           HD2      PHE  17  -7.946  -6.878   3.544
  134    HE1  PHE  17           HE1      PHE  17  -4.327 -10.266   3.519
  135    HE2  PHE  17           HE2      PHE  17  -7.880  -8.607   1.769
  136    HZ   PHE  17           HZ       PHE  17  -6.072 -10.302   1.757
  137    H    ILE  18           H        ILE  18  -6.444  -3.322   4.787
  138    HA   ILE  18           HA       ILE  18  -5.913  -2.147   7.439
  139    HB   ILE  18           HB       ILE  18  -4.745  -0.979   5.625
  140   HG12  ILE  18          HG12      ILE  18  -7.040   0.764   6.540
  141   HG13  ILE  18          HG13      ILE  18  -5.783   0.223   7.655
  142   HG21  ILE  18          HG21      ILE  18  -5.988   0.166   3.863
  143   HG22  ILE  18          HG22      ILE  18  -7.517  -0.400   4.533
  144   HG23  ILE  18          HG23      ILE  18  -6.383  -1.552   3.828
  145   HD11  ILE  18          HD11      ILE  18  -5.051   2.351   6.863
  146   HD12  ILE  18          HD12      ILE  18  -5.471   1.952   5.198
  147   HD13  ILE  18          HD13      ILE  18  -4.098   1.165   5.972
  148    H    THR  19           H        THR  19  -7.479  -1.036   8.512
  149    HA   THR  19           HA       THR  19 -10.227  -1.674   7.704
  150    HB   THR  19           HB       THR  19  -9.146  -0.881  10.411
  151    HG1  THR  19           HG1      THR  19  -8.537  -2.874  10.470
  152   HG21  THR  19          HG21      THR  19 -11.534  -0.378  10.148
  153   HG22  THR  19          HG22      THR  19 -11.328  -1.768  11.213
  154   HG23  THR  19          HG23      THR  19 -11.825  -2.007   9.540
  155    HA   PRO  20           HA       PRO  20 -10.311   2.832   6.637
  156    HB2  PRO  20           HB2      PRO  20 -13.177   2.011   6.296
  157    HB3  PRO  20           HB3      PRO  20 -12.178   3.035   5.249
  158    HG2  PRO  20           HG2      PRO  20 -12.660   0.569   4.540
  159    HG3  PRO  20           HG3      PRO  20 -11.018   1.219   4.374
  160    HD2  PRO  20           HD2      PRO  20 -12.095  -0.658   6.454
  161    HD3  PRO  20           HD3      PRO  20 -10.506  -0.653   5.651
  162    H    GLU  21           H        GLU  21 -10.604   4.463   8.066
  163    HA   GLU  21           HA       GLU  21 -11.710   4.075  10.636
  164    HB2  GLU  21           HB2      GLU  21 -11.377   6.484  10.944
  165    HB3  GLU  21           HB3      GLU  21  -9.974   5.753  10.171
  166    HG2  GLU  21           HG2      GLU  21 -10.732   6.538   7.977
  167    HG3  GLU  21           HG3      GLU  21 -12.200   7.194   8.694
  168    H    ASP  22           H        ASP  22 -13.192   4.910   7.631
  169    HA   ASP  22           HA       ASP  22 -15.546   6.130   8.827
  170    HB2  ASP  22           HB2      ASP  22 -14.939   5.353   5.969
  171    HB3  ASP  22           HB3      ASP  22 -16.355   6.260   6.498
  172    H    GLY  23           H        GLY  23 -14.526   2.968   8.539
  173    HA2  GLY  23           HA2      GLY  23 -15.767   1.081   9.192
  174    HA3  GLY  23           HA3      GLY  23 -17.250   1.967   8.871
  175    H    SER  24           H        SER  24 -15.111   2.339   6.279
  176    HA   SER  24           HA       SER  24 -16.744   0.794   4.513
  177    HB2  SER  24           HB2      SER  24 -15.637   2.806   3.700
  178    HB3  SER  24           HB3      SER  24 -14.061   2.124   4.070
  179    HG   SER  24           HG       SER  24 -15.948   0.947   2.311
  180    H    LYS  25           H        LYS  25 -15.814  -0.866   3.053
  181    HA   LYS  25           HA       LYS  25 -14.878  -3.086   4.507
  182    HB2  LYS  25           HB2      LYS  25 -14.942  -2.559   1.528
  183    HB3  LYS  25           HB3      LYS  25 -14.550  -4.122   2.245
  184    HG2  LYS  25           HG2      LYS  25 -16.741  -4.157   3.379
  185    HG3  LYS  25           HG3      LYS  25 -17.137  -2.595   2.661
  186    HD2  LYS  25           HD2      LYS  25 -16.927  -3.574   0.405
  187    HD3  LYS  25           HD3      LYS  25 -16.532  -5.137   1.121
  188    HE2  LYS  25           HE2      LYS  25 -18.724  -5.182   2.249
  189    HE3  LYS  25           HE3      LYS  25 -19.122  -3.615   1.545
  190    HZ1  LYS  25           HZ1      LYS  25 -19.189  -4.505  -0.589
  191    HZ2  LYS  25           HZ2      LYS  25 -19.957  -5.687   0.359
  192    HZ3  LYS  25           HZ3      LYS  25 -18.352  -5.911  -0.147
  193    H    ASP  26           H        ASP  26 -12.878  -4.127   4.569
  194    HA   ASP  26           HA       ASP  26 -10.608  -2.524   4.760
  195    HB2  ASP  26           HB2      ASP  26  -9.349  -4.606   4.951
  196    HB3  ASP  26           HB3      ASP  26 -10.838  -4.702   5.879
  197    H    LEU  27           H        LEU  27  -8.691  -2.447   3.523
  198    HA   LEU  27           HA       LEU  27  -9.073  -2.984   0.635
  199    HB2  LEU  27           HB2      LEU  27  -7.597  -0.675   1.931
  200    HB3  LEU  27           HB3      LEU  27  -7.708  -0.976   0.200
  201    HG   LEU  27           HG       LEU  27 -10.123  -0.532   1.988
  202   HD11  LEU  27          HD11      LEU  27  -8.690   1.402   0.140
  203   HD12  LEU  27          HD12      LEU  27  -8.694   1.484   1.901
  204   HD13  LEU  27          HD13      LEU  27 -10.191   1.730   1.002
  205   HD21  LEU  27          HD21      LEU  27 -11.220  -0.083  -0.234
  206   HD22  LEU  27          HD22      LEU  27 -10.665  -1.747  -0.055
  207   HD23  LEU  27          HD23      LEU  27  -9.732  -0.606  -1.025
  208    H    PHE  28           H        PHE  28  -7.282  -3.667  -0.543
  209    HA   PHE  28           HA       PHE  28  -5.307  -5.175   0.933
  210    HB2  PHE  28           HB2      PHE  28  -5.735  -4.669  -2.023
  211    HB3  PHE  28           HB3      PHE  28  -4.445  -5.690  -1.386
  212    HD1  PHE  28           HD1      PHE  28  -8.107  -5.307  -1.730
  213    HD2  PHE  28           HD2      PHE  28  -4.909  -7.865  -0.435
  214    HE1  PHE  28           HE1      PHE  28  -9.692  -7.207  -1.565
  215    HE2  PHE  28           HE2      PHE  28  -6.495  -9.764  -0.267
  216    HZ   PHE  28           HZ       PHE  28  -8.886  -9.435  -0.833
  217    H    VAL  29           H        VAL  29  -3.338  -4.504   1.519
  218    HA   VAL  29           HA       VAL  29  -2.143  -2.178   0.151
  219    HB   VAL  29           HB       VAL  29  -2.276  -2.653   3.144
  220   HG11  VAL  29          HG11      VAL  29  -1.151  -0.373   3.219
  221   HG12  VAL  29          HG12      VAL  29  -0.827  -0.569   1.497
  222   HG13  VAL  29          HG13      VAL  29  -0.120  -1.690   2.658
  223   HG21  VAL  29          HG21      VAL  29  -3.665  -0.717   3.231
  224   HG22  VAL  29          HG22      VAL  29  -4.317  -1.713   1.930
  225   HG23  VAL  29          HG23      VAL  29  -3.319  -0.309   1.553
  226    H    HIS  30           H        HIS  30  -0.056  -2.448  -0.417
  227    HA   HIS  30           HA       HIS  30   1.318  -4.901   0.499
  228    HB2  HIS  30           HB2      HIS  30   1.669  -3.277  -2.031
  229    HB3  HIS  30           HB3      HIS  30   2.663  -4.662  -1.586
  230    HD2  HIS  30           HD2      HIS  30  -0.614  -3.982  -3.424
  231    HE1  HIS  30           HE1      HIS  30  -0.718  -8.066  -2.361
  232    HE2  HIS  30           HE2      HIS  30  -1.827  -6.267  -3.769
  233    H    HIS  31           H        HIS  31   3.529  -4.824   1.006
  234    HA   HIS  31           HA       HIS  31   4.381  -2.594   2.522
  235    HB2  HIS  31           HB2      HIS  31   5.168  -4.932   2.876
  236    HB3  HIS  31           HB3      HIS  31   6.081  -4.827   1.372
  237    HD2  HIS  31           HD2      HIS  31   6.337  -3.560   5.071
  238    HE1  HIS  31           HE1      HIS  31   9.758  -2.205   3.009
  239    HE2  HIS  31           HE2      HIS  31   8.668  -2.410   5.291
  240    H    SER  32           H        SER  32   5.368  -3.754  -0.688
  241    HA   SER  32           HA       SER  32   7.282  -1.757  -1.230
  242    HB2  SER  32           HB2      SER  32   5.615  -3.450  -3.092
  243    HB3  SER  32           HB3      SER  32   6.952  -2.430  -3.618
  244    HG   SER  32           HG       SER  32   8.346  -3.661  -2.430
  245    H    GLU  33           H        GLU  33   3.838  -1.589  -1.260
  246    HA   GLU  33           HA       GLU  33   3.590   0.543  -3.169
  247    HB2  GLU  33           HB2      GLU  33   1.833  -1.227  -2.392
  248    HB3  GLU  33           HB3      GLU  33   1.518  -0.087  -1.085
  249    HG2  GLU  33           HG2      GLU  33  -0.021   0.369  -2.914
  250    HG3  GLU  33           HG3      GLU  33   1.125   1.696  -2.795
  251    H    ILE  34           H        ILE  34   5.293   0.885  -0.533
  252    HA   ILE  34           HA       ILE  34   3.917   3.195   0.622
  253    HB   ILE  34           HB       ILE  34   5.677   3.200   2.318
  254   HG12  ILE  34          HG12      ILE  34   6.872   0.796   0.889
  255   HG13  ILE  34          HG13      ILE  34   7.506   2.424   0.712
  256   HG21  ILE  34          HG21      ILE  34   4.328   0.571   1.687
  257   HG22  ILE  34          HG22      ILE  34   3.898   1.768   2.909
  258   HG23  ILE  34          HG23      ILE  34   5.324   0.757   3.130
  259   HD11  ILE  34          HD11      ILE  34   7.953   2.557   3.110
  260   HD12  ILE  34          HD12      ILE  34   8.729   1.120   2.445
  261   HD13  ILE  34          HD13      ILE  34   7.229   0.969   3.359
  262    H    GLN  35           H        GLN  35   5.221   5.166   1.062
  263    HA   GLN  35           HA       GLN  35   6.183   6.297  -1.353
  264    HB2  GLN  35           HB2      GLN  35   5.141   7.563   0.563
  265    HB3  GLN  35           HB3      GLN  35   6.641   7.326   1.458
  266    HG2  GLN  35           HG2      GLN  35   6.679   9.518   0.378
  267    HG3  GLN  35           HG3      GLN  35   7.885   8.476  -0.370
  268   HE21  GLN  35          HE21      GLN  35   7.888   8.816  -2.593
  269   HE22  GLN  35          HE22      GLN  35   6.503   9.056  -3.544
  270    H    SER  36           H        SER  36   8.273   6.845  -1.998
  271    HA   SER  36           HA       SER  36  10.328   5.019  -1.517
  272    HB2  SER  36           HB2      SER  36  10.316   6.445  -3.492
  273    HB3  SER  36           HB3      SER  36  10.503   7.882  -2.492
  274    HG   SER  36           HG       SER  36  12.352   6.006  -3.291
  275    H    GLY  37           H        GLY  37  12.050   4.937  -0.151
  276    HA2  GLY  37           HA2      GLY  37  13.521   5.583   1.546
  277    HA3  GLY  37           HA3      GLY  37  12.687   7.132   1.648
  278    H    GLY  38           H        GLY  38  12.966   6.602   4.029
  279    HA2  GLY  38           HA2      GLY  38  11.916   6.161   6.038
  280    HA3  GLY  38           HA3      GLY  38  10.462   5.783   5.118
  281    H    GLU  39           H        GLU  39  13.642   4.238   4.874
  282    HA   GLU  39           HA       GLU  39  12.645   1.611   4.807
  283    HB2  GLU  39           HB2      GLU  39  15.384   2.699   5.473
  284    HB3  GLU  39           HB3      GLU  39  15.040   0.974   5.329
  285    HG2  GLU  39           HG2      GLU  39  14.341   1.238   3.030
  286    HG3  GLU  39           HG3      GLU  39  14.427   2.991   3.152
  287    H    TYR  40           H        TYR  40  13.838   3.586   7.495
  288    HA   TYR  40           HA       TYR  40  13.876   1.581   9.487
  289    HB2  TYR  40           HB2      TYR  40  13.373   4.555   9.707
  290    HB3  TYR  40           HB3      TYR  40  13.645   3.485  11.081
  291    HD1  TYR  40           HD1      TYR  40  15.184   5.121   8.171
  292    HD2  TYR  40           HD2      TYR  40  15.835   2.434  11.458
  293    HE1  TYR  40           HE1      TYR  40  17.637   5.313   7.845
  294    HE2  TYR  40           HE2      TYR  40  18.285   2.625  11.131
  295    HH   TYR  40           HH       TYR  40  19.745   4.979   9.520
  296    H    ALA  41           H        ALA  41  11.332   3.737   8.317
  297    HA   ALA  41           HA       ALA  41   9.381   3.275  10.251
  298    HB1  ALA  41           HB1      ALA  41   8.595   3.514   7.374
  299    HB2  ALA  41           HB2      ALA  41   9.436   4.860   8.142
  300    HB3  ALA  41           HB3      ALA  41   7.898   4.294   8.795
  301    H    THR  42           H        THR  42   8.003   1.700  10.673
  302    HA   THR  42           HA       THR  42   7.811  -0.598   8.825
  303    HB   THR  42           HB       THR  42   9.389  -1.179  10.617
  304    HG1  THR  42           HG1      THR  42   6.949  -2.483  11.160
  305   HG21  THR  42          HG21      THR  42   8.430   0.397  12.328
  306   HG22  THR  42          HG22      THR  42   8.729  -1.227  12.946
  307   HG23  THR  42          HG23      THR  42   7.088  -0.727  12.538
  308    H    LEU  43           H        LEU  43   5.962  -2.108   9.612
  309    HA   LEU  43           HA       LEU  43   3.695  -0.540  10.656
  310    HB2  LEU  43           HB2      LEU  43   3.859  -2.015   8.046
  311    HB3  LEU  43           HB3      LEU  43   2.326  -1.944   8.902
  312    HG   LEU  43           HG       LEU  43   2.769   0.627   9.001
  313   HD11  LEU  43          HD11      LEU  43   4.039   1.208   6.729
  314   HD12  LEU  43          HD12      LEU  43   4.860  -0.316   7.061
  315   HD13  LEU  43          HD13      LEU  43   4.926   0.999   8.233
  316   HD21  LEU  43          HD21      LEU  43   2.026  -0.917   6.508
  317   HD22  LEU  43          HD22      LEU  43   1.864   0.837   6.608
  318   HD23  LEU  43          HD23      LEU  43   0.946  -0.196   7.701
  319    H    ALA  44           H        ALA  44   2.128  -1.777  11.734
  320    HA   ALA  44           HA       ALA  44   2.568  -4.655  12.063
  321    HB1  ALA  44           HB1      ALA  44   2.849  -4.571  14.420
  322    HB2  ALA  44           HB2      ALA  44   2.362  -2.879  14.499
  323    HB3  ALA  44           HB3      ALA  44   3.921  -3.315  13.800
  324    H    ASP  45           H        ASP  45   0.728  -4.721  14.422
  325    HA   ASP  45           HA       ASP  45  -1.755  -4.571  12.936
  326    HB2  ASP  45           HB2      ASP  45  -1.204  -5.465  15.775
  327    HB3  ASP  45           HB3      ASP  45  -2.706  -5.705  14.887
  328    H    GLY  46           H        GLY  46  -2.827  -2.696  12.841
  329    HA2  GLY  46           HA2      GLY  46  -4.250  -1.074  13.830
  330    HA3  GLY  46           HA3      GLY  46  -3.339  -1.214  15.325
  331    H    GLN  47           H        GLN  47  -1.181  -0.986  12.760
  332    HA   GLN  47           HA       GLN  47  -0.176   1.534  13.526
  333    HB2  GLN  47           HB2      GLN  47   1.112  -0.301  12.438
  334    HB3  GLN  47           HB3      GLN  47   0.271   0.043  10.930
  335    HG2  GLN  47           HG2      GLN  47   2.466   1.137  10.968
  336    HG3  GLN  47           HG3      GLN  47   1.181   2.334  10.945
  337   HE21  GLN  47          HE21      GLN  47   1.787   4.047  12.283
  338   HE22  GLN  47          HE22      GLN  47   2.538   3.878  13.797
  339    H    THR  48           H        THR  48  -0.665   3.552  12.925
  340    HA   THR  48           HA       THR  48  -2.939   4.064  11.224
  341    HB   THR  48           HB       THR  48  -0.991   6.009  12.501
  342    HG1  THR  48           HG1      THR  48  -2.592   6.103  14.116
  343   HG21  THR  48          HG21      THR  48  -2.971   7.561  12.317
  344   HG22  THR  48          HG22      THR  48  -3.769   6.337  11.329
  345   HG23  THR  48          HG23      THR  48  -2.281   7.096  10.761
  346    H    VAL  49           H        VAL  49  -2.942   4.633   9.118
  347    HA   VAL  49           HA       VAL  49  -0.455   5.576   7.875
  348    HB   VAL  49           HB       VAL  49  -0.646   3.955   6.014
  349   HG11  VAL  49          HG11      VAL  49  -0.439   2.650   8.743
  350   HG12  VAL  49          HG12      VAL  49   0.857   3.552   7.958
  351   HG13  VAL  49          HG13      VAL  49   0.268   2.051   7.243
  352   HG21  VAL  49          HG21      VAL  49  -2.800   2.761   7.789
  353   HG22  VAL  49          HG22      VAL  49  -2.051   1.902   6.445
  354   HG23  VAL  49          HG23      VAL  49  -2.994   3.360   6.141
  355    H    GLU  50           H        GLU  50  -0.768   6.185   5.581
  356    HA   GLU  50           HA       GLU  50  -3.433   7.405   5.142
  357    HB2  GLU  50           HB2      GLU  50  -0.639   8.360   4.490
  358    HB3  GLU  50           HB3      GLU  50  -2.037   8.973   3.608
  359    HG2  GLU  50           HG2      GLU  50  -3.025   9.837   5.616
  360    HG3  GLU  50           HG3      GLU  50  -1.830   9.029   6.629
  361    H    TYR  51           H        TYR  51  -4.423   6.963   3.186
  362    HA   TYR  51           HA       TYR  51  -2.882   5.742   1.033
  363    HB2  TYR  51           HB2      TYR  51  -4.255   3.714   0.929
  364    HB3  TYR  51           HB3      TYR  51  -3.400   3.818   2.464
  365    HD1  TYR  51           HD1      TYR  51  -6.670   3.920   0.809
  366    HD2  TYR  51           HD2      TYR  51  -4.609   4.399   4.547
  367    HE1  TYR  51           HE1      TYR  51  -8.831   3.787   2.017
  368    HE2  TYR  51           HE2      TYR  51  -6.769   4.264   5.754
  369    HH   TYR  51           HH       TYR  51  -9.575   4.796   4.570
  370    H    GLU  52           H        GLU  52  -4.129   5.339  -0.899
  371    HA   GLU  52           HA       GLU  52  -6.487   7.114  -1.144
  372    HB2  GLU  52           HB2      GLU  52  -4.456   7.964  -2.327
  373    HB3  GLU  52           HB3      GLU  52  -4.413   6.472  -3.268
  374    HG2  GLU  52           HG2      GLU  52  -6.647   6.963  -4.175
  375    HG3  GLU  52           HG3      GLU  52  -6.725   8.436  -3.212
  376    H    VAL  53           H        VAL  53  -8.305   6.125  -1.779
  377    HA   VAL  53           HA       VAL  53  -8.317   3.283  -2.284
  378    HB   VAL  53           HB       VAL  53 -10.067   4.369  -0.938
  379   HG11  VAL  53          HG11      VAL  53 -10.085   6.472  -2.443
  380   HG12  VAL  53          HG12      VAL  53 -11.623   5.915  -1.792
  381   HG13  VAL  53          HG13      VAL  53 -11.198   5.566  -3.466
  382   HG21  VAL  53          HG21      VAL  53 -11.980   3.231  -1.940
  383   HG22  VAL  53          HG22      VAL  53 -10.530   2.251  -2.175
  384   HG23  VAL  53          HG23      VAL  53 -11.177   3.205  -3.510
  385    H    GLY  54           H        GLY  54  -7.688   2.526  -4.155
  386    HA2  GLY  54           HA2      GLY  54  -8.430   3.917  -6.651
  387    HA3  GLY  54           HA3      GLY  54  -7.100   2.768  -6.481
  388    H    GLN  55           H        GLN  55  -8.416   1.913  -8.454
  389    HA   GLN  55           HA       GLN  55 -10.366  -0.061  -7.419
  390    HB2  GLN  55           HB2      GLN  55 -10.450   1.502 -10.010
  391    HB3  GLN  55           HB3      GLN  55 -11.463   0.091  -9.687
  392    HG2  GLN  55           HG2      GLN  55 -12.492   1.181  -7.790
  393    HG3  GLN  55           HG3      GLN  55 -11.367   2.532  -7.894
  394   HE21  GLN  55          HE21      GLN  55 -14.381   2.529  -8.144
  395   HE22  GLN  55          HE22      GLN  55 -14.700   3.241  -9.651
  396    H    GLY  56           H        GLY  56 -10.378  -2.094  -8.412
  397    HA2  GLY  56           HA2      GLY  56  -8.322  -2.746 -10.383
  398    HA3  GLY  56           HA3      GLY  56  -8.183  -3.521  -8.805
  399    H    GLN  57           H        GLN  57  -8.476  -5.169 -10.908
  400    HA   GLN  57           HA       GLN  57 -11.107  -5.769 -11.727
  401    HB2  GLN  57           HB2      GLN  57  -8.619  -7.474 -11.521
  402    HB3  GLN  57           HB3      GLN  57 -10.127  -8.042 -12.243
  403    HG2  GLN  57           HG2      GLN  57 -10.064  -6.303 -13.914
  404    HG3  GLN  57           HG3      GLN  57  -8.698  -5.522 -13.121
  405   HE21  GLN  57          HE21      GLN  57  -8.878  -6.675 -15.909
  406   HE22  GLN  57          HE22      GLN  57  -7.620  -7.812 -15.999
  407    H    LYS  58           H        LYS  58  -9.149  -6.978  -9.018
  408    HA   LYS  58           HA       LYS  58 -11.188  -8.788  -8.083
  409    HB2  LYS  58           HB2      LYS  58  -8.736  -9.116  -7.685
  410    HB3  LYS  58           HB3      LYS  58  -8.774  -7.735  -6.591
  411    HG2  LYS  58           HG2      LYS  58 -10.431  -8.875  -5.176
  412    HG3  LYS  58           HG3      LYS  58 -10.445 -10.249  -6.283
  413    HD2  LYS  58           HD2      LYS  58  -8.043 -10.629  -5.842
  414    HD3  LYS  58           HD3      LYS  58  -8.035  -9.264  -4.726
  415    HE2  LYS  58           HE2      LYS  58  -9.713 -10.392  -3.316
  416    HE3  LYS  58           HE3      LYS  58  -9.739 -11.756  -4.434
  417    HZ1  LYS  58           HZ1      LYS  58  -8.268 -12.386  -2.758
  418    HZ2  LYS  58           HZ2      LYS  58  -7.535 -10.855  -2.683
  419    HZ3  LYS  58           HZ3      LYS  58  -7.253 -11.872  -4.014
  420    H    GLY  59           H        GLY  59 -10.415  -5.430  -7.593
  421    HA2  GLY  59           HA2      GLY  59 -12.651  -4.366  -6.689
  422    HA3  GLY  59           HA3      GLY  59 -12.131  -5.200  -5.227
  423    HA   PRO  60           HA       PRO  60 -10.236  -0.837  -5.482
  424    HB2  PRO  60           HB2      PRO  60 -11.111  -0.818  -2.643
  425    HB3  PRO  60           HB3      PRO  60 -11.224   0.458  -3.865
  426    HG2  PRO  60           HG2      PRO  60 -13.367  -0.885  -3.111
  427    HG3  PRO  60           HG3      PRO  60 -13.114  -0.429  -4.805
  428    HD2  PRO  60           HD2      PRO  60 -12.727  -3.116  -3.500
  429    HD3  PRO  60           HD3      PRO  60 -13.416  -2.733  -5.094
  430    H    CYS  61           H        CYS  61  -8.402  -0.028  -4.370
  431    HA   CYS  61           HA       CYS  61  -7.018  -1.825  -2.509
  432    HB2  CYS  61           HB2      CYS  61  -4.952  -1.754  -3.827
  433    HB3  CYS  61           HB3      CYS  61  -6.251  -2.479  -4.773
  434    HG   CYS  61           HG       CYS  61  -5.934  -0.682  -6.438
  435    H    ALA  62           H        ALA  62  -4.897  -0.673  -1.765
  436    HA   ALA  62           HA       ALA  62  -5.412   2.241  -1.580
  437    HB1  ALA  62           HB1      ALA  62  -4.040   1.641   0.732
  438    HB2  ALA  62           HB2      ALA  62  -5.078   0.230   0.535
  439    HB3  ALA  62           HB3      ALA  62  -5.787   1.842   0.612
  440    H    ASN  63           H        ASN  63  -3.778   3.501  -2.196
  441    HA   ASN  63           HA       ASN  63  -1.064   2.318  -2.366
  442    HB2  ASN  63           HB2      ASN  63  -0.708   3.771  -4.359
  443    HB3  ASN  63           HB3      ASN  63  -1.953   2.550  -4.611
  444   HD21  ASN  63          HD21      ASN  63  -1.352   5.746  -5.215
  445   HD22  ASN  63          HD22      ASN  63  -2.943   6.341  -5.210
  446    H    LYS  64           H        LYS  64   0.567   4.283  -2.739
  447    HA   LYS  64           HA       LYS  64   1.675   6.001  -1.692
  448    HB2  LYS  64           HB2      LYS  64  -1.150   7.098  -1.558
  449    HB3  LYS  64           HB3      LYS  64   0.300   8.034  -1.197
  450    HG2  LYS  64           HG2      LYS  64   1.152   7.586  -3.476
  451    HG3  LYS  64           HG3      LYS  64  -0.312   6.671  -3.838
  452    HD2  LYS  64           HD2      LYS  64  -1.682   8.677  -3.448
  453    HD3  LYS  64           HD3      LYS  64  -0.234   9.598  -3.045
  454    HE2  LYS  64           HE2      LYS  64  -0.855  10.036  -5.369
  455    HE3  LYS  64           HE3      LYS  64   0.659   9.136  -5.326
  456    HZ1  LYS  64           HZ1      LYS  64  -0.446   7.148  -5.878
  457    HZ2  LYS  64           HZ2      LYS  64  -1.056   8.322  -6.946
  458    HZ3  LYS  64           HZ3      LYS  64  -1.980   7.820  -5.611
  459    H    VAL  65           H        VAL  65   1.457   3.898  -0.105
  460    HA   VAL  65           HA       VAL  65   0.127   4.385   2.385
  461    HB   VAL  65           HB       VAL  65   2.324   2.412   1.700
  462   HG11  VAL  65          HG11      VAL  65   1.447   1.161   3.676
  463   HG12  VAL  65          HG12      VAL  65   0.401   2.533   4.042
  464   HG13  VAL  65          HG13      VAL  65   2.152   2.718   4.115
  465   HG21  VAL  65          HG21      VAL  65   0.643   0.843   1.188
  466   HG22  VAL  65          HG22      VAL  65   0.076   2.320   0.412
  467   HG23  VAL  65          HG23      VAL  65  -0.625   1.806   1.947
  468    H    VAL  66           H        VAL  66   0.725   5.800   3.822
  469    HA   VAL  66           HA       VAL  66   3.607   6.273   4.325
  470    HB   VAL  66           HB       VAL  66   1.431   8.393   4.293
  471   HG11  VAL  66          HG11      VAL  66   4.411   8.595   4.835
  472   HG12  VAL  66          HG12      VAL  66   3.123   8.848   6.013
  473   HG13  VAL  66          HG13      VAL  66   3.318   9.967   4.664
  474   HG21  VAL  66          HG21      VAL  66   2.623   9.297   2.362
  475   HG22  VAL  66          HG22      VAL  66   2.188   7.619   2.037
  476   HG23  VAL  66          HG23      VAL  66   3.843   8.029   2.486
  477    H    ALA  67           H        ALA  67   4.158   5.868   6.363
  478    HA   ALA  67           HA       ALA  67   2.221   5.135   8.337
  479    HB1  ALA  67           HB1      ALA  67   4.517   4.152   8.167
  480    HB2  ALA  67           HB2      ALA  67   4.116   4.741   9.780
  481    HB3  ALA  67           HB3      ALA  67   5.167   5.692   8.730
  482    H    VAL  68           H        VAL  68   1.444   6.247  10.052
  483    HA   VAL  68           HA       VAL  68   2.452   8.982  10.542
  484    HB   VAL  68           HB       VAL  68  -0.490   8.232  10.414
  485   HG11  VAL  68          HG11      VAL  68  -0.868  10.637  10.674
  486   HG12  VAL  68          HG12      VAL  68   0.872  10.930  10.710
  487   HG13  VAL  68          HG13      VAL  68   0.099  10.043  12.025
  488   HG21  VAL  68          HG21      VAL  68   0.638   8.307   8.169
  489   HG22  VAL  68          HG22      VAL  68   1.127   9.964   8.515
  490   HG23  VAL  68          HG23      VAL  68  -0.583   9.563   8.374
  Start of MODEL    9
    1    H1   MET   1           HT1      MET   1  -7.676  12.923  -0.986
    2    H2   MET   1           HT2      MET   1  -8.793  12.828   0.289
    3    H3   MET   1           HT3      MET   1  -8.928  11.779  -1.041
    4    HA   MET   1           HA       MET   1  -7.133  10.501  -0.420
    5    HB2  MET   1           HB2      MET   1  -5.476  11.260   1.266
    6    HB3  MET   1           HB3      MET   1  -5.556  12.353  -0.113
    7    HG2  MET   1           HG2      MET   1  -7.043  13.860   1.180
    8    HG3  MET   1           HG3      MET   1  -6.927  12.773   2.564
    9    HE1  MET   1           HE1      MET   1  -6.088  14.708   4.117
   10    HE2  MET   1           HE2      MET   1  -6.352  15.762   2.731
   11    HE3  MET   1           HE3      MET   1  -4.844  15.868   3.636
   12    H    SER   2           H        SER   2  -6.597   9.458   1.842
   13    HA   SER   2           HA       SER   2  -8.658   9.780   3.854
   14    HB2  SER   2           HB2      SER   2  -9.617   7.584   3.652
   15    HB3  SER   2           HB3      SER   2  -9.723   8.356   2.076
   16    HG   SER   2           HG       SER   2  -8.020   7.152   1.371
   17    H    LYS   3           H        LYS   3  -8.378   8.054   5.588
   18    HA   LYS   3           HA       LYS   3  -5.852   6.688   5.757
   19    HB2  LYS   3           HB2      LYS   3  -4.963   7.963   7.676
   20    HB3  LYS   3           HB3      LYS   3  -5.059   8.954   6.223
   21    HG2  LYS   3           HG2      LYS   3  -7.194   9.921   7.023
   22    HG3  LYS   3           HG3      LYS   3  -7.079   8.941   8.484
   23    HD2  LYS   3           HD2      LYS   3  -4.889  10.862   7.672
   24    HD3  LYS   3           HD3      LYS   3  -6.254  11.366   8.668
   25    HE2  LYS   3           HE2      LYS   3  -4.373   9.083   9.344
   26    HE3  LYS   3           HE3      LYS   3  -4.280  10.702  10.035
   27    HZ1  LYS   3           HZ1      LYS   3  -6.721  10.298  10.648
   28    HZ2  LYS   3           HZ2      LYS   3  -5.521   9.531  11.574
   29    HZ3  LYS   3           HZ3      LYS   3  -6.373   8.657  10.393
   30    H    GLY   4           H        GLY   4  -5.857   5.138   7.333
   31    HA2  GLY   4           HA2      GLY   4  -7.998   5.137   9.341
   32    HA3  GLY   4           HA3      GLY   4  -7.934   3.797   8.200
   33    H    ILE   5           H        ILE   5  -7.642   2.420  10.055
   34    HA   ILE   5           HA       ILE   5  -4.848   2.443  11.049
   35    HB   ILE   5           HB       ILE   5  -5.756   1.182  13.048
   36   HG12  ILE   5          HG12      ILE   5  -8.443   2.315  12.220
   37   HG13  ILE   5          HG13      ILE   5  -7.981   0.664  11.821
   38   HG21  ILE   5          HG21      ILE   5  -5.149   3.490  13.307
   39   HG22  ILE   5          HG22      ILE   5  -6.720   3.293  14.083
   40   HG23  ILE   5          HG23      ILE   5  -6.613   4.032  12.485
   41   HD11  ILE   5          HD11      ILE   5  -7.841   1.737  14.646
   42   HD12  ILE   5          HD12      ILE   5  -7.803   0.052  14.123
   43   HD13  ILE   5          HD13      ILE   5  -9.297   0.981  13.999
   44    H    VAL   6           H        VAL   6  -3.657   0.743  10.618
   45    HA   VAL   6           HA       VAL   6  -4.585  -1.273   8.868
   46    HB   VAL   6           HB       VAL   6  -2.017  -1.133  10.471
   47   HG11  VAL   6          HG11      VAL   6  -1.205  -2.630   8.535
   48   HG12  VAL   6          HG12      VAL   6  -2.910  -2.922   8.199
   49   HG13  VAL   6          HG13      VAL   6  -2.225  -3.395   9.752
   50   HG21  VAL   6          HG21      VAL   6  -2.576   0.749   8.813
   51   HG22  VAL   6          HG22      VAL   6  -2.451  -0.472   7.547
   52   HG23  VAL   6          HG23      VAL   6  -1.050  -0.095   8.548
   53    H    LYS   7           H        LYS   7  -5.634  -3.065   9.277
   54    HA   LYS   7           HA       LYS   7  -6.327  -3.941  11.893
   55    HB2  LYS   7           HB2      LYS   7  -7.703  -4.381   9.844
   56    HB3  LYS   7           HB3      LYS   7  -6.459  -5.500   9.291
   57    HG2  LYS   7           HG2      LYS   7  -6.800  -6.920  11.246
   58    HG3  LYS   7           HG3      LYS   7  -7.943  -5.764  11.926
   59    HD2  LYS   7           HD2      LYS   7  -9.268  -7.481  10.914
   60    HD3  LYS   7           HD3      LYS   7  -9.344  -6.102   9.819
   61    HE2  LYS   7           HE2      LYS   7  -7.607  -7.099   8.400
   62    HE3  LYS   7           HE3      LYS   7  -7.452  -8.456   9.516
   63    HZ1  LYS   7           HZ1      LYS   7 -10.034  -7.762   8.257
   64    HZ2  LYS   7           HZ2      LYS   7  -9.579  -9.221   8.997
   65    HZ3  LYS   7           HZ3      LYS   7  -8.918  -8.784   7.493
   66    H    TRP   8           H        TRP   8  -4.049  -5.098   9.431
   67    HA   TRP   8           HA       TRP   8  -2.211  -6.084  11.410
   68    HB2  TRP   8           HB2      TRP   8  -4.072  -7.885  11.121
   69    HB3  TRP   8           HB3      TRP   8  -3.331  -8.179   9.551
   70    HD1  TRP   8           HD1      TRP   8  -0.641  -8.806   9.619
   71    HE1  TRP   8           HE1      TRP   8   0.649 -10.207  11.359
   72    HE3  TRP   8           HE3      TRP   8  -3.926  -8.610  13.522
   73    HZ2  TRP   8           HZ2      TRP   8   0.326 -11.127  14.047
   74    HZ3  TRP   8           HZ3      TRP   8  -3.413  -9.759  15.656
   75    HH2  TRP   8           HH2      TRP   8  -1.295 -11.017  15.924
   76    H    PHE   9           H        PHE   9  -0.208  -5.837  10.579
   77    HA   PHE   9           HA       PHE   9   0.050  -5.689   7.621
   78    HB2  PHE   9           HB2      PHE   9   0.593  -3.599   8.946
   79    HB3  PHE   9           HB3      PHE   9   1.946  -4.488   9.649
   80    HD1  PHE   9           HD1      PHE   9   0.575  -2.994   6.576
   81    HD2  PHE   9           HD2      PHE   9   3.866  -5.160   8.289
   82    HE1  PHE   9           HE1      PHE   9   1.933  -2.523   4.556
   83    HE2  PHE   9           HE2      PHE   9   5.225  -4.685   6.269
   84    HZ   PHE   9           HZ       PHE   9   4.260  -3.368   4.404
   85    H    ASN  10           H        ASN  10   1.090  -7.342   6.686
   86    HA   ASN  10           HA       ASN  10   3.090  -8.837   8.286
   87    HB2  ASN  10           HB2      ASN  10   1.204  -9.899   6.170
   88    HB3  ASN  10           HB3      ASN  10   2.468 -10.835   6.965
   89   HD21  ASN  10          HD21      ASN  10  -0.755 -10.570   7.077
   90   HD22  ASN  10          HD22      ASN  10  -1.034 -10.754   8.741
   91    H    SER  11           H        SER  11   4.869  -7.657   7.543
   92    HA   SER  11           HA       SER  11   5.410  -7.024   4.860
   93    HB2  SER  11           HB2      SER  11   7.703  -6.649   5.626
   94    HB3  SER  11           HB3      SER  11   6.558  -5.990   6.789
   95    HG   SER  11           HG       SER  11   7.269  -7.362   8.205
   96    H    ASP  12           H        ASP  12   6.058  -9.932   6.765
   97    HA   ASP  12           HA       ASP  12   7.904 -11.186   5.045
   98    HB2  ASP  12           HB2      ASP  12   5.812 -12.335   6.908
   99    HB3  ASP  12           HB3      ASP  12   7.001 -13.324   6.056
  100    H    LYS  13           H        LYS  13   4.362 -11.215   5.125
  101    HA   LYS  13           HA       LYS  13   4.068 -12.912   2.821
  102    HB2  LYS  13           HB2      LYS  13   2.140 -11.095   4.288
  103    HB3  LYS  13           HB3      LYS  13   1.679 -12.138   2.945
  104    HG2  LYS  13           HG2      LYS  13   2.473 -14.112   4.193
  105    HG3  LYS  13           HG3      LYS  13   2.933 -13.070   5.544
  106    HD2  LYS  13           HD2      LYS  13   0.585 -12.351   5.793
  107    HD3  LYS  13           HD3      LYS  13   0.122 -13.390   4.441
  108    HE2  LYS  13           HE2      LYS  13   0.909 -15.367   5.688
  109    HE3  LYS  13           HE3      LYS  13   1.380 -14.334   7.037
  110    HZ1  LYS  13           HZ1      LYS  13  -1.002 -13.570   7.062
  111    HZ2  LYS  13           HZ2      LYS  13  -0.737 -15.174   7.557
  112    HZ3  LYS  13           HZ3      LYS  13  -1.348 -14.851   6.004
  113    H    GLY  14           H        GLY  14   4.427  -9.504   3.423
  114    HA2  GLY  14           HA2      GLY  14   5.170  -7.912   1.846
  115    HA3  GLY  14           HA3      GLY  14   4.625  -8.969   0.552
  116    H    PHE  15           H        PHE  15   2.224  -8.717   2.939
  117    HA   PHE  15           HA       PHE  15   1.045  -6.254   1.978
  118    HB2  PHE  15           HB2      PHE  15  -1.017  -7.282   1.108
  119    HB3  PHE  15           HB3      PHE  15   0.396  -7.730   0.157
  120    HD1  PHE  15           HD1      PHE  15  -2.097  -8.909   2.619
  121    HD2  PHE  15           HD2      PHE  15   1.223 -10.009   0.125
  122    HE1  PHE  15           HE1      PHE  15  -2.625 -11.307   2.974
  123    HE2  PHE  15           HE2      PHE  15   0.699 -12.407   0.483
  124    HZ   PHE  15           HZ       PHE  15  -1.225 -13.055   1.908
  125    H    GLY  16           H        GLY  16  -1.248  -6.016   2.880
  126    HA2  GLY  16           HA2      GLY  16  -1.820  -7.439   5.330
  127    HA3  GLY  16           HA3      GLY  16  -1.257  -5.790   5.581
  128    H    PHE  17           H        PHE  17  -3.671  -6.252   6.513
  129    HA   PHE  17           HA       PHE  17  -5.564  -5.158   4.508
  130    HB2  PHE  17           HB2      PHE  17  -6.106  -6.888   6.941
  131    HB3  PHE  17           HB3      PHE  17  -7.353  -6.158   5.930
  132    HD1  PHE  17           HD1      PHE  17  -4.671  -8.690   6.075
  133    HD2  PHE  17           HD2      PHE  17  -7.816  -6.989   3.697
  134    HE1  PHE  17           HE1      PHE  17  -4.530 -10.612   4.515
  135    HE2  PHE  17           HE2      PHE  17  -7.676  -8.910   2.137
  136    HZ   PHE  17           HZ       PHE  17  -6.032 -10.721   2.544
  137    H    ILE  18           H        ILE  18  -6.615  -3.262   5.031
  138    HA   ILE  18           HA       ILE  18  -5.961  -2.121   7.673
  139    HB   ILE  18           HB       ILE  18  -4.885  -0.939   5.800
  140   HG12  ILE  18          HG12      ILE  18  -7.078   0.817   6.916
  141   HG13  ILE  18          HG13      ILE  18  -5.768   0.214   7.933
  142   HG21  ILE  18          HG21      ILE  18  -7.638  -0.064   4.913
  143   HG22  ILE  18          HG22      ILE  18  -6.856  -1.478   4.211
  144   HG23  ILE  18          HG23      ILE  18  -6.103   0.109   4.063
  145   HD11  ILE  18          HD11      ILE  18  -5.534   1.974   5.481
  146   HD12  ILE  18          HD12      ILE  18  -4.152   1.181   6.232
  147   HD13  ILE  18          HD13      ILE  18  -5.082   2.375   7.137
  148    H    THR  19           H        THR  19  -7.468  -1.039   8.847
  149    HA   THR  19           HA       THR  19 -10.251  -1.681   8.197
  150    HB   THR  19           HB       THR  19  -9.035  -0.781  10.812
  151    HG1  THR  19           HG1      THR  19  -9.390  -3.023  11.328
  152   HG21  THR  19          HG21      THR  19 -11.742  -1.997  10.191
  153   HG22  THR  19          HG22      THR  19 -11.462  -0.297  10.564
  154   HG23  THR  19          HG23      THR  19 -11.155  -1.530  11.788
  155    HA   PRO  20           HA       PRO  20 -10.377   2.770   6.977
  156    HB2  PRO  20           HB2      PRO  20 -13.256   1.974   6.735
  157    HB3  PRO  20           HB3      PRO  20 -12.261   2.930   5.619
  158    HG2  PRO  20           HG2      PRO  20 -12.800   0.439   5.035
  159    HG3  PRO  20           HG3      PRO  20 -11.154   1.054   4.805
  160    HD2  PRO  20           HD2      PRO  20 -12.224  -0.685   7.006
  161    HD3  PRO  20           HD3      PRO  20 -10.666  -0.779   6.151
  162    H    GLU  21           H        GLU  21 -10.593   4.432   8.380
  163    HA   GLU  21           HA       GLU  21 -11.610   4.118  10.995
  164    HB2  GLU  21           HB2      GLU  21 -11.271   6.541  11.218
  165    HB3  GLU  21           HB3      GLU  21  -9.889   5.780  10.430
  166    HG2  GLU  21           HG2      GLU  21 -10.793   6.459   8.219
  167    HG3  GLU  21           HG3      GLU  21 -12.146   7.245   9.021
  168    H    ASP  22           H        ASP  22 -13.123   5.077   8.011
  169    HA   ASP  22           HA       ASP  22 -15.457   6.280   9.186
  170    HB2  ASP  22           HB2      ASP  22 -14.826   5.306   6.398
  171    HB3  ASP  22           HB3      ASP  22 -16.363   6.045   6.835
  172    H    GLY  23           H        GLY  23 -14.431   3.053   8.873
  173    HA2  GLY  23           HA2      GLY  23 -15.591   1.206   9.771
  174    HA3  GLY  23           HA3      GLY  23 -17.102   2.083   9.577
  175    H    SER  24           H        SER  24 -15.221   2.328   6.758
  176    HA   SER  24           HA       SER  24 -17.044   0.647   5.295
  177    HB2  SER  24           HB2      SER  24 -15.902   1.399   3.315
  178    HB3  SER  24           HB3      SER  24 -16.122   2.782   4.378
  179    HG   SER  24           HG       SER  24 -13.960   2.374   3.383
  180    H    LYS  25           H        LYS  25 -16.082  -0.885   3.628
  181    HA   LYS  25           HA       LYS  25 -14.985  -3.092   4.954
  182    HB2  LYS  25           HB2      LYS  25 -14.803  -4.119   2.721
  183    HB3  LYS  25           HB3      LYS  25 -16.361  -3.330   2.955
  184    HG2  LYS  25           HG2      LYS  25 -15.523  -1.340   1.727
  185    HG3  LYS  25           HG3      LYS  25 -13.986  -2.167   1.461
  186    HD2  LYS  25           HD2      LYS  25 -15.105  -3.927   0.193
  187    HD3  LYS  25           HD3      LYS  25 -16.680  -3.209   0.534
  188    HE2  LYS  25           HE2      LYS  25 -15.960  -2.560  -1.710
  189    HE3  LYS  25           HE3      LYS  25 -15.963  -1.143  -0.661
  190    HZ1  LYS  25           HZ1      LYS  25 -13.573  -1.487  -0.310
  191    HZ2  LYS  25           HZ2      LYS  25 -13.950  -1.200  -1.941
  192    HZ3  LYS  25           HZ3      LYS  25 -13.599  -2.776  -1.410
  193    H    ASP  26           H        ASP  26 -12.994  -4.124   4.870
  194    HA   ASP  26           HA       ASP  26 -10.709  -2.520   5.049
  195    HB2  ASP  26           HB2      ASP  26 -11.066  -5.496   4.701
  196    HB3  ASP  26           HB3      ASP  26  -9.497  -4.744   4.962
  197    H    LEU  27           H        LEU  27  -8.963  -2.199   3.738
  198    HA   LEU  27           HA       LEU  27  -9.311  -2.884   0.877
  199    HB2  LEU  27           HB2      LEU  27  -7.994  -0.446   2.106
  200    HB3  LEU  27           HB3      LEU  27  -8.036  -0.815   0.385
  201    HG   LEU  27           HG       LEU  27 -10.534  -0.507   2.080
  202   HD11  LEU  27          HD11      LEU  27 -10.704   1.720   0.871
  203   HD12  LEU  27          HD12      LEU  27  -9.027   1.496   0.378
  204   HD13  LEU  27          HD13      LEU  27  -9.431   1.633   2.089
  205   HD21  LEU  27          HD21      LEU  27  -9.995  -0.648  -0.905
  206   HD22  LEU  27          HD22      LEU  27 -11.537  -0.127  -0.229
  207   HD23  LEU  27          HD23      LEU  27 -10.956  -1.768   0.059
  208    H    PHE  28           H        PHE  28  -7.456  -3.436  -0.314
  209    HA   PHE  28           HA       PHE  28  -5.425  -4.828   1.206
  210    HB2  PHE  28           HB2      PHE  28  -5.912  -4.469  -1.756
  211    HB3  PHE  28           HB3      PHE  28  -4.558  -5.393  -1.104
  212    HD1  PHE  28           HD1      PHE  28  -8.242  -5.218  -1.388
  213    HD2  PHE  28           HD2      PHE  28  -4.886  -7.546  -0.058
  214    HE1  PHE  28           HE1      PHE  28  -9.720  -7.190  -1.115
  215    HE2  PHE  28           HE2      PHE  28  -6.365  -9.517   0.219
  216    HZ   PHE  28           HZ       PHE  28  -8.780  -9.340  -0.309
  217    H    VAL  29           H        VAL  29  -3.413  -4.151   1.657
  218    HA   VAL  29           HA       VAL  29  -2.307  -1.842   0.192
  219    HB   VAL  29           HB       VAL  29  -2.315  -2.180   3.208
  220   HG11  VAL  29          HG11      VAL  29  -1.032  -0.091   1.422
  221   HG12  VAL  29          HG12      VAL  29  -0.200  -1.203   2.510
  222   HG13  VAL  29          HG13      VAL  29  -1.214   0.083   3.167
  223   HG21  VAL  29          HG21      VAL  29  -4.439  -1.346   2.079
  224   HG22  VAL  29          HG22      VAL  29  -3.502   0.047   1.540
  225   HG23  VAL  29          HG23      VAL  29  -3.731  -0.246   3.263
  226    H    HIS  30           H        HIS  30  -0.207  -2.109  -0.391
  227    HA   HIS  30           HA       HIS  30   1.152  -4.562   0.542
  228    HB2  HIS  30           HB2      HIS  30   1.540  -2.947  -1.988
  229    HB3  HIS  30           HB3      HIS  30   2.497  -4.358  -1.540
  230    HD2  HIS  30           HD2      HIS  30  -0.764  -3.594  -3.375
  231    HE1  HIS  30           HE1      HIS  30  -0.962  -7.677  -2.322
  232    HE2  HIS  30           HE2      HIS  30  -2.033  -5.850  -3.724
  233    H    HIS  31           H        HIS  31   3.314  -4.537   1.111
  234    HA   HIS  31           HA       HIS  31   4.238  -2.311   2.590
  235    HB2  HIS  31           HB2      HIS  31   4.915  -4.668   3.023
  236    HB3  HIS  31           HB3      HIS  31   5.849  -4.652   1.525
  237    HD2  HIS  31           HD2      HIS  31   6.115  -3.257   5.183
  238    HE1  HIS  31           HE1      HIS  31   9.642  -2.186   3.128
  239    HE2  HIS  31           HE2      HIS  31   8.506  -2.234   5.398
  240    H    SER  32           H        SER  32   5.216  -3.597  -0.570
  241    HA   SER  32           HA       SER  32   7.171  -1.585  -1.096
  242    HB2  SER  32           HB2      SER  32   5.748  -3.514  -2.935
  243    HB3  SER  32           HB3      SER  32   7.093  -2.486  -3.422
  244    HG   SER  32           HG       SER  32   8.070  -4.308  -2.777
  245    H    GLU  33           H        GLU  33   3.849  -1.266  -0.986
  246    HA   GLU  33           HA       GLU  33   3.334   0.302  -3.306
  247    HB2  GLU  33           HB2      GLU  33   1.622  -0.869  -1.859
  248    HB3  GLU  33           HB3      GLU  33   1.853   0.418  -0.678
  249    HG2  GLU  33           HG2      GLU  33  -0.058   0.949  -2.082
  250    HG3  GLU  33           HG3      GLU  33   1.241   2.090  -2.407
  251    H    ILE  34           H        ILE  34   4.661   1.054  -0.145
  252    HA   ILE  34           HA       ILE  34   4.238   3.892  -0.311
  253    HB   ILE  34           HB       ILE  34   4.493   2.705   1.851
  254   HG12  ILE  34          HG12      ILE  34   6.782   4.657   1.501
  255   HG13  ILE  34          HG13      ILE  34   5.097   5.176   1.476
  256   HG21  ILE  34          HG21      ILE  34   7.458   2.509   1.328
  257   HG22  ILE  34          HG22      ILE  34   6.385   1.196   0.854
  258   HG23  ILE  34          HG23      ILE  34   6.490   1.679   2.545
  259   HD11  ILE  34          HD11      ILE  34   5.881   5.437   3.740
  260   HD12  ILE  34          HD12      ILE  34   6.564   3.810   3.749
  261   HD13  ILE  34          HD13      ILE  34   4.814   4.032   3.722
  262    H    GLN  35           H        GLN  35   5.657   5.498  -0.903
  263    HA   GLN  35           HA       GLN  35   7.942   4.636  -2.559
  264    HB2  GLN  35           HB2      GLN  35   6.141   6.043  -3.604
  265    HB3  GLN  35           HB3      GLN  35   6.572   7.338  -2.488
  266    HG2  GLN  35           HG2      GLN  35   8.854   7.385  -3.381
  267    HG3  GLN  35           HG3      GLN  35   8.482   6.040  -4.455
  268   HE21  GLN  35          HE21      GLN  35   9.192   9.008  -4.989
  269   HE22  GLN  35          HE22      GLN  35   7.972   9.524  -6.049
  270    H    SER  36           H        SER  36   9.924   4.896  -1.781
  271    HA   SER  36           HA       SER  36  11.675   5.538  -0.444
  272    HB2  SER  36           HB2      SER  36  10.224   8.194  -0.583
  273    HB3  SER  36           HB3      SER  36  11.893   7.971  -0.069
  274    HG   SER  36           HG       SER  36  11.405   8.510  -2.387
  275    H    GLY  37           H        GLY  37   9.544   4.274   0.893
  276    HA2  GLY  37           HA2      GLY  37   8.628   5.567   3.220
  277    HA3  GLY  37           HA3      GLY  37   8.776   3.824   3.016
  278    H    GLY  38           H        GLY  38  11.555   3.674   2.583
  279    HA2  GLY  38           HA2      GLY  38  13.646   4.025   3.617
  280    HA3  GLY  38           HA3      GLY  38  12.835   4.867   4.933
  281    H    GLU  39           H        GLU  39  14.808   2.828   5.201
  282    HA   GLU  39           HA       GLU  39  13.736   0.275   5.780
  283    HB2  GLU  39           HB2      GLU  39  16.155   0.759   5.438
  284    HB3  GLU  39           HB3      GLU  39  16.178   1.607   6.983
  285    HG2  GLU  39           HG2      GLU  39  15.505  -0.458   8.142
  286    HG3  GLU  39           HG3      GLU  39  15.441  -1.312   6.600
  287    H    TYR  40           H        TYR  40  14.210   3.174   7.753
  288    HA   TYR  40           HA       TYR  40  13.627   2.090  10.276
  289    HB2  TYR  40           HB2      TYR  40  13.175   4.884   9.210
  290    HB3  TYR  40           HB3      TYR  40  13.059   4.433  10.911
  291    HD1  TYR  40           HD1      TYR  40  15.328   4.964   8.070
  292    HD2  TYR  40           HD2      TYR  40  15.052   3.752  12.180
  293    HE1  TYR  40           HE1      TYR  40  17.785   5.198   8.303
  294    HE2  TYR  40           HE2      TYR  40  17.511   3.985  12.415
  295    HH   TYR  40           HH       TYR  40  19.346   5.431  11.143
  296    H    ALA  41           H        ALA  41  11.498   3.425   7.774
  297    HA   ALA  41           HA       ALA  41   9.116   3.475   9.275
  298    HB1  ALA  41           HB1      ALA  41   9.360   4.588   7.090
  299    HB2  ALA  41           HB2      ALA  41   7.971   3.502   7.103
  300    HB3  ALA  41           HB3      ALA  41   9.465   3.013   6.302
  301    H    THR  42           H        THR  42   7.934   1.903  10.089
  302    HA   THR  42           HA       THR  42   7.937  -0.755   8.804
  303    HB   THR  42           HB       THR  42   7.972  -1.820  11.029
  304    HG1  THR  42           HG1      THR  42   7.426  -0.505  12.563
  305   HG21  THR  42          HG21      THR  42  10.377  -1.117  11.628
  306   HG22  THR  42          HG22      THR  42  10.259  -0.004  10.265
  307   HG23  THR  42          HG23      THR  42  10.102  -1.741  10.002
  308    H    LEU  43           H        LEU  43   6.080  -2.096   9.445
  309    HA   LEU  43           HA       LEU  43   3.769  -0.598  10.471
  310    HB2  LEU  43           HB2      LEU  43   3.895  -2.040   7.823
  311    HB3  LEU  43           HB3      LEU  43   2.378  -1.739   8.655
  312    HG   LEU  43           HG       LEU  43   3.365   0.768   8.751
  313   HD11  LEU  43          HD11      LEU  43   4.433  -0.120   6.072
  314   HD12  LEU  43          HD12      LEU  43   5.463  -0.158   7.497
  315   HD13  LEU  43          HD13      LEU  43   4.764   1.367   6.961
  316   HD21  LEU  43          HD21      LEU  43   2.175   1.172   6.531
  317   HD22  LEU  43          HD22      LEU  43   1.233   0.316   7.750
  318   HD23  LEU  43          HD23      LEU  43   1.973  -0.576   6.421
  319    H    ALA  44           H        ALA  44   2.276  -1.868  11.555
  320    HA   ALA  44           HA       ALA  44   2.645  -4.771  11.648
  321    HB1  ALA  44           HB1      ALA  44   3.244  -4.903  13.886
  322    HB2  ALA  44           HB2      ALA  44   2.542  -3.334  14.277
  323    HB3  ALA  44           HB3      ALA  44   4.080  -3.422  13.419
  324    H    ASP  45           H        ASP  45   0.970  -4.936  14.126
  325    HA   ASP  45           HA       ASP  45  -1.622  -4.658  12.844
  326    HB2  ASP  45           HB2      ASP  45  -1.046  -6.699  14.109
  327    HB3  ASP  45           HB3      ASP  45  -0.838  -5.738  15.565
  328    H    GLY  46           H        GLY  46  -2.584  -2.704  12.913
  329    HA2  GLY  46           HA2      GLY  46  -3.905  -1.155  14.188
  330    HA3  GLY  46           HA3      GLY  46  -2.771  -1.330  15.518
  331    H    GLN  47           H        GLN  47  -0.889  -1.078  12.806
  332    HA   GLN  47           HA       GLN  47   0.107   1.483  13.418
  333    HB2  GLN  47           HB2      GLN  47   1.340  -0.339  12.236
  334    HB3  GLN  47           HB3      GLN  47   0.348  -0.039  10.810
  335    HG2  GLN  47           HG2      GLN  47   2.497   1.121  10.611
  336    HG3  GLN  47           HG3      GLN  47   1.188   2.285  10.731
  337   HE21  GLN  47          HE21      GLN  47   1.811   4.001  12.056
  338   HE22  GLN  47          HE22      GLN  47   2.756   3.855  13.459
  339    H    THR  48           H        THR  48  -0.557   3.467  12.873
  340    HA   THR  48           HA       THR  48  -2.936   3.806  11.240
  341    HB   THR  48           HB       THR  48  -1.213   5.879  12.633
  342    HG1  THR  48           HG1      THR  48  -2.051   4.647  14.205
  343   HG21  THR  48          HG21      THR  48  -2.659   6.808  10.856
  344   HG22  THR  48          HG22      THR  48  -3.227   7.294  12.455
  345   HG23  THR  48          HG23      THR  48  -4.056   6.007  11.577
  346    H    VAL  49           H        VAL  49  -2.974   4.375   9.152
  347    HA   VAL  49           HA       VAL  49  -0.612   5.663   7.968
  348    HB   VAL  49           HB       VAL  49  -0.663   4.129   6.028
  349   HG11  VAL  49          HG11      VAL  49  -0.353   2.567   8.599
  350   HG12  VAL  49          HG12      VAL  49   0.806   3.792   8.085
  351   HG13  VAL  49          HG13      VAL  49   0.536   2.362   7.091
  352   HG21  VAL  49          HG21      VAL  49  -1.875   1.941   6.333
  353   HG22  VAL  49          HG22      VAL  49  -2.955   3.321   6.139
  354   HG23  VAL  49          HG23      VAL  49  -2.681   2.637   7.739
  355    H    GLU  50           H        GLU  50  -1.017   6.365   5.705
  356    HA   GLU  50           HA       GLU  50  -3.801   7.339   5.380
  357    HB2  GLU  50           HB2      GLU  50  -1.224   8.602   4.377
  358    HB3  GLU  50           HB3      GLU  50  -2.848   9.248   4.158
  359    HG2  GLU  50           HG2      GLU  50  -3.088   9.440   6.621
  360    HG3  GLU  50           HG3      GLU  50  -1.446   8.835   6.816
  361    H    TYR  51           H        TYR  51  -4.758   6.987   3.353
  362    HA   TYR  51           HA       TYR  51  -3.131   5.935   1.175
  363    HB2  TYR  51           HB2      TYR  51  -4.456   3.878   0.948
  364    HB3  TYR  51           HB3      TYR  51  -3.605   3.923   2.484
  365    HD1  TYR  51           HD1      TYR  51  -6.886   4.110   0.835
  366    HD2  TYR  51           HD2      TYR  51  -4.820   4.268   4.598
  367    HE1  TYR  51           HE1      TYR  51  -9.043   3.851   2.030
  368    HE2  TYR  51           HE2      TYR  51  -6.979   4.008   5.793
  369    HH   TYR  51           HH       TYR  51  -9.506   2.830   4.785
  370    H    GLU  52           H        GLU  52  -4.359   5.537  -0.785
  371    HA   GLU  52           HA       GLU  52  -6.825   7.157  -0.983
  372    HB2  GLU  52           HB2      GLU  52  -4.554   6.992  -2.989
  373    HB3  GLU  52           HB3      GLU  52  -6.084   7.829  -3.253
  374    HG2  GLU  52           HG2      GLU  52  -5.607   9.290  -1.311
  375    HG3  GLU  52           HG3      GLU  52  -4.067   8.466  -1.077
  376    H    VAL  53           H        VAL  53  -8.492   6.131  -1.940
  377    HA   VAL  53           HA       VAL  53  -8.412   3.351  -2.427
  378    HB   VAL  53           HB       VAL  53 -10.463   4.593  -1.802
  379   HG11  VAL  53          HG11      VAL  53 -10.030   6.590  -3.249
  380   HG12  VAL  53          HG12      VAL  53 -11.662   5.947  -3.423
  381   HG13  VAL  53          HG13      VAL  53 -10.447   5.616  -4.657
  382   HG21  VAL  53          HG21      VAL  53 -11.986   3.348  -3.196
  383   HG22  VAL  53          HG22      VAL  53 -10.534   2.367  -3.004
  384   HG23  VAL  53          HG23      VAL  53 -10.805   3.257  -4.501
  385    H    GLY  54           H        GLY  54  -8.550   2.171  -4.325
  386    HA2  GLY  54           HA2      GLY  54  -8.003   3.496  -6.885
  387    HA3  GLY  54           HA3      GLY  54  -6.834   2.307  -6.309
  388    H    GLN  55           H        GLN  55  -8.184   1.901  -8.711
  389    HA   GLN  55           HA       GLN  55 -10.261  -0.099  -8.073
  390    HB2  GLN  55           HB2      GLN  55  -9.578   1.225 -10.710
  391    HB3  GLN  55           HB3      GLN  55 -10.867   0.049 -10.462
  392    HG2  GLN  55           HG2      GLN  55 -10.665   2.736  -9.066
  393    HG3  GLN  55           HG3      GLN  55 -11.721   2.380 -10.428
  394   HE21  GLN  55          HE21      GLN  55 -11.815   2.690  -7.137
  395   HE22  GLN  55          HE22      GLN  55 -13.090   1.629  -6.784
  396    H    GLY  56           H        GLY  56 -10.128  -2.182  -8.753
  397    HA2  GLY  56           HA2      GLY  56  -7.785  -3.083 -10.269
  398    HA3  GLY  56           HA3      GLY  56  -8.014  -3.745  -8.652
  399    H    GLN  57           H        GLN  57  -8.032  -5.256 -11.092
  400    HA   GLN  57           HA       GLN  57 -10.628  -5.831 -12.039
  401    HB2  GLN  57           HB2      GLN  57  -8.103  -7.491 -11.957
  402    HB3  GLN  57           HB3      GLN  57  -9.581  -8.005 -12.776
  403    HG2  GLN  57           HG2      GLN  57  -9.526  -5.973 -14.167
  404    HG3  GLN  57           HG3      GLN  57  -8.055  -5.449 -13.346
  405   HE21  GLN  57          HE21      GLN  57  -6.506  -5.661 -15.017
  406   HE22  GLN  57          HE22      GLN  57  -6.204  -7.115 -15.840
  407    H    LYS  58           H        LYS  58  -8.700  -7.227  -9.414
  408    HA   LYS  58           HA       LYS  58 -10.780  -9.130  -8.707
  409    HB2  LYS  58           HB2      LYS  58  -8.353  -9.664  -8.488
  410    HB3  LYS  58           HB3      LYS  58  -8.228  -8.436  -7.232
  411    HG2  LYS  58           HG2      LYS  58  -9.881  -9.643  -5.864
  412    HG3  LYS  58           HG3      LYS  58 -10.050 -10.862  -7.126
  413    HD2  LYS  58           HD2      LYS  58  -7.660 -11.438  -6.893
  414    HD3  LYS  58           HD3      LYS  58  -7.492 -10.226  -5.624
  415    HE2  LYS  58           HE2      LYS  58  -9.155 -11.421  -4.253
  416    HE3  LYS  58           HE3      LYS  58  -9.338 -12.631  -5.522
  417    HZ1  LYS  58           HZ1      LYS  58  -6.671 -12.044  -4.427
  418    HZ2  LYS  58           HZ2      LYS  58  -7.244 -13.469  -5.155
  419    HZ3  LYS  58           HZ3      LYS  58  -7.721 -13.066  -3.574
  420    H    GLY  59           H        GLY  59  -9.819  -5.911  -7.812
  421    HA2  GLY  59           HA2      GLY  59 -12.075  -5.108  -6.520
  422    HA3  GLY  59           HA3      GLY  59 -11.139  -5.876  -5.241
  423    HA   PRO  60           HA       PRO  60  -9.598  -1.463  -5.987
  424    HB2  PRO  60           HB2      PRO  60 -10.380  -0.230  -3.718
  425    HB3  PRO  60           HB3      PRO  60 -11.465  -0.403  -5.114
  426    HG2  PRO  60           HG2      PRO  60 -11.325  -2.035  -2.618
  427    HG3  PRO  60           HG3      PRO  60 -12.741  -1.372  -3.457
  428    HD2  PRO  60           HD2      PRO  60 -11.938  -3.976  -3.749
  429    HD3  PRO  60           HD3      PRO  60 -12.768  -3.077  -5.039
  430    H    CYS  61           H        CYS  61  -7.880  -0.371  -4.897
  431    HA   CYS  61           HA       CYS  61  -6.585  -1.868  -2.706
  432    HB2  CYS  61           HB2      CYS  61  -4.409  -1.546  -3.790
  433    HB3  CYS  61           HB3      CYS  61  -5.490  -2.456  -4.846
  434    HG   CYS  61           HG       CYS  61  -5.222   0.624  -5.269
  435    H    ALA  62           H        ALA  62  -4.660  -0.433  -1.856
  436    HA   ALA  62           HA       ALA  62  -5.535   2.389  -1.775
  437    HB1  ALA  62           HB1      ALA  62  -4.317   1.802   0.709
  438    HB2  ALA  62           HB2      ALA  62  -5.434   0.474   0.395
  439    HB3  ALA  62           HB3      ALA  62  -6.021   2.134   0.405
  440    H    ASN  63           H        ASN  63  -3.966   3.497  -2.795
  441    HA   ASN  63           HA       ASN  63  -1.178   2.620  -2.539
  442    HB2  ASN  63           HB2      ASN  63  -0.737   4.127  -4.421
  443    HB3  ASN  63           HB3      ASN  63  -2.030   2.995  -4.811
  444   HD21  ASN  63          HD21      ASN  63  -1.403   5.915  -5.705
  445   HD22  ASN  63          HD22      ASN  63  -2.887   6.711  -5.492
  446    H    LYS  64           H        LYS  64   0.403   4.597  -2.649
  447    HA   LYS  64           HA       LYS  64   1.406   6.281  -1.461
  448    HB2  LYS  64           HB2      LYS  64  -0.396   7.548  -2.670
  449    HB3  LYS  64           HB3      LYS  64  -1.381   7.424  -1.213
  450    HG2  LYS  64           HG2      LYS  64   0.342   8.588   0.082
  451    HG3  LYS  64           HG3      LYS  64   1.382   8.670  -1.340
  452    HD2  LYS  64           HD2      LYS  64  -0.381   9.987  -2.513
  453    HD3  LYS  64           HD3      LYS  64  -1.335   9.979  -1.027
  454    HE2  LYS  64           HE2      LYS  64   1.473  11.100  -1.266
  455    HE3  LYS  64           HE3      LYS  64  -0.001  12.069  -1.287
  456    HZ1  LYS  64           HZ1      LYS  64  -0.543  11.172   0.910
  457    HZ2  LYS  64           HZ2      LYS  64   0.927  12.020   0.919
  458    HZ3  LYS  64           HZ3      LYS  64   0.923  10.321   0.929
  459    H    VAL  65           H        VAL  65   1.553   4.411   0.101
  460    HA   VAL  65           HA       VAL  65  -0.035   4.660   2.527
  461    HB   VAL  65           HB       VAL  65   2.317   2.849   1.887
  462   HG11  VAL  65          HG11      VAL  65   1.999   3.179   4.318
  463   HG12  VAL  65          HG12      VAL  65   1.550   1.543   3.838
  464   HG13  VAL  65          HG13      VAL  65   0.298   2.743   4.153
  465   HG21  VAL  65          HG21      VAL  65  -0.636   2.176   1.998
  466   HG22  VAL  65          HG22      VAL  65   0.677   1.134   1.455
  467   HG23  VAL  65          HG23      VAL  65   0.216   2.543   0.500
  468    H    VAL  66           H        VAL  66   0.421   6.181   3.928
  469    HA   VAL  66           HA       VAL  66   3.260   6.898   4.438
  470    HB   VAL  66           HB       VAL  66   0.843   8.733   4.576
  471   HG11  VAL  66          HG11      VAL  66   2.507  10.511   4.985
  472   HG12  VAL  66          HG12      VAL  66   3.793   9.305   4.997
  473   HG13  VAL  66          HG13      VAL  66   2.561   9.292   6.258
  474   HG21  VAL  66          HG21      VAL  66   3.199   8.704   2.663
  475   HG22  VAL  66          HG22      VAL  66   1.878   9.873   2.661
  476   HG23  VAL  66          HG23      VAL  66   1.562   8.184   2.262
  477    H    ALA  67           H        ALA  67   3.914   6.383   6.413
  478    HA   ALA  67           HA       ALA  67   2.130   5.392   8.415
  479    HB1  ALA  67           HB1      ALA  67   4.272   4.414   8.420
  480    HB2  ALA  67           HB2      ALA  67   4.282   5.471   9.830
  481    HB3  ALA  67           HB3      ALA  67   5.083   5.979   8.344
  482    H    VAL  68           H        VAL  68   1.308   6.348  10.191
  483    HA   VAL  68           HA       VAL  68   1.764   9.250  10.502
  484    HB   VAL  68           HB       VAL  68  -0.525   7.560  11.568
  485   HG11  VAL  68          HG11      VAL  68  -1.588   9.828  11.868
  486   HG12  VAL  68          HG12      VAL  68  -0.027  10.551  11.480
  487   HG13  VAL  68          HG13      VAL  68  -0.198   9.546  12.918
  488   HG21  VAL  68          HG21      VAL  68  -0.517   9.513   9.243
  489   HG22  VAL  68          HG22      VAL  68  -1.868   8.514   9.782
  490   HG23  VAL  68          HG23      VAL  68  -0.448   7.760   9.055
  Start of MODEL   10
    1    H1   MET   1           HT1      MET   1  -8.808  11.815  -0.103
    2    H2   MET   1           HT2      MET   1  -7.385  11.056  -0.636
    3    H3   MET   1           HT3      MET   1  -7.543  12.744  -0.747
    4    HA   MET   1           HA       MET   1  -6.163  11.706   1.170
    5    HB2  MET   1           HB2      MET   1  -6.769  14.126   0.829
    6    HB3  MET   1           HB3      MET   1  -8.255  13.831   1.732
    7    HG2  MET   1           HG2      MET   1  -6.929  13.118   3.688
    8    HG3  MET   1           HG3      MET   1  -5.441  13.404   2.787
    9    HE1  MET   1           HE1      MET   1  -5.024  17.045   2.388
   10    HE2  MET   1           HE2      MET   1  -5.957  16.174   1.173
   11    HE3  MET   1           HE3      MET   1  -4.594  15.383   1.961
   12    H    SER   2           H        SER   2  -6.408  10.009   2.467
   13    HA   SER   2           HA       SER   2  -8.741   9.826   4.214
   14    HB2  SER   2           HB2      SER   2  -9.425   8.520   2.257
   15    HB3  SER   2           HB3      SER   2  -7.940   7.579   2.347
   16    HG   SER   2           HG       SER   2  -8.636   6.998   4.509
   17    H    LYS   3           H        LYS   3  -8.370   8.630   6.086
   18    HA   LYS   3           HA       LYS   3  -5.690   7.465   6.455
   19    HB2  LYS   3           HB2      LYS   3  -5.695   9.838   7.278
   20    HB3  LYS   3           HB3      LYS   3  -6.955   9.387   8.426
   21    HG2  LYS   3           HG2      LYS   3  -5.476   7.756   9.477
   22    HG3  LYS   3           HG3      LYS   3  -4.229   8.059   8.267
   23    HD2  LYS   3           HD2      LYS   3  -3.589   9.330  10.188
   24    HD3  LYS   3           HD3      LYS   3  -4.256  10.494   9.046
   25    HE2  LYS   3           HE2      LYS   3  -6.408  10.456  10.223
   26    HE3  LYS   3           HE3      LYS   3  -5.795   9.234  11.338
   27    HZ1  LYS   3           HZ1      LYS   3  -5.724  11.655  12.077
   28    HZ2  LYS   3           HZ2      LYS   3  -4.424  11.826  10.998
   29    HZ3  LYS   3           HZ3      LYS   3  -4.317  10.732  12.292
   30    H    GLY   4           H        GLY   4  -5.877   5.489   7.273
   31    HA2  GLY   4           HA2      GLY   4  -8.154   4.870   9.066
   32    HA3  GLY   4           HA3      GLY   4  -7.710   3.792   7.746
   33    H    ILE   5           H        ILE   5  -7.658   2.367   9.794
   34    HA   ILE   5           HA       ILE   5  -4.902   2.420  10.888
   35    HB   ILE   5           HB       ILE   5  -5.868   1.151  12.853
   36   HG12  ILE   5          HG12      ILE   5  -8.537   2.243  11.920
   37   HG13  ILE   5          HG13      ILE   5  -8.037   0.598  11.545
   38   HG21  ILE   5          HG21      ILE   5  -6.677   3.997  12.232
   39   HG22  ILE   5          HG22      ILE   5  -5.312   3.433  13.197
   40   HG23  ILE   5          HG23      ILE   5  -6.955   3.268  13.815
   41   HD11  ILE   5          HD11      ILE   5  -9.402   0.672  13.607
   42   HD12  ILE   5          HD12      ILE   5  -8.236   1.779  14.333
   43   HD13  ILE   5          HD13      ILE   5  -7.761   0.123  13.951
   44    H    VAL   6           H        VAL   6  -3.673   0.731  10.537
   45    HA   VAL   6           HA       VAL   6  -4.506  -1.317   8.765
   46    HB   VAL   6           HB       VAL   6  -2.001  -1.128  10.462
   47   HG11  VAL   6          HG11      VAL   6  -2.784  -2.934   8.162
   48   HG12  VAL   6          HG12      VAL   6  -2.174  -3.400   9.749
   49   HG13  VAL   6          HG13      VAL   6  -1.098  -2.633   8.583
   50   HG21  VAL   6          HG21      VAL   6  -2.513   0.736   8.770
   51   HG22  VAL   6          HG22      VAL   6  -2.329  -0.491   7.518
   52   HG23  VAL   6          HG23      VAL   6  -0.971  -0.094   8.571
   53    H    LYS   7           H        LYS   7  -5.558  -3.111   9.178
   54    HA   LYS   7           HA       LYS   7  -6.325  -3.933  11.793
   55    HB2  LYS   7           HB2      LYS   7  -7.630  -4.421   9.702
   56    HB3  LYS   7           HB3      LYS   7  -6.377  -5.573   9.242
   57    HG2  LYS   7           HG2      LYS   7  -6.804  -6.918  11.223
   58    HG3  LYS   7           HG3      LYS   7  -7.937  -5.718  11.841
   59    HD2  LYS   7           HD2      LYS   7  -9.280  -7.435  10.863
   60    HD3  LYS   7           HD3      LYS   7  -9.300  -6.098   9.715
   61    HE2  LYS   7           HE2      LYS   7  -7.553  -7.186   8.379
   62    HE3  LYS   7           HE3      LYS   7  -7.462  -8.506   9.546
   63    HZ1  LYS   7           HZ1      LYS   7  -8.844  -9.190   7.751
   64    HZ2  LYS   7           HZ2      LYS   7  -9.780  -7.776   7.846
   65    HZ3  LYS   7           HZ3      LYS   7  -9.846  -8.928   9.094
   66    H    TRP   8           H        TRP   8  -3.953  -5.118   9.438
   67    HA   TRP   8           HA       TRP   8  -2.192  -6.065  11.506
   68    HB2  TRP   8           HB2      TRP   8  -4.035  -7.880  11.169
   69    HB3  TRP   8           HB3      TRP   8  -3.222  -8.199   9.639
   70    HD1  TRP   8           HD1      TRP   8  -0.634  -8.987   9.774
   71    HE1  TRP   8           HE1      TRP   8   0.617 -10.287  11.617
   72    HE3  TRP   8           HE3      TRP   8  -3.861  -8.320  13.671
   73    HZ2  TRP   8           HZ2      TRP   8   0.289 -10.961  14.377
   74    HZ3  TRP   8           HZ3      TRP   8  -3.373  -9.305  15.893
   75    HH2  TRP   8           HH2      TRP   8  -1.304 -10.622  16.250
   76    H    PHE   9           H        PHE   9  -0.176  -5.753  10.753
   77    HA   PHE   9           HA       PHE   9   0.210  -5.679   7.806
   78    HB2  PHE   9           HB2      PHE   9   0.688  -3.566   9.119
   79    HB3  PHE   9           HB3      PHE   9   2.016  -4.434   9.888
   80    HD1  PHE   9           HD1      PHE   9   0.763  -2.979   6.751
   81    HD2  PHE   9           HD2      PHE   9   3.988  -5.131   8.603
   82    HE1  PHE   9           HE1      PHE   9   2.196  -2.526   4.779
   83    HE2  PHE   9           HE2      PHE   9   5.421  -4.674   6.632
   84    HZ   PHE   9           HZ       PHE   9   4.526  -3.374   4.719
   85    H    ASN  10           H        ASN  10   1.327  -7.317   6.927
   86    HA   ASN  10           HA       ASN  10   3.301  -8.747   8.618
   87    HB2  ASN  10           HB2      ASN  10   1.389  -9.913   6.583
   88    HB3  ASN  10           HB3      ASN  10   2.715 -10.804   7.327
   89   HD21  ASN  10          HD21      ASN  10  -0.375 -11.007   7.578
   90   HD22  ASN  10          HD22      ASN  10  -0.628 -11.025   9.256
   91    H    SER  11           H        SER  11   5.103  -7.642   7.821
   92    HA   SER  11           HA       SER  11   5.616  -7.109   5.105
   93    HB2  SER  11           HB2      SER  11   7.918  -6.716   5.827
   94    HB3  SER  11           HB3      SER  11   6.790  -6.002   6.976
   95    HG   SER  11           HG       SER  11   8.107  -8.512   7.196
   96    H    ASP  12           H        ASP  12   6.273  -9.932   7.130
   97    HA   ASP  12           HA       ASP  12   8.093 -11.289   5.480
   98    HB2  ASP  12           HB2      ASP  12   7.260 -13.360   6.563
   99    HB3  ASP  12           HB3      ASP  12   7.590 -12.082   7.733
  100    H    LYS  13           H        LYS  13   4.552 -11.296   5.516
  101    HA   LYS  13           HA       LYS  13   4.285 -13.032   3.237
  102    HB2  LYS  13           HB2      LYS  13   2.340 -11.199   4.655
  103    HB3  LYS  13           HB3      LYS  13   1.893 -12.254   3.315
  104    HG2  LYS  13           HG2      LYS  13   2.667 -14.217   4.594
  105    HG3  LYS  13           HG3      LYS  13   3.107 -13.163   5.940
  106    HD2  LYS  13           HD2      LYS  13   0.769 -12.451   6.174
  107    HD3  LYS  13           HD3      LYS  13   0.311 -13.456   4.798
  108    HE2  LYS  13           HE2      LYS  13  -0.198 -14.638   6.878
  109    HE3  LYS  13           HE3      LYS  13   1.112 -15.464   6.035
  110    HZ1  LYS  13           HZ1      LYS  13   2.680 -14.671   7.516
  111    HZ2  LYS  13           HZ2      LYS  13   1.356 -14.994   8.531
  112    HZ3  LYS  13           HZ3      LYS  13   1.697 -13.399   8.055
  113    H    GLY  14           H        GLY  14   4.687  -9.624   3.781
  114    HA2  GLY  14           HA2      GLY  14   5.436  -8.060   2.187
  115    HA3  GLY  14           HA3      GLY  14   4.897  -9.135   0.907
  116    H    PHE  15           H        PHE  15   2.470  -8.836   3.260
  117    HA   PHE  15           HA       PHE  15   1.324  -6.376   2.258
  118    HB2  PHE  15           HB2      PHE  15  -0.726  -7.399   1.355
  119    HB3  PHE  15           HB3      PHE  15   0.704  -7.868   0.439
  120    HD1  PHE  15           HD1      PHE  15  -1.846  -8.999   2.859
  121    HD2  PHE  15           HD2      PHE  15   1.515 -10.155   0.448
  122    HE1  PHE  15           HE1      PHE  15  -2.398 -11.388   3.234
  123    HE2  PHE  15           HE2      PHE  15   0.966 -12.544   0.826
  124    HZ   PHE  15           HZ       PHE  15  -0.992 -13.159   2.219
  125    H    GLY  16           H        GLY  16  -0.974  -6.112   3.110
  126    HA2  GLY  16           HA2      GLY  16  -1.604  -7.508   5.568
  127    HA3  GLY  16           HA3      GLY  16  -1.069  -5.845   5.794
  128    H    PHE  17           H        PHE  17  -3.527  -6.353   6.650
  129    HA   PHE  17           HA       PHE  17  -5.352  -5.337   4.546
  130    HB2  PHE  17           HB2      PHE  17  -5.960  -6.983   7.020
  131    HB3  PHE  17           HB3      PHE  17  -7.178  -6.309   5.939
  132    HD1  PHE  17           HD1      PHE  17  -4.492  -8.808   6.292
  133    HD2  PHE  17           HD2      PHE  17  -7.519  -7.208   3.698
  134    HE1  PHE  17           HE1      PHE  17  -4.256 -10.776   4.803
  135    HE2  PHE  17           HE2      PHE  17  -7.283  -9.177   2.210
  136    HZ   PHE  17           HZ       PHE  17  -5.651 -10.961   2.761
  137    H    ILE  18           H        ILE  18  -6.410  -3.430   4.937
  138    HA   ILE  18           HA       ILE  18  -5.878  -2.161   7.545
  139    HB   ILE  18           HB       ILE  18  -4.739  -1.053   5.681
  140   HG12  ILE  18          HG12      ILE  18  -7.037   0.719   6.531
  141   HG13  ILE  18          HG13      ILE  18  -5.786   0.218   7.670
  142   HG21  ILE  18          HG21      ILE  18  -6.276   0.199   4.032
  143   HG22  ILE  18          HG22      ILE  18  -7.543  -0.905   4.564
  144   HG23  ILE  18          HG23      ILE  18  -6.091  -1.538   3.791
  145   HD11  ILE  18          HD11      ILE  18  -5.160   2.370   6.719
  146   HD12  ILE  18          HD12      ILE  18  -5.370   1.745   5.083
  147   HD13  ILE  18          HD13      ILE  18  -4.067   1.133   6.098
  148    H    THR  19           H        THR  19  -7.438  -1.078   8.621
  149    HA   THR  19           HA       THR  19 -10.190  -1.747   7.872
  150    HB   THR  19           HB       THR  19  -9.064  -0.863  10.533
  151    HG1  THR  19           HG1      THR  19  -9.117  -3.009  11.040
  152   HG21  THR  19          HG21      THR  19 -11.248  -1.798  11.376
  153   HG22  THR  19          HG22      THR  19 -11.774  -1.938   9.700
  154   HG23  THR  19          HG23      THR  19 -11.430  -0.350  10.385
  155    HA   PRO  20           HA       PRO  20 -10.361   2.729   6.733
  156    HB2  PRO  20           HB2      PRO  20 -13.218   1.909   6.356
  157    HB3  PRO  20           HB3      PRO  20 -12.178   2.867   5.285
  158    HG2  PRO  20           HG2      PRO  20 -12.715   0.372   4.686
  159    HG3  PRO  20           HG3      PRO  20 -11.066   0.996   4.486
  160    HD2  PRO  20           HD2      PRO  20 -12.157  -0.765   6.659
  161    HD3  PRO  20           HD3      PRO  20 -10.581  -0.836   5.837
  162    H    GLU  21           H        GLU  21 -10.703   4.366   8.181
  163    HA   GLU  21           HA       GLU  21 -11.814   3.916  10.741
  164    HB2  GLU  21           HB2      GLU  21 -11.565   6.335  11.078
  165    HB3  GLU  21           HB3      GLU  21 -10.128   5.656  10.317
  166    HG2  GLU  21           HG2      GLU  21 -10.893   6.432   8.118
  167    HG3  GLU  21           HG3      GLU  21 -12.383   7.043   8.829
  168    H    ASP  22           H        ASP  22 -13.209   5.108   7.757
  169    HA   ASP  22           HA       ASP  22 -15.598   6.207   8.842
  170    HB2  ASP  22           HB2      ASP  22 -14.880   5.192   6.090
  171    HB3  ASP  22           HB3      ASP  22 -16.444   5.905   6.465
  172    H    GLY  23           H        GLY  23 -14.572   2.956   8.303
  173    HA2  GLY  23           HA2      GLY  23 -15.765   1.132   9.336
  174    HA3  GLY  23           HA3      GLY  23 -17.268   1.979   9.001
  175    H    SER  24           H        SER  24 -15.152   2.199   6.366
  176    HA   SER  24           HA       SER  24 -16.806   0.574   4.698
  177    HB2  SER  24           HB2      SER  24 -14.137   1.894   4.172
  178    HB3  SER  24           HB3      SER  24 -15.130   1.118   2.948
  179    HG   SER  24           HG       SER  24 -16.047   3.193   4.650
  180    H    LYS  25           H        LYS  25 -15.811  -1.099   3.253
  181    HA   LYS  25           HA       LYS  25 -14.863  -3.269   4.797
  182    HB2  LYS  25           HB2      LYS  25 -14.982  -2.865   1.802
  183    HB3  LYS  25           HB3      LYS  25 -14.585  -4.397   2.580
  184    HG2  LYS  25           HG2      LYS  25 -16.771  -4.280   3.804
  185    HG3  LYS  25           HG3      LYS  25 -17.172  -2.840   2.871
  186    HD2  LYS  25           HD2      LYS  25 -16.450  -5.484   1.579
  187    HD3  LYS  25           HD3      LYS  25 -18.108  -5.027   1.958
  188    HE2  LYS  25           HE2      LYS  25 -17.849  -2.989   0.557
  189    HE3  LYS  25           HE3      LYS  25 -16.212  -3.498   0.146
  190    HZ1  LYS  25           HZ1      LYS  25 -17.085  -5.483  -0.860
  191    HZ2  LYS  25           HZ2      LYS  25 -17.857  -4.131  -1.541
  192    HZ3  LYS  25           HZ3      LYS  25 -18.665  -5.085  -0.389
  193    H    ASP  26           H        ASP  26 -12.867  -4.344   4.774
  194    HA   ASP  26           HA       ASP  26 -10.585  -2.740   4.917
  195    HB2  ASP  26           HB2      ASP  26 -10.924  -5.730   4.654
  196    HB3  ASP  26           HB3      ASP  26  -9.361  -4.962   4.911
  197    H    LEU  27           H        LEU  27  -8.825  -2.447   3.611
  198    HA   LEU  27           HA       LEU  27  -9.137  -3.213   0.765
  199    HB2  LEU  27           HB2      LEU  27  -8.303  -0.665   2.099
  200    HB3  LEU  27           HB3      LEU  27  -7.489  -1.094   0.598
  201    HG   LEU  27           HG       LEU  27  -9.793  -1.394  -0.440
  202   HD11  LEU  27          HD11      LEU  27 -10.570  -0.181   2.221
  203   HD12  LEU  27          HD12      LEU  27 -11.204  -1.642   1.465
  204   HD13  LEU  27          HD13      LEU  27 -11.602  -0.060   0.795
  205   HD21  LEU  27          HD21      LEU  27  -8.582   0.591  -0.987
  206   HD22  LEU  27          HD22      LEU  27  -8.848   1.282   0.614
  207   HD23  LEU  27          HD23      LEU  27 -10.192   1.139  -0.519
  208    H    PHE  28           H        PHE  28  -7.238  -3.748  -0.393
  209    HA   PHE  28           HA       PHE  28  -5.260  -5.147   1.186
  210    HB2  PHE  28           HB2      PHE  28  -5.631  -4.769  -1.792
  211    HB3  PHE  28           HB3      PHE  28  -4.315  -5.711  -1.088
  212    HD1  PHE  28           HD1      PHE  28  -7.952  -5.531  -1.640
  213    HD2  PHE  28           HD2      PHE  28  -4.740  -7.824   0.058
  214    HE1  PHE  28           HE1      PHE  28  -9.462  -7.486  -1.423
  215    HE2  PHE  28           HE2      PHE  28  -6.252  -9.779   0.275
  216    HZ   PHE  28           HZ       PHE  28  -8.614  -9.609  -0.466
  217    H    VAL  29           H        VAL  29  -3.260  -4.502   1.693
  218    HA   VAL  29           HA       VAL  29  -2.124  -2.123   0.362
  219    HB   VAL  29           HB       VAL  29  -2.172  -2.676   3.342
  220   HG11  VAL  29          HG11      VAL  29  -0.057  -1.656   2.844
  221   HG12  VAL  29          HG12      VAL  29  -1.098  -0.360   3.432
  222   HG13  VAL  29          HG13      VAL  29  -0.800  -0.537   1.703
  223   HG21  VAL  29          HG21      VAL  29  -3.306  -0.294   1.885
  224   HG22  VAL  29          HG22      VAL  29  -3.615  -0.804   3.542
  225   HG23  VAL  29          HG23      VAL  29  -4.268  -1.737   2.195
  226    H    HIS  30           H        HIS  30  -0.019  -2.357  -0.226
  227    HA   HIS  30           HA       HIS  30   1.369  -4.825   0.629
  228    HB2  HIS  30           HB2      HIS  30   1.623  -3.165  -1.886
  229    HB3  HIS  30           HB3      HIS  30   2.709  -4.493  -1.471
  230    HD2  HIS  30           HD2      HIS  30   1.656  -7.054  -1.928
  231    HE1  HIS  30           HE1      HIS  30  -2.204  -5.822  -3.111
  232    HE2  HIS  30           HE2      HIS  30  -0.641  -7.812  -2.913
  233    H    HIS  31           H        HIS  31   3.551  -4.756   1.169
  234    HA   HIS  31           HA       HIS  31   4.431  -2.535   2.682
  235    HB2  HIS  31           HB2      HIS  31   5.173  -4.901   3.029
  236    HB3  HIS  31           HB3      HIS  31   6.116  -4.785   1.544
  237    HD2  HIS  31           HD2      HIS  31   6.346  -3.642   5.274
  238    HE1  HIS  31           HE1      HIS  31   9.756  -2.160   3.276
  239    HE2  HIS  31           HE2      HIS  31   8.665  -2.479   5.547
  240    H    SER  32           H        SER  32   5.368  -3.714  -0.529
  241    HA   SER  32           HA       SER  32   7.254  -1.616  -1.024
  242    HB2  SER  32           HB2      SER  32   5.943  -3.608  -2.877
  243    HB3  SER  32           HB3      SER  32   7.241  -2.514  -3.349
  244    HG   SER  32           HG       SER  32   7.873  -4.681  -2.615
  245    H    GLU  33           H        GLU  33   3.949  -1.404  -0.864
  246    HA   GLU  33           HA       GLU  33   3.325   0.101  -3.204
  247    HB2  GLU  33           HB2      GLU  33   1.665  -1.079  -1.722
  248    HB3  GLU  33           HB3      GLU  33   1.912   0.196  -0.531
  249    HG2  GLU  33           HG2      GLU  33  -0.049   0.731  -1.875
  250    HG3  GLU  33           HG3      GLU  33   1.232   1.880  -2.239
  251    H    ILE  34           H        ILE  34   4.725   0.946  -0.101
  252    HA   ILE  34           HA       ILE  34   4.221   3.765  -0.304
  253    HB   ILE  34           HB       ILE  34   4.548   2.638   1.867
  254   HG12  ILE  34          HG12      ILE  34   6.820   4.594   1.451
  255   HG13  ILE  34          HG13      ILE  34   5.135   5.111   1.422
  256   HG21  ILE  34          HG21      ILE  34   6.385   1.098   0.913
  257   HG22  ILE  34          HG22      ILE  34   6.609   1.702   2.553
  258   HG23  ILE  34          HG23      ILE  34   7.490   2.438   1.215
  259   HD11  ILE  34          HD11      ILE  34   5.859   5.428   3.675
  260   HD12  ILE  34          HD12      ILE  34   6.654   3.854   3.717
  261   HD13  ILE  34          HD13      ILE  34   4.894   3.951   3.694
  262    H    GLN  35           H        GLN  35   5.218   5.174  -1.545
  263    HA   GLN  35           HA       GLN  35   7.327   4.529  -3.310
  264    HB2  GLN  35           HB2      GLN  35   5.616   6.334  -3.649
  265    HB3  GLN  35           HB3      GLN  35   6.455   7.291  -2.430
  266    HG2  GLN  35           HG2      GLN  35   7.206   7.968  -4.654
  267    HG3  GLN  35           HG3      GLN  35   8.529   7.174  -3.804
  268   HE21  GLN  35          HE21      GLN  35   9.652   5.855  -5.236
  269   HE22  GLN  35          HE22      GLN  35   8.942   4.900  -6.446
  270    H    SER  36           H        SER  36   7.272   6.188  -0.184
  271    HA   SER  36           HA       SER  36   9.916   7.128  -0.140
  272    HB2  SER  36           HB2      SER  36   8.096   6.281   2.120
  273    HB3  SER  36           HB3      SER  36   9.633   7.110   2.348
  274    HG   SER  36           HG       SER  36   7.260   8.017   1.122
  275    H    GLY  37           H        GLY  37   8.544   4.010   0.799
  276    HA2  GLY  37           HA2      GLY  37   9.805   1.974   0.521
  277    HA3  GLY  37           HA3      GLY  37  11.271   2.882   0.879
  278    H    GLY  38           H        GLY  38  10.645   0.510   2.187
  279    HA2  GLY  38           HA2      GLY  38   9.744   1.336   4.874
  280    HA3  GLY  38           HA3      GLY  38   9.768  -0.316   4.274
  281    H    GLU  39           H        GLU  39  12.438   1.944   3.823
  282    HA   GLU  39           HA       GLU  39  14.390   0.156   4.797
  283    HB2  GLU  39           HB2      GLU  39  14.445   3.154   4.389
  284    HB3  GLU  39           HB3      GLU  39  15.864   2.213   4.843
  285    HG2  GLU  39           HG2      GLU  39  14.191   1.761   2.351
  286    HG3  GLU  39           HG3      GLU  39  15.753   2.576   2.392
  287    H    TYR  40           H        TYR  40  12.695   2.864   6.325
  288    HA   TYR  40           HA       TYR  40  13.748   1.982   8.955
  289    HB2  TYR  40           HB2      TYR  40  12.956   4.766   8.073
  290    HB3  TYR  40           HB3      TYR  40  13.405   4.314   9.716
  291    HD1  TYR  40           HD1      TYR  40  14.623   4.914   6.304
  292    HD2  TYR  40           HD2      TYR  40  15.716   3.651  10.261
  293    HE1  TYR  40           HE1      TYR  40  17.018   5.200   5.733
  294    HE2  TYR  40           HE2      TYR  40  18.114   3.937   9.690
  295    HH   TYR  40           HH       TYR  40  19.428   3.876   7.203
  296    H    ALA  41           H        ALA  41  11.014   3.329   7.167
  297    HA   ALA  41           HA       ALA  41   9.152   3.408   9.270
  298    HB1  ALA  41           HB1      ALA  41   8.950   4.444   6.946
  299    HB2  ALA  41           HB2      ALA  41   7.494   3.688   7.595
  300    HB3  ALA  41           HB3      ALA  41   8.463   2.843   6.389
  301    H    THR  42           H        THR  42   7.987   1.926  10.246
  302    HA   THR  42           HA       THR  42   7.895  -0.821   9.132
  303    HB   THR  42           HB       THR  42   7.979  -1.679  11.444
  304    HG1  THR  42           HG1      THR  42   8.076  -0.353  13.111
  305   HG21  THR  42          HG21      THR  42  10.075  -1.286  10.057
  306   HG22  THR  42          HG22      THR  42  10.325  -1.356  11.803
  307   HG23  THR  42          HG23      THR  42  10.302   0.203  10.978
  308    H    LEU  43           H        LEU  43   6.023  -2.074   9.768
  309    HA   LEU  43           HA       LEU  43   3.744  -0.537  10.801
  310    HB2  LEU  43           HB2      LEU  43   3.831  -1.993   8.157
  311    HB3  LEU  43           HB3      LEU  43   2.324  -1.644   8.991
  312    HG   LEU  43           HG       LEU  43   3.397   0.836   9.073
  313   HD11  LEU  43          HD11      LEU  43   4.386  -0.094   6.378
  314   HD12  LEU  43          HD12      LEU  43   5.439  -0.172   7.787
  315   HD13  LEU  43          HD13      LEU  43   4.788   1.379   7.260
  316   HD21  LEU  43          HD21      LEU  43   1.931  -0.454   6.753
  317   HD22  LEU  43          HD22      LEU  43   2.175   1.287   6.892
  318   HD23  LEU  43          HD23      LEU  43   1.229   0.429   8.109
  319    H    ALA  44           H        ALA  44   2.186  -1.791  11.836
  320    HA   ALA  44           HA       ALA  44   2.545  -4.694  11.971
  321    HB1  ALA  44           HB1      ALA  44   2.954  -4.793  14.286
  322    HB2  ALA  44           HB2      ALA  44   2.415  -3.132  14.546
  323    HB3  ALA  44           HB3      ALA  44   3.963  -3.445  13.759
  324    H    ASP  45           H        ASP  45   0.774  -4.828  14.388
  325    HA   ASP  45           HA       ASP  45  -1.759  -4.557  13.004
  326    HB2  ASP  45           HB2      ASP  45  -1.254  -6.575  14.327
  327    HB3  ASP  45           HB3      ASP  45  -1.090  -5.590  15.774
  328    H    GLY  46           H        GLY  46  -2.730  -2.620  13.003
  329    HA2  GLY  46           HA2      GLY  46  -4.095  -1.034  14.166
  330    HA3  GLY  46           HA3      GLY  46  -3.038  -1.193  15.561
  331    H    GLN  47           H        GLN  47  -1.058  -0.981  12.889
  332    HA   GLN  47           HA       GLN  47  -0.097   1.608  13.537
  333    HB2  GLN  47           HB2      GLN  47   1.241  -0.235  12.504
  334    HB3  GLN  47           HB3      GLN  47   0.356   0.011  11.003
  335    HG2  GLN  47           HG2      GLN  47   2.494   1.201  10.920
  336    HG3  GLN  47           HG3      GLN  47   1.163   2.349  10.923
  337   HE21  GLN  47          HE21      GLN  47   1.721   4.111  12.210
  338   HE22  GLN  47          HE22      GLN  47   2.546   4.013  13.690
  339    H    THR  48           H        THR  48  -0.731   3.572  12.858
  340    HA   THR  48           HA       THR  48  -3.006   3.817  11.081
  341    HB   THR  48           HB       THR  48  -2.753   6.257  11.534
  342    HG1  THR  48           HG1      THR  48  -1.179   6.760  13.175
  343   HG21  THR  48          HG21      THR  48  -4.184   5.176  13.045
  344   HG22  THR  48          HG22      THR  48  -3.034   5.997  14.097
  345   HG23  THR  48          HG23      THR  48  -2.871   4.267  13.796
  346    H    VAL  49           H        VAL  49  -3.051   4.739   9.063
  347    HA   VAL  49           HA       VAL  49  -0.596   5.727   7.855
  348    HB   VAL  49           HB       VAL  49  -0.712   4.166   5.932
  349   HG11  VAL  49          HG11      VAL  49   0.776   3.773   7.923
  350   HG12  VAL  49          HG12      VAL  49   0.334   2.300   7.057
  351   HG13  VAL  49          HG13      VAL  49  -0.468   2.705   8.574
  352   HG21  VAL  49          HG21      VAL  49  -2.836   2.846   7.647
  353   HG22  VAL  49          HG22      VAL  49  -2.020   2.024   6.316
  354   HG23  VAL  49          HG23      VAL  49  -3.013   3.448   5.999
  355    H    GLU  50           H        GLU  50  -0.974   6.384   5.547
  356    HA   GLU  50           HA       GLU  50  -3.720   7.441   5.189
  357    HB2  GLU  50           HB2      GLU  50  -1.092   8.677   4.302
  358    HB3  GLU  50           HB3      GLU  50  -2.696   9.327   3.957
  359    HG2  GLU  50           HG2      GLU  50  -3.121   9.550   6.384
  360    HG3  GLU  50           HG3      GLU  50  -1.506   8.927   6.719
  361    H    TYR  51           H        TYR  51  -4.668   7.050   3.199
  362    HA   TYR  51           HA       TYR  51  -3.056   6.042   0.993
  363    HB2  TYR  51           HB2      TYR  51  -4.274   3.910   0.823
  364    HB3  TYR  51           HB3      TYR  51  -3.379   4.020   2.334
  365    HD1  TYR  51           HD1      TYR  51  -6.722   4.025   0.786
  366    HD2  TYR  51           HD2      TYR  51  -4.543   4.316   4.478
  367    HE1  TYR  51           HE1      TYR  51  -8.823   3.677   2.054
  368    HE2  TYR  51           HE2      TYR  51  -6.647   3.965   5.745
  369    HH   TYR  51           HH       TYR  51  -9.325   2.696   4.544
  370    H    GLU  52           H        GLU  52  -4.309   5.533  -0.924
  371    HA   GLU  52           HA       GLU  52  -6.834   7.082  -1.087
  372    HB2  GLU  52           HB2      GLU  52  -4.559   6.836  -3.064
  373    HB3  GLU  52           HB3      GLU  52  -6.168   7.386  -3.539
  374    HG2  GLU  52           HG2      GLU  52  -4.875   9.354  -3.052
  375    HG3  GLU  52           HG3      GLU  52  -6.005   9.138  -1.721
  376    H    VAL  53           H        VAL  53  -8.558   5.989  -1.815
  377    HA   VAL  53           HA       VAL  53  -8.282   3.158  -2.393
  378    HB   VAL  53           HB       VAL  53 -10.081   3.972  -0.918
  379   HG11  VAL  53          HG11      VAL  53 -10.416   6.136  -2.255
  380   HG12  VAL  53          HG12      VAL  53 -11.876   5.336  -1.670
  381   HG13  VAL  53          HG13      VAL  53 -11.396   5.171  -3.360
  382   HG21  VAL  53          HG21      VAL  53 -11.780   2.549  -1.756
  383   HG22  VAL  53          HG22      VAL  53 -10.296   1.906  -2.459
  384   HG23  VAL  53          HG23      VAL  53 -11.372   2.905  -3.434
  385    H    GLY  54           H        GLY  54  -7.889   2.413  -4.339
  386    HA2  GLY  54           HA2      GLY  54  -9.107   3.756  -6.680
  387    HA3  GLY  54           HA3      GLY  54  -7.424   3.239  -6.702
  388    H    GLN  55           H        GLN  55 -10.419   2.398  -7.704
  389    HA   GLN  55           HA       GLN  55 -10.620  -0.353  -7.138
  390    HB2  GLN  55           HB2      GLN  55 -11.710   1.329  -9.401
  391    HB3  GLN  55           HB3      GLN  55 -12.120  -0.373  -9.171
  392    HG2  GLN  55           HG2      GLN  55 -13.067   0.080  -6.992
  393    HG3  GLN  55           HG3      GLN  55 -12.492   1.745  -7.037
  394   HE21  GLN  55          HE21      GLN  55 -15.323   0.713  -6.843
  395   HE22  GLN  55          HE22      GLN  55 -16.142   1.416  -8.155
  396    H    GLY  56           H        GLY  56 -10.055  -2.151  -8.296
  397    HA2  GLY  56           HA2      GLY  56  -8.274  -1.839 -10.615
  398    HA3  GLY  56           HA3      GLY  56  -7.731  -2.781  -9.228
  399    H    GLN  57           H        GLN  57  -7.628  -4.410 -11.068
  400    HA   GLN  57           HA       GLN  57  -9.963  -5.506 -12.214
  401    HB2  GLN  57           HB2      GLN  57  -7.226  -6.671 -11.678
  402    HB3  GLN  57           HB3      GLN  57  -8.479  -7.517 -12.588
  403    HG2  GLN  57           HG2      GLN  57  -8.565  -5.765 -14.240
  404    HG3  GLN  57           HG3      GLN  57  -7.511  -4.734 -13.274
  405   HE21  GLN  57          HE21      GLN  57  -7.082  -5.821 -16.062
  406   HE22  GLN  57          HE22      GLN  57  -5.612  -6.665 -15.986
  407    H    LYS  58           H        LYS  58  -8.186  -6.283  -9.240
  408    HA   LYS  58           HA       LYS  58 -10.024  -8.437  -8.559
  409    HB2  LYS  58           HB2      LYS  58  -7.690  -7.211  -7.079
  410    HB3  LYS  58           HB3      LYS  58  -8.643  -8.567  -6.476
  411    HG2  LYS  58           HG2      LYS  58  -8.069  -9.872  -8.489
  412    HG3  LYS  58           HG3      LYS  58  -7.113  -8.520  -9.094
  413    HD2  LYS  58           HD2      LYS  58  -5.652  -8.661  -7.111
  414    HD3  LYS  58           HD3      LYS  58  -6.606 -10.015  -6.504
  415    HE2  LYS  58           HE2      LYS  58  -6.034 -11.326  -8.512
  416    HE3  LYS  58           HE3      LYS  58  -5.086  -9.974  -9.130
  417    HZ1  LYS  58           HZ1      LYS  58  -3.683 -10.122  -7.156
  418    HZ2  LYS  58           HZ2      LYS  58  -3.671 -11.578  -8.031
  419    HZ3  LYS  58           HZ3      LYS  58  -4.580 -11.450  -6.601
  420    H    GLY  59           H        GLY  59  -9.695  -5.040  -7.935
  421    HA2  GLY  59           HA2      GLY  59 -12.014  -4.205  -7.120
  422    HA3  GLY  59           HA3      GLY  59 -11.608  -5.155  -5.695
  423    HA   PRO  60           HA       PRO  60 -10.094  -0.682  -5.160
  424    HB2  PRO  60           HB2      PRO  60 -11.030  -1.303  -2.398
  425    HB3  PRO  60           HB3      PRO  60 -11.232   0.178  -3.354
  426    HG2  PRO  60           HG2      PRO  60 -13.267  -1.449  -2.998
  427    HG3  PRO  60           HG3      PRO  60 -12.977  -0.697  -4.580
  428    HD2  PRO  60           HD2      PRO  60 -12.373  -3.514  -3.694
  429    HD3  PRO  60           HD3      PRO  60 -13.052  -2.943  -5.238
  430    H    CYS  61           H        CYS  61  -8.245   0.010  -4.157
  431    HA   CYS  61           HA       CYS  61  -6.793  -1.765  -2.338
  432    HB2  CYS  61           HB2      CYS  61  -4.752  -1.677  -3.691
  433    HB3  CYS  61           HB3      CYS  61  -6.054  -2.426  -4.612
  434    HG   CYS  61           HG       CYS  61  -5.756  -0.644  -6.299
  435    H    ALA  62           H        ALA  62  -4.705  -0.569  -1.593
  436    HA   ALA  62           HA       ALA  62  -5.332   2.326  -1.388
  437    HB1  ALA  62           HB1      ALA  62  -4.878   0.334   0.662
  438    HB2  ALA  62           HB2      ALA  62  -5.381   2.012   0.832
  439    HB3  ALA  62           HB3      ALA  62  -3.667   1.611   0.778
  440    H    ASN  63           H        ASN  63  -3.851   3.671  -2.193
  441    HA   ASN  63           HA       ASN  63  -1.114   2.642  -2.657
  442    HB2  ASN  63           HB2      ASN  63  -2.700   4.642  -4.284
  443    HB3  ASN  63           HB3      ASN  63  -1.028   4.173  -4.591
  444   HD21  ASN  63          HD21      ASN  63  -3.736   3.693  -6.097
  445   HD22  ASN  63          HD22      ASN  63  -3.686   2.032  -6.442
  446    H    LYS  64           H        LYS  64   0.584   4.272  -2.646
  447    HA   LYS  64           HA       LYS  64   1.780   5.938  -1.633
  448    HB2  LYS  64           HB2      LYS  64  -0.897   7.348  -1.689
  449    HB3  LYS  64           HB3      LYS  64   0.639   8.124  -1.311
  450    HG2  LYS  64           HG2      LYS  64   1.513   7.542  -3.524
  451    HG3  LYS  64           HG3      LYS  64   0.030   6.670  -3.906
  452    HD2  LYS  64           HD2      LYS  64  -0.208   8.802  -4.946
  453    HD3  LYS  64           HD3      LYS  64  -1.205   8.877  -3.494
  454    HE2  LYS  64           HE2      LYS  64   0.100  10.924  -3.649
  455    HE3  LYS  64           HE3      LYS  64   0.710   9.970  -2.299
  456    HZ1  LYS  64           HZ1      LYS  64   1.888   9.679  -4.984
  457    HZ2  LYS  64           HZ2      LYS  64   2.582   9.344  -3.471
  458    HZ3  LYS  64           HZ3      LYS  64   2.372  10.953  -3.975
  459    H    VAL  65           H        VAL  65   1.417   4.014   0.037
  460    HA   VAL  65           HA       VAL  65  -0.049   4.632   2.418
  461    HB   VAL  65           HB       VAL  65   2.212   2.652   1.970
  462   HG11  VAL  65          HG11      VAL  65   1.220   1.502   3.963
  463   HG12  VAL  65          HG12      VAL  65   0.164   2.897   4.198
  464   HG13  VAL  65          HG13      VAL  65   1.912   3.077   4.349
  465   HG21  VAL  65          HG21      VAL  65   0.061   2.438   0.562
  466   HG22  VAL  65          HG22      VAL  65  -0.753   2.057   2.078
  467   HG23  VAL  65          HG23      VAL  65   0.552   1.024   1.495
  468    H    VAL  66           H        VAL  66   0.475   6.106   3.850
  469    HA   VAL  66           HA       VAL  66   3.337   6.729   4.343
  470    HB   VAL  66           HB       VAL  66   0.997   8.668   4.414
  471   HG11  VAL  66          HG11      VAL  66   3.966   9.097   4.882
  472   HG12  VAL  66          HG12      VAL  66   2.694   9.228   6.098
  473   HG13  VAL  66          HG13      VAL  66   2.764  10.382   4.767
  474   HG21  VAL  66          HG21      VAL  66   1.622   8.135   2.120
  475   HG22  VAL  66          HG22      VAL  66   3.331   8.361   2.498
  476   HG23  VAL  66          HG23      VAL  66   2.234   9.742   2.513
  477    H    ALA  67           H        ALA  67   3.949   6.222   6.339
  478    HA   ALA  67           HA       ALA  67   2.106   5.354   8.340
  479    HB1  ALA  67           HB1      ALA  67   4.289   5.474   9.772
  480    HB2  ALA  67           HB2      ALA  67   5.075   5.775   8.223
  481    HB3  ALA  67           HB3      ALA  67   4.170   4.282   8.478
  482    H    VAL  68           H        VAL  68   1.303   6.377  10.088
  483    HA   VAL  68           HA       VAL  68   2.014   9.231  10.457
  484    HB   VAL  68           HB       VAL  68  -0.649   7.895  11.060
  485   HG11  VAL  68          HG11      VAL  68  -0.095   9.857  12.487
  486   HG12  VAL  68          HG12      VAL  68  -1.444  10.193  11.402
  487   HG13  VAL  68          HG13      VAL  68   0.162  10.822  11.034
  488   HG21  VAL  68          HG21      VAL  68  -1.487   9.199   9.124
  489   HG22  VAL  68          HG22      VAL  68  -0.245   8.049   8.628
  490   HG23  VAL  68          HG23      VAL  68   0.153   9.758   8.797
  Start of MODEL   11
    1    H1   MET   1           HT1      MET   1  -5.591  14.216   1.686
    2    H2   MET   1           HT2      MET   1  -6.280  13.843   3.192
    3    H3   MET   1           HT3      MET   1  -7.276  14.242   1.875
    4    HA   MET   1           HA       MET   1  -7.095  12.225   0.904
    5    HB2  MET   1           HB2      MET   1  -5.104  10.768   1.173
    6    HB3  MET   1           HB3      MET   1  -4.663  12.372   0.593
    7    HG2  MET   1           HG2      MET   1  -4.090  13.029   2.928
    8    HG3  MET   1           HG3      MET   1  -4.457  11.389   3.457
    9    HE1  MET   1           HE1      MET   1  -2.366  12.680   0.103
   10    HE2  MET   1           HE2      MET   1  -0.977  13.053   1.120
   11    HE3  MET   1           HE3      MET   1  -2.544  13.765   1.490
   12    H    SER   2           H        SER   2  -7.636  10.084   1.640
   13    HA   SER   2           HA       SER   2  -8.940  10.063   4.174
   14    HB2  SER   2           HB2      SER   2  -8.375   7.820   2.226
   15    HB3  SER   2           HB3      SER   2  -9.439   7.693   3.624
   16    HG   SER   2           HG       SER   2 -10.826   8.328   2.130
   17    H    LYS   3           H        LYS   3  -8.521   8.770   5.990
   18    HA   LYS   3           HA       LYS   3  -5.831   7.584   6.198
   19    HB2  LYS   3           HB2      LYS   3  -5.790   9.893   7.151
   20    HB3  LYS   3           HB3      LYS   3  -7.046   9.411   8.289
   21    HG2  LYS   3           HG2      LYS   3  -5.526   7.614   9.137
   22    HG3  LYS   3           HG3      LYS   3  -4.266   8.216   8.060
   23    HD2  LYS   3           HD2      LYS   3  -5.626   9.977  10.113
   24    HD3  LYS   3           HD3      LYS   3  -4.162   9.061  10.469
   25    HE2  LYS   3           HE2      LYS   3  -3.018  10.195   8.574
   26    HE3  LYS   3           HE3      LYS   3  -4.472  11.152   8.292
   27    HZ1  LYS   3           HZ1      LYS   3  -4.184  12.330  10.217
   28    HZ2  LYS   3           HZ2      LYS   3  -2.563  12.065   9.780
   29    HZ3  LYS   3           HZ3      LYS   3  -3.291  11.106  10.979
   30    H    GLY   4           H        GLY   4  -5.933   5.593   6.962
   31    HA2  GLY   4           HA2      GLY   4  -8.181   4.827   8.737
   32    HA3  GLY   4           HA3      GLY   4  -7.678   3.809   7.388
   33    H    ILE   5           H        ILE   5  -7.677   2.525   9.665
   34    HA   ILE   5           HA       ILE   5  -4.892   2.597  10.674
   35    HB   ILE   5           HB       ILE   5  -5.833   1.343  12.664
   36   HG12  ILE   5          HG12      ILE   5  -8.520   2.379  11.717
   37   HG13  ILE   5          HG13      ILE   5  -7.998   0.735  11.368
   38   HG21  ILE   5          HG21      ILE   5  -6.731   4.156  12.000
   39   HG22  ILE   5          HG22      ILE   5  -5.308   3.663  12.917
   40   HG23  ILE   5          HG23      ILE   5  -6.917   3.450  13.606
   41   HD11  ILE   5          HD11      ILE   5  -9.306   0.687  13.408
   42   HD12  ILE   5          HD12      ILE   5  -8.348   1.995  14.104
   43   HD13  ILE   5          HD13      ILE   5  -7.619   0.410  13.841
   44    H    VAL   6           H        VAL   6  -3.627   0.962  10.275
   45    HA   VAL   6           HA       VAL   6  -4.402  -1.149   8.568
   46    HB   VAL   6           HB       VAL   6  -1.894  -0.866  10.249
   47   HG11  VAL   6          HG11      VAL   6  -2.652  -2.720   7.980
   48   HG12  VAL   6          HG12      VAL   6  -1.982  -3.140   9.556
   49   HG13  VAL   6          HG13      VAL   6  -0.968  -2.350   8.350
   50   HG21  VAL   6          HG21      VAL   6  -0.907   0.182   8.339
   51   HG22  VAL   6          HG22      VAL   6  -2.468   0.974   8.555
   52   HG23  VAL   6          HG23      VAL   6  -2.269  -0.253   7.305
   53    H    LYS   7           H        LYS   7  -5.433  -2.933   9.019
   54    HA   LYS   7           HA       LYS   7  -6.110  -3.779  11.654
   55    HB2  LYS   7           HB2      LYS   7  -7.513  -4.260   9.652
   56    HB3  LYS   7           HB3      LYS   7  -6.255  -5.341   9.053
   57    HG2  LYS   7           HG2      LYS   7  -6.501  -6.757  11.054
   58    HG3  LYS   7           HG3      LYS   7  -7.732  -5.665  11.686
   59    HD2  LYS   7           HD2      LYS   7  -9.169  -6.131   9.749
   60    HD3  LYS   7           HD3      LYS   7  -7.933  -7.190   9.071
   61    HE2  LYS   7           HE2      LYS   7  -9.620  -8.538  10.216
   62    HE3  LYS   7           HE3      LYS   7  -8.093  -8.631  11.095
   63    HZ1  LYS   7           HZ1      LYS   7 -10.335  -8.121  12.321
   64    HZ2  LYS   7           HZ2      LYS   7  -9.995  -6.529  11.832
   65    HZ3  LYS   7           HZ3      LYS   7  -8.887  -7.377  12.802
   66    H    TRP   8           H        TRP   8  -3.825  -4.946   9.200
   67    HA   TRP   8           HA       TRP   8  -1.984  -5.904  11.204
   68    HB2  TRP   8           HB2      TRP   8  -3.825  -7.716  10.883
   69    HB3  TRP   8           HB3      TRP   8  -3.070  -7.993   9.317
   70    HD1  TRP   8           HD1      TRP   8  -0.660  -9.068   9.271
   71    HE1  TRP   8           HE1      TRP   8   0.717 -10.320  11.055
   72    HE3  TRP   8           HE3      TRP   8  -3.310  -7.838  13.457
   73    HZ2  TRP   8           HZ2      TRP   8   0.697 -10.746  13.884
   74    HZ3  TRP   8           HZ3      TRP   8  -2.613  -8.682  15.680
   75    HH2  TRP   8           HH2      TRP   8  -0.615 -10.133  15.899
   76    H    PHE   9           H        PHE   9   0.002  -5.530  10.398
   77    HA   PHE   9           HA       PHE   9   0.313  -5.409   7.442
   78    HB2  PHE   9           HB2      PHE   9   0.821  -3.319   8.786
   79    HB3  PHE   9           HB3      PHE   9   2.176  -4.200   9.494
   80    HD1  PHE   9           HD1      PHE   9   0.856  -2.603   6.471
   81    HD2  PHE   9           HD2      PHE   9   4.074  -4.943   8.091
   82    HE1  PHE   9           HE1      PHE   9   2.225  -2.106   4.466
   83    HE2  PHE   9           HE2      PHE   9   5.445  -4.442   6.086
   84    HZ   PHE   9           HZ       PHE   9   4.522  -3.024   4.274
   85    H    ASN  10           H        ASN  10   1.455  -7.007   6.491
   86    HA   ASN  10           HA       ASN  10   3.484  -8.432   8.115
   87    HB2  ASN  10           HB2      ASN  10   1.395  -9.605   6.277
   88    HB3  ASN  10           HB3      ASN  10   2.824 -10.497   6.790
   89   HD21  ASN  10          HD21      ASN  10   0.106 -11.260   7.481
   90   HD22  ASN  10          HD22      ASN  10  -0.043 -11.138   9.167
   91    H    SER  11           H        SER  11   5.250  -7.369   7.216
   92    HA   SER  11           HA       SER  11   5.634  -6.909   4.454
   93    HB2  SER  11           HB2      SER  11   7.959  -6.476   5.061
   94    HB3  SER  11           HB3      SER  11   6.881  -5.728   6.233
   95    HG   SER  11           HG       SER  11   7.644  -7.011   7.713
   96    H    ASP  12           H        ASP  12   6.234  -9.693   6.507
   97    HA   ASP  12           HA       ASP  12   8.064 -11.113   4.908
   98    HB2  ASP  12           HB2      ASP  12   7.381 -11.752   7.227
   99    HB3  ASP  12           HB3      ASP  12   5.822 -12.268   6.591
  100    H    LYS  13           H        LYS  13   4.522 -11.100   4.952
  101    HA   LYS  13           HA       LYS  13   4.244 -12.830   2.670
  102    HB2  LYS  13           HB2      LYS  13   2.301 -11.001   4.101
  103    HB3  LYS  13           HB3      LYS  13   1.853 -12.066   2.771
  104    HG2  LYS  13           HG2      LYS  13   2.643 -14.018   4.052
  105    HG3  LYS  13           HG3      LYS  13   3.090 -12.957   5.390
  106    HD2  LYS  13           HD2      LYS  13   0.741 -12.238   5.615
  107    HD3  LYS  13           HD3      LYS  13   0.288 -13.297   4.276
  108    HE2  LYS  13           HE2      LYS  13   1.071 -15.255   5.554
  109    HE3  LYS  13           HE3      LYS  13   1.532 -14.200   6.891
  110    HZ1  LYS  13           HZ1      LYS  13  -1.220 -14.441   5.801
  111    HZ2  LYS  13           HZ2      LYS  13  -0.745 -13.536   7.158
  112    HZ3  LYS  13           HZ3      LYS  13  -0.662 -15.232   7.195
  113    H    GLY  14           H        GLY  14   4.676  -9.432   3.225
  114    HA2  GLY  14           HA2      GLY  14   5.423  -7.873   1.620
  115    HA3  GLY  14           HA3      GLY  14   4.830  -8.928   0.346
  116    H    PHE  15           H        PHE  15   2.475  -8.597   2.768
  117    HA   PHE  15           HA       PHE  15   1.345  -6.113   1.811
  118    HB2  PHE  15           HB2      PHE  15  -0.753  -7.099   0.972
  119    HB3  PHE  15           HB3      PHE  15   0.638  -7.581   0.006
  120    HD1  PHE  15           HD1      PHE  15  -1.841  -8.697   2.511
  121    HD2  PHE  15           HD2      PHE  15   1.406  -9.877  -0.041
  122    HE1  PHE  15           HE1      PHE  15  -2.416 -11.081   2.882
  123    HE2  PHE  15           HE2      PHE  15   0.835 -12.260   0.333
  124    HZ   PHE  15           HZ       PHE  15  -1.077 -12.862   1.793
  125    H    GLY  16           H        GLY  16  -0.954  -5.850   2.724
  126    HA2  GLY  16           HA2      GLY  16  -1.479  -7.231   5.217
  127    HA3  GLY  16           HA3      GLY  16  -0.958  -5.559   5.404
  128    H    PHE  17           H        PHE  17  -3.389  -6.156   6.344
  129    HA   PHE  17           HA       PHE  17  -5.299  -5.136   4.319
  130    HB2  PHE  17           HB2      PHE  17  -5.800  -6.830   6.784
  131    HB3  PHE  17           HB3      PHE  17  -7.062  -6.163   5.748
  132    HD1  PHE  17           HD1      PHE  17  -4.360  -8.645   6.012
  133    HD2  PHE  17           HD2      PHE  17  -7.418  -7.009   3.479
  134    HE1  PHE  17           HE1      PHE  17  -4.136 -10.589   4.488
  135    HE2  PHE  17           HE2      PHE  17  -7.194  -8.953   1.955
  136    HZ   PHE  17           HZ       PHE  17  -5.553 -10.741   2.458
  137    H    ILE  18           H        ILE  18  -6.325  -3.233   4.764
  138    HA   ILE  18           HA       ILE  18  -5.806  -2.043   7.410
  139    HB   ILE  18           HB       ILE  18  -4.579  -0.923   5.610
  140   HG12  ILE  18          HG12      ILE  18  -6.837   0.907   6.451
  141   HG13  ILE  18          HG13      ILE  18  -5.655   0.312   7.620
  142   HG21  ILE  18          HG21      ILE  18  -5.905  -1.303   3.678
  143   HG22  ILE  18          HG22      ILE  18  -6.014   0.432   3.966
  144   HG23  ILE  18          HG23      ILE  18  -7.347  -0.625   4.433
  145   HD11  ILE  18          HD11      ILE  18  -5.066   2.546   6.604
  146   HD12  ILE  18          HD12      ILE  18  -4.897   1.725   5.050
  147   HD13  ILE  18          HD13      ILE  18  -3.838   1.298   6.392
  148    H    THR  19           H        THR  19  -7.378  -1.075   8.527
  149    HA   THR  19           HA       THR  19 -10.110  -1.668   7.700
  150    HB   THR  19           HB       THR  19  -9.024  -0.729  10.357
  151    HG1  THR  19           HG1      THR  19  -9.736  -3.298   9.390
  152   HG21  THR  19          HG21      THR  19 -11.412  -0.232  10.096
  153   HG22  THR  19          HG22      THR  19 -11.204  -1.578  11.215
  154   HG23  THR  19          HG23      THR  19 -11.716  -1.883   9.555
  155    HA   PRO  20           HA       PRO  20 -10.337   2.781   6.478
  156    HB2  PRO  20           HB2      PRO  20 -13.191   1.943   6.127
  157    HB3  PRO  20           HB3      PRO  20 -12.152   2.872   5.029
  158    HG2  PRO  20           HG2      PRO  20 -12.691   0.358   4.503
  159    HG3  PRO  20           HG3      PRO  20 -11.044   0.982   4.271
  160    HD2  PRO  20           HD2      PRO  20 -12.113  -0.725   6.502
  161    HD3  PRO  20           HD3      PRO  20 -10.541  -0.809   5.670
  162    H    GLU  21           H        GLU  21 -10.665   4.438   7.895
  163    HA   GLU  21           HA       GLU  21 -11.747   4.070  10.467
  164    HB2  GLU  21           HB2      GLU  21 -11.561   6.507  10.706
  165    HB3  GLU  21           HB3      GLU  21 -10.117   5.838   9.948
  166    HG2  GLU  21           HG2      GLU  21 -10.916   6.517   7.739
  167    HG3  GLU  21           HG3      GLU  21 -12.431   7.087   8.431
  168    H    ASP  22           H        ASP  22 -13.230   5.080   7.462
  169    HA   ASP  22           HA       ASP  22 -15.631   6.159   8.554
  170    HB2  ASP  22           HB2      ASP  22 -14.927   5.084   5.822
  171    HB3  ASP  22           HB3      ASP  22 -16.500   5.774   6.203
  172    H    GLY  23           H        GLY  23 -14.518   2.925   8.093
  173    HA2  GLY  23           HA2      GLY  23 -15.639   1.085   9.168
  174    HA3  GLY  23           HA3      GLY  23 -17.172   1.889   8.863
  175    H    SER  24           H        SER  24 -15.137   2.130   6.171
  176    HA   SER  24           HA       SER  24 -16.785   0.456   4.553
  177    HB2  SER  24           HB2      SER  24 -14.154   1.830   3.979
  178    HB3  SER  24           HB3      SER  24 -15.143   1.023   2.772
  179    HG   SER  24           HG       SER  24 -15.957   2.992   2.668
  180    H    LYS  25           H        LYS  25 -15.712  -1.165   3.052
  181    HA   LYS  25           HA       LYS  25 -14.744  -3.347   4.565
  182    HB2  LYS  25           HB2      LYS  25 -14.800  -2.864   1.580
  183    HB3  LYS  25           HB3      LYS  25 -14.358  -4.403   2.322
  184    HG2  LYS  25           HG2      LYS  25 -16.555  -4.496   3.441
  185    HG3  LYS  25           HG3      LYS  25 -17.002  -2.963   2.693
  186    HD2  LYS  25           HD2      LYS  25 -16.721  -3.981   0.454
  187    HD3  LYS  25           HD3      LYS  25 -16.306  -5.519   1.212
  188    HE2  LYS  25           HE2      LYS  25 -18.930  -4.050   1.612
  189    HE3  LYS  25           HE3      LYS  25 -18.700  -5.419   0.523
  190    HZ1  LYS  25           HZ1      LYS  25 -17.861  -6.652   2.535
  191    HZ2  LYS  25           HZ2      LYS  25 -19.523  -6.307   2.518
  192    HZ3  LYS  25           HZ3      LYS  25 -18.471  -5.378   3.475
  193    H    ASP  26           H        ASP  26 -12.712  -4.365   4.566
  194    HA   ASP  26           HA       ASP  26 -10.497  -2.735   4.885
  195    HB2  ASP  26           HB2      ASP  26  -9.166  -4.788   4.880
  196    HB3  ASP  26           HB3      ASP  26 -10.649  -5.006   5.799
  197    H    LEU  27           H        LEU  27  -8.601  -2.406   3.670
  198    HA   LEU  27           HA       LEU  27  -8.950  -2.686   0.743
  199    HB2  LEU  27           HB2      LEU  27  -8.078  -0.418   2.469
  200    HB3  LEU  27           HB3      LEU  27  -7.194  -0.628   0.968
  201    HG   LEU  27           HG       LEU  27  -9.073   0.957   0.715
  202   HD11  LEU  27          HD11      LEU  27  -8.312  -0.641  -1.139
  203   HD12  LEU  27          HD12      LEU  27  -9.883   0.130  -1.342
  204   HD13  LEU  27          HD13      LEU  27  -9.787  -1.546  -0.806
  205   HD21  LEU  27          HD21      LEU  27 -10.922  -1.392   1.220
  206   HD22  LEU  27          HD22      LEU  27 -11.378   0.288   0.938
  207   HD23  LEU  27          HD23      LEU  27 -10.559  -0.163   2.432
  208    H    PHE  28           H        PHE  28  -7.191  -3.307  -0.482
  209    HA   PHE  28           HA       PHE  28  -5.155  -4.836   0.904
  210    HB2  PHE  28           HB2      PHE  28  -5.734  -4.355  -2.026
  211    HB3  PHE  28           HB3      PHE  28  -4.416  -5.377  -1.444
  212    HD1  PHE  28           HD1      PHE  28  -8.072  -5.009  -1.717
  213    HD2  PHE  28           HD2      PHE  28  -4.861  -7.504  -0.336
  214    HE1  PHE  28           HE1      PHE  28  -9.658  -6.896  -1.443
  215    HE2  PHE  28           HE2      PHE  28  -6.446  -9.392  -0.062
  216    HZ   PHE  28           HZ       PHE  28  -8.844  -9.087  -0.615
  217    H    VAL  29           H        VAL  29  -3.176  -4.160   1.404
  218    HA   VAL  29           HA       VAL  29  -2.012  -1.874  -0.058
  219    HB   VAL  29           HB       VAL  29  -2.050  -2.276   2.943
  220   HG11  VAL  29          HG11      VAL  29   0.107  -1.379   2.480
  221   HG12  VAL  29          HG12      VAL  29  -0.877   0.032   2.868
  222   HG13  VAL  29          HG13      VAL  29  -0.513  -0.356   1.186
  223   HG21  VAL  29          HG21      VAL  29  -4.090  -1.289   1.733
  224   HG22  VAL  29          HG22      VAL  29  -3.053   0.088   1.358
  225   HG23  VAL  29          HG23      VAL  29  -3.397  -0.324   3.036
  226    H    HIS  30           H        HIS  30   0.062  -2.154  -0.668
  227    HA   HIS  30           HA       HIS  30   1.444  -4.612   0.230
  228    HB2  HIS  30           HB2      HIS  30   1.736  -3.041  -2.345
  229    HB3  HIS  30           HB3      HIS  30   2.688  -4.462  -1.913
  230    HD2  HIS  30           HD2      HIS  30  -0.651  -3.656  -3.607
  231    HE1  HIS  30           HE1      HIS  30  -0.832  -7.742  -2.562
  232    HE2  HIS  30           HE2      HIS  30  -1.954  -5.899  -3.902
  233    H    HIS  31           H        HIS  31   3.757  -4.517   0.466
  234    HA   HIS  31           HA       HIS  31   4.687  -2.305   1.970
  235    HB2  HIS  31           HB2      HIS  31   5.581  -4.639   2.152
  236    HB3  HIS  31           HB3      HIS  31   6.369  -4.414   0.588
  237    HD2  HIS  31           HD2      HIS  31   6.827  -3.275   4.320
  238    HE1  HIS  31           HE1      HIS  31  10.024  -1.675   2.070
  239    HE2  HIS  31           HE2      HIS  31   9.113  -2.018   4.415
  240    H    SER  32           H        SER  32   5.225  -3.320  -1.372
  241    HA   SER  32           HA       SER  32   7.062  -1.341  -2.146
  242    HB2  SER  32           HB2      SER  32   5.013  -2.862  -3.764
  243    HB3  SER  32           HB3      SER  32   6.269  -1.846  -4.467
  244    HG   SER  32           HG       SER  32   7.365  -3.653  -4.342
  245    H    GLU  33           H        GLU  33   3.524  -1.336  -2.090
  246    HA   GLU  33           HA       GLU  33   3.177   1.112  -3.503
  247    HB2  GLU  33           HB2      GLU  33   1.380  -0.405  -1.606
  248    HB3  GLU  33           HB3      GLU  33   0.874   1.045  -2.471
  249    HG2  GLU  33           HG2      GLU  33   1.886  -1.503  -3.771
  250    HG3  GLU  33           HG3      GLU  33   0.197  -1.016  -3.668
  251    H    ILE  34           H        ILE  34   3.933   0.391  -0.172
  252    HA   ILE  34           HA       ILE  34   3.365   3.165   0.633
  253    HB   ILE  34           HB       ILE  34   2.489   1.420   2.119
  254   HG12  ILE  34          HG12      ILE  34   4.869   2.729   3.474
  255   HG13  ILE  34          HG13      ILE  34   3.417   3.618   3.030
  256   HG21  ILE  34          HG21      ILE  34   4.064  -0.368   1.646
  257   HG22  ILE  34          HG22      ILE  34   4.080  -0.036   3.377
  258   HG23  ILE  34          HG23      ILE  34   5.388   0.556   2.354
  259   HD11  ILE  34          HD11      ILE  34   2.179   1.709   4.363
  260   HD12  ILE  34          HD12      ILE  34   2.947   3.029   5.240
  261   HD13  ILE  34          HD13      ILE  34   3.760   1.472   5.103
  262    H    GLN  35           H        GLN  35   4.915   4.608   1.046
  263    HA   GLN  35           HA       GLN  35   7.663   3.940   0.353
  264    HB2  GLN  35           HB2      GLN  35   6.529   6.045  -0.435
  265    HB3  GLN  35           HB3      GLN  35   6.517   6.603   1.236
  266    HG2  GLN  35           HG2      GLN  35   8.457   7.538   0.080
  267    HG3  GLN  35           HG3      GLN  35   8.998   6.388   1.298
  268   HE21  GLN  35          HE21      GLN  35  10.706   5.175   0.480
  269   HE22  GLN  35          HE22      GLN  35  10.817   4.598  -1.112
  270    H    SER  36           H        SER  36   9.262   3.584   1.771
  271    HA   SER  36           HA       SER  36   8.694   3.994   4.645
  272    HB2  SER  36           HB2      SER  36  10.595   2.081   3.274
  273    HB3  SER  36           HB3      SER  36  10.441   2.268   5.018
  274    HG   SER  36           HG       SER  36   8.360   1.524   4.899
  275    H    GLY  37           H        GLY  37  10.009   5.207   5.875
  276    HA2  GLY  37           HA2      GLY  37  11.713   7.133   4.723
  277    HA3  GLY  37           HA3      GLY  37  11.608   6.759   6.441
  278    H    GLY  38           H        GLY  38  12.384   4.038   6.310
  279    HA2  GLY  38           HA2      GLY  38  14.834   3.627   4.933
  280    HA3  GLY  38           HA3      GLY  38  15.152   4.191   6.570
  281    H    GLU  39           H        GLU  39  16.192   2.021   6.690
  282    HA   GLU  39           HA       GLU  39  14.748  -0.396   6.599
  283    HB2  GLU  39           HB2      GLU  39  17.238   0.393   8.122
  284    HB3  GLU  39           HB3      GLU  39  16.602  -1.251   8.095
  285    HG2  GLU  39           HG2      GLU  39  18.177  -1.257   6.347
  286    HG3  GLU  39           HG3      GLU  39  16.649  -1.010   5.510
  287    H    TYR  40           H        TYR  40  15.309   1.916   9.220
  288    HA   TYR  40           HA       TYR  40  14.216   0.398  11.336
  289    HB2  TYR  40           HB2      TYR  40  14.358   3.393  10.941
  290    HB3  TYR  40           HB3      TYR  40  13.905   2.607  12.452
  291    HD1  TYR  40           HD1      TYR  40  16.657   3.331  10.128
  292    HD2  TYR  40           HD2      TYR  40  15.541   1.311  13.750
  293    HE1  TYR  40           HE1      TYR  40  19.052   3.055  10.710
  294    HE2  TYR  40           HE2      TYR  40  17.936   1.035  14.334
  295    HH   TYR  40           HH       TYR  40  20.245   2.629  13.416
  296    H    ALA  41           H        ALA  41  12.753   2.631   9.008
  297    HA   ALA  41           HA       ALA  41  10.197   2.823  10.144
  298    HB1  ALA  41           HB1      ALA  41  10.802   2.800   7.182
  299    HB2  ALA  41           HB2      ALA  41  11.110   4.190   8.223
  300    HB3  ALA  41           HB3      ALA  41   9.460   3.602   8.000
  301    H    THR  42           H        THR  42   8.596   1.442  10.354
  302    HA   THR  42           HA       THR  42   8.238  -0.781   8.498
  303    HB   THR  42           HB       THR  42   9.787  -1.697  10.179
  304    HG1  THR  42           HG1      THR  42   8.392  -3.432  10.823
  305   HG21  THR  42          HG21      THR  42   7.602  -1.004  12.166
  306   HG22  THR  42          HG22      THR  42   9.197  -0.256  12.080
  307   HG23  THR  42          HG23      THR  42   9.043  -1.955  12.524
  308    H    LEU  43           H        LEU  43   6.288  -2.167   9.393
  309    HA   LEU  43           HA       LEU  43   4.248  -0.448  10.619
  310    HB2  LEU  43           HB2      LEU  43   3.974  -1.825   7.942
  311    HB3  LEU  43           HB3      LEU  43   2.606  -1.226   8.874
  312    HG   LEU  43           HG       LEU  43   4.139   1.018   8.889
  313   HD11  LEU  43          HD11      LEU  43   5.856  -0.290   7.462
  314   HD12  LEU  43          HD12      LEU  43   5.407   1.325   6.919
  315   HD13  LEU  43          HD13      LEU  43   4.711  -0.094   6.138
  316   HD21  LEU  43          HD21      LEU  43   2.700   1.891   7.196
  317   HD22  LEU  43          HD22      LEU  43   1.763   0.639   8.010
  318   HD23  LEU  43          HD23      LEU  43   2.502   0.308   6.444
  319    H    ALA  44           H        ALA  44   2.528  -1.629  11.590
  320    HA   ALA  44           HA       ALA  44   2.747  -4.553  11.651
  321    HB1  ALA  44           HB1      ALA  44   4.213  -3.389  13.466
  322    HB2  ALA  44           HB2      ALA  44   3.173  -4.727  13.951
  323    HB3  ALA  44           HB3      ALA  44   2.677  -3.065  14.267
  324    H    ASP  45           H        ASP  45   0.975  -4.608  14.104
  325    HA   ASP  45           HA       ASP  45  -1.545  -4.259  12.712
  326    HB2  ASP  45           HB2      ASP  45  -1.097  -6.282  14.056
  327    HB3  ASP  45           HB3      ASP  45  -0.928  -5.286  15.494
  328    H    GLY  46           H        GLY  46  -2.437  -2.285  12.694
  329    HA2  GLY  46           HA2      GLY  46  -3.766  -0.678  13.905
  330    HA3  GLY  46           HA3      GLY  46  -2.632  -0.804  15.240
  331    H    GLN  47           H        GLN  47  -0.878  -0.688  12.377
  332    HA   GLN  47           HA       GLN  47   0.261   1.834  12.911
  333    HB2  GLN  47           HB2      GLN  47   1.349  -0.016  11.623
  334    HB3  GLN  47           HB3      GLN  47   0.263   0.336  10.278
  335    HG2  GLN  47           HG2      GLN  47   2.396   1.468   9.917
  336    HG3  GLN  47           HG3      GLN  47   1.141   2.657  10.210
  337   HE21  GLN  47          HE21      GLN  47   2.010   4.315  11.460
  338   HE22  GLN  47          HE22      GLN  47   3.042   4.089  12.788
  339    H    THR  48           H        THR  48  -0.280   3.839  12.340
  340    HA   THR  48           HA       THR  48  -2.782   4.281  10.895
  341    HB   THR  48           HB       THR  48  -0.929   6.266  12.252
  342    HG1  THR  48           HG1      THR  48  -2.642   6.144  13.852
  343   HG21  THR  48          HG21      THR  48  -2.779   7.812  12.123
  344   HG22  THR  48          HG22      THR  48  -3.846   6.563  11.483
  345   HG23  THR  48          HG23      THR  48  -2.517   7.176  10.499
  346    H    VAL  49           H        VAL  49  -2.891   4.786   8.811
  347    HA   VAL  49           HA       VAL  49  -0.623   6.152   7.516
  348    HB   VAL  49           HB       VAL  49  -0.679   4.602   5.597
  349   HG11  VAL  49          HG11      VAL  49   0.596   2.871   6.612
  350   HG12  VAL  49          HG12      VAL  49  -0.288   2.999   8.132
  351   HG13  VAL  49          HG13      VAL  49   0.824   4.275   7.650
  352   HG21  VAL  49          HG21      VAL  49  -2.979   3.782   5.808
  353   HG22  VAL  49          HG22      VAL  49  -2.586   3.015   7.346
  354   HG23  VAL  49          HG23      VAL  49  -1.858   2.423   5.853
  355    H    GLU  50           H        GLU  50  -1.200   6.858   5.256
  356    HA   GLU  50           HA       GLU  50  -4.067   7.573   5.060
  357    HB2  GLU  50           HB2      GLU  50  -1.668   9.229   4.217
  358    HB3  GLU  50           HB3      GLU  50  -3.356   9.667   3.948
  359    HG2  GLU  50           HG2      GLU  50  -3.746   9.661   6.388
  360    HG3  GLU  50           HG3      GLU  50  -2.058   9.229   6.655
  361    H    TYR  51           H        TYR  51  -5.029   7.050   3.152
  362    HA   TYR  51           HA       TYR  51  -3.395   6.469   0.791
  363    HB2  TYR  51           HB2      TYR  51  -4.348   4.210   0.521
  364    HB3  TYR  51           HB3      TYR  51  -3.396   4.339   1.994
  365    HD1  TYR  51           HD1      TYR  51  -6.799   4.055   0.605
  366    HD2  TYR  51           HD2      TYR  51  -4.461   4.301   4.200
  367    HE1  TYR  51           HE1      TYR  51  -8.770   3.352   1.935
  368    HE2  TYR  51           HE2      TYR  51  -6.431   3.596   5.529
  369    HH   TYR  51           HH       TYR  51  -9.594   3.496   4.215
  370    H    GLU  52           H        GLU  52  -4.726   5.822  -1.096
  371    HA   GLU  52           HA       GLU  52  -7.373   7.160  -1.055
  372    HB2  GLU  52           HB2      GLU  52  -5.338   7.002  -3.295
  373    HB3  GLU  52           HB3      GLU  52  -6.981   7.623  -3.481
  374    HG2  GLU  52           HG2      GLU  52  -6.521   9.328  -1.744
  375    HG3  GLU  52           HG3      GLU  52  -4.876   8.723  -1.592
  376    H    VAL  53           H        VAL  53  -9.070   6.013  -1.799
  377    HA   VAL  53           HA       VAL  53  -8.721   3.176  -2.250
  378    HB   VAL  53           HB       VAL  53 -10.564   4.059  -0.865
  379   HG11  VAL  53          HG11      VAL  53 -12.367   5.325  -1.750
  380   HG12  VAL  53          HG12      VAL  53 -11.852   5.049  -3.414
  381   HG13  VAL  53          HG13      VAL  53 -10.913   6.111  -2.364
  382   HG21  VAL  53          HG21      VAL  53 -11.303   2.549  -3.382
  383   HG22  VAL  53          HG22      VAL  53 -12.433   2.783  -2.047
  384   HG23  VAL  53          HG23      VAL  53 -10.936   1.886  -1.789
  385    H    GLY  54           H        GLY  54  -8.303   2.314  -4.126
  386    HA2  GLY  54           HA2      GLY  54  -9.184   3.640  -6.615
  387    HA3  GLY  54           HA3      GLY  54  -7.763   2.600  -6.482
  388    H    GLN  55           H        GLN  55  -9.021   1.572  -8.367
  389    HA   GLN  55           HA       GLN  55 -10.788  -0.527  -7.254
  390    HB2  GLN  55           HB2      GLN  55 -11.107   0.996  -9.850
  391    HB3  GLN  55           HB3      GLN  55 -11.982  -0.491  -9.475
  392    HG2  GLN  55           HG2      GLN  55 -13.024   0.534  -7.548
  393    HG3  GLN  55           HG3      GLN  55 -12.024   1.974  -7.712
  394   HE21  GLN  55          HE21      GLN  55 -15.035   1.710  -7.845
  395   HE22  GLN  55          HE22      GLN  55 -15.468   2.373  -9.346
  396    H    GLY  56           H        GLY  56 -10.690  -2.567  -8.303
  397    HA2  GLY  56           HA2      GLY  56  -8.823  -3.087 -10.431
  398    HA3  GLY  56           HA3      GLY  56  -8.232  -3.622  -8.861
  399    H    GLN  57           H        GLN  57  -8.471  -5.577 -10.572
  400    HA   GLN  57           HA       GLN  57 -10.992  -6.803 -10.912
  401    HB2  GLN  57           HB2      GLN  57  -8.186  -7.923 -10.881
  402    HB3  GLN  57           HB3      GLN  57  -9.608  -8.887 -11.280
  403    HG2  GLN  57           HG2      GLN  57 -10.140  -7.455 -13.150
  404    HG3  GLN  57           HG3      GLN  57  -8.889  -6.304 -12.688
  405   HE21  GLN  57          HE21      GLN  57  -9.160  -7.893 -15.242
  406   HE22  GLN  57          HE22      GLN  57  -7.707  -8.760 -15.381
  407    H    LYS  58           H        LYS  58  -8.559  -7.051  -8.360
  408    HA   LYS  58           HA       LYS  58 -10.091  -9.062  -6.907
  409    HB2  LYS  58           HB2      LYS  58  -7.501  -7.637  -6.261
  410    HB3  LYS  58           HB3      LYS  58  -8.226  -8.892  -5.258
  411    HG2  LYS  58           HG2      LYS  58  -8.158 -10.437  -7.231
  412    HG3  LYS  58           HG3      LYS  58  -7.296  -9.191  -8.131
  413    HD2  LYS  58           HD2      LYS  58  -6.306 -10.286  -5.485
  414    HD3  LYS  58           HD3      LYS  58  -5.825 -10.960  -7.039
  415    HE2  LYS  58           HE2      LYS  58  -4.974  -8.720  -7.719
  416    HE3  LYS  58           HE3      LYS  58  -5.393  -8.100  -6.122
  417    HZ1  LYS  58           HZ1      LYS  58  -3.181  -8.671  -5.900
  418    HZ2  LYS  58           HZ2      LYS  58  -3.326 -10.066  -6.859
  419    HZ3  LYS  58           HZ3      LYS  58  -3.965 -10.044  -5.286
  420    H    GLY  59           H        GLY  59 -11.011  -6.159  -7.353
  421    HA2  GLY  59           HA2      GLY  59 -12.604  -4.999  -6.046
  422    HA3  GLY  59           HA3      GLY  59 -11.904  -5.713  -4.596
  423    HA   PRO  60           HA       PRO  60 -10.448  -1.203  -5.294
  424    HB2  PRO  60           HB2      PRO  60 -11.251  -1.067  -2.426
  425    HB3  PRO  60           HB3      PRO  60 -11.459   0.136  -3.712
  426    HG2  PRO  60           HG2      PRO  60 -13.509  -1.275  -2.864
  427    HG3  PRO  60           HG3      PRO  60 -13.287  -0.937  -4.592
  428    HD2  PRO  60           HD2      PRO  60 -12.732  -3.487  -3.083
  429    HD3  PRO  60           HD3      PRO  60 -13.448  -3.272  -4.699
  430    H    CYS  61           H        CYS  61  -8.579  -0.267  -4.499
  431    HA   CYS  61           HA       CYS  61  -6.992  -1.813  -2.541
  432    HB2  CYS  61           HB2      CYS  61  -5.008  -1.625  -3.965
  433    HB3  CYS  61           HB3      CYS  61  -6.285  -2.492  -4.814
  434    HG   CYS  61           HG       CYS  61  -5.010  -0.070  -5.887
  435    H    ALA  62           H        ALA  62  -4.944  -0.483  -1.939
  436    HA   ALA  62           HA       ALA  62  -5.708   2.375  -1.750
  437    HB1  ALA  62           HB1      ALA  62  -5.831   1.827   0.459
  438    HB2  ALA  62           HB2      ALA  62  -4.082   2.036   0.386
  439    HB3  ALA  62           HB3      ALA  62  -4.788   0.423   0.278
  440    H    ASN  63           H        ASN  63  -4.242   3.825  -2.511
  441    HA   ASN  63           HA       ASN  63  -1.484   2.863  -3.001
  442    HB2  ASN  63           HB2      ASN  63  -1.472   4.285  -5.032
  443    HB3  ASN  63           HB3      ASN  63  -2.666   2.991  -5.130
  444   HD21  ASN  63          HD21      ASN  63  -4.455   3.851  -6.206
  445   HD22  ASN  63          HD22      ASN  63  -5.162   5.354  -5.855
  446    H    LYS  64           H        LYS  64   0.037   4.775  -3.353
  447    HA   LYS  64           HA       LYS  64   1.133   6.546  -2.388
  448    HB2  LYS  64           HB2      LYS  64  -1.689   7.643  -2.425
  449    HB3  LYS  64           HB3      LYS  64  -0.266   8.602  -2.013
  450    HG2  LYS  64           HG2      LYS  64   0.725   7.955  -4.238
  451    HG3  LYS  64           HG3      LYS  64  -0.804   7.180  -4.642
  452    HD2  LYS  64           HD2      LYS  64  -0.602  10.093  -3.834
  453    HD3  LYS  64           HD3      LYS  64  -0.522   9.559  -5.511
  454    HE2  LYS  64           HE2      LYS  64  -2.745   8.470  -5.242
  455    HE3  LYS  64           HE3      LYS  64  -2.827   9.088  -3.593
  456    HZ1  LYS  64           HZ1      LYS  64  -2.286  10.972  -5.771
  457    HZ2  LYS  64           HZ2      LYS  64  -3.103  11.221  -4.301
  458    HZ3  LYS  64           HZ3      LYS  64  -3.872  10.405  -5.577
  459    H    VAL  65           H        VAL  65   0.803   4.528  -0.683
  460    HA   VAL  65           HA       VAL  65  -0.489   5.354   1.758
  461    HB   VAL  65           HB       VAL  65   1.343   3.002   1.211
  462   HG11  VAL  65          HG11      VAL  65   1.179   3.631   3.619
  463   HG12  VAL  65          HG12      VAL  65   0.430   2.069   3.282
  464   HG13  VAL  65          HG13      VAL  65  -0.575   3.499   3.509
  465   HG21  VAL  65          HG21      VAL  65  -1.675   3.027   1.470
  466   HG22  VAL  65          HG22      VAL  65  -0.651   1.705   0.914
  467   HG23  VAL  65          HG23      VAL  65  -0.853   3.142  -0.086
  468    H    VAL  66           H        VAL  66   0.329   6.592   3.233
  469    HA   VAL  66           HA       VAL  66   3.269   6.785   3.551
  470    HB   VAL  66           HB       VAL  66   2.429   8.787   2.376
  471   HG11  VAL  66          HG11      VAL  66   0.928  10.356   3.572
  472   HG12  VAL  66          HG12      VAL  66   0.723   9.163   4.854
  473   HG13  VAL  66          HG13      VAL  66   0.138   8.819   3.226
  474   HG21  VAL  66          HG21      VAL  66   3.328  10.482   3.960
  475   HG22  VAL  66          HG22      VAL  66   4.344   9.044   3.879
  476   HG23  VAL  66          HG23      VAL  66   3.264   9.284   5.251
  477    H    ALA  67           H        ALA  67   4.019   6.603   5.576
  478    HA   ALA  67           HA       ALA  67   2.292   5.719   7.660
  479    HB1  ALA  67           HB1      ALA  67   5.222   6.448   7.619
  480    HB2  ALA  67           HB2      ALA  67   4.514   4.833   7.563
  481    HB3  ALA  67           HB3      ALA  67   4.401   5.795   9.037
  482    H    VAL  68           H        VAL  68   1.372   6.761   9.282
  483    HA   VAL  68           HA       VAL  68   0.423   8.560  10.371
  484    HB   VAL  68           HB       VAL  68   2.043   9.772  11.792
  485   HG11  VAL  68          HG11      VAL  68   2.794   7.849  13.015
  486   HG12  VAL  68          HG12      VAL  68   2.781   6.846  11.563
  487   HG13  VAL  68          HG13      VAL  68   1.261   7.408  12.261
  488   HG21  VAL  68          HG21      VAL  68   3.827   9.908   9.983
  489   HG22  VAL  68          HG22      VAL  68   4.187   8.215  10.323
  490   HG23  VAL  68          HG23      VAL  68   4.414   9.433  11.577
  Start of MODEL   12
    1    H1   MET   1           HT1      MET   1 -10.143  13.412   4.334
    2    H2   MET   1           HT2      MET   1 -10.495  11.749   4.367
    3    H3   MET   1           HT3      MET   1  -9.386  12.363   3.236
    4    HA   MET   1           HA       MET   1  -8.148  13.183   5.373
    5    HB2  MET   1           HB2      MET   1 -10.030  12.322   6.816
    6    HB3  MET   1           HB3      MET   1  -9.585  10.688   6.324
    7    HG2  MET   1           HG2      MET   1  -7.318  11.025   7.237
    8    HG3  MET   1           HG3      MET   1  -7.754  12.662   7.725
    9    HE1  MET   1           HE1      MET   1 -10.806  12.346   8.978
   10    HE2  MET   1           HE2      MET   1  -9.372  13.348   9.184
   11    HE3  MET   1           HE3      MET   1 -10.035  12.478  10.565
   12    H    SER   2           H        SER   2  -9.113  10.146   3.813
   13    HA   SER   2           HA       SER   2  -7.908   8.429   2.884
   14    HB2  SER   2           HB2      SER   2  -5.872  10.644   2.535
   15    HB3  SER   2           HB3      SER   2  -5.831   9.087   1.715
   16    HG   SER   2           HG       SER   2  -6.845  10.804   0.503
   17    H    LYS   3           H        LYS   3  -7.856   8.502   5.646
   18    HA   LYS   3           HA       LYS   3  -5.299   7.175   6.191
   19    HB2  LYS   3           HB2      LYS   3  -5.088   9.558   6.946
   20    HB3  LYS   3           HB3      LYS   3  -6.436   9.283   8.047
   21    HG2  LYS   3           HG2      LYS   3  -5.127   7.414   9.091
   22    HG3  LYS   3           HG3      LYS   3  -3.763   7.843   8.058
   23    HD2  LYS   3           HD2      LYS   3  -5.083   9.835   9.916
   24    HD3  LYS   3           HD3      LYS   3  -3.724   8.830  10.414
   25    HE2  LYS   3           HE2      LYS   3  -2.385   9.746   8.529
   26    HE3  LYS   3           HE3      LYS   3  -3.738  10.793   8.100
   27    HZ1  LYS   3           HZ1      LYS   3  -1.905  11.734   9.591
   28    HZ2  LYS   3           HZ2      LYS   3  -2.612  10.806  10.828
   29    HZ3  LYS   3           HZ3      LYS   3  -3.516  12.012  10.043
   30    H    GLY   4           H        GLY   4  -5.697   5.267   7.083
   31    HA2  GLY   4           HA2      GLY   4  -8.075   4.929   8.810
   32    HA3  GLY   4           HA3      GLY   4  -7.677   3.753   7.557
   33    H    ILE   5           H        ILE   5  -7.748   2.388   9.643
   34    HA   ILE   5           HA       ILE   5  -5.041   2.378  10.857
   35    HB   ILE   5           HB       ILE   5  -6.135   1.165  12.792
   36   HG12  ILE   5          HG12      ILE   5  -8.726   2.309  11.709
   37   HG13  ILE   5          HG13      ILE   5  -8.251   0.645  11.385
   38   HG21  ILE   5          HG21      ILE   5  -7.160   3.303  13.700
   39   HG22  ILE   5          HG22      ILE   5  -6.907   4.011  12.104
   40   HG23  ILE   5          HG23      ILE   5  -5.526   3.470  13.058
   41   HD11  ILE   5          HD11      ILE   5  -8.489   1.851  14.158
   42   HD12  ILE   5          HD12      ILE   5  -8.155   0.162  13.777
   43   HD13  ILE   5          HD13      ILE   5  -9.730   0.858  13.391
   44    H    VAL   6           H        VAL   6  -3.830   0.666  10.553
   45    HA   VAL   6           HA       VAL   6  -4.655  -1.380   8.775
   46    HB   VAL   6           HB       VAL   6  -2.188  -1.238  10.527
   47   HG11  VAL   6          HG11      VAL   6  -1.296  -2.738   8.601
   48   HG12  VAL   6          HG12      VAL   6  -2.994  -3.042   8.239
   49   HG13  VAL   6          HG13      VAL   6  -2.335  -3.491   9.811
   50   HG21  VAL   6          HG21      VAL   6  -1.093  -0.225   8.653
   51   HG22  VAL   6          HG22      VAL   6  -2.610   0.652   8.848
   52   HG23  VAL   6          HG23      VAL   6  -2.454  -0.566   7.583
   53    H    LYS   7           H        LYS   7  -5.724  -3.166   9.163
   54    HA   LYS   7           HA       LYS   7  -6.566  -3.972  11.762
   55    HB2  LYS   7           HB2      LYS   7  -7.832  -4.443   9.648
   56    HB3  LYS   7           HB3      LYS   7  -6.580  -5.605   9.205
   57    HG2  LYS   7           HG2      LYS   7  -7.037  -6.872  11.294
   58    HG3  LYS   7           HG3      LYS   7  -8.322  -5.733  11.689
   59    HD2  LYS   7           HD2      LYS   7  -8.276  -7.305   9.102
   60    HD3  LYS   7           HD3      LYS   7  -9.070  -7.898  10.558
   61    HE2  LYS   7           HE2      LYS   7 -10.457  -5.825  10.610
   62    HE3  LYS   7           HE3      LYS   7  -9.704  -5.313   9.100
   63    HZ1  LYS   7           HZ1      LYS   7 -11.373  -7.723   9.548
   64    HZ2  LYS   7           HZ2      LYS   7 -10.498  -7.436   8.120
   65    HZ3  LYS   7           HZ3      LYS   7 -11.748  -6.381   8.580
   66    H    TRP   8           H        TRP   8  -4.162  -5.190   9.459
   67    HA   TRP   8           HA       TRP   8  -2.453  -6.166  11.559
   68    HB2  TRP   8           HB2      TRP   8  -4.298  -7.951  11.180
   69    HB3  TRP   8           HB3      TRP   8  -3.484  -8.261   9.650
   70    HD1  TRP   8           HD1      TRP   8  -1.072  -9.355   9.730
   71    HE1  TRP   8           HE1      TRP   8   0.199 -10.610  11.589
   72    HE3  TRP   8           HE3      TRP   8  -3.926  -8.076  13.769
   73    HZ2  TRP   8           HZ2      TRP   8   0.026 -11.021  14.414
   74    HZ3  TRP   8           HZ3      TRP   8  -3.353  -8.916  16.028
   75    HH2  TRP   8           HH2      TRP   8  -1.382 -10.385  16.356
   76    H    PHE   9           H        PHE   9  -0.434  -5.765  10.842
   77    HA   PHE   9           HA       PHE   9   0.015  -5.717   7.904
   78    HB2  PHE   9           HB2      PHE   9   0.470  -3.603   9.243
   79    HB3  PHE   9           HB3      PHE   9   1.797  -4.478  10.008
   80    HD1  PHE   9           HD1      PHE   9   0.576  -2.944   6.908
   81    HD2  PHE   9           HD2      PHE   9   3.748  -5.222   8.698
   82    HE1  PHE   9           HE1      PHE   9   2.016  -2.483   4.943
   83    HE2  PHE   9           HE2      PHE   9   5.187  -4.758   6.734
   84    HZ   PHE   9           HZ       PHE   9   4.324  -3.389   4.856
   85    H    ASN  10           H        ASN  10   1.188  -7.332   7.041
   86    HA   ASN  10           HA       ASN  10   3.106  -8.761   8.791
   87    HB2  ASN  10           HB2      ASN  10   1.179  -9.892   6.760
   88    HB3  ASN  10           HB3      ASN  10   2.555 -10.801   7.384
   89   HD21  ASN  10          HD21      ASN  10  -0.237 -11.537   7.821
   90   HD22  ASN  10          HD22      ASN  10  -0.526 -11.444   9.492
   91    H    SER  11           H        SER  11   4.911  -7.631   8.058
   92    HA   SER  11           HA       SER  11   5.522  -7.092   5.366
   93    HB2  SER  11           HB2      SER  11   7.792  -6.672   6.182
   94    HB3  SER  11           HB3      SER  11   6.604  -5.962   7.269
   95    HG   SER  11           HG       SER  11   7.343  -7.213   8.776
   96    H    ASP  12           H        ASP  12   6.104  -9.929   7.389
   97    HA   ASP  12           HA       ASP  12   8.032 -11.228   5.796
   98    HB2  ASP  12           HB2      ASP  12   5.854 -12.328   7.588
   99    HB3  ASP  12           HB3      ASP  12   7.064 -13.346   6.810
  100    H    LYS  13           H        LYS  13   4.494 -11.256   5.701
  101    HA   LYS  13           HA       LYS  13   4.320 -12.999   3.416
  102    HB2  LYS  13           HB2      LYS  13   2.310 -11.178   4.763
  103    HB3  LYS  13           HB3      LYS  13   1.922 -12.245   3.415
  104    HG2  LYS  13           HG2      LYS  13   2.670 -14.194   4.728
  105    HG3  LYS  13           HG3      LYS  13   3.055 -13.130   6.083
  106    HD2  LYS  13           HD2      LYS  13   0.686 -12.419   6.190
  107    HD3  LYS  13           HD3      LYS  13   0.306 -13.509   4.854
  108    HE2  LYS  13           HE2      LYS  13   1.482 -14.379   7.513
  109    HE3  LYS  13           HE3      LYS  13  -0.220 -14.515   7.073
  110    HZ1  LYS  13           HZ1      LYS  13   0.705 -15.758   5.029
  111    HZ2  LYS  13           HZ2      LYS  13   0.609 -16.574   6.516
  112    HZ3  LYS  13           HZ3      LYS  13   2.099 -15.961   5.976
  113    H    GLY  14           H        GLY  14   4.661  -9.587   3.987
  114    HA2  GLY  14           HA2      GLY  14   5.458  -8.008   2.427
  115    HA3  GLY  14           HA3      GLY  14   4.971  -9.081   1.121
  116    H    PHE  15           H        PHE  15   2.473  -8.828   3.398
  117    HA   PHE  15           HA       PHE  15   1.321  -6.373   2.395
  118    HB2  PHE  15           HB2      PHE  15  -0.686  -7.417   1.414
  119    HB3  PHE  15           HB3      PHE  15   0.779  -7.842   0.531
  120    HD1  PHE  15           HD1      PHE  15  -1.828  -9.069   2.842
  121    HD2  PHE  15           HD2      PHE  15   1.645 -10.110   0.540
  122    HE1  PHE  15           HE1      PHE  15  -2.339 -11.474   3.159
  123    HE2  PHE  15           HE2      PHE  15   1.136 -12.516   0.861
  124    HZ   PHE  15           HZ       PHE  15  -0.857 -13.198   2.170
  125    H    GLY  16           H        GLY  16  -1.018  -6.175   3.180
  126    HA2  GLY  16           HA2      GLY  16  -1.704  -7.627   5.584
  127    HA3  GLY  16           HA3      GLY  16  -1.177  -5.972   5.877
  128    H    PHE  17           H        PHE  17  -3.647  -6.463   6.656
  129    HA   PHE  17           HA       PHE  17  -5.415  -5.413   4.521
  130    HB2  PHE  17           HB2      PHE  17  -6.104  -7.066   6.967
  131    HB3  PHE  17           HB3      PHE  17  -7.286  -6.375   5.858
  132    HD1  PHE  17           HD1      PHE  17  -4.716  -8.956   6.322
  133    HD2  PHE  17           HD2      PHE  17  -7.489  -7.203   3.550
  134    HE1  PHE  17           HE1      PHE  17  -4.458 -10.916   4.823
  135    HE2  PHE  17           HE2      PHE  17  -7.232  -9.162   2.052
  136    HZ   PHE  17           HZ       PHE  17  -5.716 -11.018   2.687
  137    H    ILE  18           H        ILE  18  -6.413  -3.482   4.885
  138    HA   ILE  18           HA       ILE  18  -5.963  -2.251   7.522
  139    HB   ILE  18           HB       ILE  18  -4.700  -1.170   5.722
  140   HG12  ILE  18          HG12      ILE  18  -6.972   0.671   6.492
  141   HG13  ILE  18          HG13      ILE  18  -5.786   0.119   7.676
  142   HG21  ILE  18          HG21      ILE  18  -6.102   0.146   4.016
  143   HG22  ILE  18          HG22      ILE  18  -7.446  -0.895   4.486
  144   HG23  ILE  18          HG23      ILE  18  -5.995  -1.597   3.772
  145   HD11  ILE  18          HD11      ILE  18  -5.200   1.638   5.118
  146   HD12  ILE  18          HD12      ILE  18  -3.973   0.995   6.204
  147   HD13  ILE  18          HD13      ILE  18  -5.064   2.264   6.761
  148    H    THR  19           H        THR  19  -7.540  -1.162   8.547
  149    HA   THR  19           HA       THR  19 -10.268  -1.752   7.673
  150    HB   THR  19           HB       THR  19  -9.242  -0.826  10.359
  151    HG1  THR  19           HG1      THR  19  -9.989  -3.391   9.408
  152   HG21  THR  19          HG21      THR  19 -11.591  -0.281  10.090
  153   HG22  THR  19          HG22      THR  19 -11.474  -1.703  11.127
  154   HG23  THR  19          HG23      THR  19 -11.931  -1.881   9.431
  155    HA   PRO  20           HA       PRO  20 -10.303   2.693   6.411
  156    HB2  PRO  20           HB2      PRO  20 -13.172   1.933   5.997
  157    HB3  PRO  20           HB3      PRO  20 -12.088   2.838   4.923
  158    HG2  PRO  20           HG2      PRO  20 -12.671   0.340   4.380
  159    HG3  PRO  20           HG3      PRO  20 -11.005   0.924   4.194
  160    HD2  PRO  20           HD2      PRO  20 -12.172  -0.765   6.385
  161    HD3  PRO  20           HD3      PRO  20 -10.576  -0.873   5.604
  162    H    GLU  21           H        GLU  21 -10.646   4.391   7.770
  163    HA   GLU  21           HA       GLU  21 -11.803   4.077  10.330
  164    HB2  GLU  21           HB2      GLU  21 -11.509   6.509  10.554
  165    HB3  GLU  21           HB3      GLU  21 -10.073   5.758   9.860
  166    HG2  GLU  21           HG2      GLU  21 -10.811   6.420   7.598
  167    HG3  GLU  21           HG3      GLU  21 -12.258   7.155   8.280
  168    H    ASP  22           H        ASP  22 -13.128   5.133   7.268
  169    HA   ASP  22           HA       ASP  22 -15.511   6.338   8.265
  170    HB2  ASP  22           HB2      ASP  22 -14.761   5.205   5.570
  171    HB3  ASP  22           HB3      ASP  22 -16.314   5.969   5.888
  172    H    GLY  23           H        GLY  23 -14.543   3.048   7.869
  173    HA2  GLY  23           HA2      GLY  23 -15.797   1.285   8.935
  174    HA3  GLY  23           HA3      GLY  23 -17.276   2.152   8.539
  175    H    SER  24           H        SER  24 -15.101   2.243   5.946
  176    HA   SER  24           HA       SER  24 -16.752   0.602   4.289
  177    HB2  SER  24           HB2      SER  24 -14.043   1.853   3.790
  178    HB3  SER  24           HB3      SER  24 -15.023   1.063   2.564
  179    HG   SER  24           HG       SER  24 -16.459   2.666   2.656
  180    H    LYS  25           H        LYS  25 -15.739  -1.124   2.902
  181    HA   LYS  25           HA       LYS  25 -14.880  -3.279   4.520
  182    HB2  LYS  25           HB2      LYS  25 -14.898  -2.923   1.515
  183    HB3  LYS  25           HB3      LYS  25 -14.527  -4.446   2.326
  184    HG2  LYS  25           HG2      LYS  25 -16.733  -4.393   3.436
  185    HG3  LYS  25           HG3      LYS  25 -17.108  -2.879   2.612
  186    HD2  LYS  25           HD2      LYS  25 -16.904  -3.992   0.431
  187    HD3  LYS  25           HD3      LYS  25 -16.482  -5.506   1.231
  188    HE2  LYS  25           HE2      LYS  25 -18.854  -5.534   0.642
  189    HE3  LYS  25           HE3      LYS  25 -18.683  -5.469   2.397
  190    HZ1  LYS  25           HZ1      LYS  25 -18.855  -2.941   0.932
  191    HZ2  LYS  25           HZ2      LYS  25 -19.413  -3.333   2.489
  192    HZ3  LYS  25           HZ3      LYS  25 -20.279  -3.846   1.120
  193    H    ASP  26           H        ASP  26 -12.886  -4.372   4.602
  194    HA   ASP  26           HA       ASP  26 -10.613  -2.809   4.838
  195    HB2  ASP  26           HB2      ASP  26  -9.367  -4.905   4.988
  196    HB3  ASP  26           HB3      ASP  26 -10.872  -5.016   5.889
  197    H    LEU  27           H        LEU  27  -8.691  -2.662   3.635
  198    HA   LEU  27           HA       LEU  27  -8.992  -3.152   0.728
  199    HB2  LEU  27           HB2      LEU  27  -7.603  -0.832   2.103
  200    HB3  LEU  27           HB3      LEU  27  -7.667  -1.102   0.364
  201    HG   LEU  27           HG       LEU  27 -10.140  -0.767   2.090
  202   HD11  LEU  27          HD11      LEU  27 -10.204   1.525   0.992
  203   HD12  LEU  27          HD12      LEU  27  -8.539   1.240   0.483
  204   HD13  LEU  27          HD13      LEU  27  -8.936   1.312   2.200
  205   HD21  LEU  27          HD21      LEU  27 -10.575  -1.920  -0.013
  206   HD22  LEU  27          HD22      LEU  27  -9.640  -0.720  -0.907
  207   HD23  LEU  27          HD23      LEU  27 -11.169  -0.265  -0.153
  208    H    PHE  28           H        PHE  28  -7.130  -3.772  -0.410
  209    HA   PHE  28           HA       PHE  28  -5.179  -5.239   1.136
  210    HB2  PHE  28           HB2      PHE  28  -5.511  -4.751  -1.832
  211    HB3  PHE  28           HB3      PHE  28  -4.216  -5.736  -1.147
  212    HD1  PHE  28           HD1      PHE  28  -7.838  -5.489  -1.754
  213    HD2  PHE  28           HD2      PHE  28  -4.695  -7.873  -0.053
  214    HE1  PHE  28           HE1      PHE  28  -9.381  -7.425  -1.615
  215    HE2  PHE  28           HE2      PHE  28  -6.240  -9.809   0.086
  216    HZ   PHE  28           HZ       PHE  28  -8.582  -9.584  -0.695
  217    H    VAL  29           H        VAL  29  -3.190  -4.595   1.720
  218    HA   VAL  29           HA       VAL  29  -2.061  -2.149   0.499
  219    HB   VAL  29           HB       VAL  29  -2.118  -2.872   3.440
  220   HG11  VAL  29          HG11      VAL  29  -0.777  -0.614   1.945
  221   HG12  VAL  29          HG12      VAL  29  -0.019  -1.790   3.016
  222   HG13  VAL  29          HG13      VAL  29  -1.085  -0.553   3.680
  223   HG21  VAL  29          HG21      VAL  29  -3.266  -0.370   2.229
  224   HG22  VAL  29          HG22      VAL  29  -3.659  -1.139   3.762
  225   HG23  VAL  29          HG23      VAL  29  -4.213  -1.856   2.250
  226    H    HIS  30           H        HIS  30   0.043  -2.326  -0.100
  227    HA   HIS  30           HA       HIS  30   1.489  -4.788   0.676
  228    HB2  HIS  30           HB2      HIS  30   1.768  -3.054  -1.786
  229    HB3  HIS  30           HB3      HIS  30   2.800  -4.435  -1.410
  230    HD2  HIS  30           HD2      HIS  30  -0.526  -3.752  -3.166
  231    HE1  HIS  30           HE1      HIS  30  -0.517  -7.879  -2.278
  232    HE2  HIS  30           HE2      HIS  30  -1.696  -6.050  -3.584
  233    H    HIS  31           H        HIS  31   3.610  -4.686   1.308
  234    HA   HIS  31           HA       HIS  31   4.420  -2.443   2.833
  235    HB2  HIS  31           HB2      HIS  31   5.119  -4.805   3.257
  236    HB3  HIS  31           HB3      HIS  31   6.154  -4.718   1.831
  237    HD2  HIS  31           HD2      HIS  31   6.160  -3.537   5.548
  238    HE1  HIS  31           HE1      HIS  31   9.688  -2.071   3.751
  239    HE2  HIS  31           HE2      HIS  31   8.460  -2.369   5.954
  240    H    SER  32           H        SER  32   5.581  -3.656  -0.301
  241    HA   SER  32           HA       SER  32   7.623  -1.769  -0.703
  242    HB2  SER  32           HB2      SER  32   6.013  -3.379  -2.679
  243    HB3  SER  32           HB3      SER  32   7.430  -2.428  -3.111
  244    HG   SER  32           HG       SER  32   7.359  -4.455  -1.121
  245    H    GLU  33           H        GLU  33   4.189  -1.411  -1.136
  246    HA   GLU  33           HA       GLU  33   4.270   0.688  -3.061
  247    HB2  GLU  33           HB2      GLU  33   2.138  -0.230  -1.140
  248    HB3  GLU  33           HB3      GLU  33   1.890   1.079  -2.293
  249    HG2  GLU  33           HG2      GLU  33   2.753  -1.733  -3.033
  250    HG3  GLU  33           HG3      GLU  33   1.107  -1.122  -3.170
  251    H    ILE  34           H        ILE  34   5.051   0.748   0.270
  252    HA   ILE  34           HA       ILE  34   4.067   3.217   1.117
  253    HB   ILE  34           HB       ILE  34   5.920   3.286   2.718
  254   HG12  ILE  34          HG12      ILE  34   7.065   0.878   1.259
  255   HG13  ILE  34          HG13      ILE  34   7.667   2.512   1.028
  256   HG21  ILE  34          HG21      ILE  34   4.167   1.841   3.385
  257   HG22  ILE  34          HG22      ILE  34   5.626   0.876   3.600
  258   HG23  ILE  34          HG23      ILE  34   4.600   0.618   2.191
  259   HD11  ILE  34          HD11      ILE  34   8.979   1.196   2.718
  260   HD12  ILE  34          HD12      ILE  34   7.530   1.129   3.722
  261   HD13  ILE  34          HD13      ILE  34   8.285   2.682   3.368
  262    H    GLN  35           H        GLN  35   5.356   5.231   1.488
  263    HA   GLN  35           HA       GLN  35   6.349   6.198  -1.052
  264    HB2  GLN  35           HB2      GLN  35   6.027   7.547   1.642
  265    HB3  GLN  35           HB3      GLN  35   6.535   8.371   0.168
  266    HG2  GLN  35           HG2      GLN  35   3.929   6.845   0.465
  267    HG3  GLN  35           HG3      GLN  35   4.083   8.595   0.619
  268   HE21  GLN  35          HE21      GLN  35   5.285   9.624  -1.413
  269   HE22  GLN  35          HE22      GLN  35   4.795   9.022  -2.923
  270    H    SER  36           H        SER  36   8.395   6.984  -1.497
  271    HA   SER  36           HA       SER  36  10.587   5.610  -0.346
  272    HB2  SER  36           HB2      SER  36  10.655   6.384  -2.653
  273    HB3  SER  36           HB3      SER  36  10.512   8.058  -2.126
  274    HG   SER  36           HG       SER  36  12.674   6.300  -1.995
  275    H    GLY  37           H        GLY  37  12.111   6.213   1.121
  276    HA2  GLY  37           HA2      GLY  37  12.765   8.724   2.068
  277    HA3  GLY  37           HA3      GLY  37  11.422   8.185   3.074
  278    H    GLY  38           H        GLY  38  14.111   6.365   1.623
  279    HA2  GLY  38           HA2      GLY  38  15.989   5.430   2.690
  280    HA3  GLY  38           HA3      GLY  38  15.306   5.879   4.247
  281    H    GLU  39           H        GLU  39  12.730   4.534   2.832
  282    HA   GLU  39           HA       GLU  39  11.630   2.539   3.047
  283    HB2  GLU  39           HB2      GLU  39  14.399   1.422   2.535
  284    HB3  GLU  39           HB3      GLU  39  12.899   0.500   2.443
  285    HG2  GLU  39           HG2      GLU  39  12.082   2.028   0.672
  286    HG3  GLU  39           HG3      GLU  39  13.602   2.917   0.748
  287    H    TYR  40           H        TYR  40  12.619   3.812   5.461
  288    HA   TYR  40           HA       TYR  40  13.276   1.525   7.203
  289    HB2  TYR  40           HB2      TYR  40  13.258   4.494   7.769
  290    HB3  TYR  40           HB3      TYR  40  13.669   3.246   8.942
  291    HD1  TYR  40           HD1      TYR  40  14.803   5.136   6.029
  292    HD2  TYR  40           HD2      TYR  40  15.688   1.824   8.616
  293    HE1  TYR  40           HE1      TYR  40  17.136   5.100   5.185
  294    HE2  TYR  40           HE2      TYR  40  18.018   1.787   7.772
  295    HH   TYR  40           HH       TYR  40  18.994   3.403   4.997
  296    H    ALA  41           H        ALA  41  10.535   3.136   6.116
  297    HA   ALA  41           HA       ALA  41   9.008   3.470   8.454
  298    HB1  ALA  41           HB1      ALA  41   8.261   2.941   5.580
  299    HB2  ALA  41           HB2      ALA  41   8.177   4.463   6.469
  300    HB3  ALA  41           HB3      ALA  41   7.046   3.161   6.841
  301    H    THR  42           H        THR  42   7.971   2.106   9.735
  302    HA   THR  42           HA       THR  42   7.824  -0.751   8.951
  303    HB   THR  42           HB       THR  42   7.990  -1.284  11.358
  304    HG1  THR  42           HG1      THR  42   8.380   0.337  12.810
  305   HG21  THR  42          HG21      THR  42  10.026  -1.053   9.844
  306   HG22  THR  42          HG22      THR  42  10.343  -0.901  11.572
  307   HG23  THR  42          HG23      THR  42  10.267   0.541  10.560
  308    H    LEU  43           H        LEU  43   5.982  -1.928   9.648
  309    HA   LEU  43           HA       LEU  43   3.709  -0.379  10.676
  310    HB2  LEU  43           HB2      LEU  43   3.635  -2.050   8.157
  311    HB3  LEU  43           HB3      LEU  43   2.228  -1.339   8.932
  312    HG   LEU  43           HG       LEU  43   4.596   0.271   7.922
  313   HD11  LEU  43          HD11      LEU  43   3.593  -0.747   5.995
  314   HD12  LEU  43          HD12      LEU  43   2.952   0.894   6.073
  315   HD13  LEU  43          HD13      LEU  43   1.965  -0.464   6.611
  316   HD21  LEU  43          HD21      LEU  43   2.715   2.079   7.976
  317   HD22  LEU  43          HD22      LEU  43   3.426   1.587   9.508
  318   HD23  LEU  43          HD23      LEU  43   1.857   0.945   9.023
  319    H    ALA  44           H        ALA  44   2.103  -1.676  11.692
  320    HA   ALA  44           HA       ALA  44   2.622  -4.550  11.973
  321    HB1  ALA  44           HB1      ALA  44   3.894  -3.195  13.758
  322    HB2  ALA  44           HB2      ALA  44   2.864  -4.508  14.329
  323    HB3  ALA  44           HB3      ALA  44   2.306  -2.838  14.439
  324    H    ASP  45           H        ASP  45   0.774  -4.881  14.203
  325    HA   ASP  45           HA       ASP  45  -1.711  -4.631  12.730
  326    HB2  ASP  45           HB2      ASP  45  -2.638  -5.898  14.712
  327    HB3  ASP  45           HB3      ASP  45  -1.366  -6.733  13.823
  328    H    GLY  46           H        GLY  46  -2.850  -2.828  12.844
  329    HA2  GLY  46           HA2      GLY  46  -4.296  -1.345  14.023
  330    HA3  GLY  46           HA3      GLY  46  -3.296  -1.543  15.454
  331    H    GLN  47           H        GLN  47  -1.231  -1.133  12.878
  332    HA   GLN  47           HA       GLN  47  -0.354   1.433  13.694
  333    HB2  GLN  47           HB2      GLN  47   1.056  -0.353  12.667
  334    HB3  GLN  47           HB3      GLN  47   0.255  -0.052  11.129
  335    HG2  GLN  47           HG2      GLN  47   2.395   1.140  11.245
  336    HG3  GLN  47           HG3      GLN  47   1.060   2.275  11.158
  337   HE21  GLN  47          HE21      GLN  47   1.571   4.031  12.482
  338   HE22  GLN  47          HE22      GLN  47   2.255   3.910  14.032
  339    H    THR  48           H        THR  48  -0.862   3.423  13.012
  340    HA   THR  48           HA       THR  48  -3.086   3.781  11.180
  341    HB   THR  48           HB       THR  48  -1.402   5.844  12.637
  342    HG1  THR  48           HG1      THR  48  -2.565   4.301  13.951
  343   HG21  THR  48          HG21      THR  48  -2.800   6.580  10.619
  344   HG22  THR  48          HG22      THR  48  -3.143   7.400  12.142
  345   HG23  THR  48          HG23      THR  48  -4.216   6.125  11.566
  346    H    VAL  49           H        VAL  49  -2.940   4.287   9.088
  347    HA   VAL  49           HA       VAL  49  -0.450   5.448   8.039
  348    HB   VAL  49           HB       VAL  49  -0.415   3.851   6.150
  349   HG11  VAL  49          HG11      VAL  49   0.619   2.063   7.359
  350   HG12  VAL  49          HG12      VAL  49  -0.367   2.370   8.788
  351   HG13  VAL  49          HG13      VAL  49   0.885   3.519   8.317
  352   HG21  VAL  49          HG21      VAL  49  -1.734   1.722   6.432
  353   HG22  VAL  49          HG22      VAL  49  -2.733   3.137   6.098
  354   HG23  VAL  49          HG23      VAL  49  -2.620   2.505   7.741
  355    H    GLU  50           H        GLU  50  -0.673   6.116   5.736
  356    HA   GLU  50           HA       GLU  50  -3.392   7.165   5.205
  357    HB2  GLU  50           HB2      GLU  50  -0.703   8.319   4.398
  358    HB3  GLU  50           HB3      GLU  50  -2.275   8.990   3.959
  359    HG2  GLU  50           HG2      GLU  50  -2.808   9.289   6.359
  360    HG3  GLU  50           HG3      GLU  50  -1.221   8.651   6.783
  361    H    TYR  51           H        TYR  51  -4.277   6.748   3.202
  362    HA   TYR  51           HA       TYR  51  -2.615   5.647   1.078
  363    HB2  TYR  51           HB2      TYR  51  -3.897   3.562   0.894
  364    HB3  TYR  51           HB3      TYR  51  -3.088   3.672   2.453
  365    HD1  TYR  51           HD1      TYR  51  -6.325   3.716   0.713
  366    HD2  TYR  51           HD2      TYR  51  -4.369   4.116   4.517
  367    HE1  TYR  51           HE1      TYR  51  -8.508   3.476   1.861
  368    HE2  TYR  51           HE2      TYR  51  -6.554   3.873   5.665
  369    HH   TYR  51           HH       TYR  51  -9.082   4.354   4.923
  370    H    GLU  52           H        GLU  52  -3.804   5.192  -0.894
  371    HA   GLU  52           HA       GLU  52  -6.175   6.936  -1.210
  372    HB2  GLU  52           HB2      GLU  52  -3.938   6.243  -3.130
  373    HB3  GLU  52           HB3      GLU  52  -5.434   7.030  -3.637
  374    HG2  GLU  52           HG2      GLU  52  -5.013   8.917  -2.177
  375    HG3  GLU  52           HG3      GLU  52  -3.628   8.105  -1.455
  376    H    VAL  53           H        VAL  53  -8.015   5.938  -1.791
  377    HA   VAL  53           HA       VAL  53  -7.971   3.068  -2.317
  378    HB   VAL  53           HB       VAL  53 -10.314   4.988  -2.069
  379   HG11  VAL  53          HG11      VAL  53 -10.261   1.957  -1.891
  380   HG12  VAL  53          HG12      VAL  53 -10.785   2.857  -3.315
  381   HG13  VAL  53          HG13      VAL  53 -11.686   2.996  -1.805
  382   HG21  VAL  53          HG21      VAL  53  -8.861   3.236  -0.076
  383   HG22  VAL  53          HG22      VAL  53 -10.518   3.777   0.199
  384   HG23  VAL  53          HG23      VAL  53  -9.216   4.957   0.044
  385    H    GLY  54           H        GLY  54  -7.715   2.337  -4.317
  386    HA2  GLY  54           HA2      GLY  54  -8.979   3.811  -6.559
  387    HA3  GLY  54           HA3      GLY  54  -7.362   3.127  -6.693
  388    H    GLN  55           H        GLN  55 -10.575   2.601  -7.339
  389    HA   GLN  55           HA       GLN  55 -11.037  -0.095  -6.845
  390    HB2  GLN  55           HB2      GLN  55 -12.704   1.578  -7.706
  391    HB3  GLN  55           HB3      GLN  55 -11.950   1.428  -9.296
  392    HG2  GLN  55           HG2      GLN  55 -12.454  -0.971  -9.336
  393    HG3  GLN  55           HG3      GLN  55 -13.146  -0.873  -7.718
  394   HE21  GLN  55          HE21      GLN  55 -14.380  -1.482 -10.502
  395   HE22  GLN  55          HE22      GLN  55 -15.723  -0.446 -10.572
  396    H    GLY  56           H        GLY  56 -10.343  -1.944  -7.701
  397    HA2  GLY  56           HA2      GLY  56  -8.578  -1.847 -10.070
  398    HA3  GLY  56           HA3      GLY  56  -8.341  -2.950  -8.717
  399    H    GLN  57           H        GLN  57  -8.387  -4.297 -10.874
  400    HA   GLN  57           HA       GLN  57 -10.864  -4.914 -12.087
  401    HB2  GLN  57           HB2      GLN  57  -8.277  -6.458 -11.843
  402    HB3  GLN  57           HB3      GLN  57  -9.643  -6.994 -12.826
  403    HG2  GLN  57           HG2      GLN  57  -9.550  -5.000 -14.178
  404    HG3  GLN  57           HG3      GLN  57  -8.357  -4.268 -13.101
  405   HE21  GLN  57          HE21      GLN  57  -8.122  -4.937 -16.043
  406   HE22  GLN  57          HE22      GLN  57  -6.764  -5.947 -16.160
  407    H    LYS  58           H        LYS  58  -9.139  -6.345  -9.334
  408    HA   LYS  58           HA       LYS  58 -11.317  -8.265  -8.906
  409    HB2  LYS  58           HB2      LYS  58  -8.646  -7.898  -7.535
  410    HB3  LYS  58           HB3      LYS  58  -9.829  -9.130  -7.094
  411    HG2  LYS  58           HG2      LYS  58  -9.733 -10.043  -9.388
  412    HG3  LYS  58           HG3      LYS  58  -8.541  -8.817  -9.823
  413    HD2  LYS  58           HD2      LYS  58  -6.994  -9.696  -8.126
  414    HD3  LYS  58           HD3      LYS  58  -8.187 -10.907  -7.654
  415    HE2  LYS  58           HE2      LYS  58  -6.561 -11.917  -9.176
  416    HE3  LYS  58           HE3      LYS  58  -8.132 -11.822  -9.970
  417    HZ1  LYS  58           HZ1      LYS  58  -6.018  -9.767 -10.280
  418    HZ2  LYS  58           HZ2      LYS  58  -7.450  -9.921 -11.180
  419    HZ3  LYS  58           HZ3      LYS  58  -6.212 -11.072 -11.346
  420    H    GLY  59           H        GLY  59 -10.171  -5.227  -7.696
  421    HA2  GLY  59           HA2      GLY  59 -12.377  -4.437  -6.313
  422    HA3  GLY  59           HA3      GLY  59 -11.479  -5.378  -5.125
  423    HA   PRO  60           HA       PRO  60  -9.764  -0.951  -5.431
  424    HB2  PRO  60           HB2      PRO  60 -10.404  -0.037  -2.953
  425    HB3  PRO  60           HB3      PRO  60 -11.505   0.097  -4.338
  426    HG2  PRO  60           HG2      PRO  60 -11.485  -1.908  -2.131
  427    HG3  PRO  60           HG3      PRO  60 -12.849  -1.039  -2.852
  428    HD2  PRO  60           HD2      PRO  60 -12.242  -3.608  -3.522
  429    HD3  PRO  60           HD3      PRO  60 -12.969  -2.469  -4.678
  430    H    CYS  61           H        CYS  61  -7.833  -0.266  -4.567
  431    HA   CYS  61           HA       CYS  61  -6.569  -1.953  -2.493
  432    HB2  CYS  61           HB2      CYS  61  -5.272  -0.897  -5.022
  433    HB3  CYS  61           HB3      CYS  61  -4.449  -1.784  -3.740
  434    HG   CYS  61           HG       CYS  61  -5.277  -3.892  -4.729
  435    H    ALA  62           H        ALA  62  -4.510  -0.794  -1.641
  436    HA   ALA  62           HA       ALA  62  -5.134   2.090  -1.345
  437    HB1  ALA  62           HB1      ALA  62  -5.266   1.569   0.848
  438    HB2  ALA  62           HB2      ALA  62  -3.509   1.433   0.797
  439    HB3  ALA  62           HB3      ALA  62  -4.511  -0.005   0.607
  440    H    ASN  63           H        ASN  63  -3.590   3.516  -1.931
  441    HA   ASN  63           HA       ASN  63  -0.897   2.469  -2.578
  442    HB2  ASN  63           HB2      ASN  63  -2.361   3.060  -4.545
  443    HB3  ASN  63           HB3      ASN  63  -2.334   4.727  -3.977
  444   HD21  ASN  63          HD21      ASN  63  -1.046   5.646  -5.635
  445   HD22  ASN  63          HD22      ASN  63   0.558   5.180  -5.931
  446    H    LYS  64           H        LYS  64   0.834   4.062  -2.505
  447    HA   LYS  64           HA       LYS  64   2.096   5.621  -1.403
  448    HB2  LYS  64           HB2      LYS  64  -0.546   7.101  -1.397
  449    HB3  LYS  64           HB3      LYS  64   1.003   7.824  -0.965
  450    HG2  LYS  64           HG2      LYS  64   1.886   7.252  -3.208
  451    HG3  LYS  64           HG3      LYS  64   0.322   6.562  -3.639
  452    HD2  LYS  64           HD2      LYS  64  -0.753   8.744  -3.293
  453    HD3  LYS  64           HD3      LYS  64   0.795   9.445  -2.828
  454    HE2  LYS  64           HE2      LYS  64   0.341   9.965  -5.173
  455    HE3  LYS  64           HE3      LYS  64   1.704   8.851  -5.071
  456    HZ1  LYS  64           HZ1      LYS  64  -0.985   7.720  -5.309
  457    HZ2  LYS  64           HZ2      LYS  64   0.492   7.139  -5.912
  458    HZ3  LYS  64           HZ3      LYS  64  -0.300   8.423  -6.691
  459    H    VAL  65           H        VAL  65   1.752   3.663   0.211
  460    HA   VAL  65           HA       VAL  65   0.293   4.208   2.617
  461    HB   VAL  65           HB       VAL  65   2.538   2.228   2.110
  462   HG11  VAL  65          HG11      VAL  65   1.537   1.030   4.068
  463   HG12  VAL  65          HG12      VAL  65   0.490   2.423   4.340
  464   HG13  VAL  65          HG13      VAL  65   2.239   2.590   4.500
  465   HG21  VAL  65          HG21      VAL  65   0.864   0.624   1.595
  466   HG22  VAL  65          HG22      VAL  65   0.402   2.064   0.689
  467   HG23  VAL  65          HG23      VAL  65  -0.433   1.664   2.190
  468    H    VAL  66           H        VAL  66   0.821   5.633   4.082
  469    HA   VAL  66           HA       VAL  66   3.677   6.214   4.626
  470    HB   VAL  66           HB       VAL  66   1.394   8.218   4.590
  471   HG11  VAL  66          HG11      VAL  66   2.983   8.840   6.308
  472   HG12  VAL  66          HG12      VAL  66   3.274   9.875   4.910
  473   HG13  VAL  66          HG13      VAL  66   4.343   8.510   5.236
  474   HG21  VAL  66          HG21      VAL  66   2.644   9.216   2.696
  475   HG22  VAL  66          HG22      VAL  66   2.135   7.567   2.333
  476   HG23  VAL  66          HG23      VAL  66   3.809   7.894   2.779
  477    H    ALA  67           H        ALA  67   4.238   5.804   6.663
  478    HA   ALA  67           HA       ALA  67   2.312   5.016   8.632
  479    HB1  ALA  67           HB1      ALA  67   4.740   4.187   8.347
  480    HB2  ALA  67           HB2      ALA  67   4.155   4.466   9.987
  481    HB3  ALA  67           HB3      ALA  67   5.196   5.657   9.205
  482    H    VAL  68           H        VAL  68   1.500   6.121  10.331
  483    HA   VAL  68           HA       VAL  68   1.967   9.015  10.402
  484    HB   VAL  68           HB       VAL  68  -0.082   7.359  11.919
  485   HG11  VAL  68          HG11      VAL  68  -0.071  10.332  11.330
  486   HG12  VAL  68          HG12      VAL  68   0.550   9.650  12.832
  487   HG13  VAL  68          HG13      VAL  68  -1.152   9.453  12.414
  488   HG21  VAL  68          HG21      VAL  68  -0.275   8.897   9.308
  489   HG22  VAL  68          HG22      VAL  68  -1.675   8.323  10.214
  490   HG23  VAL  68          HG23      VAL  68  -0.525   7.167   9.539
  Start of MODEL   13
    1    H1   MET   1           HT1      MET   1  -7.530  14.310   2.567
    2    H2   MET   1           HT2      MET   1  -5.869  14.611   2.370
    3    H3   MET   1           HT3      MET   1  -6.456  14.000   3.843
    4    HA   MET   1           HA       MET   1  -6.870  12.484   1.355
    5    HB2  MET   1           HB2      MET   1  -4.437  13.097   1.543
    6    HB3  MET   1           HB3      MET   1  -4.410  12.309   3.120
    7    HG2  MET   1           HG2      MET   1  -5.107  10.185   2.075
    8    HG3  MET   1           HG3      MET   1  -5.139  10.970   0.497
    9    HE1  MET   1           HE1      MET   1  -2.537  12.870   0.447
   10    HE2  MET   1           HE2      MET   1  -3.379  11.865  -0.729
   11    HE3  MET   1           HE3      MET   1  -1.645  11.666  -0.495
   12    H    SER   2           H        SER   2  -7.575  10.416   1.810
   13    HA   SER   2           HA       SER   2  -8.942   9.975   4.246
   14    HB2  SER   2           HB2      SER   2  -9.658   8.901   2.180
   15    HB3  SER   2           HB3      SER   2  -8.132   8.029   2.071
   16    HG   SER   2           HG       SER   2  -8.677   6.883   3.888
   17    H    LYS   3           H        LYS   3  -8.450   8.793   6.044
   18    HA   LYS   3           HA       LYS   3  -5.775   7.538   6.191
   19    HB2  LYS   3           HB2      LYS   3  -7.004   9.316   8.317
   20    HB3  LYS   3           HB3      LYS   3  -5.487   8.433   8.466
   21    HG2  LYS   3           HG2      LYS   3  -4.644   9.681   6.448
   22    HG3  LYS   3           HG3      LYS   3  -6.106  10.661   6.506
   23    HD2  LYS   3           HD2      LYS   3  -4.220  10.394   8.860
   24    HD3  LYS   3           HD3      LYS   3  -4.075  11.675   7.660
   25    HE2  LYS   3           HE2      LYS   3  -6.415  12.373   8.163
   26    HE3  LYS   3           HE3      LYS   3  -6.489  11.137   9.418
   27    HZ1  LYS   3           HZ1      LYS   3  -4.905  12.224  10.696
   28    HZ2  LYS   3           HZ2      LYS   3  -5.854  13.499  10.096
   29    HZ3  LYS   3           HZ3      LYS   3  -4.341  13.161   9.400
   30    H    GLY   4           H        GLY   4  -5.806   5.547   7.026
   31    HA2  GLY   4           HA2      GLY   4  -8.152   4.714   8.639
   32    HA3  GLY   4           HA3      GLY   4  -7.569   3.728   7.304
   33    H    ILE   5           H        ILE   5  -7.665   2.346   9.464
   34    HA   ILE   5           HA       ILE   5  -4.936   2.373  10.620
   35    HB   ILE   5           HB       ILE   5  -5.974   1.105  12.554
   36   HG12  ILE   5          HG12      ILE   5  -8.601   2.233  11.546
   37   HG13  ILE   5          HG13      ILE   5  -8.108   0.583  11.180
   38   HG21  ILE   5          HG21      ILE   5  -7.062   3.232  13.491
   39   HG22  ILE   5          HG22      ILE   5  -6.728   3.962  11.920
   40   HG23  ILE   5          HG23      ILE   5  -5.402   3.377  12.922
   41   HD11  ILE   5          HD11      ILE   5  -9.474   0.506  13.170
   42   HD12  ILE   5          HD12      ILE   5  -8.541   1.802  13.921
   43   HD13  ILE   5          HD13      ILE   5  -7.809   0.218  13.667
   44    H    VAL   6           H        VAL   6  -3.709   0.673  10.269
   45    HA   VAL   6           HA       VAL   6  -4.514  -1.340   8.456
   46    HB   VAL   6           HB       VAL   6  -2.071  -1.231  10.249
   47   HG11  VAL   6          HG11      VAL   6  -2.232  -3.481   9.491
   48   HG12  VAL   6          HG12      VAL   6  -1.137  -2.709   8.343
   49   HG13  VAL   6          HG13      VAL   6  -2.821  -2.989   7.903
   50   HG21  VAL   6          HG21      VAL   6  -2.286  -0.525   7.310
   51   HG22  VAL   6          HG22      VAL   6  -0.953  -0.180   8.414
   52   HG23  VAL   6          HG23      VAL   6  -2.484   0.679   8.584
   53    H    LYS   7           H        LYS   7  -5.603  -3.125   8.788
   54    HA   LYS   7           HA       LYS   7  -6.477  -3.999  11.355
   55    HB2  LYS   7           HB2      LYS   7  -7.713  -4.433   9.213
   56    HB3  LYS   7           HB3      LYS   7  -6.449  -5.573   8.760
   57    HG2  LYS   7           HG2      LYS   7  -6.942  -6.970  10.691
   58    HG3  LYS   7           HG3      LYS   7  -8.097  -5.787  11.300
   59    HD2  LYS   7           HD2      LYS   7  -9.401  -7.483  10.231
   60    HD3  LYS   7           HD3      LYS   7  -9.386  -6.114   9.121
   61    HE2  LYS   7           HE2      LYS   7  -7.601  -7.161   7.808
   62    HE3  LYS   7           HE3      LYS   7  -7.527  -8.506   8.945
   63    HZ1  LYS   7           HZ1      LYS   7  -9.803  -7.762   7.195
   64    HZ2  LYS   7           HZ2      LYS   7  -9.899  -8.934   8.422
   65    HZ3  LYS   7           HZ3      LYS   7  -8.854  -9.165   7.102
   66    H    TRP   8           H        TRP   8  -4.042  -5.145   9.049
   67    HA   TRP   8           HA       TRP   8  -2.337  -6.135  11.137
   68    HB2  TRP   8           HB2      TRP   8  -4.171  -7.943  10.735
   69    HB3  TRP   8           HB3      TRP   8  -3.334  -8.236   9.213
   70    HD1  TRP   8           HD1      TRP   8  -0.676  -8.892   9.427
   71    HE1  TRP   8           HE1      TRP   8   0.521 -10.273  11.245
   72    HE3  TRP   8           HE3      TRP   8  -4.136  -8.605  13.166
   73    HZ2  TRP   8           HZ2      TRP   8   0.067 -11.144  13.933
   74    HZ3  TRP   8           HZ3      TRP   8  -3.733  -9.719  15.343
   75    HH2  TRP   8           HH2      TRP   8  -1.636 -10.986  15.731
   76    H    PHE   9           H        PHE   9  -0.293  -5.877  10.435
   77    HA   PHE   9           HA       PHE   9   0.152  -5.692   7.501
   78    HB2  PHE   9           HB2      PHE   9   0.636  -3.642   8.903
   79    HB3  PHE   9           HB3      PHE   9   1.930  -4.564   9.671
   80    HD1  PHE   9           HD1      PHE   9   0.747  -3.077   6.502
   81    HD2  PHE   9           HD2      PHE   9   3.961  -5.135   8.474
   82    HE1  PHE   9           HE1      PHE   9   2.242  -2.571   4.590
   83    HE2  PHE   9           HE2      PHE   9   5.456  -4.626   6.561
   84    HZ   PHE   9           HZ       PHE   9   4.597  -3.345   4.621
   85    H    ASN  10           H        ASN  10   1.231  -7.335   6.587
   86    HA   ASN  10           HA       ASN  10   3.144  -8.866   8.255
   87    HB2  ASN  10           HB2      ASN  10   1.285  -9.912   6.111
   88    HB3  ASN  10           HB3      ASN  10   2.535 -10.862   6.911
   89   HD21  ASN  10          HD21      ASN  10  -0.660 -10.675   6.988
   90   HD22  ASN  10          HD22      ASN  10  -0.968 -10.828   8.650
   91    H    SER  11           H        SER  11   4.969  -7.747   7.550
   92    HA   SER  11           HA       SER  11   5.577  -7.131   4.871
   93    HB2  SER  11           HB2      SER  11   7.853  -6.777   5.684
   94    HB3  SER  11           HB3      SER  11   6.690  -6.096   6.819
   95    HG   SER  11           HG       SER  11   8.299  -7.356   7.861
   96    H    ASP  12           H        ASP  12   6.070 -10.051   6.787
   97    HA   ASP  12           HA       ASP  12   7.982 -11.341   5.174
   98    HB2  ASP  12           HB2      ASP  12   5.753 -12.447   6.896
   99    HB3  ASP  12           HB3      ASP  12   6.947 -13.468   6.098
  100    H    LYS  13           H        LYS  13   4.439 -11.310   5.031
  101    HA   LYS  13           HA       LYS  13   4.299 -12.954   2.668
  102    HB2  LYS  13           HB2      LYS  13   2.256 -11.213   4.064
  103    HB3  LYS  13           HB3      LYS  13   1.901 -12.202   2.648
  104    HG2  LYS  13           HG2      LYS  13   2.770 -14.200   3.922
  105    HG3  LYS  13           HG3      LYS  13   2.870 -13.171   5.350
  106    HD2  LYS  13           HD2      LYS  13   0.313 -13.548   3.766
  107    HD3  LYS  13           HD3      LYS  13   0.740 -14.551   5.152
  108    HE2  LYS  13           HE2      LYS  13   0.896 -12.492   6.552
  109    HE3  LYS  13           HE3      LYS  13   0.372 -11.540   5.163
  110    HZ1  LYS  13           HZ1      LYS  13  -1.731 -12.360   5.266
  111    HZ2  LYS  13           HZ2      LYS  13  -1.334 -12.449   6.917
  112    HZ3  LYS  13           HZ3      LYS  13  -1.257 -13.841   5.945
  113    H    GLY  14           H        GLY  14   4.673  -9.578   3.377
  114    HA2  GLY  14           HA2      GLY  14   5.511  -7.967   1.870
  115    HA3  GLY  14           HA3      GLY  14   4.981  -8.972   0.531
  116    H    PHE  15           H        PHE  15   2.513  -8.718   2.847
  117    HA   PHE  15           HA       PHE  15   1.433  -6.195   1.929
  118    HB2  PHE  15           HB2      PHE  15  -0.618  -7.136   0.938
  119    HB3  PHE  15           HB3      PHE  15   0.822  -7.578   0.026
  120    HD1  PHE  15           HD1      PHE  15  -1.793  -8.800   2.334
  121    HD2  PHE  15           HD2      PHE  15   1.599  -9.872  -0.071
  122    HE1  PHE  15           HE1      PHE  15  -2.385 -11.195   2.567
  123    HE2  PHE  15           HE2      PHE  15   1.010 -12.269   0.164
  124    HZ   PHE  15           HZ       PHE  15  -0.982 -12.932   1.483
  125    H    GLY  16           H        GLY  16  -0.913  -5.966   2.718
  126    HA2  GLY  16           HA2      GLY  16  -1.596  -7.440   5.113
  127    HA3  GLY  16           HA3      GLY  16  -1.065  -5.788   5.409
  128    H    PHE  17           H        PHE  17  -3.535  -6.302   6.202
  129    HA   PHE  17           HA       PHE  17  -5.322  -5.222   4.095
  130    HB2  PHE  17           HB2      PHE  17  -5.971  -6.933   6.512
  131    HB3  PHE  17           HB3      PHE  17  -7.174  -6.223   5.439
  132    HD1  PHE  17           HD1      PHE  17  -4.500  -8.743   5.749
  133    HD2  PHE  17           HD2      PHE  17  -7.495  -7.058   3.173
  134    HE1  PHE  17           HE1      PHE  17  -4.263 -10.673   4.211
  135    HE2  PHE  17           HE2      PHE  17  -7.257  -8.987   1.635
  136    HZ   PHE  17           HZ       PHE  17  -5.639 -10.795   2.152
  137    H    ILE  18           H        ILE  18  -6.357  -3.306   4.520
  138    HA   ILE  18           HA       ILE  18  -5.879  -2.130   7.179
  139    HB   ILE  18           HB       ILE  18  -4.694  -0.973   5.371
  140   HG12  ILE  18          HG12      ILE  18  -6.992   0.788   6.251
  141   HG13  ILE  18          HG13      ILE  18  -5.756   0.240   7.386
  142   HG21  ILE  18          HG21      ILE  18  -7.474  -0.783   4.206
  143   HG22  ILE  18          HG22      ILE  18  -5.995  -1.356   3.437
  144   HG23  ILE  18          HG23      ILE  18  -6.211   0.363   3.754
  145   HD11  ILE  18          HD11      ILE  18  -4.011   1.199   5.880
  146   HD12  ILE  18          HD12      ILE  18  -5.111   2.423   6.513
  147   HD13  ILE  18          HD13      ILE  18  -5.291   1.844   4.857
  148    H    THR  19           H        THR  19  -7.454  -1.074   8.260
  149    HA   THR  19           HA       THR  19 -10.195  -1.696   7.436
  150    HB   THR  19           HB       THR  19  -9.116  -0.878  10.139
  151    HG1  THR  19           HG1      THR  19  -9.405  -3.097  10.590
  152   HG21  THR  19          HG21      THR  19 -11.340  -1.882  10.881
  153   HG22  THR  19          HG22      THR  19 -11.825  -1.838   9.186
  154   HG23  THR  19          HG23      THR  19 -11.450  -0.338  10.035
  155    HA   PRO  20           HA       PRO  20 -10.296   2.802   6.342
  156    HB2  PRO  20           HB2      PRO  20 -13.154   1.957   5.975
  157    HB3  PRO  20           HB3      PRO  20 -12.151   2.986   4.935
  158    HG2  PRO  20           HG2      PRO  20 -12.601   0.518   4.222
  159    HG3  PRO  20           HG3      PRO  20 -10.960   1.174   4.086
  160    HD2  PRO  20           HD2      PRO  20 -12.067  -0.694   6.166
  161    HD3  PRO  20           HD3      PRO  20 -10.474  -0.703   5.376
  162    H    GLU  21           H        GLU  21 -10.620   4.435   7.768
  163    HA   GLU  21           HA       GLU  21 -11.688   4.050  10.340
  164    HB2  GLU  21           HB2      GLU  21 -11.477   6.480  10.605
  165    HB3  GLU  21           HB3      GLU  21 -10.049   5.808   9.821
  166    HG2  GLU  21           HG2      GLU  21 -10.873   6.519   7.630
  167    HG3  GLU  21           HG3      GLU  21 -12.370   7.098   8.352
  168    H    ASP  22           H        ASP  22 -13.259   4.786   7.352
  169    HA   ASP  22           HA       ASP  22 -15.666   5.853   8.604
  170    HB2  ASP  22           HB2      ASP  22 -15.049   5.199   5.717
  171    HB3  ASP  22           HB3      ASP  22 -16.508   6.005   6.289
  172    H    GLY  23           H        GLY  23 -14.465   2.775   8.263
  173    HA2  GLY  23           HA2      GLY  23 -15.567   0.788   8.834
  174    HA3  GLY  23           HA3      GLY  23 -17.111   1.594   8.588
  175    H    SER  24           H        SER  24 -15.099   2.212   5.951
  176    HA   SER  24           HA       SER  24 -16.683   0.684   4.153
  177    HB2  SER  24           HB2      SER  24 -15.619   2.746   3.418
  178    HB3  SER  24           HB3      SER  24 -14.026   2.074   3.739
  179    HG   SER  24           HG       SER  24 -15.918   0.942   1.953
  180    H    LYS  25           H        LYS  25 -15.742  -0.877   2.607
  181    HA   LYS  25           HA       LYS  25 -14.800  -3.179   3.891
  182    HB2  LYS  25           HB2      LYS  25 -16.029  -3.073   1.689
  183    HB3  LYS  25           HB3      LYS  25 -14.512  -2.571   0.944
  184    HG2  LYS  25           HG2      LYS  25 -13.430  -4.644   1.775
  185    HG3  LYS  25           HG3      LYS  25 -14.965  -5.154   2.473
  186    HD2  LYS  25           HD2      LYS  25 -14.651  -4.514  -0.469
  187    HD3  LYS  25           HD3      LYS  25 -14.404  -6.134   0.180
  188    HE2  LYS  25           HE2      LYS  25 -16.710  -6.071   1.128
  189    HE3  LYS  25           HE3      LYS  25 -16.948  -4.494   0.374
  190    HZ1  LYS  25           HZ1      LYS  25 -17.736  -6.557  -0.880
  191    HZ2  LYS  25           HZ2      LYS  25 -16.093  -6.832  -1.212
  192    HZ3  LYS  25           HZ3      LYS  25 -16.841  -5.402  -1.743
  193    H    ASP  26           H        ASP  26 -12.802  -4.144   4.074
  194    HA   ASP  26           HA       ASP  26 -10.534  -2.540   4.373
  195    HB2  ASP  26           HB2      ASP  26 -10.841  -5.524   4.014
  196    HB3  ASP  26           HB3      ASP  26  -9.300  -4.756   4.376
  197    H    LEU  27           H        LEU  27  -8.730  -2.170   3.156
  198    HA   LEU  27           HA       LEU  27  -8.918  -2.825   0.275
  199    HB2  LEU  27           HB2      LEU  27  -8.073  -0.387   1.781
  200    HB3  LEU  27           HB3      LEU  27  -7.170  -0.766   0.320
  201    HG   LEU  27           HG       LEU  27  -9.402  -0.929  -0.889
  202   HD11  LEU  27          HD11      LEU  27 -10.317   0.160   1.780
  203   HD12  LEU  27          HD12      LEU  27 -10.960  -1.214   0.882
  204   HD13  LEU  27          HD13      LEU  27 -11.239   0.426   0.299
  205   HD21  LEU  27          HD21      LEU  27  -7.825   1.085  -0.847
  206   HD22  LEU  27          HD22      LEU  27  -8.899   1.782   0.366
  207   HD23  LEU  27          HD23      LEU  27  -9.505   1.434  -1.253
  208    H    PHE  28           H        PHE  28  -7.035  -3.435  -0.831
  209    HA   PHE  28           HA       PHE  28  -5.119  -4.916   0.762
  210    HB2  PHE  28           HB2      PHE  28  -5.455  -4.499  -2.217
  211    HB3  PHE  28           HB3      PHE  28  -4.162  -5.475  -1.515
  212    HD1  PHE  28           HD1      PHE  28  -7.819  -5.184  -1.992
  213    HD2  PHE  28           HD2      PHE  28  -4.614  -7.625  -0.500
  214    HE1  PHE  28           HE1      PHE  28  -9.369  -7.112  -1.813
  215    HE2  PHE  28           HE2      PHE  28  -6.165  -9.552  -0.320
  216    HZ   PHE  28           HZ       PHE  28  -8.541  -9.296  -0.978
  217    H    VAL  29           H        VAL  29  -3.119  -4.280   1.323
  218    HA   VAL  29           HA       VAL  29  -1.929  -1.939  -0.028
  219    HB   VAL  29           HB       VAL  29  -2.065  -2.376   2.971
  220   HG11  VAL  29          HG11      VAL  29  -0.673  -0.292   1.275
  221   HG12  VAL  29          HG12      VAL  29   0.058  -1.367   2.467
  222   HG13  VAL  29          HG13      VAL  29  -1.002  -0.060   2.992
  223   HG21  VAL  29          HG21      VAL  29  -3.194  -0.104   1.320
  224   HG22  VAL  29          HG22      VAL  29  -3.484  -0.439   3.027
  225   HG23  VAL  29          HG23      VAL  29  -4.147  -1.512   1.793
  226    H    HIS  30           H        HIS  30   0.196  -2.163  -0.504
  227    HA   HIS  30           HA       HIS  30   1.534  -4.643   0.391
  228    HB2  HIS  30           HB2      HIS  30   1.929  -2.931  -2.072
  229    HB3  HIS  30           HB3      HIS  30   2.979  -4.280  -1.632
  230    HD2  HIS  30           HD2      HIS  30   1.929  -6.815  -2.215
  231    HE1  HIS  30           HE1      HIS  30  -1.856  -5.511  -3.554
  232    HE2  HIS  30           HE2      HIS  30  -0.322  -7.523  -3.333
  233    H    HIS  31           H        HIS  31   3.721  -4.597   0.984
  234    HA   HIS  31           HA       HIS  31   4.538  -2.428   2.610
  235    HB2  HIS  31           HB2      HIS  31   5.292  -4.798   2.890
  236    HB3  HIS  31           HB3      HIS  31   6.277  -4.619   1.438
  237    HD2  HIS  31           HD2      HIS  31   6.399  -3.634   5.211
  238    HE1  HIS  31           HE1      HIS  31   9.826  -2.004   3.366
  239    HE2  HIS  31           HE2      HIS  31   8.691  -2.443   5.593
  240    H    SER  32           H        SER  32   5.619  -3.509  -0.596
  241    HA   SER  32           HA       SER  32   7.482  -1.378  -0.987
  242    HB2  SER  32           HB2      SER  32   7.636  -3.562  -2.142
  243    HB3  SER  32           HB3      SER  32   6.177  -3.167  -3.047
  244    HG   SER  32           HG       SER  32   7.331  -1.935  -4.293
  245    H    GLU  33           H        GLU  33   4.179  -1.182  -0.847
  246    HA   GLU  33           HA       GLU  33   3.562   0.408  -3.127
  247    HB2  GLU  33           HB2      GLU  33   1.911  -0.851  -1.695
  248    HB3  GLU  33           HB3      GLU  33   2.128   0.397  -0.469
  249    HG2  GLU  33           HG2      GLU  33   0.173   0.931  -1.817
  250    HG3  GLU  33           HG3      GLU  33   1.436   2.116  -2.127
  251    H    ILE  34           H        ILE  34   4.923   1.144   0.023
  252    HA   ILE  34           HA       ILE  34   4.397   3.960  -0.063
  253    HB   ILE  34           HB       ILE  34   4.786   2.771   2.061
  254   HG12  ILE  34          HG12      ILE  34   7.049   4.739   1.658
  255   HG13  ILE  34          HG13      ILE  34   5.366   5.257   1.680
  256   HG21  ILE  34          HG21      ILE  34   6.603   1.266   1.009
  257   HG22  ILE  34          HG22      ILE  34   6.860   1.811   2.665
  258   HG23  ILE  34          HG23      ILE  34   7.712   2.596   1.336
  259   HD11  ILE  34          HD11      ILE  34   6.891   3.873   3.902
  260   HD12  ILE  34          HD12      ILE  34   5.141   4.087   3.920
  261   HD13  ILE  34          HD13      ILE  34   6.200   5.497   3.925
  262    H    GLN  35           H        GLN  35   5.395   5.467  -1.195
  263    HA   GLN  35           HA       GLN  35   7.405   4.902  -3.091
  264    HB2  GLN  35           HB2      GLN  35   6.363   7.511  -1.977
  265    HB3  GLN  35           HB3      GLN  35   7.520   7.416  -3.304
  266    HG2  GLN  35           HG2      GLN  35   4.790   6.095  -3.304
  267    HG3  GLN  35           HG3      GLN  35   5.161   7.623  -4.096
  268   HE21  GLN  35          HE21      GLN  35   4.554   4.616  -5.009
  269   HE22  GLN  35          HE22      GLN  35   5.689   4.401  -6.252
  270    H    SER  36           H        SER  36   7.564   6.375   0.137
  271    HA   SER  36           HA       SER  36  10.241   7.235   0.049
  272    HB2  SER  36           HB2      SER  36   8.695   7.933   1.814
  273    HB3  SER  36           HB3      SER  36   8.616   6.281   2.419
  274    HG   SER  36           HG       SER  36  10.305   6.812   3.542
  275    H    GLY  37           H        GLY  37   8.857   4.168   1.226
  276    HA2  GLY  37           HA2      GLY  37   9.785   2.082   1.515
  277    HA3  GLY  37           HA3      GLY  37  10.998   2.568   0.336
  278    H    GLY  38           H        GLY  38  10.471   4.284   3.367
  279    HA2  GLY  38           HA2      GLY  38  13.198   4.242   4.094
  280    HA3  GLY  38           HA3      GLY  38  11.867   4.703   5.148
  281    H    GLU  39           H        GLU  39  14.399   2.886   5.271
  282    HA   GLU  39           HA       GLU  39  13.527   0.245   5.835
  283    HB2  GLU  39           HB2      GLU  39  15.889   0.921   5.333
  284    HB3  GLU  39           HB3      GLU  39  15.968   1.666   6.928
  285    HG2  GLU  39           HG2      GLU  39  15.463  -0.513   7.976
  286    HG3  GLU  39           HG3      GLU  39  15.381  -1.261   6.383
  287    H    TYR  40           H        TYR  40  14.018   3.114   7.851
  288    HA   TYR  40           HA       TYR  40  13.617   1.905  10.370
  289    HB2  TYR  40           HB2      TYR  40  13.111   4.744   9.458
  290    HB3  TYR  40           HB3      TYR  40  13.098   4.218  11.140
  291    HD1  TYR  40           HD1      TYR  40  15.195   4.884   8.200
  292    HD2  TYR  40           HD2      TYR  40  15.159   3.474  12.256
  293    HE1  TYR  40           HE1      TYR  40  17.663   5.106   8.300
  294    HE2  TYR  40           HE2      TYR  40  17.627   3.696  12.357
  295    HH   TYR  40           HH       TYR  40  19.383   5.394  10.773
  296    H    ALA  41           H        ALA  41  11.364   3.353   8.055
  297    HA   ALA  41           HA       ALA  41   9.070   3.358   9.683
  298    HB1  ALA  41           HB1      ALA  41   9.175   4.569   7.558
  299    HB2  ALA  41           HB2      ALA  41   7.812   3.450   7.561
  300    HB3  ALA  41           HB3      ALA  41   9.285   3.043   6.680
  301    H    THR  42           H        THR  42   7.856   1.792  10.447
  302    HA   THR  42           HA       THR  42   7.837  -0.844   9.108
  303    HB   THR  42           HB       THR  42   7.804  -1.932  11.323
  304    HG1  THR  42           HG1      THR  42   7.446  -0.741  12.984
  305   HG21  THR  42          HG21      THR  42   9.963  -1.875  10.365
  306   HG22  THR  42          HG22      THR  42  10.200  -1.249  11.997
  307   HG23  THR  42          HG23      THR  42  10.128  -0.141  10.628
  308    H    LEU  43           H        LEU  43   5.942  -2.159   9.655
  309    HA   LEU  43           HA       LEU  43   3.628  -0.643  10.652
  310    HB2  LEU  43           HB2      LEU  43   3.846  -1.998   7.966
  311    HB3  LEU  43           HB3      LEU  43   2.293  -1.761   8.754
  312    HG   LEU  43           HG       LEU  43   3.237   0.761   8.990
  313   HD11  LEU  43          HD11      LEU  43   4.385  -0.002   6.306
  314   HD12  LEU  43          HD12      LEU  43   5.378  -0.077   7.756
  315   HD13  LEU  43          HD13      LEU  43   4.667   1.455   7.260
  316   HD21  LEU  43          HD21      LEU  43   1.915  -0.511   6.579
  317   HD22  LEU  43          HD22      LEU  43   2.098   1.235   6.752
  318   HD23  LEU  43          HD23      LEU  43   1.138   0.329   7.920
  319    H    ALA  44           H        ALA  44   2.059  -1.920  11.636
  320    HA   ALA  44           HA       ALA  44   2.412  -4.828  11.699
  321    HB1  ALA  44           HB1      ALA  44   3.774  -3.572  13.553
  322    HB2  ALA  44           HB2      ALA  44   2.822  -4.989  13.996
  323    HB3  ALA  44           HB3      ALA  44   2.199  -3.372  14.322
  324    H    ASP  45           H        ASP  45   0.595  -5.028  14.074
  325    HA   ASP  45           HA       ASP  45  -1.913  -4.723  12.649
  326    HB2  ASP  45           HB2      ASP  45  -1.422  -6.777  13.922
  327    HB3  ASP  45           HB3      ASP  45  -1.291  -5.833  15.399
  328    H    GLY  46           H        GLY  46  -2.878  -2.779  12.678
  329    HA2  GLY  46           HA2      GLY  46  -4.272  -1.227  13.846
  330    HA3  GLY  46           HA3      GLY  46  -3.269  -1.439  15.272
  331    H    GLN  47           H        GLN  47  -1.206  -1.144  12.666
  332    HA   GLN  47           HA       GLN  47  -0.239   1.407  13.444
  333    HB2  GLN  47           HB2      GLN  47   1.108  -0.415  12.383
  334    HB3  GLN  47           HB3      GLN  47   0.276  -0.096  10.865
  335    HG2  GLN  47           HG2      GLN  47   2.428   1.065  10.898
  336    HG3  GLN  47           HG3      GLN  47   1.115   2.233  10.908
  337   HE21  GLN  47          HE21      GLN  47   1.628   3.926  12.306
  338   HE22  GLN  47          HE22      GLN  47   2.417   3.752  13.799
  339    H    THR  48           H        THR  48  -0.848   3.401  12.836
  340    HA   THR  48           HA       THR  48  -3.060   3.754  11.008
  341    HB   THR  48           HB       THR  48  -2.690   6.196  11.520
  342    HG1  THR  48           HG1      THR  48  -1.184   6.674  13.097
  343   HG21  THR  48          HG21      THR  48  -3.208   5.861  14.036
  344   HG22  THR  48          HG22      THR  48  -3.125   4.136  13.678
  345   HG23  THR  48          HG23      THR  48  -4.312   5.155  12.858
  346    H    VAL  49           H        VAL  49  -3.038   4.762   9.017
  347    HA   VAL  49           HA       VAL  49  -0.517   5.686   7.899
  348    HB   VAL  49           HB       VAL  49  -0.657   4.200   5.921
  349   HG11  VAL  49          HG11      VAL  49   0.279   2.253   7.002
  350   HG12  VAL  49          HG12      VAL  49  -0.535   2.642   8.517
  351   HG13  VAL  49          HG13      VAL  49   0.768   3.673   7.927
  352   HG21  VAL  49          HG21      VAL  49  -2.988   3.582   5.915
  353   HG22  VAL  49          HG22      VAL  49  -2.872   2.914   7.544
  354   HG23  VAL  49          HG23      VAL  49  -2.064   2.107   6.200
  355    H    GLU  50           H        GLU  50  -0.777   6.485   5.661
  356    HA   GLU  50           HA       GLU  50  -3.456   7.690   5.251
  357    HB2  GLU  50           HB2      GLU  50  -0.755   8.755   4.351
  358    HB3  GLU  50           HB3      GLU  50  -2.313   9.540   4.112
  359    HG2  GLU  50           HG2      GLU  50  -2.592   9.714   6.566
  360    HG3  GLU  50           HG3      GLU  50  -1.023   8.950   6.795
  361    H    TYR  51           H        TYR  51  -4.421   7.245   3.284
  362    HA   TYR  51           HA       TYR  51  -2.796   6.272   1.069
  363    HB2  TYR  51           HB2      TYR  51  -4.025   4.159   0.840
  364    HB3  TYR  51           HB3      TYR  51  -3.157   4.228   2.366
  365    HD1  TYR  51           HD1      TYR  51  -6.466   4.275   0.761
  366    HD2  TYR  51           HD2      TYR  51  -4.359   4.503   4.497
  367    HE1  TYR  51           HE1      TYR  51  -8.591   3.906   1.982
  368    HE2  TYR  51           HE2      TYR  51  -6.486   4.130   5.717
  369    HH   TYR  51           HH       TYR  51  -8.819   4.282   5.431
  370    H    GLU  52           H        GLU  52  -4.026   5.823  -0.870
  371    HA   GLU  52           HA       GLU  52  -6.518   7.413  -1.044
  372    HB2  GLU  52           HB2      GLU  52  -4.147   7.243  -2.902
  373    HB3  GLU  52           HB3      GLU  52  -5.742   7.677  -3.520
  374    HG2  GLU  52           HG2      GLU  52  -4.408   9.091  -1.195
  375    HG3  GLU  52           HG3      GLU  52  -4.299   9.647  -2.863
  376    H    VAL  53           H        VAL  53  -8.225   6.399  -1.875
  377    HA   VAL  53           HA       VAL  53  -8.277   3.607  -2.190
  378    HB   VAL  53           HB       VAL  53 -10.241   4.975  -1.564
  379   HG11  VAL  53          HG11      VAL  53 -10.425   5.782  -4.472
  380   HG12  VAL  53          HG12      VAL  53  -9.710   6.821  -3.238
  381   HG13  VAL  53          HG13      VAL  53 -11.408   6.355  -3.125
  382   HG21  VAL  53          HG21      VAL  53 -11.877   3.701  -2.763
  383   HG22  VAL  53          HG22      VAL  53 -10.445   2.679  -2.657
  384   HG23  VAL  53          HG23      VAL  53 -10.815   3.525  -4.159
  385    H    GLY  54           H        GLY  54  -8.620   2.312  -3.990
  386    HA2  GLY  54           HA2      GLY  54  -8.085   3.402  -6.660
  387    HA3  GLY  54           HA3      GLY  54  -7.000   2.157  -6.044
  388    H    GLN  55           H        GLN  55  -8.495   1.741  -8.361
  389    HA   GLN  55           HA       GLN  55 -10.745   0.026  -7.556
  390    HB2  GLN  55           HB2      GLN  55  -9.867   1.107 -10.239
  391    HB3  GLN  55           HB3      GLN  55 -11.187  -0.051 -10.037
  392    HG2  GLN  55           HG2      GLN  55 -12.422   1.501  -8.655
  393    HG3  GLN  55           HG3      GLN  55 -11.065   2.621  -8.612
  394   HE21  GLN  55          HE21      GLN  55 -13.854   3.051  -9.687
  395   HE22  GLN  55          HE22      GLN  55 -13.637   3.528 -11.302
  396    H    GLY  56           H        GLY  56 -10.831  -2.136  -7.994
  397    HA2  GLY  56           HA2      GLY  56  -8.794  -3.500  -9.520
  398    HA3  GLY  56           HA3      GLY  56  -8.675  -3.774  -7.783
  399    H    GLN  57           H        GLN  57  -9.293  -5.715  -9.850
  400    HA   GLN  57           HA       GLN  57 -12.065  -6.313  -9.930
  401    HB2  GLN  57           HB2      GLN  57  -9.613  -8.017 -10.378
  402    HB3  GLN  57           HB3      GLN  57 -11.258  -8.611 -10.610
  403    HG2  GLN  57           HG2      GLN  57 -10.599  -7.865 -12.762
  404    HG3  GLN  57           HG3      GLN  57 -11.595  -6.553 -12.130
  405   HE21  GLN  57          HE21      GLN  57 -10.622  -4.678 -12.946
  406   HE22  GLN  57          HE22      GLN  57  -8.972  -4.310 -12.784
  407    H    LYS  58           H        LYS  58  -9.453  -7.318  -7.774
  408    HA   LYS  58           HA       LYS  58 -11.213  -9.051  -6.237
  409    HB2  LYS  58           HB2      LYS  58  -9.213  -9.535  -4.892
  410    HB3  LYS  58           HB3      LYS  58  -8.893  -9.742  -6.612
  411    HG2  LYS  58           HG2      LYS  58  -7.856  -7.494  -6.687
  412    HG3  LYS  58           HG3      LYS  58  -8.166  -7.298  -4.962
  413    HD2  LYS  58           HD2      LYS  58  -6.763  -9.269  -4.480
  414    HD3  LYS  58           HD3      LYS  58  -6.449  -9.465  -6.206
  415    HE2  LYS  58           HE2      LYS  58  -5.402  -7.235  -6.277
  416    HE3  LYS  58           HE3      LYS  58  -5.719  -7.029  -4.554
  417    HZ1  LYS  58           HZ1      LYS  58  -4.109  -9.248  -5.687
  418    HZ2  LYS  58           HZ2      LYS  58  -4.299  -8.852  -4.046
  419    HZ3  LYS  58           HZ3      LYS  58  -3.442  -7.812  -5.081
  420    H    GLY  59           H        GLY  59 -11.556  -6.018  -6.375
  421    HA2  GLY  59           HA2      GLY  59 -12.815  -4.884  -4.622
  422    HA3  GLY  59           HA3      GLY  59 -11.675  -5.555  -3.455
  423    HA   PRO  60           HA       PRO  60 -10.259  -1.277  -5.012
  424    HB2  PRO  60           HB2      PRO  60 -10.541   0.177  -2.735
  425    HB3  PRO  60           HB3      PRO  60 -11.855  -0.020  -3.912
  426    HG2  PRO  60           HG2      PRO  60 -11.389  -1.472  -1.348
  427    HG3  PRO  60           HG3      PRO  60 -12.889  -0.793  -2.000
  428    HD2  PRO  60           HD2      PRO  60 -12.306  -3.444  -2.188
  429    HD3  PRO  60           HD3      PRO  60 -13.238  -2.588  -3.438
  430    H    CYS  61           H        CYS  61  -8.254  -0.331  -4.565
  431    HA   CYS  61           HA       CYS  61  -6.575  -1.739  -2.570
  432    HB2  CYS  61           HB2      CYS  61  -6.099  -2.146  -5.052
  433    HB3  CYS  61           HB3      CYS  61  -5.590  -0.459  -5.125
  434    HG   CYS  61           HG       CYS  61  -3.490  -1.030  -3.922
  435    H    ALA  62           H        ALA  62  -4.678  -0.377  -1.841
  436    HA   ALA  62           HA       ALA  62  -5.354   2.497  -1.762
  437    HB1  ALA  62           HB1      ALA  62  -5.838   2.120   0.430
  438    HB2  ALA  62           HB2      ALA  62  -4.087   2.082   0.634
  439    HB3  ALA  62           HB3      ALA  62  -4.987   0.578   0.454
  440    H    ASN  63           H        ASN  63  -3.620   3.888  -1.997
  441    HA   ASN  63           HA       ASN  63  -0.923   2.682  -2.134
  442    HB2  ASN  63           HB2      ASN  63  -0.449   4.048  -4.137
  443    HB3  ASN  63           HB3      ASN  63  -1.733   2.876  -4.423
  444   HD21  ASN  63          HD21      ASN  63  -3.222   3.885  -5.787
  445   HD22  ASN  63          HD22      ASN  63  -3.828   5.454  -5.562
  446    H    LYS  64           H        LYS  64   0.749   4.568  -2.428
  447    HA   LYS  64           HA       LYS  64   1.834   6.305  -1.396
  448    HB2  LYS  64           HB2      LYS  64  -0.966   7.469  -1.366
  449    HB3  LYS  64           HB3      LYS  64   0.503   8.377  -1.000
  450    HG2  LYS  64           HG2      LYS  64   1.385   7.741  -3.267
  451    HG3  LYS  64           HG3      LYS  64  -0.176   7.009  -3.622
  452    HD2  LYS  64           HD2      LYS  64   0.125   9.904  -2.782
  453    HD3  LYS  64           HD3      LYS  64   0.130   9.392  -4.468
  454    HE2  LYS  64           HE2      LYS  64  -2.108   8.352  -4.132
  455    HE3  LYS  64           HE3      LYS  64  -2.115   8.953  -2.474
  456    HZ1  LYS  64           HZ1      LYS  64  -2.319  11.114  -3.158
  457    HZ2  LYS  64           HZ2      LYS  64  -3.216  10.326  -4.367
  458    HZ3  LYS  64           HZ3      LYS  64  -1.624  10.830  -4.678
  459    H    VAL  65           H        VAL  65   1.576   4.259   0.209
  460    HA   VAL  65           HA       VAL  65   0.152   4.761   2.645
  461    HB   VAL  65           HB       VAL  65   2.407   2.815   2.062
  462   HG11  VAL  65          HG11      VAL  65   1.524   1.582   4.026
  463   HG12  VAL  65          HG12      VAL  65   0.380   2.891   4.321
  464   HG13  VAL  65          HG13      VAL  65   2.111   3.183   4.475
  465   HG21  VAL  65          HG21      VAL  65  -0.553   2.203   2.201
  466   HG22  VAL  65          HG22      VAL  65   0.747   1.201   1.551
  467   HG23  VAL  65          HG23      VAL  65   0.234   2.650   0.687
  468    H    VAL  66           H        VAL  66   0.691   6.206   4.091
  469    HA   VAL  66           HA       VAL  66   3.561   6.752   4.626
  470    HB   VAL  66           HB       VAL  66   1.285   8.763   4.712
  471   HG11  VAL  66          HG11      VAL  66   4.256   9.053   5.251
  472   HG12  VAL  66          HG12      VAL  66   2.952   9.259   6.422
  473   HG13  VAL  66          HG13      VAL  66   3.135  10.405   5.093
  474   HG21  VAL  66          HG21      VAL  66   1.918   8.259   2.412
  475   HG22  VAL  66          HG22      VAL  66   3.628   8.430   2.812
  476   HG23  VAL  66          HG23      VAL  66   2.568   9.840   2.847
  477    H    ALA  67           H        ALA  67   4.125   6.191   6.624
  478    HA   ALA  67           HA       ALA  67   2.252   5.274   8.555
  479    HB1  ALA  67           HB1      ALA  67   4.530   4.393   8.460
  480    HB2  ALA  67           HB2      ALA  67   4.221   5.104  10.045
  481    HB3  ALA  67           HB3      ALA  67   5.181   5.984   8.854
  482    H    VAL  68           H        VAL  68   1.314   6.252  10.250
  483    HA   VAL  68           HA       VAL  68   0.540   7.926  11.617
  484    HB   VAL  68           HB       VAL  68   3.353   9.042  11.334
  485   HG11  VAL  68          HG11      VAL  68   1.207   9.420  13.450
  486   HG12  VAL  68          HG12      VAL  68   1.784  10.646  12.322
  487   HG13  VAL  68          HG13      VAL  68   2.861  10.023  13.573
  488   HG21  VAL  68          HG21      VAL  68   3.469   6.740  12.116
  489   HG22  VAL  68          HG22      VAL  68   2.175   7.028  13.278
  490   HG23  VAL  68          HG23      VAL  68   3.741   7.808  13.492
  Start of MODEL   14
    1    H1   MET   1           HT1      MET   1  -5.904  13.946   3.910
    2    H2   MET   1           HT2      MET   1  -7.308  13.881   2.956
    3    H3   MET   1           HT3      MET   1  -5.849  14.442   2.289
    4    HA   MET   1           HA       MET   1  -6.301  12.196   1.544
    5    HB2  MET   1           HB2      MET   1  -3.998  12.735   3.414
    6    HB3  MET   1           HB3      MET   1  -4.168  11.151   2.658
    7    HG2  MET   1           HG2      MET   1  -4.136  13.758   1.111
    8    HG3  MET   1           HG3      MET   1  -2.711  12.751   1.365
    9    HE1  MET   1           HE1      MET   1  -3.510  13.700  -1.205
   10    HE2  MET   1           HE2      MET   1  -3.876  12.430  -2.369
   11    HE3  MET   1           HE3      MET   1  -2.384  12.355  -1.437
   12    H    SER   2           H        SER   2  -7.000  10.150   1.988
   13    HA   SER   2           HA       SER   2  -8.532   9.696   4.319
   14    HB2  SER   2           HB2      SER   2  -9.062   8.579   2.225
   15    HB3  SER   2           HB3      SER   2  -7.508   7.754   2.237
   16    HG   SER   2           HG       SER   2  -8.959   6.346   3.110
   17    H    LYS   3           H        LYS   3  -8.152   8.529   6.153
   18    HA   LYS   3           HA       LYS   3  -5.550   7.223   6.513
   19    HB2  LYS   3           HB2      LYS   3  -5.296   9.562   7.318
   20    HB3  LYS   3           HB3      LYS   3  -6.631   9.301   8.439
   21    HG2  LYS   3           HG2      LYS   3  -5.367   7.531   9.570
   22    HG3  LYS   3           HG3      LYS   3  -4.054   7.698   8.405
   23    HD2  LYS   3           HD2      LYS   3  -3.372   8.936  10.332
   24    HD3  LYS   3           HD3      LYS   3  -3.881  10.136   9.146
   25    HE2  LYS   3           HE2      LYS   3  -6.069  10.328  10.238
   26    HE3  LYS   3           HE3      LYS   3  -5.623   9.069  11.390
   27    HZ1  LYS   3           HZ1      LYS   3  -3.751  10.509  12.081
   28    HZ2  LYS   3           HZ2      LYS   3  -5.277  11.184  12.403
   29    HZ3  LYS   3           HZ3      LYS   3  -4.361  11.737  11.082
   30    H    GLY   4           H        GLY   4  -5.854   5.289   7.387
   31    HA2  GLY   4           HA2      GLY   4  -8.162   4.856   9.188
   32    HA3  GLY   4           HA3      GLY   4  -7.793   3.725   7.887
   33    H    ILE   5           H        ILE   5  -7.802   2.332   9.952
   34    HA   ILE   5           HA       ILE   5  -5.056   2.274  11.074
   35    HB   ILE   5           HB       ILE   5  -6.120   1.001  13.002
   36   HG12  ILE   5          HG12      ILE   5  -8.707   2.273  12.068
   37   HG13  ILE   5          HG13      ILE   5  -8.297   0.621  11.625
   38   HG21  ILE   5          HG21      ILE   5  -5.434   3.407  13.079
   39   HG22  ILE   5          HG22      ILE   5  -6.799   3.044  14.138
   40   HG23  ILE   5          HG23      ILE   5  -7.069   3.852  12.594
   41   HD11  ILE   5          HD11      ILE   5  -9.640   0.547  13.643
   42   HD12  ILE   5          HD12      ILE   5  -8.601   1.736  14.428
   43   HD13  ILE   5          HD13      ILE   5  -7.986   0.121  14.079
   44    H    VAL   6           H        VAL   6  -3.865   0.567  10.659
   45    HA   VAL   6           HA       VAL   6  -4.801  -1.447   8.892
   46    HB   VAL   6           HB       VAL   6  -2.226  -1.325  10.481
   47   HG11  VAL   6          HG11      VAL   6  -2.397  -3.565   9.742
   48   HG12  VAL   6          HG12      VAL   6  -1.463  -2.788   8.465
   49   HG13  VAL   6          HG13      VAL   6  -3.179  -3.103   8.233
   50   HG21  VAL   6          HG21      VAL   6  -1.257  -0.272   8.563
   51   HG22  VAL   6          HG22      VAL   6  -2.766   0.590   8.864
   52   HG23  VAL   6          HG23      VAL   6  -2.679  -0.608   7.573
   53    H    LYS   7           H        LYS   7  -5.843  -3.235   9.313
   54    HA   LYS   7           HA       LYS   7  -6.502  -4.097  11.950
   55    HB2  LYS   7           HB2      LYS   7  -7.921  -4.544   9.936
   56    HB3  LYS   7           HB3      LYS   7  -6.695  -5.675   9.365
   57    HG2  LYS   7           HG2      LYS   7  -6.968  -7.003  11.448
   58    HG3  LYS   7           HG3      LYS   7  -8.226  -5.890  11.978
   59    HD2  LYS   7           HD2      LYS   7  -8.386  -7.388   9.354
   60    HD3  LYS   7           HD3      LYS   7  -9.040  -8.038  10.857
   61    HE2  LYS   7           HE2      LYS   7 -10.436  -5.982  11.096
   62    HE3  LYS   7           HE3      LYS   7  -9.837  -5.426   9.533
   63    HZ1  LYS   7           HZ1      LYS   7 -11.646  -7.650  10.147
   64    HZ2  LYS   7           HZ2      LYS   7 -10.637  -7.778   8.786
   65    HZ3  LYS   7           HZ3      LYS   7 -11.739  -6.492   8.912
   66    H    TRP   8           H        TRP   8  -4.244  -5.245   9.468
   67    HA   TRP   8           HA       TRP   8  -2.402  -6.245  11.434
   68    HB2  TRP   8           HB2      TRP   8  -4.248  -8.048  11.127
   69    HB3  TRP   8           HB3      TRP   8  -3.511  -8.320   9.551
   70    HD1  TRP   8           HD1      TRP   8  -1.093  -9.371   9.480
   71    HE1  TRP   8           HE1      TRP   8   0.312 -10.625  11.241
   72    HE3  TRP   8           HE3      TRP   8  -3.719  -8.196  13.695
   73    HZ2  TRP   8           HZ2      TRP   8   0.317 -11.071  14.067
   74    HZ3  TRP   8           HZ3      TRP   8  -2.996  -9.049  15.907
   75    HH2  TRP   8           HH2      TRP   8  -0.982 -10.484  16.098
   76    H    PHE   9           H        PHE   9  -0.410  -5.892  10.610
   77    HA   PHE   9           HA       PHE   9  -0.141  -5.776   7.648
   78    HB2  PHE   9           HB2      PHE   9   0.337  -3.651   8.997
   79    HB3  PHE   9           HB3      PHE   9   1.752  -4.496   9.627
   80    HD1  PHE   9           HD1      PHE   9   0.266  -2.857   6.726
   81    HD2  PHE   9           HD2      PHE   9   3.554  -5.266   8.081
   82    HE1  PHE   9           HE1      PHE   9   1.505  -2.334   4.643
   83    HE2  PHE   9           HE2      PHE   9   4.792  -4.738   5.999
   84    HZ   PHE   9           HZ       PHE   9   3.770  -3.275   4.283
   85    H    ASN  10           H        ASN  10   1.072  -7.319   6.708
   86    HA   ASN  10           HA       ASN  10   3.067  -8.747   8.377
   87    HB2  ASN  10           HB2      ASN  10   1.292  -9.892   6.211
   88    HB3  ASN  10           HB3      ASN  10   2.587 -10.768   7.021
   89   HD21  ASN  10          HD21      ASN  10  -0.514 -11.035   7.054
   90   HD22  ASN  10          HD22      ASN  10  -0.878 -11.104   8.711
   91    H    SER  11           H        SER  11   4.863  -7.579   7.692
   92    HA   SER  11           HA       SER  11   5.445  -6.859   5.042
   93    HB2  SER  11           HB2      SER  11   7.288  -7.374   7.385
   94    HB3  SER  11           HB3      SER  11   7.779  -6.625   5.869
   95    HG   SER  11           HG       SER  11   6.094  -5.668   7.897
   96    H    ASP  12           H        ASP  12   6.208  -9.776   6.910
   97    HA   ASP  12           HA       ASP  12   8.029 -10.970   5.136
   98    HB2  ASP  12           HB2      ASP  12   6.019 -12.188   7.042
   99    HB3  ASP  12           HB3      ASP  12   7.196 -13.145   6.148
  100    H    LYS  13           H        LYS  13   4.490 -11.083   5.262
  101    HA   LYS  13           HA       LYS  13   4.213 -12.790   2.960
  102    HB2  LYS  13           HB2      LYS  13   2.231 -10.979   4.369
  103    HB3  LYS  13           HB3      LYS  13   1.816 -12.127   3.104
  104    HG2  LYS  13           HG2      LYS  13   3.212 -12.953   5.660
  105    HG3  LYS  13           HG3      LYS  13   1.457 -12.938   5.498
  106    HD2  LYS  13           HD2      LYS  13   3.260 -14.469   3.599
  107    HD3  LYS  13           HD3      LYS  13   2.583 -15.184   5.061
  108    HE2  LYS  13           HE2      LYS  13   0.296 -14.587   4.244
  109    HE3  LYS  13           HE3      LYS  13   1.018 -14.015   2.740
  110    HZ1  LYS  13           HZ1      LYS  13   0.173 -16.373   2.752
  111    HZ2  LYS  13           HZ2      LYS  13   1.474 -16.748   3.779
  112    HZ3  LYS  13           HZ3      LYS  13   1.766 -16.157   2.212
  113    H    GLY  14           H        GLY  14   4.519  -9.387   3.570
  114    HA2  GLY  14           HA2      GLY  14   5.205  -7.758   2.016
  115    HA3  GLY  14           HA3      GLY  14   4.718  -8.827   0.708
  116    H    PHE  15           H        PHE  15   2.270  -8.694   3.044
  117    HA   PHE  15           HA       PHE  15   1.006  -6.266   2.109
  118    HB2  PHE  15           HB2      PHE  15  -0.982  -7.374   1.163
  119    HB3  PHE  15           HB3      PHE  15   0.475  -7.736   0.239
  120    HD1  PHE  15           HD1      PHE  15  -2.037  -9.084   2.586
  121    HD2  PHE  15           HD2      PHE  15   1.438  -9.969   0.221
  122    HE1  PHE  15           HE1      PHE  15  -2.443 -11.511   2.898
  123    HE2  PHE  15           HE2      PHE  15   1.034 -12.394   0.535
  124    HZ   PHE  15           HZ       PHE  15  -0.905 -13.166   1.874
  125    H    GLY  16           H        GLY  16  -1.305  -6.143   2.971
  126    HA2  GLY  16           HA2      GLY  16  -1.915  -7.673   5.337
  127    HA3  GLY  16           HA3      GLY  16  -1.372  -6.035   5.688
  128    H    PHE  17           H        PHE  17  -3.803  -6.499   6.534
  129    HA   PHE  17           HA       PHE  17  -5.639  -5.373   4.497
  130    HB2  PHE  17           HB2      PHE  17  -6.256  -7.123   6.896
  131    HB3  PHE  17           HB3      PHE  17  -7.470  -6.381   5.855
  132    HD1  PHE  17           HD1      PHE  17  -4.878  -8.976   6.112
  133    HD2  PHE  17           HD2      PHE  17  -7.782  -7.130   3.540
  134    HE1  PHE  17           HE1      PHE  17  -4.683 -10.875   4.528
  135    HE2  PHE  17           HE2      PHE  17  -7.587  -9.029   1.958
  136    HZ   PHE  17           HZ       PHE  17  -6.037 -10.902   2.451
  137    H    ILE  18           H        ILE  18  -6.651  -3.465   4.985
  138    HA   ILE  18           HA       ILE  18  -6.104  -2.354   7.662
  139    HB   ILE  18           HB       ILE  18  -4.885  -1.176   5.899
  140   HG12  ILE  18          HG12      ILE  18  -7.149   0.627   6.786
  141   HG13  ILE  18          HG13      ILE  18  -5.962   0.010   7.936
  142   HG21  ILE  18          HG21      ILE  18  -6.359   0.231   4.301
  143   HG22  ILE  18          HG22      ILE  18  -7.651  -0.896   4.716
  144   HG23  ILE  18          HG23      ILE  18  -6.181  -1.486   3.945
  145   HD11  ILE  18          HD11      ILE  18  -5.386   2.271   6.974
  146   HD12  ILE  18          HD12      ILE  18  -5.222   1.489   5.400
  147   HD13  ILE  18          HD13      ILE  18  -4.152   1.037   6.725
  148    H    THR  19           H        THR  19  -7.625  -1.231   8.754
  149    HA   THR  19           HA       THR  19 -10.389  -1.788   7.972
  150    HB   THR  19           HB       THR  19  -9.267  -0.891  10.630
  151    HG1  THR  19           HG1      THR  19  -9.085  -2.954  11.095
  152   HG21  THR  19          HG21      THR  19 -11.994  -1.923   9.792
  153   HG22  THR  19          HG22      THR  19 -11.620  -0.315  10.411
  154   HG23  THR  19          HG23      THR  19 -11.483  -1.721  11.469
  155    HA   PRO  20           HA       PRO  20 -10.329   2.642   6.694
  156    HB2  PRO  20           HB2      PRO  20 -13.224   1.955   6.337
  157    HB3  PRO  20           HB3      PRO  20 -12.139   2.844   5.250
  158    HG2  PRO  20           HG2      PRO  20 -12.764   0.365   4.696
  159    HG3  PRO  20           HG3      PRO  20 -11.085   0.908   4.519
  160    HD2  PRO  20           HD2      PRO  20 -12.300  -0.741   6.719
  161    HD3  PRO  20           HD3      PRO  20 -10.719  -0.912   5.921
  162    H    GLU  21           H        GLU  21 -10.655   4.388   7.918
  163    HA   GLU  21           HA       GLU  21 -11.607   4.275  10.557
  164    HB2  GLU  21           HB2      GLU  21  -9.988   5.950   9.773
  165    HB3  GLU  21           HB3      GLU  21 -11.216   6.669   8.737
  166    HG2  GLU  21           HG2      GLU  21 -11.043   7.982  10.780
  167    HG3  GLU  21           HG3      GLU  21 -12.596   7.143  10.750
  168    H    ASP  22           H        ASP  22 -13.134   5.395   7.559
  169    HA   ASP  22           HA       ASP  22 -15.491   6.443   8.717
  170    HB2  ASP  22           HB2      ASP  22 -14.881   5.403   5.950
  171    HB3  ASP  22           HB3      ASP  22 -16.428   6.121   6.381
  172    H    GLY  23           H        GLY  23 -14.477   3.194   8.307
  173    HA2  GLY  23           HA2      GLY  23 -15.646   1.381   9.344
  174    HA3  GLY  23           HA3      GLY  23 -17.159   2.239   9.069
  175    H    SER  24           H        SER  24 -15.114   2.424   6.372
  176    HA   SER  24           HA       SER  24 -16.864   0.856   4.737
  177    HB2  SER  24           HB2      SER  24 -14.151   2.061   4.163
  178    HB3  SER  24           HB3      SER  24 -15.195   1.328   2.957
  179    HG   SER  24           HG       SER  24 -15.447   3.620   3.126
  180    H    LYS  25           H        LYS  25 -15.979  -0.886   3.274
  181    HA   LYS  25           HA       LYS  25 -15.088  -3.084   4.808
  182    HB2  LYS  25           HB2      LYS  25 -15.213  -2.668   1.813
  183    HB3  LYS  25           HB3      LYS  25 -14.849  -4.214   2.580
  184    HG2  LYS  25           HG2      LYS  25 -17.012  -4.136   3.769
  185    HG3  LYS  25           HG3      LYS  25 -17.378  -2.592   3.000
  186    HD2  LYS  25           HD2      LYS  25 -17.262  -3.664   0.781
  187    HD3  LYS  25           HD3      LYS  25 -16.895  -5.210   1.546
  188    HE2  LYS  25           HE2      LYS  25 -19.053  -5.143   2.734
  189    HE3  LYS  25           HE3      LYS  25 -19.424  -3.593   1.979
  190    HZ1  LYS  25           HZ1      LYS  25 -19.034  -6.198   0.612
  191    HZ2  LYS  25           HZ2      LYS  25 -19.192  -4.713  -0.199
  192    HZ3  LYS  25           HZ3      LYS  25 -20.477  -5.316   0.736
  193    H    ASP  26           H        ASP  26 -13.114  -4.234   4.776
  194    HA   ASP  26           HA       ASP  26 -10.791  -2.734   4.963
  195    HB2  ASP  26           HB2      ASP  26 -11.222  -5.684   4.523
  196    HB3  ASP  26           HB3      ASP  26  -9.633  -4.985   4.807
  197    H    LEU  27           H        LEU  27  -9.061  -2.350   3.689
  198    HA   LEU  27           HA       LEU  27  -9.357  -2.936   0.800
  199    HB2  LEU  27           HB2      LEU  27  -7.966  -0.587   2.129
  200    HB3  LEU  27           HB3      LEU  27  -8.081  -0.866   0.396
  201    HG   LEU  27           HG       LEU  27 -10.492  -0.520   2.211
  202   HD11  LEU  27          HD11      LEU  27 -10.636   1.749   1.346
  203   HD12  LEU  27          HD12      LEU  27  -9.232   1.484   0.313
  204   HD13  LEU  27          HD13      LEU  27  -9.043   1.524   2.066
  205   HD21  LEU  27          HD21      LEU  27 -11.628  -0.087   0.006
  206   HD22  LEU  27          HD22      LEU  27 -11.021  -1.734   0.166
  207   HD23  LEU  27          HD23      LEU  27 -10.136  -0.559  -0.806
  208    H    PHE  28           H        PHE  28  -7.476  -3.513  -0.359
  209    HA   PHE  28           HA       PHE  28  -5.519  -4.982   1.169
  210    HB2  PHE  28           HB2      PHE  28  -5.845  -4.443  -1.789
  211    HB3  PHE  28           HB3      PHE  28  -4.541  -5.429  -1.120
  212    HD1  PHE  28           HD1      PHE  28  -8.169  -5.201  -1.708
  213    HD2  PHE  28           HD2      PHE  28  -4.994  -7.597  -0.090
  214    HE1  PHE  28           HE1      PHE  28  -9.694  -7.156  -1.611
  215    HE2  PHE  28           HE2      PHE  28  -6.516  -9.550   0.007
  216    HZ   PHE  28           HZ       PHE  28  -8.864  -9.331  -0.755
  217    H    VAL  29           H        VAL  29  -3.498  -4.379   1.722
  218    HA   VAL  29           HA       VAL  29  -2.380  -1.901   0.563
  219    HB   VAL  29           HB       VAL  29  -2.353  -2.716   3.480
  220   HG11  VAL  29          HG11      VAL  29  -0.276  -1.537   2.633
  221   HG12  VAL  29          HG12      VAL  29  -1.133  -0.689   3.919
  222   HG13  VAL  29          HG13      VAL  29  -1.308  -0.162   2.248
  223   HG21  VAL  29          HG21      VAL  29  -3.895  -1.002   3.918
  224   HG22  VAL  29          HG22      VAL  29  -4.506  -1.693   2.416
  225   HG23  VAL  29          HG23      VAL  29  -3.580  -0.193   2.386
  226    H    HIS  30           H        HIS  30  -0.293  -2.127  -0.110
  227    HA   HIS  30           HA       HIS  30   1.114  -4.628   0.619
  228    HB2  HIS  30           HB2      HIS  30   1.369  -2.923  -1.868
  229    HB3  HIS  30           HB3      HIS  30   2.356  -4.339  -1.511
  230    HD2  HIS  30           HD2      HIS  30  -0.989  -3.542  -3.174
  231    HE1  HIS  30           HE1      HIS  30  -1.105  -7.662  -2.261
  232    HE2  HIS  30           HE2      HIS  30  -2.253  -5.797  -3.546
  233    H    HIS  31           H        HIS  31   3.213  -4.589   1.234
  234    HA   HIS  31           HA       HIS  31   4.179  -2.326   2.647
  235    HB2  HIS  31           HB2      HIS  31   4.782  -4.706   3.166
  236    HB3  HIS  31           HB3      HIS  31   5.779  -4.725   1.710
  237    HD2  HIS  31           HD2      HIS  31   5.915  -3.341   5.363
  238    HE1  HIS  31           HE1      HIS  31   9.476  -2.165   3.422
  239    HE2  HIS  31           HE2      HIS  31   8.276  -2.268   5.658
  240    H    SER  32           H        SER  32   5.097  -3.751  -0.460
  241    HA   SER  32           HA       SER  32   7.180  -1.912  -1.052
  242    HB2  SER  32           HB2      SER  32   7.132  -2.881  -3.282
  243    HB3  SER  32           HB3      SER  32   6.994  -4.151  -2.069
  244    HG   SER  32           HG       SER  32   5.462  -4.230  -3.873
  245    H    GLU  33           H        GLU  33   3.814  -1.439  -1.088
  246    HA   GLU  33           HA       GLU  33   3.558   0.243  -3.374
  247    HB2  GLU  33           HB2      GLU  33   1.679  -0.890  -2.101
  248    HB3  GLU  33           HB3      GLU  33   1.861   0.365  -0.879
  249    HG2  GLU  33           HG2      GLU  33   0.120   1.053  -2.421
  250    HG3  GLU  33           HG3      GLU  33   1.526   2.083  -2.676
  251    H    ILE  34           H        ILE  34   4.674   0.820  -0.103
  252    HA   ILE  34           HA       ILE  34   4.301   3.606   0.047
  253    HB   ILE  34           HB       ILE  34   4.892   2.196   1.986
  254   HG12  ILE  34          HG12      ILE  34   7.106   4.225   1.598
  255   HG13  ILE  34          HG13      ILE  34   5.431   4.724   1.816
  256   HG21  ILE  34          HG21      ILE  34   6.962   1.135   2.258
  257   HG22  ILE  34          HG22      ILE  34   7.766   2.161   1.069
  258   HG23  ILE  34          HG23      ILE  34   6.663   0.897   0.538
  259   HD11  ILE  34          HD11      ILE  34   5.327   3.558   3.965
  260   HD12  ILE  34          HD12      ILE  34   6.696   4.672   3.966
  261   HD13  ILE  34          HD13      ILE  34   6.965   2.945   3.736
  262    H    GLN  35           H        GLN  35   5.417   5.327  -0.693
  263    HA   GLN  35           HA       GLN  35   7.660   4.799  -2.543
  264    HB2  GLN  35           HB2      GLN  35   5.607   5.919  -3.462
  265    HB3  GLN  35           HB3      GLN  35   5.904   7.262  -2.361
  266    HG2  GLN  35           HG2      GLN  35   8.093   7.659  -3.393
  267    HG3  GLN  35           HG3      GLN  35   7.859   6.276  -4.460
  268   HE21  GLN  35          HE21      GLN  35   8.062   9.334  -4.976
  269   HE22  GLN  35          HE22      GLN  35   6.715   9.656  -5.958
  270    H    SER  36           H        SER  36   9.587   5.157  -1.671
  271    HA   SER  36           HA       SER  36  11.306   6.058  -0.449
  272    HB2  SER  36           HB2      SER  36  10.665   8.058  -1.839
  273    HB3  SER  36           HB3      SER  36   9.669   8.601  -0.493
  274    HG   SER  36           HG       SER  36  12.457   8.386  -0.714
  275    H    GLY  37           H        GLY  37  11.901   7.032   1.656
  276    HA2  GLY  37           HA2      GLY  37  11.672   7.319   3.935
  277    HA3  GLY  37           HA3      GLY  37   9.934   7.441   3.695
  278    H    GLY  38           H        GLY  38  11.355   4.602   2.378
  279    HA2  GLY  38           HA2      GLY  38  10.024   2.962   4.397
  280    HA3  GLY  38           HA3      GLY  38  10.674   2.404   2.863
  281    H    GLU  39           H        GLU  39  13.044   4.299   4.230
  282    HA   GLU  39           HA       GLU  39  14.805   2.155   4.729
  283    HB2  GLU  39           HB2      GLU  39  14.905   5.071   5.523
  284    HB3  GLU  39           HB3      GLU  39  16.229   3.945   5.812
  285    HG2  GLU  39           HG2      GLU  39  15.029   4.569   3.095
  286    HG3  GLU  39           HG3      GLU  39  16.547   5.217   3.704
  287    H    TYR  40           H        TYR  40  12.846   4.155   6.911
  288    HA   TYR  40           HA       TYR  40  13.488   2.270   9.110
  289    HB2  TYR  40           HB2      TYR  40  12.905   5.232   9.290
  290    HB3  TYR  40           HB3      TYR  40  13.104   4.155  10.672
  291    HD1  TYR  40           HD1      TYR  40  14.809   5.924   7.949
  292    HD2  TYR  40           HD2      TYR  40  15.291   3.116  11.163
  293    HE1  TYR  40           HE1      TYR  40  17.270   6.197   7.817
  294    HE2  TYR  40           HE2      TYR  40  17.752   3.387  11.032
  295    HH   TYR  40           HH       TYR  40  19.383   4.279   8.758
  296    H    ALA  41           H        ALA  41  11.000   3.839   7.273
  297    HA   ALA  41           HA       ALA  41   8.849   3.696   9.079
  298    HB1  ALA  41           HB1      ALA  41   8.840   3.477   6.061
  299    HB2  ALA  41           HB2      ALA  41   8.710   4.965   6.999
  300    HB3  ALA  41           HB3      ALA  41   7.418   3.767   7.063
  301    H    THR  42           H        THR  42   7.737   2.073   9.878
  302    HA   THR  42           HA       THR  42   7.709  -0.527   8.476
  303    HB   THR  42           HB       THR  42   7.898  -1.677  10.651
  304    HG1  THR  42           HG1      THR  42   8.204  -0.550  12.478
  305   HG21  THR  42          HG21      THR  42  10.314  -0.976  11.129
  306   HG22  THR  42          HG22      THR  42  10.099   0.240   9.869
  307   HG23  THR  42          HG23      THR  42   9.957  -1.473   9.476
  308    H    LEU  43           H        LEU  43   5.904  -1.926   9.164
  309    HA   LEU  43           HA       LEU  43   3.629  -0.475  10.344
  310    HB2  LEU  43           HB2      LEU  43   3.491  -2.085   7.786
  311    HB3  LEU  43           HB3      LEU  43   2.119  -1.370   8.613
  312    HG   LEU  43           HG       LEU  43   4.469   0.226   7.542
  313   HD11  LEU  43          HD11      LEU  43   1.758  -0.400   6.342
  314   HD12  LEU  43          HD12      LEU  43   3.343  -0.757   5.653
  315   HD13  LEU  43          HD13      LEU  43   2.789   0.913   5.773
  316   HD21  LEU  43          HD21      LEU  43   1.792   0.933   8.767
  317   HD22  LEU  43          HD22      LEU  43   2.643   2.071   7.720
  318   HD23  LEU  43          HD23      LEU  43   3.392   1.520   9.215
  319    H    ALA  44           H        ALA  44   2.135  -1.805  11.428
  320    HA   ALA  44           HA       ALA  44   2.653  -4.689  11.551
  321    HB1  ALA  44           HB1      ALA  44   2.492  -3.115  14.116
  322    HB2  ALA  44           HB2      ALA  44   4.038  -3.374  13.307
  323    HB3  ALA  44           HB3      ALA  44   3.093  -4.755  13.864
  324    H    ASP  45           H        ASP  45   0.957  -5.056  13.919
  325    HA   ASP  45           HA       ASP  45  -1.615  -4.771  12.610
  326    HB2  ASP  45           HB2      ASP  45  -2.445  -6.158  14.477
  327    HB3  ASP  45           HB3      ASP  45  -1.070  -6.898  13.666
  328    H    GLY  46           H        GLY  46  -2.725  -2.960  12.816
  329    HA2  GLY  46           HA2      GLY  46  -4.111  -1.515  14.119
  330    HA3  GLY  46           HA3      GLY  46  -3.019  -1.733  15.478
  331    H    GLN  47           H        GLN  47  -1.125  -1.267  12.778
  332    HA   GLN  47           HA       GLN  47  -0.214   1.292  13.585
  333    HB2  GLN  47           HB2      GLN  47   1.147  -0.466  12.442
  334    HB3  GLN  47           HB3      GLN  47   0.256  -0.137  10.960
  335    HG2  GLN  47           HG2      GLN  47   2.385   1.078  10.975
  336    HG3  GLN  47           HG3      GLN  47   1.038   2.201  11.009
  337   HE21  GLN  47          HE21      GLN  47   1.502   3.900  12.419
  338   HE22  GLN  47          HE22      GLN  47   2.329   3.744  13.893
  339    H    THR  48           H        THR  48  -0.782   3.285  12.969
  340    HA   THR  48           HA       THR  48  -3.089   3.636  11.227
  341    HB   THR  48           HB       THR  48  -1.433   5.700  12.717
  342    HG1  THR  48           HG1      THR  48  -2.400   4.273  14.141
  343   HG21  THR  48          HG21      THR  48  -2.903   6.462  10.764
  344   HG22  THR  48          HG22      THR  48  -3.243   7.210  12.324
  345   HG23  THR  48          HG23      THR  48  -4.280   5.920  11.721
  346    H    VAL  49           H        VAL  49  -3.003   4.206   9.150
  347    HA   VAL  49           HA       VAL  49  -0.565   5.469   8.085
  348    HB   VAL  49           HB       VAL  49  -0.548   3.946   6.137
  349   HG11  VAL  49          HG11      VAL  49   0.257   1.907   7.395
  350   HG12  VAL  49          HG12      VAL  49  -0.306   2.678   8.878
  351   HG13  VAL  49          HG13      VAL  49   0.978   3.426   7.926
  352   HG21  VAL  49          HG21      VAL  49  -2.700   2.508   7.717
  353   HG22  VAL  49          HG22      VAL  49  -1.823   1.780   6.369
  354   HG23  VAL  49          HG23      VAL  49  -2.848   3.190   6.098
  355    H    GLU  50           H        GLU  50  -0.857   6.210   5.819
  356    HA   GLU  50           HA       GLU  50  -3.630   7.137   5.330
  357    HB2  GLU  50           HB2      GLU  50  -1.037   8.590   4.727
  358    HB3  GLU  50           HB3      GLU  50  -2.650   9.156   4.292
  359    HG2  GLU  50           HG2      GLU  50  -3.275   9.200   6.683
  360    HG3  GLU  50           HG3      GLU  50  -1.656   8.652   7.114
  361    H    TYR  51           H        TYR  51  -4.394   6.906   3.238
  362    HA   TYR  51           HA       TYR  51  -2.593   6.116   1.098
  363    HB2  TYR  51           HB2      TYR  51  -3.699   3.957   0.679
  364    HB3  TYR  51           HB3      TYR  51  -2.912   3.985   2.254
  365    HD1  TYR  51           HD1      TYR  51  -6.143   3.998   0.482
  366    HD2  TYR  51           HD2      TYR  51  -4.224   4.037   4.324
  367    HE1  TYR  51           HE1      TYR  51  -8.306   3.460   1.567
  368    HE2  TYR  51           HE2      TYR  51  -6.386   3.495   5.409
  369    HH   TYR  51           HH       TYR  51  -8.620   2.261   4.538
  370    H    GLU  52           H        GLU  52  -3.721   5.696  -0.939
  371    HA   GLU  52           HA       GLU  52  -6.251   7.215  -1.164
  372    HB2  GLU  52           HB2      GLU  52  -4.282   8.388  -2.170
  373    HB3  GLU  52           HB3      GLU  52  -4.032   6.995  -3.224
  374    HG2  GLU  52           HG2      GLU  52  -6.270   7.311  -4.198
  375    HG3  GLU  52           HG3      GLU  52  -6.554   8.679  -3.124
  376    H    VAL  53           H        VAL  53  -7.912   6.072  -1.952
  377    HA   VAL  53           HA       VAL  53  -7.817   3.320  -2.437
  378    HB   VAL  53           HB       VAL  53  -9.869   4.568  -1.840
  379   HG11  VAL  53          HG11      VAL  53  -9.863   5.514  -4.722
  380   HG12  VAL  53          HG12      VAL  53  -9.441   6.527  -3.341
  381   HG13  VAL  53          HG13      VAL  53 -11.073   5.878  -3.491
  382   HG21  VAL  53          HG21      VAL  53  -9.886   2.307  -3.042
  383   HG22  VAL  53          HG22      VAL  53 -10.273   3.202  -4.510
  384   HG23  VAL  53          HG23      VAL  53 -11.377   3.244  -3.135
  385    H    GLY  54           H        GLY  54  -7.937   2.083  -4.305
  386    HA2  GLY  54           HA2      GLY  54  -7.271   3.387  -6.868
  387    HA3  GLY  54           HA3      GLY  54  -6.272   2.059  -6.279
  388    H    GLN  55           H        GLN  55  -7.847   2.117  -8.726
  389    HA   GLN  55           HA       GLN  55 -10.134   0.379  -8.229
  390    HB2  GLN  55           HB2      GLN  55 -10.178   2.209  -9.949
  391    HB3  GLN  55           HB3      GLN  55  -8.988   1.297 -10.877
  392    HG2  GLN  55           HG2      GLN  55 -11.229   0.814 -11.726
  393    HG3  GLN  55           HG3      GLN  55 -10.567  -0.627 -10.962
  394   HE21  GLN  55          HE21      GLN  55 -12.184  -1.665  -9.792
  395   HE22  GLN  55          HE22      GLN  55 -13.375  -0.883  -8.872
  396    H    GLY  56           H        GLY  56 -10.101  -1.764  -8.325
  397    HA2  GLY  56           HA2      GLY  56  -7.924  -3.132  -9.781
  398    HA3  GLY  56           HA3      GLY  56  -8.312  -3.598  -8.127
  399    H    GLN  57           H        GLN  57  -8.480  -5.139 -10.665
  400    HA   GLN  57           HA       GLN  57 -11.166  -5.464 -11.485
  401    HB2  GLN  57           HB2      GLN  57  -8.782  -7.317 -11.591
  402    HB3  GLN  57           HB3      GLN  57 -10.341  -7.700 -12.325
  403    HG2  GLN  57           HG2      GLN  57 -10.223  -5.758 -13.757
  404    HG3  GLN  57           HG3      GLN  57  -8.785  -5.174 -12.923
  405   HE21  GLN  57          HE21      GLN  57  -9.131  -5.936 -15.829
  406   HE22  GLN  57          HE22      GLN  57  -7.953  -7.124 -16.116
  407    H    LYS  58           H        LYS  58  -9.238  -7.122  -9.002
  408    HA   LYS  58           HA       LYS  58 -11.479  -8.830  -8.254
  409    HB2  LYS  58           HB2      LYS  58  -8.687  -8.536  -7.131
  410    HB3  LYS  58           HB3      LYS  58  -9.878  -9.691  -6.536
  411    HG2  LYS  58           HG2      LYS  58 -10.044 -10.657  -8.829
  412    HG3  LYS  58           HG3      LYS  58  -8.777  -9.555  -9.359
  413    HD2  LYS  58           HD2      LYS  58  -8.401 -11.507  -7.074
  414    HD3  LYS  58           HD3      LYS  58  -8.000 -11.902  -8.743
  415    HE2  LYS  58           HE2      LYS  58  -6.854  -9.554  -7.195
  416    HE3  LYS  58           HE3      LYS  58  -6.021 -11.082  -7.473
  417    HZ1  LYS  58           HZ1      LYS  58  -5.253  -9.793  -9.193
  418    HZ2  LYS  58           HZ2      LYS  58  -6.729  -8.976  -9.400
  419    HZ3  LYS  58           HZ3      LYS  58  -6.559 -10.579  -9.935
  420    H    GLY  59           H        GLY  59 -10.125  -5.799  -7.296
  421    HA2  GLY  59           HA2      GLY  59 -12.183  -4.892  -5.739
  422    HA3  GLY  59           HA3      GLY  59 -11.149  -5.761  -4.605
  423    HA   PRO  60           HA       PRO  60  -9.418  -1.425  -5.636
  424    HB2  PRO  60           HB2      PRO  60 -10.128   0.014  -3.450
  425    HB3  PRO  60           HB3      PRO  60 -11.175  -0.132  -4.877
  426    HG2  PRO  60           HG2      PRO  60 -11.287  -1.623  -2.296
  427    HG3  PRO  60           HG3      PRO  60 -12.602  -0.888  -3.227
  428    HD2  PRO  60           HD2      PRO  60 -12.058  -3.557  -3.334
  429    HD3  PRO  60           HD3      PRO  60 -12.713  -2.664  -4.725
  430    H    CYS  61           H        CYS  61  -7.530  -0.558  -4.765
  431    HA   CYS  61           HA       CYS  61  -6.383  -1.971  -2.428
  432    HB2  CYS  61           HB2      CYS  61  -4.956  -1.036  -4.931
  433    HB3  CYS  61           HB3      CYS  61  -4.189  -1.787  -3.534
  434    HG   CYS  61           HG       CYS  61  -5.048  -4.026  -4.236
  435    H    ALA  62           H        ALA  62  -4.280  -0.604  -1.742
  436    HA   ALA  62           HA       ALA  62  -5.157   2.215  -1.509
  437    HB1  ALA  62           HB1      ALA  62  -4.167   0.244   0.466
  438    HB2  ALA  62           HB2      ALA  62  -5.263   1.605   0.688
  439    HB3  ALA  62           HB3      ALA  62  -3.522   1.877   0.628
  440    H    ASN  63           H        ASN  63  -3.707   3.776  -2.080
  441    HA   ASN  63           HA       ASN  63  -0.977   2.910  -2.824
  442    HB2  ASN  63           HB2      ASN  63  -2.514   3.568  -4.720
  443    HB3  ASN  63           HB3      ASN  63  -2.543   5.193  -4.039
  444   HD21  ASN  63          HD21      ASN  63  -1.372   6.182  -5.797
  445   HD22  ASN  63          HD22      ASN  63   0.263   5.840  -6.100
  446    H    LYS  64           H        LYS  64   0.683   4.589  -2.664
  447    HA   LYS  64           HA       LYS  64   1.880   6.113  -1.438
  448    HB2  LYS  64           HB2      LYS  64  -0.829   7.467  -1.335
  449    HB3  LYS  64           HB3      LYS  64   0.685   8.220  -0.837
  450    HG2  LYS  64           HG2      LYS  64   1.601   7.945  -3.091
  451    HG3  LYS  64           HG3      LYS  64   0.145   7.093  -3.603
  452    HD2  LYS  64           HD2      LYS  64  -0.126   9.337  -4.372
  453    HD3  LYS  64           HD3      LYS  64  -1.151   9.200  -2.945
  454    HE2  LYS  64           HE2      LYS  64   0.103  11.283  -2.814
  455    HE3  LYS  64           HE3      LYS  64   0.704  10.181  -1.575
  456    HZ1  LYS  64           HZ1      LYS  64   1.935  10.438  -4.260
  457    HZ2  LYS  64           HZ2      LYS  64   2.567   9.637  -2.900
  458    HZ3  LYS  64           HZ3      LYS  64   2.451  11.332  -2.914
  459    H    VAL  65           H        VAL  65   1.394   3.931  -0.020
  460    HA   VAL  65           HA       VAL  65   0.026   4.405   2.463
  461    HB   VAL  65           HB       VAL  65   2.036   2.258   1.701
  462   HG11  VAL  65          HG11      VAL  65   0.044   2.371   3.989
  463   HG12  VAL  65          HG12      VAL  65   1.794   2.521   4.150
  464   HG13  VAL  65          HG13      VAL  65   1.087   1.002   3.599
  465   HG21  VAL  65          HG21      VAL  65  -0.131   2.421   0.352
  466   HG22  VAL  65          HG22      VAL  65  -0.981   2.038   1.849
  467   HG23  VAL  65          HG23      VAL  65   0.157   0.880   1.158
  468    H    VAL  66           H        VAL  66   0.748   5.566   4.083
  469    HA   VAL  66           HA       VAL  66   3.626   5.653   4.676
  470    HB   VAL  66           HB       VAL  66   3.173   7.623   3.266
  471   HG11  VAL  66          HG11      VAL  66   0.768   7.870   3.912
  472   HG12  VAL  66          HG12      VAL  66   1.671   9.383   3.994
  473   HG13  VAL  66          HG13      VAL  66   1.292   8.502   5.474
  474   HG21  VAL  66          HG21      VAL  66   4.087   9.325   4.799
  475   HG22  VAL  66          HG22      VAL  66   4.879   7.769   5.048
  476   HG23  VAL  66          HG23      VAL  66   3.647   8.322   6.182
  477    H    ALA  67           H        ALA  67   4.070   5.487   6.770
  478    HA   ALA  67           HA       ALA  67   1.952   5.108   8.675
  479    HB1  ALA  67           HB1      ALA  67   4.950   5.003   8.768
  480    HB2  ALA  67           HB2      ALA  67   3.782   3.718   9.074
  481    HB3  ALA  67           HB3      ALA  67   4.017   4.998  10.266
  482    H    VAL  68           H        VAL  68   1.381   6.368  10.408
  483    HA   VAL  68           HA       VAL  68   1.737   9.202  10.127
  484    HB   VAL  68           HB       VAL  68   0.545   7.659  12.457
  485   HG11  VAL  68          HG11      VAL  68   0.050  10.514  11.563
  486   HG12  VAL  68          HG12      VAL  68   1.165  10.078  12.857
  487   HG13  VAL  68          HG13      VAL  68  -0.557   9.734  13.024
  488   HG21  VAL  68          HG21      VAL  68  -0.682   8.747   9.906
  489   HG22  VAL  68          HG22      VAL  68  -1.635   8.290  11.318
  490   HG23  VAL  68          HG23      VAL  68  -0.684   7.074  10.466
  Start of MODEL   15
    1    H1   MET   1           HT1      MET   1  -6.926  13.923   1.140
    2    H2   MET   1           HT2      MET   1  -7.003  14.020   2.834
    3    H3   MET   1           HT3      MET   1  -8.069  13.004   1.987
    4    HA   MET   1           HA       MET   1  -5.916  11.880   1.138
    5    HB2  MET   1           HB2      MET   1  -4.493  13.666   2.205
    6    HB3  MET   1           HB3      MET   1  -5.013  13.069   3.779
    7    HG2  MET   1           HG2      MET   1  -4.083  10.844   3.247
    8    HG3  MET   1           HG3      MET   1  -3.564  11.438   1.671
    9    HE1  MET   1           HE1      MET   1  -0.796  13.880   2.277
   10    HE2  MET   1           HE2      MET   1  -2.491  14.351   2.159
   11    HE3  MET   1           HE3      MET   1  -1.881  13.028   1.169
   12    H    SER   2           H        SER   2  -7.155  10.084   1.360
   13    HA   SER   2           HA       SER   2  -8.605   9.344   3.671
   14    HB2  SER   2           HB2      SER   2  -9.184   8.438   1.495
   15    HB3  SER   2           HB3      SER   2  -7.609   7.667   1.356
   16    HG   SER   2           HG       SER   2  -8.733   6.069   2.208
   17    H    LYS   3           H        LYS   3  -8.155   7.999   5.347
   18    HA   LYS   3           HA       LYS   3  -5.705   6.480   5.530
   19    HB2  LYS   3           HB2      LYS   3  -4.779   7.680   7.459
   20    HB3  LYS   3           HB3      LYS   3  -4.865   8.734   6.050
   21    HG2  LYS   3           HG2      LYS   3  -6.977   9.705   6.911
   22    HG3  LYS   3           HG3      LYS   3  -6.857   8.669   8.337
   23    HD2  LYS   3           HD2      LYS   3  -4.666   9.712   8.882
   24    HD3  LYS   3           HD3      LYS   3  -4.857  10.790   7.499
   25    HE2  LYS   3           HE2      LYS   3  -6.788  10.610   9.832
   26    HE3  LYS   3           HE3      LYS   3  -5.565  11.865   9.629
   27    HZ1  LYS   3           HZ1      LYS   3  -8.027  11.401   8.099
   28    HZ2  LYS   3           HZ2      LYS   3  -6.700  12.121   7.316
   29    HZ3  LYS   3           HZ3      LYS   3  -7.380  12.855   8.690
   30    H    GLY   4           H        GLY   4  -5.736   4.988   7.223
   31    HA2  GLY   4           HA2      GLY   4  -7.998   5.019   9.088
   32    HA3  GLY   4           HA3      GLY   4  -7.907   3.673   7.957
   33    H    ILE   5           H        ILE   5  -7.766   2.332   9.878
   34    HA   ILE   5           HA       ILE   5  -5.027   2.289  11.018
   35    HB   ILE   5           HB       ILE   5  -6.078   1.038  12.951
   36   HG12  ILE   5          HG12      ILE   5  -8.693   2.212  11.963
   37   HG13  ILE   5          HG13      ILE   5  -8.232   0.556  11.587
   38   HG21  ILE   5          HG21      ILE   5  -5.447   3.380  13.162
   39   HG22  ILE   5          HG22      ILE   5  -6.989   3.128  13.981
   40   HG23  ILE   5          HG23      ILE   5  -6.950   3.889  12.392
   41   HD11  ILE   5          HD11      ILE   5  -9.591   0.508  13.587
   42   HD12  ILE   5          HD12      ILE   5  -8.611   1.768  14.339
   43   HD13  ILE   5          HD13      ILE   5  -7.928   0.165  14.064
   44    H    VAL   6           H        VAL   6  -3.839   0.568  10.641
   45    HA   VAL   6           HA       VAL   6  -4.745  -1.427   8.844
   46    HB   VAL   6           HB       VAL   6  -2.209  -1.341  10.498
   47   HG11  VAL   6          HG11      VAL   6  -3.128  -3.098   8.218
   48   HG12  VAL   6          HG12      VAL   6  -2.376  -3.574   9.740
   49   HG13  VAL   6          HG13      VAL   6  -1.412  -2.798   8.488
   50   HG21  VAL   6          HG21      VAL   6  -2.692   0.588   8.880
   51   HG22  VAL   6          HG22      VAL   6  -2.581  -0.603   7.583
   52   HG23  VAL   6          HG23      VAL   6  -1.184  -0.284   8.611
   53    H    LYS   7           H        LYS   7  -5.803  -3.214   9.228
   54    HA   LYS   7           HA       LYS   7  -6.558  -4.085  11.833
   55    HB2  LYS   7           HB2      LYS   7  -7.921  -4.508   9.792
   56    HB3  LYS   7           HB3      LYS   7  -6.671  -5.606   9.206
   57    HG2  LYS   7           HG2      LYS   7  -6.992  -7.043  11.184
   58    HG3  LYS   7           HG3      LYS   7  -8.226  -5.938  11.794
   59    HD2  LYS   7           HD2      LYS   7  -9.596  -6.350   9.783
   60    HD3  LYS   7           HD3      LYS   7  -8.364  -7.456   9.170
   61    HE2  LYS   7           HE2      LYS   7  -8.671  -8.901  11.144
   62    HE3  LYS   7           HE3      LYS   7  -9.893  -7.796  11.768
   63    HZ1  LYS   7           HZ1      LYS   7 -11.123  -9.407  10.680
   64    HZ2  LYS   7           HZ2      LYS   7 -10.018  -9.542   9.396
   65    HZ3  LYS   7           HZ3      LYS   7 -11.021  -8.176   9.517
   66    H    TRP   8           H        TRP   8  -4.231  -5.241   9.419
   67    HA   TRP   8           HA       TRP   8  -2.460  -6.275  11.443
   68    HB2  TRP   8           HB2      TRP   8  -4.304  -8.057  11.029
   69    HB3  TRP   8           HB3      TRP   8  -3.516  -8.299   9.471
   70    HD1  TRP   8           HD1      TRP   8  -1.146  -9.442   9.450
   71    HE1  TRP   8           HE1      TRP   8   0.188 -10.736  11.237
   72    HE3  TRP   8           HE3      TRP   8  -3.815  -8.188  13.619
   73    HZ2  TRP   8           HZ2      TRP   8   0.127 -11.184  14.062
   74    HZ3  TRP   8           HZ3      TRP   8  -3.159  -9.066  15.842
   75    HH2  TRP   8           HH2      TRP   8  -1.194 -10.560  16.069
   76    H    PHE   9           H        PHE   9  -0.452  -5.851  10.697
   77    HA   PHE   9           HA       PHE   9  -0.067  -5.710   7.750
   78    HB2  PHE   9           HB2      PHE   9   0.370  -3.611   9.153
   79    HB3  PHE   9           HB3      PHE   9   1.757  -4.475   9.818
   80    HD1  PHE   9           HD1      PHE   9   0.373  -2.795   6.885
   81    HD2  PHE   9           HD2      PHE   9   3.618  -5.210   8.333
   82    HE1  PHE   9           HE1      PHE   9   1.686  -2.244   4.856
   83    HE2  PHE   9           HE2      PHE   9   4.930  -4.650   6.305
   84    HZ   PHE   9           HZ       PHE   9   3.968  -3.170   4.568
   85    H    ASN  10           H        ASN  10   1.151  -7.272   6.838
   86    HA   ASN  10           HA       ASN  10   3.135  -8.672   8.539
   87    HB2  ASN  10           HB2      ASN  10   1.176  -9.855   6.569
   88    HB3  ASN  10           HB3      ASN  10   2.590 -10.727   7.154
   89   HD21  ASN  10          HD21      ASN  10  -0.159 -11.542   7.678
   90   HD22  ASN  10          HD22      ASN  10  -0.400 -11.451   9.355
   91    H    SER  11           H        SER  11   4.958  -7.657   7.774
   92    HA   SER  11           HA       SER  11   5.490  -7.000   5.095
   93    HB2  SER  11           HB2      SER  11   7.382  -7.564   7.386
   94    HB3  SER  11           HB3      SER  11   7.856  -6.860   5.843
   95    HG   SER  11           HG       SER  11   6.152  -5.814   7.840
   96    H    ASP  12           H        ASP  12   6.161  -9.927   6.983
   97    HA   ASP  12           HA       ASP  12   7.894 -11.246   5.225
   98    HB2  ASP  12           HB2      ASP  12   7.327 -12.051   7.504
   99    HB3  ASP  12           HB3      ASP  12   5.719 -12.495   6.930
  100    H    LYS  13           H        LYS  13   4.353 -11.233   5.356
  101    HA   LYS  13           HA       LYS  13   4.016 -12.845   2.998
  102    HB2  LYS  13           HB2      LYS  13   2.122 -11.071   4.562
  103    HB3  LYS  13           HB3      LYS  13   1.630 -12.065   3.189
  104    HG2  LYS  13           HG2      LYS  13   2.319 -14.093   4.325
  105    HG3  LYS  13           HG3      LYS  13   3.026 -13.164   5.647
  106    HD2  LYS  13           HD2      LYS  13   0.901 -13.940   6.438
  107    HD3  LYS  13           HD3      LYS  13   0.697 -12.225   6.075
  108    HE2  LYS  13           HE2      LYS  13  -0.323 -12.772   3.922
  109    HE3  LYS  13           HE3      LYS  13  -0.051 -14.490   4.198
  110    HZ1  LYS  13           HZ1      LYS  13  -1.723 -12.725   5.902
  111    HZ2  LYS  13           HZ2      LYS  13  -1.492 -14.393   6.116
  112    HZ3  LYS  13           HZ3      LYS  13  -2.318 -13.816   4.748
  113    H    GLY  14           H        GLY  14   4.600  -9.510   3.678
  114    HA2  GLY  14           HA2      GLY  14   5.283  -7.850   2.184
  115    HA3  GLY  14           HA3      GLY  14   4.760  -8.864   0.848
  116    H    PHE  15           H        PHE  15   2.305  -8.677   3.176
  117    HA   PHE  15           HA       PHE  15   1.161  -6.170   2.331
  118    HB2  PHE  15           HB2      PHE  15  -0.849  -7.133   1.271
  119    HB3  PHE  15           HB3      PHE  15   0.620  -7.483   0.361
  120    HD1  PHE  15           HD1      PHE  15  -2.035  -8.895   2.489
  121    HD2  PHE  15           HD2      PHE  15   1.538  -9.744   0.263
  122    HE1  PHE  15           HE1      PHE  15  -2.534 -11.321   2.612
  123    HE2  PHE  15           HE2      PHE  15   1.040 -12.170   0.387
  124    HZ   PHE  15           HZ       PHE  15  -0.996 -12.959   1.561
  125    H    GLY  16           H        GLY  16  -1.226  -6.079   3.091
  126    HA2  GLY  16           HA2      GLY  16  -1.897  -7.678   5.394
  127    HA3  GLY  16           HA3      GLY  16  -1.374  -6.047   5.807
  128    H    PHE  17           H        PHE  17  -3.810  -6.494   6.581
  129    HA   PHE  17           HA       PHE  17  -5.606  -5.375   4.504
  130    HB2  PHE  17           HB2      PHE  17  -6.269  -7.082   6.921
  131    HB3  PHE  17           HB3      PHE  17  -7.460  -6.354   5.846
  132    HD1  PHE  17           HD1      PHE  17  -4.886  -8.954   6.198
  133    HD2  PHE  17           HD2      PHE  17  -7.736  -7.147   3.539
  134    HE1  PHE  17           HE1      PHE  17  -4.670 -10.883   4.657
  135    HE2  PHE  17           HE2      PHE  17  -7.521  -9.078   1.998
  136    HZ   PHE  17           HZ       PHE  17  -5.988 -10.946   2.556
  137    H    ILE  18           H        ILE  18  -6.582  -3.439   4.944
  138    HA   ILE  18           HA       ILE  18  -6.072  -2.300   7.614
  139    HB   ILE  18           HB       ILE  18  -4.825  -1.161   5.844
  140   HG12  ILE  18          HG12      ILE  18  -7.079   0.670   6.693
  141   HG13  ILE  18          HG13      ILE  18  -5.901   0.059   7.857
  142   HG21  ILE  18          HG21      ILE  18  -6.104  -1.483   3.882
  143   HG22  ILE  18          HG22      ILE  18  -6.270   0.239   4.215
  144   HG23  ILE  18          HG23      ILE  18  -7.575  -0.870   4.634
  145   HD11  ILE  18          HD11      ILE  18  -5.378   2.331   6.777
  146   HD12  ILE  18          HD12      ILE  18  -5.049   1.424   5.300
  147   HD13  ILE  18          HD13      ILE  18  -4.096   1.121   6.751
  148    H    THR  19           H        THR  19  -7.611  -1.202   8.692
  149    HA   THR  19           HA       THR  19 -10.364  -1.741   7.862
  150    HB   THR  19           HB       THR  19  -9.273  -0.871  10.542
  151    HG1  THR  19           HG1      THR  19  -9.694  -3.098  11.037
  152   HG21  THR  19          HG21      THR  19 -11.514  -1.785  11.315
  153   HG22  THR  19          HG22      THR  19 -11.995  -1.828   9.620
  154   HG23  THR  19          HG23      THR  19 -11.602  -0.289  10.386
  155    HA   PRO  20           HA       PRO  20 -10.337   2.719   6.667
  156    HB2  PRO  20           HB2      PRO  20 -13.224   2.020   6.267
  157    HB3  PRO  20           HB3      PRO  20 -12.131   2.921   5.198
  158    HG2  PRO  20           HG2      PRO  20 -12.762   0.446   4.619
  159    HG3  PRO  20           HG3      PRO  20 -11.084   0.995   4.440
  160    HD2  PRO  20           HD2      PRO  20 -12.285  -0.688   6.618
  161    HD3  PRO  20           HD3      PRO  20 -10.701  -0.839   5.820
  162    H    GLU  21           H        GLU  21 -10.610   4.386   8.064
  163    HA   GLU  21           HA       GLU  21 -11.780   4.050  10.620
  164    HB2  GLU  21           HB2      GLU  21 -11.366   6.454  10.914
  165    HB3  GLU  21           HB3      GLU  21  -9.966   5.655  10.201
  166    HG2  GLU  21           HG2      GLU  21 -10.709   6.402   7.948
  167    HG3  GLU  21           HG3      GLU  21 -12.070   7.236   8.684
  168    H    ASP  22           H        ASP  22 -13.040   5.237   7.583
  169    HA   ASP  22           HA       ASP  22 -15.370   6.528   8.585
  170    HB2  ASP  22           HB2      ASP  22 -14.373   6.845   6.298
  171    HB3  ASP  22           HB3      ASP  22 -15.014   5.260   5.866
  172    H    GLY  23           H        GLY  23 -14.547   3.200   8.130
  173    HA2  GLY  23           HA2      GLY  23 -15.873   1.486   9.204
  174    HA3  GLY  23           HA3      GLY  23 -17.314   2.415   8.810
  175    H    SER  24           H        SER  24 -15.130   2.420   6.222
  176    HA   SER  24           HA       SER  24 -16.846   0.839   4.564
  177    HB2  SER  24           HB2      SER  24 -14.116   2.038   4.056
  178    HB3  SER  24           HB3      SER  24 -15.116   1.270   2.830
  179    HG   SER  24           HG       SER  24 -15.334   3.738   4.019
  180    H    LYS  25           H        LYS  25 -15.884  -0.902   3.156
  181    HA   LYS  25           HA       LYS  25 -15.044  -3.080   4.755
  182    HB2  LYS  25           HB2      LYS  25 -15.102  -2.718   1.751
  183    HB3  LYS  25           HB3      LYS  25 -14.762  -4.251   2.556
  184    HG2  LYS  25           HG2      LYS  25 -16.951  -4.143   3.692
  185    HG3  LYS  25           HG3      LYS  25 -17.294  -2.613   2.882
  186    HD2  LYS  25           HD2      LYS  25 -17.125  -3.731   0.689
  187    HD3  LYS  25           HD3      LYS  25 -16.784  -5.262   1.495
  188    HE2  LYS  25           HE2      LYS  25 -18.973  -5.162   2.624
  189    HE3  LYS  25           HE3      LYS  25 -19.317  -3.627   1.827
  190    HZ1  LYS  25           HZ1      LYS  25 -20.346  -5.327   0.567
  191    HZ2  LYS  25           HZ2      LYS  25 -18.938  -6.277   0.551
  192    HZ3  LYS  25           HZ3      LYS  25 -18.994  -4.820  -0.321
  193    H    ASP  26           H        ASP  26 -13.073  -4.244   4.744
  194    HA   ASP  26           HA       ASP  26 -10.758  -2.739   4.977
  195    HB2  ASP  26           HB2      ASP  26 -11.168  -5.693   4.526
  196    HB3  ASP  26           HB3      ASP  26  -9.587  -4.986   4.842
  197    H    LEU  27           H        LEU  27  -9.008  -2.343   3.721
  198    HA   LEU  27           HA       LEU  27  -9.290  -2.890   0.824
  199    HB2  LEU  27           HB2      LEU  27  -7.857  -0.602   2.208
  200    HB3  LEU  27           HB3      LEU  27  -7.958  -0.846   0.468
  201    HG   LEU  27           HG       LEU  27 -10.384  -0.489   2.259
  202   HD11  LEU  27          HD11      LEU  27  -8.933   1.513   0.501
  203   HD12  LEU  27          HD12      LEU  27  -9.018   1.551   2.262
  204   HD13  LEU  27          HD13      LEU  27 -10.477   1.801   1.303
  205   HD21  LEU  27          HD21      LEU  27  -9.974  -0.490  -0.750
  206   HD22  LEU  27          HD22      LEU  27 -11.463   0.038   0.033
  207   HD23  LEU  27          HD23      LEU  27 -10.930  -1.635   0.190
  208    H    PHE  28           H        PHE  28  -7.444  -3.508  -0.344
  209    HA   PHE  28           HA       PHE  28  -5.504  -5.033   1.155
  210    HB2  PHE  28           HB2      PHE  28  -5.857  -4.478  -1.798
  211    HB3  PHE  28           HB3      PHE  28  -4.575  -5.503  -1.146
  212    HD1  PHE  28           HD1      PHE  28  -8.200  -5.168  -1.695
  213    HD2  PHE  28           HD2      PHE  28  -5.082  -7.658  -0.109
  214    HE1  PHE  28           HE1      PHE  28  -9.780  -7.076  -1.584
  215    HE2  PHE  28           HE2      PHE  28  -6.662  -9.566   0.004
  216    HZ   PHE  28           HZ       PHE  28  -9.011  -9.275  -0.733
  217    H    VAL  29           H        VAL  29  -3.490  -4.453   1.723
  218    HA   VAL  29           HA       VAL  29  -2.311  -2.013   0.537
  219    HB   VAL  29           HB       VAL  29  -2.310  -2.816   3.458
  220   HG11  VAL  29          HG11      VAL  29  -0.189  -1.728   2.693
  221   HG12  VAL  29          HG12      VAL  29  -1.073  -0.761   3.874
  222   HG13  VAL  29          HG13      VAL  29  -1.141  -0.343   2.162
  223   HG21  VAL  29          HG21      VAL  29  -3.812  -1.071   3.880
  224   HG22  VAL  29          HG22      VAL  29  -4.423  -1.721   2.361
  225   HG23  VAL  29          HG23      VAL  29  -3.448  -0.252   2.364
  226    H    HIS  30           H        HIS  30  -0.232  -2.280  -0.142
  227    HA   HIS  30           HA       HIS  30   1.128  -4.811   0.567
  228    HB2  HIS  30           HB2      HIS  30   1.428  -3.061  -1.885
  229    HB3  HIS  30           HB3      HIS  30   2.386  -4.504  -1.553
  230    HD2  HIS  30           HD2      HIS  30  -0.934  -3.610  -3.217
  231    HE1  HIS  30           HE1      HIS  30  -1.141  -7.744  -2.380
  232    HE2  HIS  30           HE2      HIS  30  -2.241  -5.832  -3.638
  233    H    HIS  31           H        HIS  31   3.253  -4.816   1.184
  234    HA   HIS  31           HA       HIS  31   4.241  -2.599   2.642
  235    HB2  HIS  31           HB2      HIS  31   4.853  -4.987   3.089
  236    HB3  HIS  31           HB3      HIS  31   5.815  -4.978   1.611
  237    HD2  HIS  31           HD2      HIS  31   6.048  -3.678   5.288
  238    HE1  HIS  31           HE1      HIS  31   9.575  -2.501   3.294
  239    HE2  HIS  31           HE2      HIS  31   8.428  -2.640   5.553
  240    H    SER  32           H        SER  32   5.176  -3.953  -0.501
  241    HA   SER  32           HA       SER  32   7.259  -2.149  -1.091
  242    HB2  SER  32           HB2      SER  32   5.472  -3.766  -2.911
  243    HB3  SER  32           HB3      SER  32   6.892  -2.879  -3.458
  244    HG   SER  32           HG       SER  32   8.136  -4.341  -2.573
  245    H    GLU  33           H        GLU  33   3.849  -1.667  -1.151
  246    HA   GLU  33           HA       GLU  33   3.693   0.312  -3.189
  247    HB2  GLU  33           HB2      GLU  33   1.774  -1.018  -2.211
  248    HB3  GLU  33           HB3      GLU  33   1.854   0.047  -0.809
  249    HG2  GLU  33           HG2      GLU  33   0.186   0.919  -2.338
  250    HG3  GLU  33           HG3      GLU  33   1.571   2.005  -2.346
  251    H    ILE  34           H        ILE  34   4.638   0.461   0.182
  252    HA   ILE  34           HA       ILE  34   4.125   3.106   0.832
  253    HB   ILE  34           HB       ILE  34   6.032   2.966   2.389
  254   HG12  ILE  34          HG12      ILE  34   7.122   0.491   2.308
  255   HG13  ILE  34          HG13      ILE  34   6.769   0.660   0.590
  256   HG21  ILE  34          HG21      ILE  34   5.283   0.801   3.518
  257   HG22  ILE  34          HG22      ILE  34   4.228   0.556   2.126
  258   HG23  ILE  34          HG23      ILE  34   4.013   1.970   3.158
  259   HD11  ILE  34          HD11      ILE  34   9.081   1.459   1.451
  260   HD12  ILE  34          HD12      ILE  34   8.201   2.845   2.090
  261   HD13  ILE  34          HD13      ILE  34   8.197   2.521   0.358
  262    H    GLN  35           H        GLN  35   5.417   5.018   0.798
  263    HA   GLN  35           HA       GLN  35   7.270   5.158  -1.509
  264    HB2  GLN  35           HB2      GLN  35   5.413   7.291  -0.423
  265    HB3  GLN  35           HB3      GLN  35   6.551   7.516  -1.750
  266    HG2  GLN  35           HG2      GLN  35   4.292   5.489  -1.725
  267    HG3  GLN  35           HG3      GLN  35   4.243   7.040  -2.557
  268   HE21  GLN  35          HE21      GLN  35   4.744   3.828  -3.167
  269   HE22  GLN  35          HE22      GLN  35   5.788   3.949  -4.499
  270    H    SER  36           H        SER  36   7.886   4.623   1.384
  271    HA   SER  36           HA       SER  36   9.017   6.877   2.631
  272    HB2  SER  36           HB2      SER  36   9.791   3.959   2.829
  273    HB3  SER  36           HB3      SER  36  10.378   5.225   3.902
  274    HG   SER  36           HG       SER  36   7.673   4.471   3.474
  275    H    GLY  37           H        GLY  37  10.354   4.588   0.282
  276    HA2  GLY  37           HA2      GLY  37  12.172   4.759  -1.128
  277    HA3  GLY  37           HA3      GLY  37  12.280   6.460  -0.682
  278    H    GLY  38           H        GLY  38  14.149   6.993   0.235
  279    HA2  GLY  38           HA2      GLY  38  16.123   5.175   1.058
  280    HA3  GLY  38           HA3      GLY  38  16.102   6.892   1.451
  281    H    GLU  39           H        GLU  39  13.689   6.960   2.921
  282    HA   GLU  39           HA       GLU  39  14.614   6.081   5.490
  283    HB2  GLU  39           HB2      GLU  39  11.928   7.190   4.629
  284    HB3  GLU  39           HB3      GLU  39  12.434   6.949   6.301
  285    HG2  GLU  39           HG2      GLU  39  14.338   8.488   5.940
  286    HG3  GLU  39           HG3      GLU  39  13.809   8.744   4.279
  287    H    TYR  40           H        TYR  40  13.681   4.502   6.855
  288    HA   TYR  40           HA       TYR  40  12.319   2.329   5.388
  289    HB2  TYR  40           HB2      TYR  40  13.861   2.282   7.992
  290    HB3  TYR  40           HB3      TYR  40  13.076   0.886   7.258
  291    HD1  TYR  40           HD1      TYR  40  15.899   3.224   7.042
  292    HD2  TYR  40           HD2      TYR  40  13.904  -0.075   5.148
  293    HE1  TYR  40           HE1      TYR  40  17.889   2.841   5.613
  294    HE2  TYR  40           HE2      TYR  40  15.893  -0.459   3.719
  295    HH   TYR  40           HH       TYR  40  18.895   0.879   4.351
  296    H    ALA  41           H        ALA  41  10.197   2.305   5.624
  297    HA   ALA  41           HA       ALA  41   8.974   3.317   8.094
  298    HB1  ALA  41           HB1      ALA  41   7.849   4.265   6.293
  299    HB2  ALA  41           HB2      ALA  41   6.840   2.863   6.644
  300    HB3  ALA  41           HB3      ALA  41   7.990   2.810   5.307
  301    H    THR  42           H        THR  42   7.965   2.035   9.526
  302    HA   THR  42           HA       THR  42   7.788  -0.859   8.907
  303    HB   THR  42           HB       THR  42   7.985  -1.232  11.346
  304    HG1  THR  42           HG1      THR  42   8.299   0.453  12.691
  305   HG21  THR  42          HG21      THR  42  10.012  -1.249   9.935
  306   HG22  THR  42          HG22      THR  42  10.363  -0.631  11.549
  307   HG23  THR  42          HG23      THR  42  10.203   0.485  10.194
  308    H    LEU  43           H        LEU  43   5.937  -1.976   9.536
  309    HA   LEU  43           HA       LEU  43   3.684  -0.450  10.638
  310    HB2  LEU  43           HB2      LEU  43   3.554  -2.031   8.061
  311    HB3  LEU  43           HB3      LEU  43   2.172  -1.327   8.883
  312    HG   LEU  43           HG       LEU  43   4.542   0.288   7.888
  313   HD11  LEU  43          HD11      LEU  43   3.494  -0.660   5.946
  314   HD12  LEU  43          HD12      LEU  43   2.891   0.992   6.085
  315   HD13  LEU  43          HD13      LEU  43   1.881  -0.361   6.594
  316   HD21  LEU  43          HD21      LEU  43   2.689   2.116   8.032
  317   HD22  LEU  43          HD22      LEU  43   3.405   1.558   9.539
  318   HD23  LEU  43          HD23      LEU  43   1.825   0.957   9.044
  319    H    ALA  44           H        ALA  44   2.091  -1.786  11.632
  320    HA   ALA  44           HA       ALA  44   2.609  -4.670  11.779
  321    HB1  ALA  44           HB1      ALA  44   3.872  -3.264  13.610
  322    HB2  ALA  44           HB2      ALA  44   3.035  -4.747  14.067
  323    HB3  ALA  44           HB3      ALA  44   2.280  -3.181  14.364
  324    H    ASP  45           H        ASP  45   0.817  -5.077  14.050
  325    HA   ASP  45           HA       ASP  45  -1.702  -4.782  12.650
  326    HB2  ASP  45           HB2      ASP  45  -2.591  -6.193  14.472
  327    HB3  ASP  45           HB3      ASP  45  -1.185  -6.918  13.704
  328    H    GLY  46           H        GLY  46  -2.821  -2.972  12.842
  329    HA2  GLY  46           HA2      GLY  46  -4.253  -1.553  14.133
  330    HA3  GLY  46           HA3      GLY  46  -3.179  -1.765  15.508
  331    H    GLN  47           H        GLN  47  -1.158  -1.296  12.953
  332    HA   GLN  47           HA       GLN  47  -0.344   1.294  13.742
  333    HB2  GLN  47           HB2      GLN  47   1.090  -0.469  12.692
  334    HB3  GLN  47           HB3      GLN  47   0.271  -0.165  11.164
  335    HG2  GLN  47           HG2      GLN  47   2.385   1.071  11.270
  336    HG3  GLN  47           HG3      GLN  47   1.027   2.182  11.224
  337   HE21  GLN  47          HE21      GLN  47   1.510   3.920  12.581
  338   HE22  GLN  47          HE22      GLN  47   2.223   3.784  14.117
  339    H    THR  48           H        THR  48  -0.947   3.258  13.094
  340    HA   THR  48           HA       THR  48  -3.152   3.547  11.221
  341    HB   THR  48           HB       THR  48  -1.627   5.653  12.788
  342    HG1  THR  48           HG1      THR  48  -3.513   5.487  14.135
  343   HG21  THR  48          HG21      THR  48  -2.995   6.380  10.750
  344   HG22  THR  48          HG22      THR  48  -3.440   7.127  12.284
  345   HG23  THR  48          HG23      THR  48  -4.416   5.814  11.626
  346    H    VAL  49           H        VAL  49  -2.984   4.150   9.148
  347    HA   VAL  49           HA       VAL  49  -0.509   5.444   8.217
  348    HB   VAL  49           HB       VAL  49  -0.389   3.939   6.253
  349   HG11  VAL  49          HG11      VAL  49   0.449   1.941   7.510
  350   HG12  VAL  49          HG12      VAL  49  -0.266   2.614   8.976
  351   HG13  VAL  49          HG13      VAL  49   1.042   3.470   8.159
  352   HG21  VAL  49          HG21      VAL  49  -2.672   3.147   6.113
  353   HG22  VAL  49          HG22      VAL  49  -2.581   2.458   7.734
  354   HG23  VAL  49          HG23      VAL  49  -1.636   1.752   6.423
  355    H    GLU  50           H        GLU  50  -0.704   6.238   5.966
  356    HA   GLU  50           HA       GLU  50  -3.464   7.162   5.400
  357    HB2  GLU  50           HB2      GLU  50  -0.857   8.593   4.793
  358    HB3  GLU  50           HB3      GLU  50  -2.472   9.184   4.421
  359    HG2  GLU  50           HG2      GLU  50  -3.010   9.184   6.847
  360    HG3  GLU  50           HG3      GLU  50  -1.368   8.652   7.195
  361    H    TYR  51           H        TYR  51  -4.187   6.923   3.315
  362    HA   TYR  51           HA       TYR  51  -2.383   6.157   1.173
  363    HB2  TYR  51           HB2      TYR  51  -3.482   3.997   0.736
  364    HB3  TYR  51           HB3      TYR  51  -2.701   4.007   2.311
  365    HD1  TYR  51           HD1      TYR  51  -5.920   4.021   0.528
  366    HD2  TYR  51           HD2      TYR  51  -4.027   4.055   4.382
  367    HE1  TYR  51           HE1      TYR  51  -8.088   3.470   1.595
  368    HE2  TYR  51           HE2      TYR  51  -6.197   3.503   5.450
  369    HH   TYR  51           HH       TYR  51  -9.180   3.622   3.722
  370    H    GLU  52           H        GLU  52  -3.566   5.713  -0.861
  371    HA   GLU  52           HA       GLU  52  -6.107   7.224  -1.018
  372    HB2  GLU  52           HB2      GLU  52  -3.740   7.197  -2.901
  373    HB3  GLU  52           HB3      GLU  52  -5.341   7.737  -3.409
  374    HG2  GLU  52           HG2      GLU  52  -4.130   9.696  -2.708
  375    HG3  GLU  52           HG3      GLU  52  -5.322   9.346  -1.459
  376    H    VAL  53           H        VAL  53  -7.763   6.183  -1.953
  377    HA   VAL  53           HA       VAL  53  -7.689   3.414  -2.403
  378    HB   VAL  53           HB       VAL  53  -9.735   4.678  -1.824
  379   HG11  VAL  53          HG11      VAL  53 -10.918   5.992  -3.494
  380   HG12  VAL  53          HG12      VAL  53  -9.678   5.640  -4.698
  381   HG13  VAL  53          HG13      VAL  53  -9.290   6.641  -3.300
  382   HG21  VAL  53          HG21      VAL  53 -10.082   3.290  -4.494
  383   HG22  VAL  53          HG22      VAL  53 -11.256   3.403  -3.182
  384   HG23  VAL  53          HG23      VAL  53  -9.802   2.424  -2.984
  385    H    GLY  54           H        GLY  54  -7.831   2.182  -4.279
  386    HA2  GLY  54           HA2      GLY  54  -7.100   3.476  -6.828
  387    HA3  GLY  54           HA3      GLY  54  -6.159   2.107  -6.236
  388    H    GLN  55           H        GLN  55  -7.676   2.207  -8.704
  389    HA   GLN  55           HA       GLN  55 -10.050   0.580  -8.240
  390    HB2  GLN  55           HB2      GLN  55  -9.980   2.402  -9.967
  391    HB3  GLN  55           HB3      GLN  55  -8.815   1.433 -10.870
  392    HG2  GLN  55           HG2      GLN  55 -11.056   1.048 -11.765
  393    HG3  GLN  55           HG3      GLN  55 -10.479  -0.418 -10.979
  394   HE21  GLN  55          HE21      GLN  55 -12.172  -1.374  -9.850
  395   HE22  GLN  55          HE22      GLN  55 -13.345  -0.532  -8.955
  396    H    GLY  56           H        GLY  56 -10.113  -1.563  -8.321
  397    HA2  GLY  56           HA2      GLY  56  -7.997  -3.042  -9.757
  398    HA3  GLY  56           HA3      GLY  56  -8.392  -3.469  -8.094
  399    H    GLN  57           H        GLN  57  -8.651  -5.019 -10.629
  400    HA   GLN  57           HA       GLN  57 -11.357  -5.241 -11.409
  401    HB2  GLN  57           HB2      GLN  57  -9.050  -7.188 -11.538
  402    HB3  GLN  57           HB3      GLN  57 -10.633  -7.513 -12.248
  403    HG2  GLN  57           HG2      GLN  57 -10.456  -5.582 -13.691
  404    HG3  GLN  57           HG3      GLN  57  -8.986  -5.052 -12.877
  405   HE21  GLN  57          HE21      GLN  57  -9.396  -5.810 -15.774
  406   HE22  GLN  57          HE22      GLN  57  -8.268  -7.045 -16.071
  407    H    LYS  58           H        LYS  58  -9.462  -6.978  -8.953
  408    HA   LYS  58           HA       LYS  58 -11.736  -8.616  -8.175
  409    HB2  LYS  58           HB2      LYS  58  -9.393  -9.477  -8.131
  410    HB3  LYS  58           HB3      LYS  58  -9.033  -8.331  -6.842
  411    HG2  LYS  58           HG2      LYS  58 -10.748  -9.366  -5.415
  412    HG3  LYS  58           HG3      LYS  58 -11.158 -10.495  -6.708
  413    HD2  LYS  58           HD2      LYS  58  -8.858 -11.397  -6.650
  414    HD3  LYS  58           HD3      LYS  58  -8.453 -10.274  -5.351
  415    HE2  LYS  58           HE2      LYS  58 -10.180 -11.294  -3.920
  416    HE3  LYS  58           HE3      LYS  58 -10.602 -12.411  -5.217
  417    HZ1  LYS  58           HZ1      LYS  58  -8.050 -12.246  -3.723
  418    HZ2  LYS  58           HZ2      LYS  58  -8.215 -13.128  -5.165
  419    HZ3  LYS  58           HZ3      LYS  58  -9.130 -13.552  -3.798
  420    H    GLY  59           H        GLY  59 -10.280  -5.613  -7.225
  421    HA2  GLY  59           HA2      GLY  59 -12.352  -4.595  -5.748
  422    HA3  GLY  59           HA3      GLY  59 -11.381  -5.480  -4.572
  423    HA   PRO  60           HA       PRO  60  -9.466  -1.232  -5.616
  424    HB2  PRO  60           HB2      PRO  60 -10.122   0.238  -3.434
  425    HB3  PRO  60           HB3      PRO  60 -11.175   0.128  -4.859
  426    HG2  PRO  60           HG2      PRO  60 -11.343  -1.347  -2.270
  427    HG3  PRO  60           HG3      PRO  60 -12.628  -0.572  -3.210
  428    HD2  PRO  60           HD2      PRO  60 -12.172  -3.262  -3.299
  429    HD3  PRO  60           HD3      PRO  60 -12.806  -2.354  -4.692
  430    H    CYS  61           H        CYS  61  -7.540  -0.442  -4.756
  431    HA   CYS  61           HA       CYS  61  -6.447  -1.891  -2.416
  432    HB2  CYS  61           HB2      CYS  61  -4.987  -1.032  -4.928
  433    HB3  CYS  61           HB3      CYS  61  -4.250  -1.810  -3.530
  434    HG   CYS  61           HG       CYS  61  -6.146  -3.789  -4.118
  435    H    ALA  62           H        ALA  62  -4.299  -0.625  -1.716
  436    HA   ALA  62           HA       ALA  62  -5.033   2.241  -1.522
  437    HB1  ALA  62           HB1      ALA  62  -4.083   0.257   0.481
  438    HB2  ALA  62           HB2      ALA  62  -5.223   1.585   0.674
  439    HB3  ALA  62           HB3      ALA  62  -3.488   1.908   0.641
  440    H    ASN  63           H        ASN  63  -3.530   3.694  -2.184
  441    HA   ASN  63           HA       ASN  63  -0.833   2.680  -2.867
  442    HB2  ASN  63           HB2      ASN  63  -2.418   4.937  -4.117
  443    HB3  ASN  63           HB3      ASN  63  -0.782   4.464  -4.572
  444   HD21  ASN  63          HD21      ASN  63  -3.594   4.279  -5.968
  445   HD22  ASN  63          HD22      ASN  63  -3.615   2.685  -6.552
  446    H    LYS  64           H        LYS  64   0.942   4.165  -2.621
  447    HA   LYS  64           HA       LYS  64   2.236   5.602  -1.389
  448    HB2  LYS  64           HB2      LYS  64   0.742   7.251  -2.572
  449    HB3  LYS  64           HB3      LYS  64  -0.261   7.274  -1.121
  450    HG2  LYS  64           HG2      LYS  64   1.661   8.005   0.220
  451    HG3  LYS  64           HG3      LYS  64   2.692   7.953  -1.208
  452    HD2  LYS  64           HD2      LYS  64   1.279   9.663  -2.293
  453    HD3  LYS  64           HD3      LYS  64   0.255   9.724  -0.858
  454    HE2  LYS  64           HE2      LYS  64   2.188  10.439   0.498
  455    HE3  LYS  64           HE3      LYS  64   3.216  10.373  -0.931
  456    HZ1  LYS  64           HZ1      LYS  64   2.624  12.567  -0.906
  457    HZ2  LYS  64           HZ2      LYS  64   1.079  12.270  -0.265
  458    HZ3  LYS  64           HZ3      LYS  64   1.402  11.938  -1.901
  459    H    VAL  65           H        VAL  65   1.965   3.693   0.088
  460    HA   VAL  65           HA       VAL  65   0.377   4.125   2.480
  461    HB   VAL  65           HB       VAL  65   2.389   1.958   1.796
  462   HG11  VAL  65          HG11      VAL  65   2.088   2.188   4.230
  463   HG12  VAL  65          HG12      VAL  65   1.318   0.710   3.653
  464   HG13  VAL  65          HG13      VAL  65   0.337   2.127   4.027
  465   HG21  VAL  65          HG21      VAL  65   0.288   2.135   0.367
  466   HG22  VAL  65          HG22      VAL  65  -0.634   1.799   1.833
  467   HG23  VAL  65          HG23      VAL  65   0.500   0.600   1.210
  468    H    VAL  66           H        VAL  66   1.013   5.374   4.041
  469    HA   VAL  66           HA       VAL  66   3.881   5.470   4.773
  470    HB   VAL  66           HB       VAL  66   3.702   7.889   5.250
  471   HG11  VAL  66          HG11      VAL  66   2.917   7.206   2.403
  472   HG12  VAL  66          HG12      VAL  66   4.545   7.019   3.059
  473   HG13  VAL  66          HG13      VAL  66   3.821   8.623   2.937
  474   HG21  VAL  66          HG21      VAL  66   1.760   9.118   4.221
  475   HG22  VAL  66          HG22      VAL  66   1.316   8.124   5.610
  476   HG23  VAL  66          HG23      VAL  66   0.971   7.558   3.975
  477    H    ALA  67           H        ALA  67   4.314   6.063   6.968
  478    HA   ALA  67           HA       ALA  67   2.236   5.084   8.788
  479    HB1  ALA  67           HB1      ALA  67   5.190   5.607   9.180
  480    HB2  ALA  67           HB2      ALA  67   4.405   4.037   9.010
  481    HB3  ALA  67           HB3      ALA  67   4.109   5.021  10.443
  482    H    VAL  68           H        VAL  68   1.274   6.280  10.322
  483    HA   VAL  68           HA       VAL  68   1.648   9.175  10.233
  484    HB   VAL  68           HB       VAL  68  -0.351   7.540  11.834
  485   HG11  VAL  68          HG11      VAL  68  -0.059   9.781  12.743
  486   HG12  VAL  68          HG12      VAL  68  -1.595   9.716  11.877
  487   HG13  VAL  68          HG13      VAL  68  -0.196  10.488  11.132
  488   HG21  VAL  68          HG21      VAL  68  -1.956   8.145  10.058
  489   HG22  VAL  68          HG22      VAL  68  -0.620   7.208   9.391
  490   HG23  VAL  68          HG23      VAL  68  -0.670   8.956   9.164
  Start of MODEL   16
    1    H1   MET   1           HT1      MET   1  -5.561  13.527   1.697
    2    H2   MET   1           HT2      MET   1  -7.114  13.063   1.187
    3    H3   MET   1           HT3      MET   1  -5.854  13.216   0.056
    4    HA   MET   1           HA       MET   1  -6.061  10.926   0.383
    5    HB2  MET   1           HB2      MET   1  -3.864  12.086   2.117
    6    HB3  MET   1           HB3      MET   1  -3.967  10.375   1.698
    7    HG2  MET   1           HG2      MET   1  -3.819  10.896  -0.674
    8    HG3  MET   1           HG3      MET   1  -3.875  12.626  -0.332
    9    HE1  MET   1           HE1      MET   1  -2.041   9.350  -0.237
   10    HE2  MET   1           HE2      MET   1  -1.967   9.648   1.498
   11    HE3  MET   1           HE3      MET   1  -0.485   9.665   0.545
   12    H    SER   2           H        SER   2  -7.151   9.421   1.475
   13    HA   SER   2           HA       SER   2  -8.412  10.002   3.974
   14    HB2  SER   2           HB2      SER   2  -9.396   7.810   3.771
   15    HB3  SER   2           HB3      SER   2  -9.384   8.550   2.173
   16    HG   SER   2           HG       SER   2  -8.404   6.747   1.667
   17    H    LYS   3           H        LYS   3  -8.261   8.593   5.885
   18    HA   LYS   3           HA       LYS   3  -5.636   7.332   6.282
   19    HB2  LYS   3           HB2      LYS   3  -5.474   9.673   7.092
   20    HB3  LYS   3           HB3      LYS   3  -6.820   9.370   8.187
   21    HG2  LYS   3           HG2      LYS   3  -5.529   7.690   9.383
   22    HG3  LYS   3           HG3      LYS   3  -4.221   7.806   8.205
   23    HD2  LYS   3           HD2      LYS   3  -3.512   9.121  10.062
   24    HD3  LYS   3           HD3      LYS   3  -4.050  10.277   8.846
   25    HE2  LYS   3           HE2      LYS   3  -4.976  10.946  10.982
   26    HE3  LYS   3           HE3      LYS   3  -6.292  10.329   9.986
   27    HZ1  LYS   3           HZ1      LYS   3  -6.086   9.512  12.394
   28    HZ2  LYS   3           HZ2      LYS   3  -4.821   8.540  11.810
   29    HZ3  LYS   3           HZ3      LYS   3  -6.389   8.368  11.179
   30    H    GLY   4           H        GLY   4  -5.884   5.390   7.110
   31    HA2  GLY   4           HA2      GLY   4  -8.197   4.835   8.877
   32    HA3  GLY   4           HA3      GLY   4  -7.741   3.731   7.582
   33    H    ILE   5           H        ILE   5  -7.739   2.352   9.685
   34    HA   ILE   5           HA       ILE   5  -5.005   2.432  10.830
   35    HB   ILE   5           HB       ILE   5  -6.011   1.170  12.780
   36   HG12  ILE   5          HG12      ILE   5  -8.665   2.225  11.763
   37   HG13  ILE   5          HG13      ILE   5  -8.137   0.583  11.411
   38   HG21  ILE   5          HG21      ILE   5  -6.864   3.201  13.833
   39   HG22  ILE   5          HG22      ILE   5  -7.127   3.941  12.254
   40   HG23  ILE   5          HG23      ILE   5  -5.488   3.604  12.808
   41   HD11  ILE   5          HD11      ILE   5  -7.796   0.289  13.923
   42   HD12  ILE   5          HD12      ILE   5  -9.473   0.449  13.399
   43   HD13  ILE   5          HD13      ILE   5  -8.640   1.823  14.126
   44    H    VAL   6           H        VAL   6  -3.745   0.770  10.522
   45    HA   VAL   6           HA       VAL   6  -4.479  -1.314   8.752
   46    HB   VAL   6           HB       VAL   6  -2.040  -1.079  10.542
   47   HG11  VAL   6          HG11      VAL   6  -2.147  -3.351   9.832
   48   HG12  VAL   6          HG12      VAL   6  -1.053  -2.573   8.688
   49   HG13  VAL   6          HG13      VAL   6  -2.722  -2.904   8.226
   50   HG21  VAL   6          HG21      VAL   6  -0.945  -0.092   8.629
   51   HG22  VAL   6          HG22      VAL   6  -2.450   0.794   8.880
   52   HG23  VAL   6          HG23      VAL   6  -2.340  -0.412   7.597
   53    H    LYS   7           H        LYS   7  -5.522  -3.114   9.153
   54    HA   LYS   7           HA       LYS   7  -6.363  -3.922  11.748
   55    HB2  LYS   7           HB2      LYS   7  -7.623  -4.442   9.661
   56    HB3  LYS   7           HB3      LYS   7  -6.322  -5.525   9.168
   57    HG2  LYS   7           HG2      LYS   7  -6.702  -6.911  11.167
   58    HG3  LYS   7           HG3      LYS   7  -7.982  -5.818  11.693
   59    HD2  LYS   7           HD2      LYS   7  -9.274  -6.321   9.666
   60    HD3  LYS   7           HD3      LYS   7  -7.985  -7.380   9.093
   61    HE2  LYS   7           HE2      LYS   7  -9.742  -8.725  10.133
   62    HE3  LYS   7           HE3      LYS   7  -8.284  -8.793  11.122
   63    HZ1  LYS   7           HZ1      LYS   7  -9.206  -7.083  12.550
   64    HZ2  LYS   7           HZ2      LYS   7 -10.259  -8.415  12.464
   65    HZ3  LYS   7           HZ3      LYS   7 -10.605  -6.998  11.592
   66    H    TRP   8           H        TRP   8  -3.929  -5.121   9.464
   67    HA   TRP   8           HA       TRP   8  -2.206  -6.034  11.584
   68    HB2  TRP   8           HB2      TRP   8  -4.021  -7.862  11.193
   69    HB3  TRP   8           HB3      TRP   8  -3.170  -8.167   9.682
   70    HD1  TRP   8           HD1      TRP   8  -0.740  -9.206   9.813
   71    HE1  TRP   8           HE1      TRP   8   0.529 -10.414  11.703
   72    HE3  TRP   8           HE3      TRP   8  -3.687  -7.954  13.791
   73    HZ2  TRP   8           HZ2      TRP   8   0.318 -10.802  14.529
   74    HZ3  TRP   8           HZ3      TRP   8  -3.133  -8.760  16.068
   75    HH2  TRP   8           HH2      TRP   8  -1.136 -10.182  16.442
   76    H    PHE   9           H        PHE   9  -0.181  -5.639  10.877
   77    HA   PHE   9           HA       PHE   9   0.281  -5.558   7.943
   78    HB2  PHE   9           HB2      PHE   9   0.726  -3.466   9.301
   79    HB3  PHE   9           HB3      PHE   9   2.034  -4.348  10.089
   80    HD1  PHE   9           HD1      PHE   9   0.861  -2.852   6.938
   81    HD2  PHE   9           HD2      PHE   9   4.040  -5.012   8.856
   82    HE1  PHE   9           HE1      PHE   9   2.350  -2.367   5.015
   83    HE2  PHE   9           HE2      PHE   9   5.529  -4.523   6.935
   84    HZ   PHE   9           HZ       PHE   9   4.684  -3.203   5.014
   85    H    ASN  10           H        ASN  10   1.428  -7.187   7.069
   86    HA   ASN  10           HA       ASN  10   3.378  -8.609   8.791
   87    HB2  ASN  10           HB2      ASN  10   1.369  -9.775   6.860
   88    HB3  ASN  10           HB3      ASN  10   2.766 -10.676   7.444
   89   HD21  ASN  10          HD21      ASN  10  -0.003 -11.394   8.007
   90   HD22  ASN  10          HD22      ASN  10  -0.223 -11.271   9.687
   91    H    SER  11           H        SER  11   5.180  -7.542   7.974
   92    HA   SER  11           HA       SER  11   5.705  -7.075   5.246
   93    HB2  SER  11           HB2      SER  11   8.003  -6.669   5.973
   94    HB3  SER  11           HB3      SER  11   6.869  -5.924   7.097
   95    HG   SER  11           HG       SER  11   8.681  -7.286   7.955
   96    H    ASP  12           H        ASP  12   6.285  -9.862   7.329
   97    HA   ASP  12           HA       ASP  12   8.131 -11.263   5.728
   98    HB2  ASP  12           HB2      ASP  12   5.974 -12.246   7.611
   99    HB3  ASP  12           HB3      ASP  12   7.135 -13.320   6.834
  100    H    LYS  13           H        LYS  13   4.593 -11.179   5.718
  101    HA   LYS  13           HA       LYS  13   4.301 -12.996   3.503
  102    HB2  LYS  13           HB2      LYS  13   2.394 -11.048   4.823
  103    HB3  LYS  13           HB3      LYS  13   1.935 -12.144   3.520
  104    HG2  LYS  13           HG2      LYS  13   2.628 -14.076   4.886
  105    HG3  LYS  13           HG3      LYS  13   3.088 -12.983   6.195
  106    HD2  LYS  13           HD2      LYS  13   0.763 -12.175   6.345
  107    HD3  LYS  13           HD3      LYS  13   0.298 -13.266   5.036
  108    HE2  LYS  13           HE2      LYS  13   0.984 -15.203   6.398
  109    HE3  LYS  13           HE3      LYS  13   1.455 -14.120   7.708
  110    HZ1  LYS  13           HZ1      LYS  13  -0.876 -13.286   7.686
  111    HZ2  LYS  13           HZ2      LYS  13  -0.716 -14.907   8.172
  112    HZ3  LYS  13           HZ3      LYS  13  -1.267 -14.536   6.608
  113    H    GLY  14           H        GLY  14   4.777  -9.581   3.943
  114    HA2  GLY  14           HA2      GLY  14   5.619  -8.102   2.306
  115    HA3  GLY  14           HA3      GLY  14   5.046  -9.194   1.054
  116    H    PHE  15           H        PHE  15   2.622  -8.736   3.380
  117    HA   PHE  15           HA       PHE  15   1.571  -6.265   2.306
  118    HB2  PHE  15           HB2      PHE  15  -0.516  -7.243   1.425
  119    HB3  PHE  15           HB3      PHE  15   0.901  -7.777   0.521
  120    HD1  PHE  15           HD1      PHE  15  -1.698  -8.776   2.950
  121    HD2  PHE  15           HD2      PHE  15   1.652 -10.085   0.601
  122    HE1  PHE  15           HE1      PHE  15  -2.321 -11.138   3.377
  123    HE2  PHE  15           HE2      PHE  15   1.031 -12.446   1.031
  124    HZ   PHE  15           HZ       PHE  15  -0.956 -12.973   2.419
  125    H    GLY  16           H        GLY  16  -0.721  -5.893   3.152
  126    HA2  GLY  16           HA2      GLY  16  -1.305  -7.191   5.696
  127    HA3  GLY  16           HA3      GLY  16  -0.849  -5.491   5.783
  128    H    PHE  17           H        PHE  17  -3.306  -6.283   6.669
  129    HA   PHE  17           HA       PHE  17  -5.200  -5.396   4.574
  130    HB2  PHE  17           HB2      PHE  17  -5.675  -6.997   7.107
  131    HB3  PHE  17           HB3      PHE  17  -6.940  -6.458   6.009
  132    HD1  PHE  17           HD1      PHE  17  -4.155  -8.795   6.506
  133    HD2  PHE  17           HD2      PHE  17  -7.145  -7.417   3.746
  134    HE1  PHE  17           HE1      PHE  17  -3.780 -10.801   5.098
  135    HE2  PHE  17           HE2      PHE  17  -6.769  -9.423   2.338
  136    HZ   PHE  17           HZ       PHE  17  -5.086 -11.115   3.013
  137    H    ILE  18           H        ILE  18  -6.263  -3.476   4.904
  138    HA   ILE  18           HA       ILE  18  -5.846  -2.184   7.523
  139    HB   ILE  18           HB       ILE  18  -4.633  -1.089   5.698
  140   HG12  ILE  18          HG12      ILE  18  -6.963   0.679   6.472
  141   HG13  ILE  18          HG13      ILE  18  -5.740   0.186   7.646
  142   HG21  ILE  18          HG21      ILE  18  -5.918  -1.572   3.760
  143   HG22  ILE  18          HG22      ILE  18  -6.103   0.165   3.993
  144   HG23  ILE  18          HG23      ILE  18  -7.396  -0.932   4.477
  145   HD11  ILE  18          HD11      ILE  18  -4.000   1.068   6.010
  146   HD12  ILE  18          HD12      ILE  18  -5.011   2.296   6.772
  147   HD13  ILE  18          HD13      ILE  18  -5.333   1.787   5.115
  148    H    THR  19           H        THR  19  -7.447  -1.218   8.586
  149    HA   THR  19           HA       THR  19 -10.168  -1.850   7.728
  150    HB   THR  19           HB       THR  19  -9.131  -0.907  10.406
  151    HG1  THR  19           HG1      THR  19  -8.787  -2.937  10.823
  152   HG21  THR  19          HG21      THR  19 -11.812  -1.990   9.492
  153   HG22  THR  19          HG22      THR  19 -11.486  -0.407  10.199
  154   HG23  THR  19          HG23      THR  19 -11.343  -1.862  11.186
  155    HA   PRO  20           HA       PRO  20 -10.302   2.600   6.494
  156    HB2  PRO  20           HB2      PRO  20 -13.139   1.760   6.028
  157    HB3  PRO  20           HB3      PRO  20 -12.067   2.715   4.985
  158    HG2  PRO  20           HG2      PRO  20 -12.535   0.220   4.378
  159    HG3  PRO  20           HG3      PRO  20 -10.876   0.838   4.287
  160    HD2  PRO  20           HD2      PRO  20 -12.127  -0.864   6.431
  161    HD3  PRO  20           HD3      PRO  20 -10.514  -0.998   5.686
  162    H    GLU  21           H        GLU  21 -10.698   4.281   7.843
  163    HA   GLU  21           HA       GLU  21 -11.921   3.956  10.372
  164    HB2  GLU  21           HB2      GLU  21 -11.636   6.375  10.620
  165    HB3  GLU  21           HB3      GLU  21 -10.189   5.653   9.924
  166    HG2  GLU  21           HG2      GLU  21 -10.838   6.379   7.691
  167    HG3  GLU  21           HG3      GLU  21 -12.384   6.967   8.293
  168    H    ASP  22           H        ASP  22 -13.259   4.702   7.271
  169    HA   ASP  22           HA       ASP  22 -15.694   5.899   8.320
  170    HB2  ASP  22           HB2      ASP  22 -14.930   5.073   5.513
  171    HB3  ASP  22           HB3      ASP  22 -16.387   5.965   5.952
  172    H    GLY  23           H        GLY  23 -14.608   2.747   8.135
  173    HA2  GLY  23           HA2      GLY  23 -15.860   0.859   8.780
  174    HA3  GLY  23           HA3      GLY  23 -17.335   1.711   8.346
  175    H    SER  24           H        SER  24 -15.096   2.081   5.855
  176    HA   SER  24           HA       SER  24 -16.582   0.467   4.045
  177    HB2  SER  24           HB2      SER  24 -15.410   2.449   3.247
  178    HB3  SER  24           HB3      SER  24 -13.866   1.764   3.732
  179    HG   SER  24           HG       SER  24 -15.017   1.483   1.436
  180    H    LYS  25           H        LYS  25 -15.555  -1.235   2.695
  181    HA   LYS  25           HA       LYS  25 -14.730  -3.409   4.290
  182    HB2  LYS  25           HB2      LYS  25 -14.678  -3.002   1.295
  183    HB3  LYS  25           HB3      LYS  25 -14.326  -4.539   2.087
  184    HG2  LYS  25           HG2      LYS  25 -16.546  -4.581   3.095
  185    HG3  LYS  25           HG3      LYS  25 -16.904  -2.980   2.448
  186    HD2  LYS  25           HD2      LYS  25 -17.956  -4.522   0.959
  187    HD3  LYS  25           HD3      LYS  25 -16.500  -3.979   0.127
  188    HE2  LYS  25           HE2      LYS  25 -16.655  -6.393  -0.099
  189    HE3  LYS  25           HE3      LYS  25 -15.319  -6.023   0.989
  190    HZ1  LYS  25           HZ1      LYS  25 -16.479  -6.740   2.810
  191    HZ2  LYS  25           HZ2      LYS  25 -17.085  -7.801   1.631
  192    HZ3  LYS  25           HZ3      LYS  25 -17.997  -6.451   2.113
  193    H    ASP  26           H        ASP  26 -12.774  -4.484   4.477
  194    HA   ASP  26           HA       ASP  26 -10.451  -3.024   4.791
  195    HB2  ASP  26           HB2      ASP  26 -10.928  -5.305   5.709
  196    HB3  ASP  26           HB3      ASP  26 -10.607  -5.964   4.106
  197    H    LEU  27           H        LEU  27  -8.723  -2.505   3.559
  198    HA   LEU  27           HA       LEU  27  -8.877  -3.128   0.671
  199    HB2  LEU  27           HB2      LEU  27  -7.579  -0.777   2.077
  200    HB3  LEU  27           HB3      LEU  27  -7.569  -1.056   0.338
  201    HG   LEU  27           HG       LEU  27 -10.114  -0.780   1.967
  202   HD11  LEU  27          HD11      LEU  27  -8.512   1.266   0.411
  203   HD12  LEU  27          HD12      LEU  27  -8.975   1.332   2.111
  204   HD13  LEU  27          HD13      LEU  27 -10.201   1.503   0.858
  205   HD21  LEU  27          HD21      LEU  27 -11.073  -0.321  -0.315
  206   HD22  LEU  27          HD22      LEU  27 -10.436  -1.956  -0.146
  207   HD23  LEU  27          HD23      LEU  27  -9.506  -0.731  -1.009
  208    H    PHE  28           H        PHE  28  -6.994  -3.692  -0.440
  209    HA   PHE  28           HA       PHE  28  -5.017  -5.102   1.152
  210    HB2  PHE  28           HB2      PHE  28  -5.436  -4.814  -1.830
  211    HB3  PHE  28           HB3      PHE  28  -4.133  -5.765  -1.110
  212    HD1  PHE  28           HD1      PHE  28  -7.774  -5.507  -1.618
  213    HD2  PHE  28           HD2      PHE  28  -4.597  -7.832   0.101
  214    HE1  PHE  28           HE1      PHE  28  -9.329  -7.414  -1.319
  215    HE2  PHE  28           HE2      PHE  28  -6.154  -9.739   0.400
  216    HZ   PHE  28           HZ       PHE  28  -8.521  -9.530  -0.310
  217    H    VAL  29           H        VAL  29  -3.037  -4.412   1.646
  218    HA   VAL  29           HA       VAL  29  -1.869  -2.148   0.151
  219    HB   VAL  29           HB       VAL  29  -1.987  -2.427   3.168
  220   HG11  VAL  29          HG11      VAL  29  -0.835  -0.194   3.151
  221   HG12  VAL  29          HG12      VAL  29  -0.599  -0.376   1.412
  222   HG13  VAL  29          HG13      VAL  29   0.178  -1.497   2.529
  223   HG21  VAL  29          HG21      VAL  29  -3.053  -0.206   1.424
  224   HG22  VAL  29          HG22      VAL  29  -3.372  -0.481   3.135
  225   HG23  VAL  29          HG23      VAL  29  -4.038  -1.579   1.927
  226    H    HIS  30           H        HIS  30   0.268  -2.385  -0.321
  227    HA   HIS  30           HA       HIS  30   1.606  -4.832   0.659
  228    HB2  HIS  30           HB2      HIS  30   2.079  -3.183  -1.835
  229    HB3  HIS  30           HB3      HIS  30   3.049  -4.573  -1.356
  230    HD2  HIS  30           HD2      HIS  30  -0.151  -3.867  -3.323
  231    HE1  HIS  30           HE1      HIS  30  -0.279  -7.970  -2.337
  232    HE2  HIS  30           HE2      HIS  30  -1.338  -6.151  -3.758
  233    H    HIS  31           H        HIS  31   3.808  -4.759   1.254
  234    HA   HIS  31           HA       HIS  31   4.584  -2.559   2.850
  235    HB2  HIS  31           HB2      HIS  31   5.386  -4.917   3.141
  236    HB3  HIS  31           HB3      HIS  31   6.378  -4.716   1.696
  237    HD2  HIS  31           HD2      HIS  31   6.455  -3.749   5.470
  238    HE1  HIS  31           HE1      HIS  31   9.837  -1.997   3.655
  239    HE2  HIS  31           HE2      HIS  31   8.701  -2.488   5.872
  240    H    SER  32           H        SER  32   5.708  -3.645  -0.342
  241    HA   SER  32           HA       SER  32   7.520  -1.474  -0.746
  242    HB2  SER  32           HB2      SER  32   7.722  -3.660  -1.893
  243    HB3  SER  32           HB3      SER  32   6.254  -3.301  -2.797
  244    HG   SER  32           HG       SER  32   7.366  -2.019  -4.039
  245    H    GLU  33           H        GLU  33   4.202  -1.384  -0.629
  246    HA   GLU  33           HA       GLU  33   3.551   0.199  -2.902
  247    HB2  GLU  33           HB2      GLU  33   1.938  -1.129  -1.499
  248    HB3  GLU  33           HB3      GLU  33   2.104   0.101  -0.249
  249    HG2  GLU  33           HG2      GLU  33   0.138   0.591  -1.592
  250    HG3  GLU  33           HG3      GLU  33   1.359   1.823  -1.884
  251    H    ILE  34           H        ILE  34   4.857   0.964   0.268
  252    HA   ILE  34           HA       ILE  34   4.189   3.708   0.364
  253    HB   ILE  34           HB       ILE  34   4.993   2.451   2.326
  254   HG12  ILE  34          HG12      ILE  34   6.990   4.649   1.737
  255   HG13  ILE  34          HG13      ILE  34   5.289   4.998   2.044
  256   HG21  ILE  34          HG21      ILE  34   7.725   2.544   1.012
  257   HG22  ILE  34          HG22      ILE  34   6.706   1.107   1.069
  258   HG23  ILE  34          HG23      ILE  34   7.320   1.812   2.565
  259   HD11  ILE  34          HD11      ILE  34   6.663   5.157   4.112
  260   HD12  ILE  34          HD12      ILE  34   7.110   3.462   3.924
  261   HD13  ILE  34          HD13      ILE  34   5.430   3.901   4.232
  262    H    GLN  35           H        GLN  35   4.901   5.393  -0.745
  263    HA   GLN  35           HA       GLN  35   6.635   5.145  -2.959
  264    HB2  GLN  35           HB2      GLN  35   5.581   7.565  -1.487
  265    HB3  GLN  35           HB3      GLN  35   6.529   7.668  -2.970
  266    HG2  GLN  35           HG2      GLN  35   3.931   6.125  -2.686
  267    HG3  GLN  35           HG3      GLN  35   4.071   7.731  -3.396
  268   HE21  GLN  35          HE21      GLN  35   3.554   4.751  -4.448
  269   HE22  GLN  35          HE22      GLN  35   4.497   4.718  -5.859
  270    H    SER  36           H        SER  36   7.161   6.384   0.326
  271    HA   SER  36           HA       SER  36   9.730   7.466  -0.069
  272    HB2  SER  36           HB2      SER  36   8.454   6.286   2.405
  273    HB3  SER  36           HB3      SER  36   9.979   7.167   2.404
  274    HG   SER  36           HG       SER  36   7.405   8.093   1.645
  275    H    GLY  37           H        GLY  37   8.703   4.214   0.928
  276    HA2  GLY  37           HA2      GLY  37   9.791   2.185   0.884
  277    HA3  GLY  37           HA3      GLY  37  10.890   2.901  -0.290
  278    H    GLY  38           H        GLY  38  10.453   4.232   2.938
  279    HA2  GLY  38           HA2      GLY  38  13.255   4.159   3.484
  280    HA3  GLY  38           HA3      GLY  38  11.991   4.644   4.609
  281    H    GLU  39           H        GLU  39  14.451   2.670   4.456
  282    HA   GLU  39           HA       GLU  39  13.463   0.086   5.086
  283    HB2  GLU  39           HB2      GLU  39  15.788   0.543   4.340
  284    HB3  GLU  39           HB3      GLU  39  16.101   1.366   5.866
  285    HG2  GLU  39           HG2      GLU  39  16.937  -0.928   5.997
  286    HG3  GLU  39           HG3      GLU  39  15.567  -0.740   7.084
  287    H    TYR  40           H        TYR  40  14.341   2.892   7.056
  288    HA   TYR  40           HA       TYR  40  14.145   1.701   9.602
  289    HB2  TYR  40           HB2      TYR  40  13.675   4.560   8.740
  290    HB3  TYR  40           HB3      TYR  40  13.809   4.033  10.416
  291    HD1  TYR  40           HD1      TYR  40  15.623   4.590   7.266
  292    HD2  TYR  40           HD2      TYR  40  15.938   3.205  11.321
  293    HE1  TYR  40           HE1      TYR  40  18.095   4.697   7.112
  294    HE2  TYR  40           HE2      TYR  40  18.410   3.311  11.165
  295    HH   TYR  40           HH       TYR  40  20.123   4.408   9.874
  296    H    ALA  41           H        ALA  41  11.716   3.240   7.534
  297    HA   ALA  41           HA       ALA  41   9.616   3.384   9.389
  298    HB1  ALA  41           HB1      ALA  41   9.796   4.335   6.977
  299    HB2  ALA  41           HB2      ALA  41   8.216   3.811   7.564
  300    HB3  ALA  41           HB3      ALA  41   9.146   2.771   6.485
  301    H    THR  42           H        THR  42   8.381   1.918  10.311
  302    HA   THR  42           HA       THR  42   8.155  -0.777   9.116
  303    HB   THR  42           HB       THR  42   8.244  -1.748  11.387
  304    HG1  THR  42           HG1      THR  42   8.677  -0.489  13.108
  305   HG21  THR  42          HG21      THR  42  10.724  -1.113  11.827
  306   HG22  THR  42          HG22      THR  42  10.578  -0.141  10.363
  307   HG23  THR  42          HG23      THR  42  10.320  -1.883  10.294
  308    H    LEU  43           H        LEU  43   6.277  -1.994   9.908
  309    HA   LEU  43           HA       LEU  43   4.110  -0.388  11.040
  310    HB2  LEU  43           HB2      LEU  43   3.856  -1.865   8.410
  311    HB3  LEU  43           HB3      LEU  43   2.528  -1.124   9.294
  312    HG   LEU  43           HG       LEU  43   4.170   1.029   9.154
  313   HD11  LEU  43          HD11      LEU  43   5.439   1.137   7.149
  314   HD12  LEU  43          HD12      LEU  43   4.709  -0.334   6.506
  315   HD13  LEU  43          HD13      LEU  43   5.849  -0.428   7.844
  316   HD21  LEU  43          HD21      LEU  43   2.423   0.124   6.840
  317   HD22  LEU  43          HD22      LEU  43   2.861   1.785   7.234
  318   HD23  LEU  43          HD23      LEU  43   1.821   0.867   8.323
  319    H    ALA  44           H        ALA  44   2.409  -1.652  11.921
  320    HA   ALA  44           HA       ALA  44   2.784  -4.555  12.067
  321    HB1  ALA  44           HB1      ALA  44   2.491  -2.991  14.628
  322    HB2  ALA  44           HB2      ALA  44   4.083  -3.304  13.938
  323    HB3  ALA  44           HB3      ALA  44   3.046  -4.650  14.407
  324    H    ASP  45           H        ASP  45   0.885  -4.771  14.342
  325    HA   ASP  45           HA       ASP  45  -1.555  -4.458  12.806
  326    HB2  ASP  45           HB2      ASP  45  -2.591  -5.705  14.663
  327    HB3  ASP  45           HB3      ASP  45  -1.175  -6.535  14.032
  328    H    GLY  46           H        GLY  46  -2.639  -2.617  12.845
  329    HA2  GLY  46           HA2      GLY  46  -4.065  -1.071  13.980
  330    HA3  GLY  46           HA3      GLY  46  -3.053  -1.223  15.407
  331    H    GLN  47           H        GLN  47  -1.021  -0.927  12.768
  332    HA   GLN  47           HA       GLN  47  -0.034   1.605  13.491
  333    HB2  GLN  47           HB2      GLN  47   1.225  -0.172  12.260
  334    HB3  GLN  47           HB3      GLN  47   0.273   0.200  10.827
  335    HG2  GLN  47           HG2      GLN  47   2.412   1.380  10.718
  336    HG3  GLN  47           HG3      GLN  47   1.106   2.539  10.911
  337   HE21  GLN  47          HE21      GLN  47   1.796   4.171  12.298
  338   HE22  GLN  47          HE22      GLN  47   2.691   3.926  13.720
  339    H    THR  48           H        THR  48  -0.549   3.626  12.912
  340    HA   THR  48           HA       THR  48  -2.940   4.097  11.335
  341    HB   THR  48           HB       THR  48  -1.010   6.079  12.593
  342    HG1  THR  48           HG1      THR  48  -2.120   4.528  13.998
  343   HG21  THR  48          HG21      THR  48  -3.780   6.317  11.405
  344   HG22  THR  48          HG22      THR  48  -2.337   7.244  10.993
  345   HG23  THR  48          HG23      THR  48  -3.144   7.509  12.539
  346    H    VAL  49           H        VAL  49  -2.971   4.486   9.211
  347    HA   VAL  49           HA       VAL  49  -0.598   5.639   7.909
  348    HB   VAL  49           HB       VAL  49  -0.689   3.957   6.095
  349   HG11  VAL  49          HG11      VAL  49   0.460   2.229   7.284
  350   HG12  VAL  49          HG12      VAL  49  -0.412   2.581   8.776
  351   HG13  VAL  49          HG13      VAL  49   0.784   3.722   8.162
  352   HG21  VAL  49          HG21      VAL  49  -2.735   2.643   7.913
  353   HG22  VAL  49          HG22      VAL  49  -1.953   1.829   6.558
  354   HG23  VAL  49          HG23      VAL  49  -2.998   3.220   6.267
  355    H    GLU  50           H        GLU  50  -1.033   6.270   5.631
  356    HA   GLU  50           HA       GLU  50  -3.859   7.061   5.242
  357    HB2  GLU  50           HB2      GLU  50  -2.998   9.042   3.996
  358    HB3  GLU  50           HB3      GLU  50  -2.568   9.072   5.706
  359    HG2  GLU  50           HG2      GLU  50  -0.330   8.191   5.147
  360    HG3  GLU  50           HG3      GLU  50  -0.764   8.170   3.439
  361    H    TYR  51           H        TYR  51  -4.682   6.854   3.149
  362    HA   TYR  51           HA       TYR  51  -2.972   5.840   1.020
  363    HB2  TYR  51           HB2      TYR  51  -4.240   3.740   0.757
  364    HB3  TYR  51           HB3      TYR  51  -3.418   3.807   2.313
  365    HD1  TYR  51           HD1      TYR  51  -6.679   3.905   0.606
  366    HD2  TYR  51           HD2      TYR  51  -4.676   4.144   4.397
  367    HE1  TYR  51           HE1      TYR  51  -8.850   3.617   1.770
  368    HE2  TYR  51           HE2      TYR  51  -6.847   3.851   5.562
  369    HH   TYR  51           HH       TYR  51  -9.253   4.222   5.078
  370    H    GLU  52           H        GLU  52  -4.192   5.351  -0.965
  371    HA   GLU  52           HA       GLU  52  -6.604   7.055  -1.225
  372    HB2  GLU  52           HB2      GLU  52  -4.588   7.946  -2.414
  373    HB3  GLU  52           HB3      GLU  52  -4.530   6.456  -3.354
  374    HG2  GLU  52           HG2      GLU  52  -6.780   6.907  -4.240
  375    HG3  GLU  52           HG3      GLU  52  -6.876   8.380  -3.275
  376    H    VAL  53           H        VAL  53  -8.395   6.044  -1.919
  377    HA   VAL  53           HA       VAL  53  -8.309   3.192  -2.443
  378    HB   VAL  53           HB       VAL  53 -10.062   4.178  -1.011
  379   HG11  VAL  53          HG11      VAL  53 -11.271   5.380  -3.506
  380   HG12  VAL  53          HG12      VAL  53 -10.235   6.312  -2.429
  381   HG13  VAL  53          HG13      VAL  53 -11.747   5.637  -1.828
  382   HG21  VAL  53          HG21      VAL  53 -11.136   2.975  -3.582
  383   HG22  VAL  53          HG22      VAL  53 -11.979   3.013  -2.033
  384   HG23  VAL  53          HG23      VAL  53 -10.501   2.065  -2.212
  385    H    GLY  54           H        GLY  54  -7.902   2.400  -4.378
  386    HA2  GLY  54           HA2      GLY  54  -8.835   3.880  -6.774
  387    HA3  GLY  54           HA3      GLY  54  -7.328   2.971  -6.724
  388    H    GLN  55           H        GLN  55 -10.588   2.867  -7.511
  389    HA   GLN  55           HA       GLN  55 -11.232   0.155  -7.048
  390    HB2  GLN  55           HB2      GLN  55 -12.288   2.139  -9.075
  391    HB3  GLN  55           HB3      GLN  55 -12.998   0.549  -8.780
  392    HG2  GLN  55           HG2      GLN  55 -13.355   1.145  -6.412
  393    HG3  GLN  55           HG3      GLN  55 -12.651   2.734  -6.706
  394   HE21  GLN  55          HE21      GLN  55 -14.480   4.090  -6.502
  395   HE22  GLN  55          HE22      GLN  55 -15.887   3.917  -7.431
  396    H    GLY  56           H        GLY  56 -11.181  -1.618  -8.379
  397    HA2  GLY  56           HA2      GLY  56 -10.020  -1.518 -11.030
  398    HA3  GLY  56           HA3      GLY  56  -8.995  -2.281  -9.818
  399    H    GLN  57           H        GLN  57  -9.485  -4.002 -11.608
  400    HA   GLN  57           HA       GLN  57 -11.970  -5.335 -11.685
  401    HB2  GLN  57           HB2      GLN  57  -9.154  -6.270 -12.262
  402    HB3  GLN  57           HB3      GLN  57 -10.584  -7.259 -12.559
  403    HG2  GLN  57           HG2      GLN  57 -11.480  -5.631 -14.099
  404    HG3  GLN  57           HG3      GLN  57 -10.223  -4.469 -13.678
  405   HE21  GLN  57          HE21      GLN  57 -10.843  -5.702 -16.362
  406   HE22  GLN  57          HE22      GLN  57  -9.399  -6.446 -16.854
  407    H    LYS  58           H        LYS  58  -9.120  -5.760  -9.629
  408    HA   LYS  58           HA       LYS  58 -10.305  -8.019  -8.222
  409    HB2  LYS  58           HB2      LYS  58  -7.796  -7.661  -8.760
  410    HB3  LYS  58           HB3      LYS  58  -7.808  -6.548  -7.394
  411    HG2  LYS  58           HG2      LYS  58  -8.532  -8.306  -5.887
  412    HG3  LYS  58           HG3      LYS  58  -8.755  -9.424  -7.232
  413    HD2  LYS  58           HD2      LYS  58  -6.345  -9.334  -7.722
  414    HD3  LYS  58           HD3      LYS  58  -6.112  -8.192  -6.399
  415    HE2  LYS  58           HE2      LYS  58  -5.535 -10.447  -5.644
  416    HE3  LYS  58           HE3      LYS  58  -6.988  -9.896  -4.809
  417    HZ1  LYS  58           HZ1      LYS  58  -6.886 -12.242  -5.927
  418    HZ2  LYS  58           HZ2      LYS  58  -7.293 -11.367  -7.326
  419    HZ3  LYS  58           HZ3      LYS  58  -8.312 -11.323  -5.967
  420    H    GLY  59           H        GLY  59 -11.469  -5.184  -8.144
  421    HA2  GLY  59           HA2      GLY  59 -12.811  -4.155  -6.547
  422    HA3  GLY  59           HA3      GLY  59 -12.073  -5.170  -5.310
  423    HA   PRO  60           HA       PRO  60 -10.390  -0.643  -5.301
  424    HB2  PRO  60           HB2      PRO  60 -11.393  -0.810  -2.494
  425    HB3  PRO  60           HB3      PRO  60 -11.444   0.549  -3.633
  426    HG2  PRO  60           HG2      PRO  60 -13.631  -0.809  -3.101
  427    HG3  PRO  60           HG3      PRO  60 -13.265  -0.295  -4.760
  428    HD2  PRO  60           HD2      PRO  60 -12.948  -3.025  -3.524
  429    HD3  PRO  60           HD3      PRO  60 -13.564  -2.589  -5.136
  430    H    CYS  61           H        CYS  61  -8.468  -0.049  -4.375
  431    HA   CYS  61           HA       CYS  61  -7.210  -1.852  -2.412
  432    HB2  CYS  61           HB2      CYS  61  -5.119  -1.850  -3.699
  433    HB3  CYS  61           HB3      CYS  61  -6.425  -2.550  -4.652
  434    HG   CYS  61           HG       CYS  61  -6.620  -0.175  -5.877
  435    H    ALA  62           H        ALA  62  -5.065  -0.784  -1.627
  436    HA   ALA  62           HA       ALA  62  -5.490   2.148  -1.445
  437    HB1  ALA  62           HB1      ALA  62  -5.958   1.587   0.724
  438    HB2  ALA  62           HB2      ALA  62  -4.199   1.642   0.856
  439    HB3  ALA  62           HB3      ALA  62  -5.024   0.095   0.654
  440    H    ASN  63           H        ASN  63  -3.852   3.311  -2.218
  441    HA   ASN  63           HA       ASN  63  -1.161   2.067  -2.296
  442    HB2  ASN  63           HB2      ASN  63  -0.751   3.344  -4.370
  443    HB3  ASN  63           HB3      ASN  63  -2.081   2.203  -4.551
  444   HD21  ASN  63          HD21      ASN  63  -3.633   3.195  -5.851
  445   HD22  ASN  63          HD22      ASN  63  -4.167   4.796  -5.667
  446    H    LYS  64           H        LYS  64   0.540   3.886  -2.707
  447    HA   LYS  64           HA       LYS  64   1.713   5.621  -1.768
  448    HB2  LYS  64           HB2      LYS  64  -1.046   6.882  -1.774
  449    HB3  LYS  64           HB3      LYS  64   0.457   7.757  -1.475
  450    HG2  LYS  64           HG2      LYS  64   1.290   7.085  -3.702
  451    HG3  LYS  64           HG3      LYS  64  -0.216   6.218  -4.002
  452    HD2  LYS  64           HD2      LYS  64  -1.481   8.325  -3.764
  453    HD3  LYS  64           HD3      LYS  64   0.026   9.195  -3.473
  454    HE2  LYS  64           HE2      LYS  64   0.848   8.530  -5.701
  455    HE3  LYS  64           HE3      LYS  64  -0.655   7.653  -5.995
  456    HZ1  LYS  64           HZ1      LYS  64  -1.757   9.892  -5.464
  457    HZ2  LYS  64           HZ2      LYS  64  -1.028   9.691  -6.984
  458    HZ3  LYS  64           HZ3      LYS  64  -0.227  10.561  -5.765
  459    H    VAL  65           H        VAL  65   1.077   3.571  -0.043
  460    HA   VAL  65           HA       VAL  65  -0.155   4.444   2.365
  461    HB   VAL  65           HB       VAL  65  -0.001   2.072   1.723
  462   HG11  VAL  65          HG11      VAL  65   2.378   2.333   0.800
  463   HG12  VAL  65          HG12      VAL  65   2.038   0.859   1.710
  464   HG13  VAL  65          HG13      VAL  65   2.923   2.180   2.471
  465   HG21  VAL  65          HG21      VAL  65  -0.240   2.767   4.122
  466   HG22  VAL  65          HG22      VAL  65   1.510   2.627   4.295
  467   HG23  VAL  65          HG23      VAL  65   0.543   1.198   3.923
  468    H    VAL  66           H        VAL  66   0.583   5.899   3.708
  469    HA   VAL  66           HA       VAL  66   3.506   6.039   4.224
  470    HB   VAL  66           HB       VAL  66   1.623   8.409   4.020
  471   HG11  VAL  66          HG11      VAL  66   4.613   8.313   4.524
  472   HG12  VAL  66          HG12      VAL  66   3.394   8.698   5.739
  473   HG13  VAL  66          HG13      VAL  66   3.635   9.773   4.361
  474   HG21  VAL  66          HG21      VAL  66   3.888   7.446   2.251
  475   HG22  VAL  66          HG22      VAL  66   3.109   9.020   2.095
  476   HG23  VAL  66          HG23      VAL  66   2.181   7.546   1.816
  477    H    ALA  67           H        ALA  67   4.038   5.777   6.281
  478    HA   ALA  67           HA       ALA  67   2.062   5.348   8.297
  479    HB1  ALA  67           HB1      ALA  67   4.081   5.173   9.805
  480    HB2  ALA  67           HB2      ALA  67   5.074   5.540   8.395
  481    HB3  ALA  67           HB3      ALA  67   4.087   4.078   8.422
  482    H    VAL  68           H        VAL  68   1.372   6.622   9.924
  483    HA   VAL  68           HA       VAL  68   0.922   8.523  11.130
  484    HB   VAL  68           HB       VAL  68   3.798   9.274  10.504
  485   HG11  VAL  68          HG11      VAL  68   3.552  10.479  12.728
  486   HG12  VAL  68          HG12      VAL  68   1.819  10.172  12.616
  487   HG13  VAL  68          HG13      VAL  68   2.619  11.169  11.401
  488   HG21  VAL  68          HG21      VAL  68   2.590   7.606  12.733
  489   HG22  VAL  68          HG22      VAL  68   4.221   8.271  12.792
  490   HG23  VAL  68          HG23      VAL  68   3.795   7.092  11.552
  Start of MODEL   17
    1    H1   MET   1           HT1      MET   1  -7.617  13.489   0.588
    2    H2   MET   1           HT2      MET   1  -6.119  14.114   1.088
    3    H3   MET   1           HT3      MET   1  -7.312  13.736   2.239
    4    HA   MET   1           HA       MET   1  -6.413  11.595   0.468
    5    HB2  MET   1           HB2      MET   1  -4.489  11.119   1.962
    6    HB3  MET   1           HB3      MET   1  -4.296  12.654   1.120
    7    HG2  MET   1           HG2      MET   1  -5.139  13.842   3.140
    8    HG3  MET   1           HG3      MET   1  -5.253  12.296   3.980
    9    HE1  MET   1           HE1      MET   1  -2.402  13.742   1.467
   10    HE2  MET   1           HE2      MET   1  -1.573  14.662   2.718
   11    HE3  MET   1           HE3      MET   1  -3.276  14.970   2.391
   12    H    SER   2           H        SER   2  -6.026   9.659   2.146
   13    HA   SER   2           HA       SER   2  -8.254   9.702   4.095
   14    HB2  SER   2           HB2      SER   2  -7.450   7.445   2.246
   15    HB3  SER   2           HB3      SER   2  -8.671   7.334   3.510
   16    HG   SER   2           HG       SER   2  -9.910   7.970   1.911
   17    H    LYS   3           H        LYS   3  -7.979   8.487   5.976
   18    HA   LYS   3           HA       LYS   3  -5.363   7.227   6.435
   19    HB2  LYS   3           HB2      LYS   3  -5.176   9.584   7.199
   20    HB3  LYS   3           HB3      LYS   3  -6.559   9.331   8.263
   21    HG2  LYS   3           HG2      LYS   3  -5.319   7.576   9.475
   22    HG3  LYS   3           HG3      LYS   3  -3.937   7.805   8.400
   23    HD2  LYS   3           HD2      LYS   3  -3.732  10.144   9.151
   24    HD3  LYS   3           HD3      LYS   3  -5.115   9.924  10.222
   25    HE2  LYS   3           HE2      LYS   3  -3.900   8.165  11.446
   26    HE3  LYS   3           HE3      LYS   3  -2.516   8.370  10.373
   27    HZ1  LYS   3           HZ1      LYS   3  -3.649  10.399  12.220
   28    HZ2  LYS   3           HZ2      LYS   3  -2.416  10.712  11.093
   29    HZ3  LYS   3           HZ3      LYS   3  -2.151   9.617  12.365
   30    H    GLY   4           H        GLY   4  -5.695   5.275   7.266
   31    HA2  GLY   4           HA2      GLY   4  -8.001   4.840   9.073
   32    HA3  GLY   4           HA3      GLY   4  -7.646   3.716   7.763
   33    H    ILE   5           H        ILE   5  -7.706   2.420   9.981
   34    HA   ILE   5           HA       ILE   5  -4.934   2.305  11.031
   35    HB   ILE   5           HB       ILE   5  -5.982   1.077  12.988
   36   HG12  ILE   5          HG12      ILE   5  -8.579   2.315  12.031
   37   HG13  ILE   5          HG13      ILE   5  -8.169   0.644  11.662
   38   HG21  ILE   5          HG21      ILE   5  -5.301   3.336  13.317
   39   HG22  ILE   5          HG22      ILE   5  -6.947   3.246  13.945
   40   HG23  ILE   5          HG23      ILE   5  -6.647   3.960  12.361
   41   HD11  ILE   5          HD11      ILE   5  -7.976   0.128  14.049
   42   HD12  ILE   5          HD12      ILE   5  -9.555   0.845  13.724
   43   HD13  ILE   5          HD13      ILE   5  -8.277   1.818  14.458
   44    H    VAL   6           H        VAL   6  -3.759   0.629  10.511
   45    HA   VAL   6           HA       VAL   6  -4.705  -1.397   8.796
   46    HB   VAL   6           HB       VAL   6  -2.130  -1.280  10.390
   47   HG11  VAL   6          HG11      VAL   6  -1.358  -2.771   8.414
   48   HG12  VAL   6          HG12      VAL   6  -3.074  -3.070   8.143
   49   HG13  VAL   6          HG13      VAL   6  -2.330  -3.531   9.672
   50   HG21  VAL   6          HG21      VAL   6  -2.695   0.610   8.727
   51   HG22  VAL   6          HG22      VAL   6  -2.551  -0.613   7.464
   52   HG23  VAL   6          HG23      VAL   6  -1.162  -0.227   8.483
   53    H    LYS   7           H        LYS   7  -5.724  -3.223   9.196
   54    HA   LYS   7           HA       LYS   7  -6.415  -4.086  11.825
   55    HB2  LYS   7           HB2      LYS   7  -7.806  -4.568   9.810
   56    HB3  LYS   7           HB3      LYS   7  -6.542  -5.649   9.224
   57    HG2  LYS   7           HG2      LYS   7  -6.793  -7.048  11.241
   58    HG3  LYS   7           HG3      LYS   7  -8.043  -5.962  11.845
   59    HD2  LYS   7           HD2      LYS   7  -9.434  -6.453   9.868
   60    HD3  LYS   7           HD3      LYS   7  -8.186  -7.541   9.260
   61    HE2  LYS   7           HE2      LYS   7  -8.421  -8.949  11.270
   62    HE3  LYS   7           HE3      LYS   7  -9.663  -7.861  11.890
   63    HZ1  LYS   7           HZ1      LYS   7 -10.791  -9.619  10.846
   64    HZ2  LYS   7           HZ2      LYS   7  -9.783  -9.575   9.479
   65    HZ3  LYS   7           HZ3      LYS   7 -10.889  -8.318   9.761
   66    H    TRP   8           H        TRP   8  -4.142  -5.234   9.350
   67    HA   TRP   8           HA       TRP   8  -2.211  -6.012  11.285
   68    HB2  TRP   8           HB2      TRP   8  -2.173  -8.412  10.928
   69    HB3  TRP   8           HB3      TRP   8  -3.742  -7.924  11.554
   70    HD1  TRP   8           HD1      TRP   8  -5.828  -8.048   9.893
   71    HE1  TRP   8           HE1      TRP   8  -6.206  -9.398   7.729
   72    HE3  TRP   8           HE3      TRP   8  -1.007  -9.323   8.794
   73    HZ2  TRP   8           HZ2      TRP   8  -4.666 -10.836   5.793
   74    HZ3  TRP   8           HZ3      TRP   8  -0.493 -10.684   6.788
   75    HH2  TRP   8           HH2      TRP   8  -2.314 -11.441   5.288
   76    H    PHE   9           H        PHE   9  -0.228  -6.046  10.434
   77    HA   PHE   9           HA       PHE   9  -0.008  -6.006   7.468
   78    HB2  PHE   9           HB2      PHE   9   0.425  -3.798   8.651
   79    HB3  PHE   9           HB3      PHE   9   1.834  -4.566   9.384
   80    HD1  PHE   9           HD1      PHE   9   0.427  -3.129   6.345
   81    HD2  PHE   9           HD2      PHE   9   3.686  -5.432   7.936
   82    HE1  PHE   9           HE1      PHE   9   1.736  -2.705   4.281
   83    HE2  PHE   9           HE2      PHE   9   4.995  -5.004   5.873
   84    HZ   PHE   9           HZ       PHE   9   4.017  -3.638   4.049
   85    H    ASN  10           H        ASN  10   1.316  -7.494   6.584
   86    HA   ASN  10           HA       ASN  10   3.410  -8.703   8.282
   87    HB2  ASN  10           HB2      ASN  10   1.372 -10.169   6.609
   88    HB3  ASN  10           HB3      ASN  10   2.882 -10.908   7.131
   89   HD21  ASN  10          HD21      ASN  10   0.332 -11.901   8.003
   90   HD22  ASN  10          HD22      ASN  10   0.196 -11.629   9.673
   91    H    SER  11           H        SER  11   5.152  -7.787   7.327
   92    HA   SER  11           HA       SER  11   5.455  -7.294   4.567
   93    HB2  SER  11           HB2      SER  11   7.808  -6.902   5.114
   94    HB3  SER  11           HB3      SER  11   6.766  -6.156   6.323
   95    HG   SER  11           HG       SER  11   8.235  -8.572   6.485
   96    H    ASP  12           H        ASP  12   6.225 -10.090   6.585
   97    HA   ASP  12           HA       ASP  12   7.913 -11.483   4.809
   98    HB2  ASP  12           HB2      ASP  12   5.931 -12.480   6.874
   99    HB3  ASP  12           HB3      ASP  12   7.017 -13.548   5.989
  100    H    LYS  13           H        LYS  13   4.394 -11.391   5.137
  101    HA   LYS  13           HA       LYS  13   3.872 -13.171   2.936
  102    HB2  LYS  13           HB2      LYS  13   2.128 -11.212   4.456
  103    HB3  LYS  13           HB3      LYS  13   1.530 -12.275   3.184
  104    HG2  LYS  13           HG2      LYS  13   2.305 -14.243   4.451
  105    HG3  LYS  13           HG3      LYS  13   2.907 -13.182   5.727
  106    HD2  LYS  13           HD2      LYS  13   0.622 -12.332   6.106
  107    HD3  LYS  13           HD3      LYS  13   0.018 -13.390   4.828
  108    HE2  LYS  13           HE2      LYS  13   0.785 -15.364   6.087
  109    HE3  LYS  13           HE3      LYS  13   1.402 -14.315   7.365
  110    HZ1  LYS  13           HZ1      LYS  13  -1.408 -14.088   6.528
  111    HZ2  LYS  13           HZ2      LYS  13  -0.700 -13.729   8.029
  112    HZ3  LYS  13           HZ3      LYS  13  -0.949 -15.345   7.570
  113    H    GLY  14           H        GLY  14   4.273  -9.734   3.436
  114    HA2  GLY  14           HA2      GLY  14   4.994  -8.180   1.805
  115    HA3  GLY  14           HA3      GLY  14   4.439  -9.277   0.548
  116    H    PHE  15           H        PHE  15   2.074  -8.980   2.972
  117    HA   PHE  15           HA       PHE  15   0.864  -6.555   1.952
  118    HB2  PHE  15           HB2      PHE  15  -1.194  -7.631   1.128
  119    HB3  PHE  15           HB3      PHE  15   0.220  -8.098   0.183
  120    HD1  PHE  15           HD1      PHE  15  -2.256  -9.220   2.685
  121    HD2  PHE  15           HD2      PHE  15   1.082 -10.367   0.235
  122    HE1  PHE  15           HE1      PHE  15  -2.751 -11.610   3.130
  123    HE2  PHE  15           HE2      PHE  15   0.588 -12.756   0.683
  124    HZ   PHE  15           HZ       PHE  15  -1.328 -13.376   2.129
  125    H    GLY  16           H        GLY  16  -1.400  -6.299   2.851
  126    HA2  GLY  16           HA2      GLY  16  -2.041  -7.661   5.304
  127    HA3  GLY  16           HA3      GLY  16  -1.404  -6.037   5.560
  128    H    PHE  17           H        PHE  17  -3.859  -6.355   6.445
  129    HA   PHE  17           HA       PHE  17  -5.610  -5.131   4.390
  130    HB2  PHE  17           HB2      PHE  17  -6.299  -7.028   6.641
  131    HB3  PHE  17           HB3      PHE  17  -7.510  -6.072   5.787
  132    HD1  PHE  17           HD1      PHE  17  -4.817  -8.590   5.307
  133    HD2  PHE  17           HD2      PHE  17  -8.312  -6.741   3.646
  134    HE1  PHE  17           HE1      PHE  17  -4.852 -10.289   3.500
  135    HE2  PHE  17           HE2      PHE  17  -8.347  -8.431   1.832
  136    HZ   PHE  17           HZ       PHE  17  -6.617 -10.206   1.760
  137    H    ILE  18           H        ILE  18  -6.686  -3.282   4.946
  138    HA   ILE  18           HA       ILE  18  -6.088  -2.211   7.625
  139    HB   ILE  18           HB       ILE  18  -4.837  -1.055   5.865
  140   HG12  ILE  18          HG12      ILE  18  -7.023   0.823   6.781
  141   HG13  ILE  18          HG13      ILE  18  -5.886   0.124   7.935
  142   HG21  ILE  18          HG21      ILE  18  -7.575  -0.340   4.765
  143   HG22  ILE  18          HG22      ILE  18  -6.421  -1.439   4.009
  144   HG23  ILE  18          HG23      ILE  18  -6.032   0.273   4.168
  145   HD11  ILE  18          HD11      ILE  18  -4.038   1.169   6.929
  146   HD12  ILE  18          HD12      ILE  18  -5.280   2.416   6.905
  147   HD13  ILE  18          HD13      ILE  18  -4.913   1.510   5.438
  148    H    THR  19           H        THR  19  -7.588  -1.121   8.754
  149    HA   THR  19           HA       THR  19 -10.355  -1.616   7.959
  150    HB   THR  19           HB       THR  19  -9.207  -0.789  10.627
  151    HG1  THR  19           HG1      THR  19  -9.329  -2.934  11.122
  152   HG21  THR  19          HG21      THR  19 -11.402  -1.549  11.495
  153   HG22  THR  19          HG22      THR  19 -11.942  -1.843   9.842
  154   HG23  THR  19          HG23      THR  19 -11.582  -0.199  10.374
  155    HA   PRO  20           HA       PRO  20 -10.364   2.858   6.800
  156    HB2  PRO  20           HB2      PRO  20 -13.256   2.121   6.499
  157    HB3  PRO  20           HB3      PRO  20 -12.226   3.068   5.409
  158    HG2  PRO  20           HG2      PRO  20 -12.820   0.595   4.798
  159    HG3  PRO  20           HG3      PRO  20 -11.160   1.181   4.577
  160    HD2  PRO  20           HD2      PRO  20 -12.253  -0.583   6.749
  161    HD3  PRO  20           HD3      PRO  20 -10.689  -0.665   5.908
  162    H    GLU  21           H        GLU  21 -10.607   4.516   8.232
  163    HA   GLU  21           HA       GLU  21 -11.628   4.154  10.830
  164    HB2  GLU  21           HB2      GLU  21 -11.355   6.588  11.083
  165    HB3  GLU  21           HB3      GLU  21  -9.954   5.869  10.298
  166    HG2  GLU  21           HG2      GLU  21 -10.835   6.553   8.090
  167    HG3  GLU  21           HG3      GLU  21 -12.239   7.276   8.876
  168    H    ASP  22           H        ASP  22 -13.139   5.298   7.884
  169    HA   ASP  22           HA       ASP  22 -15.489   6.406   9.056
  170    HB2  ASP  22           HB2      ASP  22 -14.646   6.863   6.731
  171    HB3  ASP  22           HB3      ASP  22 -15.200   5.251   6.279
  172    H    GLY  23           H        GLY  23 -14.474   3.157   8.442
  173    HA2  GLY  23           HA2      GLY  23 -15.610   1.311   9.501
  174    HA3  GLY  23           HA3      GLY  23 -17.131   2.161   9.263
  175    H    SER  24           H        SER  24 -15.163   2.440   6.526
  176    HA   SER  24           HA       SER  24 -16.898   0.881   4.892
  177    HB2  SER  24           HB2      SER  24 -14.218   2.156   4.307
  178    HB3  SER  24           HB3      SER  24 -15.270   1.434   3.096
  179    HG   SER  24           HG       SER  24 -15.712   3.697   4.730
  180    H    LYS  25           H        LYS  25 -16.017  -0.762   3.363
  181    HA   LYS  25           HA       LYS  25 -15.095  -3.035   4.742
  182    HB2  LYS  25           HB2      LYS  25 -16.453  -3.011   2.613
  183    HB3  LYS  25           HB3      LYS  25 -14.971  -2.594   1.753
  184    HG2  LYS  25           HG2      LYS  25 -13.896  -4.652   2.644
  185    HG3  LYS  25           HG3      LYS  25 -15.409  -5.080   3.441
  186    HD2  LYS  25           HD2      LYS  25 -15.224  -4.603   0.457
  187    HD3  LYS  25           HD3      LYS  25 -14.992  -6.194   1.180
  188    HE2  LYS  25           HE2      LYS  25 -17.245  -6.006   2.233
  189    HE3  LYS  25           HE3      LYS  25 -17.477  -4.464   1.409
  190    HZ1  LYS  25           HZ1      LYS  25 -16.939  -7.054   0.058
  191    HZ2  LYS  25           HZ2      LYS  25 -17.250  -5.568  -0.704
  192    HZ3  LYS  25           HZ3      LYS  25 -18.468  -6.333   0.201
  193    H    ASP  26           H        ASP  26 -13.116  -4.036   4.877
  194    HA   ASP  26           HA       ASP  26 -10.800  -2.523   4.997
  195    HB2  ASP  26           HB2      ASP  26 -11.082  -5.501   4.561
  196    HB3  ASP  26           HB3      ASP  26  -9.605  -4.688   5.074
  197    H    LEU  27           H        LEU  27  -9.056  -2.181   3.689
  198    HA   LEU  27           HA       LEU  27  -9.409  -2.848   0.825
  199    HB2  LEU  27           HB2      LEU  27  -8.235  -0.432   2.202
  200    HB3  LEU  27           HB3      LEU  27  -7.803  -0.836   0.543
  201    HG   LEU  27           HG       LEU  27 -10.450  -1.002   0.234
  202   HD11  LEU  27          HD11      LEU  27 -10.320   1.139   2.364
  203   HD12  LEU  27          HD12      LEU  27 -10.700  -0.531   2.771
  204   HD13  LEU  27          HD13      LEU  27 -11.742   0.360   1.667
  205   HD21  LEU  27          HD21      LEU  27 -10.448   1.237  -0.621
  206   HD22  LEU  27          HD22      LEU  27  -8.806   0.633  -0.830
  207   HD23  LEU  27          HD23      LEU  27  -9.178   1.735   0.496
  208    H    PHE  28           H        PHE  28  -7.577  -3.435  -0.381
  209    HA   PHE  28           HA       PHE  28  -5.603  -4.960   1.078
  210    HB2  PHE  28           HB2      PHE  28  -6.010  -4.393  -1.869
  211    HB3  PHE  28           HB3      PHE  28  -4.726  -5.430  -1.241
  212    HD1  PHE  28           HD1      PHE  28  -8.380  -5.035  -1.633
  213    HD2  PHE  28           HD2      PHE  28  -5.210  -7.619  -0.322
  214    HE1  PHE  28           HE1      PHE  28  -9.972  -6.934  -1.522
  215    HE2  PHE  28           HE2      PHE  28  -6.801  -9.517  -0.212
  216    HZ   PHE  28           HZ       PHE  28  -9.181  -9.174  -0.812
  217    H    VAL  29           H        VAL  29  -3.615  -4.324   1.662
  218    HA   VAL  29           HA       VAL  29  -2.437  -1.934   0.380
  219    HB   VAL  29           HB       VAL  29  -2.352  -2.614   3.335
  220   HG11  VAL  29          HG11      VAL  29  -1.238  -0.430   3.572
  221   HG12  VAL  29          HG12      VAL  29  -1.296  -0.208   1.823
  222   HG13  VAL  29          HG13      VAL  29  -0.309  -1.497   2.517
  223   HG21  VAL  29          HG21      VAL  29  -4.522  -1.770   3.007
  224   HG22  VAL  29          HG22      VAL  29  -4.004  -0.655   1.750
  225   HG23  VAL  29          HG23      VAL  29  -3.606  -0.326   3.436
  226    H    HIS  30           H        HIS  30  -0.383  -2.271  -0.330
  227    HA   HIS  30           HA       HIS  30   0.992  -4.743   0.552
  228    HB2  HIS  30           HB2      HIS  30   1.181  -3.261  -2.075
  229    HB3  HIS  30           HB3      HIS  30   2.165  -4.656  -1.640
  230    HD2  HIS  30           HD2      HIS  30  -1.237  -3.937  -3.229
  231    HE1  HIS  30           HE1      HIS  30  -1.359  -7.975  -2.007
  232    HE2  HIS  30           HE2      HIS  30  -2.538  -6.196  -3.382
  233    H    HIS  31           H        HIS  31   3.216  -4.700   0.887
  234    HA   HIS  31           HA       HIS  31   4.232  -2.357   2.161
  235    HB2  HIS  31           HB2      HIS  31   4.866  -4.738   2.721
  236    HB3  HIS  31           HB3      HIS  31   5.831  -4.757   1.246
  237    HD2  HIS  31           HD2      HIS  31   6.048  -3.338   4.878
  238    HE1  HIS  31           HE1      HIS  31   9.459  -1.991   2.786
  239    HE2  HIS  31           HE2      HIS  31   8.364  -2.153   5.071
  240    H    SER  32           H        SER  32   4.891  -3.897  -0.951
  241    HA   SER  32           HA       SER  32   7.027  -2.277  -1.778
  242    HB2  SER  32           HB2      SER  32   6.596  -3.156  -4.006
  243    HB3  SER  32           HB3      SER  32   6.449  -4.433  -2.803
  244    HG   SER  32           HG       SER  32   4.334  -4.497  -3.112
  245    H    GLU  33           H        GLU  33   3.660  -1.477  -1.652
  246    HA   GLU  33           HA       GLU  33   3.599   0.371  -3.818
  247    HB2  GLU  33           HB2      GLU  33   1.848   0.024  -1.389
  248    HB3  GLU  33           HB3      GLU  33   1.545   1.262  -2.608
  249    HG2  GLU  33           HG2      GLU  33   1.801  -1.697  -3.205
  250    HG3  GLU  33           HG3      GLU  33   0.264  -0.854  -3.020
  251    H    ILE  34           H        ILE  34   4.759   0.685  -0.527
  252    HA   ILE  34           HA       ILE  34   4.609   3.550  -0.443
  253    HB   ILE  34           HB       ILE  34   4.705   2.174   1.610
  254   HG12  ILE  34          HG12      ILE  34   7.174   3.922   1.492
  255   HG13  ILE  34          HG13      ILE  34   5.554   4.609   1.430
  256   HG21  ILE  34          HG21      ILE  34   7.638   1.751   1.524
  257   HG22  ILE  34          HG22      ILE  34   6.750   0.773   0.362
  258   HG23  ILE  34          HG23      ILE  34   6.353   0.676   2.075
  259   HD11  ILE  34          HD11      ILE  34   5.019   3.441   3.572
  260   HD12  ILE  34          HD12      ILE  34   6.338   4.597   3.743
  261   HD13  ILE  34          HD13      ILE  34   6.689   2.872   3.644
  262    H    GLN  35           H        GLN  35   5.766   4.898  -1.627
  263    HA   GLN  35           HA       GLN  35   7.955   4.134  -3.252
  264    HB2  GLN  35           HB2      GLN  35   6.978   6.849  -2.343
  265    HB3  GLN  35           HB3      GLN  35   8.276   6.627  -3.513
  266    HG2  GLN  35           HG2      GLN  35   5.474   5.505  -3.819
  267    HG3  GLN  35           HG3      GLN  35   6.049   6.979  -4.593
  268   HE21  GLN  35          HE21      GLN  35   5.346   3.984  -5.495
  269   HE22  GLN  35          HE22      GLN  35   6.600   3.656  -6.590
  270    H    SER  36           H        SER  36   7.760   5.737  -0.103
  271    HA   SER  36           HA       SER  36  10.226   4.740   0.832
  272    HB2  SER  36           HB2      SER  36  11.230   6.314  -0.767
  273    HB3  SER  36           HB3      SER  36  10.300   7.637  -0.067
  274    HG   SER  36           HG       SER  36  12.393   6.115   1.065
  275    H    GLY  37           H        GLY  37   8.630   7.927   1.117
  276    HA2  GLY  37           HA2      GLY  37   7.221   8.695   2.827
  277    HA3  GLY  37           HA3      GLY  37   7.554   7.230   3.737
  278    H    GLY  38           H        GLY  38  10.558   8.010   2.960
  279    HA2  GLY  38           HA2      GLY  38  12.265   9.311   3.847
  280    HA3  GLY  38           HA3      GLY  38  11.058  10.295   4.662
  281    H    GLU  39           H        GLU  39  10.316   7.144   5.423
  282    HA   GLU  39           HA       GLU  39  12.155   7.000   7.717
  283    HB2  GLU  39           HB2      GLU  39   9.139   6.774   7.886
  284    HB3  GLU  39           HB3      GLU  39  10.261   6.448   9.208
  285    HG2  GLU  39           HG2      GLU  39  11.088   8.777   9.069
  286    HG3  GLU  39           HG3      GLU  39   9.942   9.101   7.769
  287    H    TYR  40           H        TYR  40  12.416   4.917   8.602
  288    HA   TYR  40           HA       TYR  40  11.733   2.741   6.730
  289    HB2  TYR  40           HB2      TYR  40  13.845   2.910   8.888
  290    HB3  TYR  40           HB3      TYR  40  13.543   1.489   7.889
  291    HD1  TYR  40           HD1      TYR  40  14.890   4.904   7.962
  292    HD2  TYR  40           HD2      TYR  40  14.030   1.510   5.476
  293    HE1  TYR  40           HE1      TYR  40  16.323   5.853   6.173
  294    HE2  TYR  40           HE2      TYR  40  15.463   2.457   3.686
  295    HH   TYR  40           HH       TYR  40  17.463   4.099   3.612
  296    H    ALA  41           H        ALA  41  10.183   3.983   9.208
  297    HA   ALA  41           HA       ALA  41   9.971   2.062  11.216
  298    HB1  ALA  41           HB1      ALA  41   7.825   3.071  11.743
  299    HB2  ALA  41           HB2      ALA  41   7.747   3.812  10.145
  300    HB3  ALA  41           HB3      ALA  41   8.971   4.339  11.302
  301    H    THR  42           H        THR  42   9.040   0.152  11.389
  302    HA   THR  42           HA       THR  42   7.981  -1.177   9.051
  303    HB   THR  42           HB       THR  42   7.827  -3.144  10.523
  304    HG1  THR  42           HG1      THR  42   7.241  -2.175  12.433
  305   HG21  THR  42          HG21      THR  42  10.267  -3.209  11.214
  306   HG22  THR  42          HG22      THR  42  10.378  -1.528  10.697
  307   HG23  THR  42          HG23      THR  42   9.980  -2.786   9.527
  308    H    LEU  43           H        LEU  43   5.981  -2.593   9.411
  309    HA   LEU  43           HA       LEU  43   3.856  -1.044  10.765
  310    HB2  LEU  43           HB2      LEU  43   3.636  -2.457   8.096
  311    HB3  LEU  43           HB3      LEU  43   2.308  -1.691   8.959
  312    HG   LEU  43           HG       LEU  43   3.894   0.436   8.911
  313   HD11  LEU  43          HD11      LEU  43   5.017  -1.362   6.757
  314   HD12  LEU  43          HD12      LEU  43   5.888  -0.417   7.962
  315   HD13  LEU  43          HD13      LEU  43   5.107   0.393   6.610
  316   HD21  LEU  43          HD21      LEU  43   2.551  -0.481   6.348
  317   HD22  LEU  43          HD22      LEU  43   2.785   1.179   6.895
  318   HD23  LEU  43          HD23      LEU  43   1.667   0.119   7.751
  319    H    ALA  44           H        ALA  44   2.244  -2.237  11.761
  320    HA   ALA  44           HA       ALA  44   2.397  -5.161  11.711
  321    HB1  ALA  44           HB1      ALA  44   2.842  -5.419  14.011
  322    HB2  ALA  44           HB2      ALA  44   2.439  -3.740  14.370
  323    HB3  ALA  44           HB3      ALA  44   3.939  -4.125  13.527
  324    H    ASP  45           H        ASP  45   0.667  -5.187  14.236
  325    HA   ASP  45           HA       ASP  45  -1.858  -4.762  12.870
  326    HB2  ASP  45           HB2      ASP  45  -1.361  -5.770  15.678
  327    HB3  ASP  45           HB3      ASP  45  -2.844  -5.931  14.741
  328    H    GLY  46           H        GLY  46  -2.746  -2.799  12.882
  329    HA2  GLY  46           HA2      GLY  46  -4.006  -1.148  14.074
  330    HA3  GLY  46           HA3      GLY  46  -2.917  -1.342  15.437
  331    H    GLN  47           H        GLN  47  -1.056  -1.227  12.648
  332    HA   GLN  47           HA       GLN  47   0.103   1.279  13.266
  333    HB2  GLN  47           HB2      GLN  47   1.244  -0.591  12.053
  334    HB3  GLN  47           HB3      GLN  47   0.245  -0.236  10.645
  335    HG2  GLN  47           HG2      GLN  47   2.415   0.867  10.398
  336    HG3  GLN  47           HG3      GLN  47   1.159   2.076  10.614
  337   HE21  GLN  47          HE21      GLN  47   2.013   3.731  11.881
  338   HE22  GLN  47          HE22      GLN  47   2.946   3.498  13.279
  339    H    THR  48           H        THR  48  -0.447   3.288  12.706
  340    HA   THR  48           HA       THR  48  -2.808   3.727  11.061
  341    HB   THR  48           HB       THR  48  -2.372   6.150  11.678
  342    HG1  THR  48           HG1      THR  48  -0.493   4.975  13.438
  343   HG21  THR  48          HG21      THR  48  -3.975   4.930  12.963
  344   HG22  THR  48          HG22      THR  48  -2.924   5.734  14.130
  345   HG23  THR  48          HG23      THR  48  -2.715   4.015  13.792
  346    H    VAL  49           H        VAL  49  -2.818   4.367   9.011
  347    HA   VAL  49           HA       VAL  49  -0.405   5.559   7.829
  348    HB   VAL  49           HB       VAL  49  -0.440   4.017   5.907
  349   HG11  VAL  49          HG11      VAL  49   0.678   2.215   6.987
  350   HG12  VAL  49          HG12      VAL  49  -0.280   2.398   8.456
  351   HG13  VAL  49          HG13      VAL  49   0.928   3.607   8.035
  352   HG21  VAL  49          HG21      VAL  49  -1.734   1.863   6.184
  353   HG22  VAL  49          HG22      VAL  49  -2.740   3.283   5.898
  354   HG23  VAL  49          HG23      VAL  49  -2.589   2.622   7.527
  355    H    GLU  50           H        GLU  50  -0.827   6.156   5.482
  356    HA   GLU  50           HA       GLU  50  -3.622   7.000   5.055
  357    HB2  GLU  50           HB2      GLU  50  -2.765   9.142   4.095
  358    HB3  GLU  50           HB3      GLU  50  -2.479   9.000   5.830
  359    HG2  GLU  50           HG2      GLU  50  -0.159   8.296   5.385
  360    HG3  GLU  50           HG3      GLU  50  -0.447   8.417   3.652
  361    H    TYR  51           H        TYR  51  -4.304   6.917   2.923
  362    HA   TYR  51           HA       TYR  51  -2.445   6.437   0.767
  363    HB2  TYR  51           HB2      TYR  51  -3.230   4.178   0.212
  364    HB3  TYR  51           HB3      TYR  51  -2.484   4.213   1.807
  365    HD1  TYR  51           HD1      TYR  51  -5.631   3.849  -0.059
  366    HD2  TYR  51           HD2      TYR  51  -3.852   4.013   3.848
  367    HE1  TYR  51           HE1      TYR  51  -7.720   2.953   0.929
  368    HE2  TYR  51           HE2      TYR  51  -5.942   3.116   4.836
  369    HH   TYR  51           HH       TYR  51  -8.777   3.185   3.512
  370    H    GLU  52           H        GLU  52  -3.619   5.843  -1.286
  371    HA   GLU  52           HA       GLU  52  -6.184   7.311  -1.423
  372    HB2  GLU  52           HB2      GLU  52  -4.234   8.265  -2.715
  373    HB3  GLU  52           HB3      GLU  52  -4.224   6.785  -3.676
  374    HG2  GLU  52           HG2      GLU  52  -6.559   7.207  -4.355
  375    HG3  GLU  52           HG3      GLU  52  -6.575   8.683  -3.393
  376    H    VAL  53           H        VAL  53  -7.933   6.129  -1.890
  377    HA   VAL  53           HA       VAL  53  -7.754   3.308  -2.340
  378    HB   VAL  53           HB       VAL  53  -9.602   4.333  -1.076
  379   HG11  VAL  53          HG11      VAL  53 -10.710   5.362  -3.690
  380   HG12  VAL  53          HG12      VAL  53  -9.723   6.372  -2.636
  381   HG13  VAL  53          HG13      VAL  53 -11.253   5.723  -2.052
  382   HG21  VAL  53          HG21      VAL  53  -9.835   2.147  -2.412
  383   HG22  VAL  53          HG22      VAL  53 -10.759   3.094  -3.580
  384   HG23  VAL  53          HG23      VAL  53 -11.332   2.939  -1.918
  385    H    GLY  54           H        GLY  54  -7.221   2.397  -4.183
  386    HA2  GLY  54           HA2      GLY  54  -7.864   3.726  -6.735
  387    HA3  GLY  54           HA3      GLY  54  -6.582   2.538  -6.501
  388    H    GLN  55           H        GLN  55  -8.059   1.865  -8.524
  389    HA   GLN  55           HA       GLN  55 -10.125   0.007  -7.515
  390    HB2  GLN  55           HB2      GLN  55 -10.924   1.741  -9.118
  391    HB3  GLN  55           HB3      GLN  55  -9.794   1.114 -10.322
  392    HG2  GLN  55           HG2      GLN  55 -10.915  -1.092 -10.214
  393    HG3  GLN  55           HG3      GLN  55 -12.050  -0.453  -9.025
  394   HE21  GLN  55          HE21      GLN  55 -14.006   0.074  -9.994
  395   HE22  GLN  55          HE22      GLN  55 -14.180   0.717 -11.556
  396    H    GLY  56           H        GLY  56  -9.832  -2.107  -7.746
  397    HA2  GLY  56           HA2      GLY  56  -7.704  -3.095  -9.547
  398    HA3  GLY  56           HA3      GLY  56  -7.867  -3.695  -7.897
  399    H    GLN  57           H        GLN  57  -7.991  -5.356 -10.172
  400    HA   GLN  57           HA       GLN  57 -10.605  -5.913 -11.075
  401    HB2  GLN  57           HB2      GLN  57  -8.134  -7.639 -10.851
  402    HB3  GLN  57           HB3      GLN  57  -9.627  -8.179 -11.625
  403    HG2  GLN  57           HG2      GLN  57  -9.511  -6.397 -13.248
  404    HG3  GLN  57           HG3      GLN  57  -8.165  -5.641 -12.399
  405   HE21  GLN  57          HE21      GLN  57  -8.265  -6.705 -15.220
  406   HE22  GLN  57          HE22      GLN  57  -7.014  -7.849 -15.310
  407    H    LYS  58           H        LYS  58  -8.742  -7.156  -8.323
  408    HA   LYS  58           HA       LYS  58 -10.884  -8.929  -7.485
  409    HB2  LYS  58           HB2      LYS  58  -8.255  -8.164  -6.196
  410    HB3  LYS  58           HB3      LYS  58  -9.384  -9.343  -5.524
  411    HG2  LYS  58           HG2      LYS  58  -9.235 -10.636  -7.663
  412    HG3  LYS  58           HG3      LYS  58  -8.005  -9.504  -8.223
  413    HD2  LYS  58           HD2      LYS  58  -7.739 -11.067  -5.643
  414    HD3  LYS  58           HD3      LYS  58  -7.117 -11.655  -7.185
  415    HE2  LYS  58           HE2      LYS  58  -5.754  -9.581  -7.395
  416    HE3  LYS  58           HE3      LYS  58  -6.329  -9.068  -5.809
  417    HZ1  LYS  58           HZ1      LYS  58  -5.050 -11.700  -6.177
  418    HZ2  LYS  58           HZ2      LYS  58  -5.214 -10.783  -4.756
  419    HZ3  LYS  58           HZ3      LYS  58  -4.110 -10.306  -5.957
  420    H    GLY  59           H        GLY  59  -9.916  -5.656  -6.889
  421    HA2  GLY  59           HA2      GLY  59 -12.162  -4.693  -5.724
  422    HA3  GLY  59           HA3      GLY  59 -11.296  -5.386  -4.356
  423    HA   PRO  60           HA       PRO  60  -9.687  -1.031  -5.157
  424    HB2  PRO  60           HB2      PRO  60 -10.062   0.006  -2.681
  425    HB3  PRO  60           HB3      PRO  60 -11.345  -0.010  -3.909
  426    HG2  PRO  60           HG2      PRO  60 -10.902  -1.872  -1.618
  427    HG3  PRO  60           HG3      PRO  60 -12.402  -1.113  -2.182
  428    HD2  PRO  60           HD2      PRO  60 -11.755  -3.684  -2.806
  429    HD3  PRO  60           HD3      PRO  60 -12.690  -2.647  -3.907
  430    H    CYS  61           H        CYS  61  -7.774  -0.024  -4.271
  431    HA   CYS  61           HA       CYS  61  -6.206  -1.664  -2.389
  432    HB2  CYS  61           HB2      CYS  61  -4.240  -1.561  -3.844
  433    HB3  CYS  61           HB3      CYS  61  -5.572  -2.365  -4.672
  434    HG   CYS  61           HG       CYS  61  -4.270  -0.279  -6.023
  435    H    ALA  62           H        ALA  62  -4.088  -0.479  -1.837
  436    HA   ALA  62           HA       ALA  62  -4.719   2.382  -1.407
  437    HB1  ALA  62           HB1      ALA  62  -2.935   2.096   0.431
  438    HB2  ALA  62           HB2      ALA  62  -3.141   0.366   0.177
  439    HB3  ALA  62           HB3      ALA  62  -4.508   1.349   0.706
  440    H    ASN  63           H        ASN  63  -3.392   3.905  -2.265
  441    HA   ASN  63           HA       ASN  63  -0.812   3.008  -3.411
  442    HB2  ASN  63           HB2      ASN  63  -2.666   5.195  -4.389
  443    HB3  ASN  63           HB3      ASN  63  -1.109   4.776  -5.100
  444   HD21  ASN  63          HD21      ASN  63  -4.136   4.482  -5.976
  445   HD22  ASN  63          HD22      ASN  63  -4.184   2.896  -6.579
  446    H    LYS  64           H        LYS  64   0.962   4.432  -3.215
  447    HA   LYS  64           HA       LYS  64   2.321   5.893  -2.075
  448    HB2  LYS  64           HB2      LYS  64  -0.206   7.559  -2.194
  449    HB3  LYS  64           HB3      LYS  64   1.375   8.177  -1.712
  450    HG2  LYS  64           HG2      LYS  64   2.303   7.516  -3.904
  451    HG3  LYS  64           HG3      LYS  64   0.721   6.901  -4.386
  452    HD2  LYS  64           HD2      LYS  64  -0.243   9.156  -4.112
  453    HD3  LYS  64           HD3      LYS  64   1.340   9.775  -3.635
  454    HE2  LYS  64           HE2      LYS  64   2.261   9.120  -5.826
  455    HE3  LYS  64           HE3      LYS  64   0.684   8.493  -6.306
  456    HZ1  LYS  64           HZ1      LYS  64   1.511  11.285  -5.860
  457    HZ2  LYS  64           HZ2      LYS  64  -0.123  10.846  -5.702
  458    HZ3  LYS  64           HZ3      LYS  64   0.683  10.613  -7.179
  459    H    VAL  65           H        VAL  65   1.551   3.939  -0.461
  460    HA   VAL  65           HA       VAL  65   0.151   4.763   1.892
  461    HB   VAL  65           HB       VAL  65   2.061   2.439   1.460
  462   HG11  VAL  65          HG11      VAL  65   0.928   1.448   3.433
  463   HG12  VAL  65          HG12      VAL  65   0.016   2.941   3.648
  464   HG13  VAL  65          HG13      VAL  65   1.768   2.942   3.852
  465   HG21  VAL  65          HG21      VAL  65  -0.035   2.568   0.010
  466   HG22  VAL  65          HG22      VAL  65  -0.966   2.417   1.499
  467   HG23  VAL  65          HG23      VAL  65   0.115   1.117   1.001
  468    H    VAL  66           H        VAL  66   0.848   6.053   3.419
  469    HA   VAL  66           HA       VAL  66   3.760   6.225   3.975
  470    HB   VAL  66           HB       VAL  66   1.788   8.534   3.973
  471   HG11  VAL  66          HG11      VAL  66   4.777   8.509   4.496
  472   HG12  VAL  66          HG12      VAL  66   3.536   8.732   5.729
  473   HG13  VAL  66          HG13      VAL  66   3.743   9.938   4.459
  474   HG21  VAL  66          HG21      VAL  66   2.534   7.701   1.716
  475   HG22  VAL  66          HG22      VAL  66   4.196   8.037   2.201
  476   HG23  VAL  66          HG23      VAL  66   3.033   9.356   2.063
  477    H    ALA  67           H        ALA  67   4.293   5.796   6.004
  478    HA   ALA  67           HA       ALA  67   2.337   5.124   7.970
  479    HB1  ALA  67           HB1      ALA  67   4.418   4.990   9.466
  480    HB2  ALA  67           HB2      ALA  67   5.340   5.364   8.010
  481    HB3  ALA  67           HB3      ALA  67   4.356   3.902   8.079
  482    H    VAL  68           H        VAL  68   1.651   6.223   9.746
  483    HA   VAL  68           HA       VAL  68   2.851   8.538  10.829
  484    HB   VAL  68           HB       VAL  68   2.143   9.583   8.708
  485   HG11  VAL  68          HG11      VAL  68  -0.126   9.693   8.004
  486   HG12  VAL  68          HG12      VAL  68  -0.714   9.055   9.539
  487   HG13  VAL  68          HG13      VAL  68   0.152   8.003   8.421
  488   HG21  VAL  68          HG21      VAL  68   0.813  11.446   9.689
  489   HG22  VAL  68          HG22      VAL  68   2.163  10.977  10.721
  490   HG23  VAL  68          HG23      VAL  68   0.526  10.460  11.123
  Start of MODEL   18
    1    H1   MET   1           HT1      MET   1  -7.210  14.191   3.344
    2    H2   MET   1           HT2      MET   1  -6.210  14.870   2.149
    3    H3   MET   1           HT3      MET   1  -5.593  14.554   3.701
    4    HA   MET   1           HA       MET   1  -6.161  12.697   1.504
    5    HB2  MET   1           HB2      MET   1  -3.858  13.565   2.098
    6    HB3  MET   1           HB3      MET   1  -4.011  12.722   3.640
    7    HG2  MET   1           HG2      MET   1  -2.805  11.286   2.096
    8    HG3  MET   1           HG3      MET   1  -4.402  10.592   2.374
    9    HE1  MET   1           HE1      MET   1  -3.121  13.622  -0.028
   10    HE2  MET   1           HE2      MET   1  -2.665  12.547  -1.346
   11    HE3  MET   1           HE3      MET   1  -1.956  12.322   0.251
   12    H    SER   2           H        SER   2  -7.093  10.767   1.828
   13    HA   SER   2           HA       SER   2  -8.474  10.181   4.242
   14    HB2  SER   2           HB2      SER   2  -7.859   8.431   1.851
   15    HB3  SER   2           HB3      SER   2  -8.979   8.010   3.142
   16    HG   SER   2           HG       SER   2  -9.355   9.590   0.996
   17    H    LYS   3           H        LYS   3  -8.114   8.572   5.776
   18    HA   LYS   3           HA       LYS   3  -5.700   6.964   5.710
   19    HB2  LYS   3           HB2      LYS   3  -4.735   7.891   7.765
   20    HB3  LYS   3           HB3      LYS   3  -4.827   9.119   6.506
   21    HG2  LYS   3           HG2      LYS   3  -6.904  10.001   7.516
   22    HG3  LYS   3           HG3      LYS   3  -6.798   8.775   8.781
   23    HD2  LYS   3           HD2      LYS   3  -4.623   9.692   9.495
   24    HD3  LYS   3           HD3      LYS   3  -4.723  10.919   8.230
   25    HE2  LYS   3           HE2      LYS   3  -6.788  11.805   9.244
   26    HE3  LYS   3           HE3      LYS   3  -6.697  10.578  10.508
   27    HZ1  LYS   3           HZ1      LYS   3  -4.915  11.579  11.487
   28    HZ2  LYS   3           HZ2      LYS   3  -5.706  12.951  10.872
   29    HZ3  LYS   3           HZ3      LYS   3  -4.369  12.298  10.053
   30    H    GLY   4           H        GLY   4  -5.806   5.211   7.043
   31    HA2  GLY   4           HA2      GLY   4  -8.107   5.006   8.886
   32    HA3  GLY   4           HA3      GLY   4  -7.830   3.762   7.671
   33    H    ILE   5           H        ILE   5  -7.790   2.399   9.647
   34    HA   ILE   5           HA       ILE   5  -5.089   2.388  10.870
   35    HB   ILE   5           HB       ILE   5  -6.196   1.077  12.744
   36   HG12  ILE   5          HG12      ILE   5  -8.777   2.278  11.709
   37   HG13  ILE   5          HG13      ILE   5  -8.303   0.638  11.282
   38   HG21  ILE   5          HG21      ILE   5  -7.053   3.938  12.222
   39   HG22  ILE   5          HG22      ILE   5  -5.575   3.414  13.025
   40   HG23  ILE   5          HG23      ILE   5  -7.139   3.139  13.791
   41   HD11  ILE   5          HD11      ILE   5  -8.829   1.756  14.047
   42   HD12  ILE   5          HD12      ILE   5  -8.037   0.202  13.785
   43   HD13  ILE   5          HD13      ILE   5  -9.692   0.452  13.231
   44    H    VAL   6           H        VAL   6  -3.855   0.720  10.488
   45    HA   VAL   6           HA       VAL   6  -4.625  -1.295   8.655
   46    HB   VAL   6           HB       VAL   6  -2.166  -1.122  10.417
   47   HG11  VAL   6          HG11      VAL   6  -1.188  -2.580   8.561
   48   HG12  VAL   6          HG12      VAL   6  -2.844  -2.861   8.030
   49   HG13  VAL   6          HG13      VAL   6  -2.333  -3.383   9.635
   50   HG21  VAL   6          HG21      VAL   6  -2.646   0.779   8.762
   51   HG22  VAL   6          HG22      VAL   6  -2.434  -0.416   7.483
   52   HG23  VAL   6          HG23      VAL   6  -1.096  -0.042   8.570
   53    H    LYS   7           H        LYS   7  -5.626  -3.150   8.989
   54    HA   LYS   7           HA       LYS   7  -6.437  -4.043  11.577
   55    HB2  LYS   7           HB2      LYS   7  -7.652  -4.550   9.419
   56    HB3  LYS   7           HB3      LYS   7  -6.352  -5.680   9.027
   57    HG2  LYS   7           HG2      LYS   7  -6.809  -6.890  11.166
   58    HG3  LYS   7           HG3      LYS   7  -8.166  -5.807  11.456
   59    HD2  LYS   7           HD2      LYS   7  -7.927  -7.474   8.939
   60    HD3  LYS   7           HD3      LYS   7  -8.753  -8.050  10.386
   61    HE2  LYS   7           HE2      LYS   7 -10.245  -6.057  10.298
   62    HE3  LYS   7           HE3      LYS   7  -9.454  -5.558   8.802
   63    HZ1  LYS   7           HZ1      LYS   7 -11.614  -6.986   8.741
   64    HZ2  LYS   7           HZ2      LYS   7 -10.541  -8.277   8.997
   65    HZ3  LYS   7           HZ3      LYS   7 -10.363  -7.279   7.632
   66    H    TRP   8           H        TRP   8  -3.989  -5.092   9.235
   67    HA   TRP   8           HA       TRP   8  -2.118  -5.798  11.228
   68    HB2  TRP   8           HB2      TRP   8  -2.004  -8.221  10.897
   69    HB3  TRP   8           HB3      TRP   8  -3.557  -7.742  11.569
   70    HD1  TRP   8           HD1      TRP   8  -5.696  -7.936  10.003
   71    HE1  TRP   8           HE1      TRP   8  -6.139  -9.309   7.868
   72    HE3  TRP   8           HE3      TRP   8  -0.902  -9.126   8.710
   73    HZ2  TRP   8           HZ2      TRP   8  -4.658 -10.731   5.880
   74    HZ3  TRP   8           HZ3      TRP   8  -0.449 -10.493   6.694
   75    HH2  TRP   8           HH2      TRP   8  -2.317 -11.295   5.278
   76    H    PHE   9           H        PHE   9  -0.106  -5.886  10.431
   77    HA   PHE   9           HA       PHE   9   0.168  -5.914   7.466
   78    HB2  PHE   9           HB2      PHE   9   0.590  -3.673   8.552
   79    HB3  PHE   9           HB3      PHE   9   1.962  -4.411   9.384
   80    HD1  PHE   9           HD1      PHE   9   0.627  -3.307   6.138
   81    HD2  PHE   9           HD2      PHE   9   3.939  -5.163   8.144
   82    HE1  PHE   9           HE1      PHE   9   2.024  -2.999   4.114
   83    HE2  PHE   9           HE2      PHE   9   5.340  -4.851   6.122
   84    HZ   PHE   9           HZ       PHE   9   4.382  -3.769   4.106
   85    H    ASN  10           H        ASN  10   1.508  -7.403   6.632
   86    HA   ASN  10           HA       ASN  10   3.516  -8.651   8.406
   87    HB2  ASN  10           HB2      ASN  10   1.542 -10.056   6.607
   88    HB3  ASN  10           HB3      ASN  10   3.010 -10.829   7.197
   89   HD21  ASN  10          HD21      ASN  10   0.393 -11.780   7.914
   90   HD22  ASN  10          HD22      ASN  10   0.178 -11.534   9.579
   91    H    SER  11           H        SER  11   5.301  -7.717   7.547
   92    HA   SER  11           HA       SER  11   5.751  -7.217   4.809
   93    HB2  SER  11           HB2      SER  11   8.070  -6.829   5.476
   94    HB3  SER  11           HB3      SER  11   6.969  -6.090   6.636
   95    HG   SER  11           HG       SER  11   8.828  -7.523   7.370
   96    H    ASP  12           H        ASP  12   6.288 -10.065   6.812
   97    HA   ASP  12           HA       ASP  12   8.122 -11.449   5.173
   98    HB2  ASP  12           HB2      ASP  12   5.933 -12.448   7.014
   99    HB3  ASP  12           HB3      ASP  12   7.075 -13.520   6.208
  100    H    LYS  13           H        LYS  13   4.584 -11.313   5.179
  101    HA   LYS  13           HA       LYS  13   4.260 -13.019   2.882
  102    HB2  LYS  13           HB2      LYS  13   2.383 -11.115   4.305
  103    HB3  LYS  13           HB3      LYS  13   1.903 -12.141   2.955
  104    HG2  LYS  13           HG2      LYS  13   2.580 -14.144   4.225
  105    HG3  LYS  13           HG3      LYS  13   3.061 -13.119   5.582
  106    HD2  LYS  13           HD2      LYS  13   0.740 -12.283   5.765
  107    HD3  LYS  13           HD3      LYS  13   0.263 -13.333   4.429
  108    HE2  LYS  13           HE2      LYS  13   1.465 -14.301   7.039
  109    HE3  LYS  13           HE3      LYS  13  -0.255 -14.336   6.651
  110    HZ1  LYS  13           HZ1      LYS  13   0.284 -15.719   4.713
  111    HZ2  LYS  13           HZ2      LYS  13   0.729 -16.461   6.176
  112    HZ3  LYS  13           HZ3      LYS  13   1.912 -15.745   5.188
  113    H    GLY  14           H        GLY  14   4.783  -9.632   3.486
  114    HA2  GLY  14           HA2      GLY  14   5.609  -8.070   1.929
  115    HA3  GLY  14           HA3      GLY  14   5.058  -9.108   0.623
  116    H    PHE  15           H        PHE  15   2.612  -8.762   2.956
  117    HA   PHE  15           HA       PHE  15   1.545  -6.259   1.983
  118    HB2  PHE  15           HB2      PHE  15  -0.516  -7.209   1.012
  119    HB3  PHE  15           HB3      PHE  15   0.925  -7.670   0.104
  120    HD1  PHE  15           HD1      PHE  15  -1.711  -8.845   2.410
  121    HD2  PHE  15           HD2      PHE  15   1.721  -9.968   0.083
  122    HE1  PHE  15           HE1      PHE  15  -2.299 -11.237   2.695
  123    HE2  PHE  15           HE2      PHE  15   1.135 -12.360   0.371
  124    HZ   PHE  15           HZ       PHE  15  -0.875 -12.995   1.678
  125    H    GLY  16           H        GLY  16  -0.792  -5.997   2.768
  126    HA2  GLY  16           HA2      GLY  16  -1.502  -7.434   5.173
  127    HA3  GLY  16           HA3      GLY  16  -0.942  -5.787   5.460
  128    H    PHE  17           H        PHE  17  -3.421  -6.255   6.239
  129    HA   PHE  17           HA       PHE  17  -5.147  -5.082   4.137
  130    HB2  PHE  17           HB2      PHE  17  -5.811  -7.031   6.351
  131    HB3  PHE  17           HB3      PHE  17  -7.045  -6.123   5.476
  132    HD1  PHE  17           HD1      PHE  17  -4.189  -8.477   5.011
  133    HD2  PHE  17           HD2      PHE  17  -7.782  -6.835   3.334
  134    HE1  PHE  17           HE1      PHE  17  -4.097 -10.150   3.183
  135    HE2  PHE  17           HE2      PHE  17  -7.688  -8.501   1.501
  136    HZ   PHE  17           HZ       PHE  17  -5.846 -10.158   1.424
  137    H    ILE  18           H        ILE  18  -6.286  -3.272   4.647
  138    HA   ILE  18           HA       ILE  18  -5.853  -2.187   7.354
  139    HB   ILE  18           HB       ILE  18  -4.591  -0.962   5.642
  140   HG12  ILE  18          HG12      ILE  18  -6.921   0.768   6.490
  141   HG13  ILE  18          HG13      ILE  18  -5.735   0.179   7.654
  142   HG21  ILE  18          HG21      ILE  18  -5.962  -1.380   3.685
  143   HG22  ILE  18          HG22      ILE  18  -5.881   0.363   3.940
  144   HG23  ILE  18          HG23      ILE  18  -7.329  -0.532   4.408
  145   HD11  ILE  18          HD11      ILE  18  -5.287   2.013   5.297
  146   HD12  ILE  18          HD12      ILE  18  -3.955   1.156   6.069
  147   HD13  ILE  18          HD13      ILE  18  -4.916   2.308   6.996
  148    H    THR  19           H        THR  19  -7.457  -1.120   8.392
  149    HA   THR  19           HA       THR  19 -10.168  -1.721   7.467
  150    HB   THR  19           HB       THR  19  -9.201  -0.861  10.199
  151    HG1  THR  19           HG1      THR  19  -8.526  -2.848  10.209
  152   HG21  THR  19          HG21      THR  19 -11.852  -1.942   9.198
  153   HG22  THR  19          HG22      THR  19 -11.553  -0.340   9.872
  154   HG23  THR  19          HG23      THR  19 -11.433  -1.766  10.903
  155    HA   PRO  20           HA       PRO  20 -10.111   2.736   6.273
  156    HB2  PRO  20           HB2      PRO  20 -12.976   2.000   5.794
  157    HB3  PRO  20           HB3      PRO  20 -11.875   2.947   4.772
  158    HG2  PRO  20           HG2      PRO  20 -12.416   0.471   4.130
  159    HG3  PRO  20           HG3      PRO  20 -10.745   1.061   4.027
  160    HD2  PRO  20           HD2      PRO  20 -11.992  -0.695   6.123
  161    HD3  PRO  20           HD3      PRO  20 -10.372  -0.777   5.396
  162    H    GLU  21           H        GLU  21 -10.483   4.440   7.531
  163    HA   GLU  21           HA       GLU  21 -11.534   4.280  10.120
  164    HB2  GLU  21           HB2      GLU  21  -9.924   5.995   9.404
  165    HB3  GLU  21           HB3      GLU  21 -11.136   6.704   8.341
  166    HG2  GLU  21           HG2      GLU  21 -11.044   7.994  10.401
  167    HG3  GLU  21           HG3      GLU  21 -12.579   7.128  10.319
  168    H    ASP  22           H        ASP  22 -12.989   5.418   7.091
  169    HA   ASP  22           HA       ASP  22 -15.410   6.385   8.201
  170    HB2  ASP  22           HB2      ASP  22 -14.689   5.425   5.430
  171    HB3  ASP  22           HB3      ASP  22 -16.265   6.093   5.830
  172    H    GLY  23           H        GLY  23 -14.288   3.176   7.768
  173    HA2  GLY  23           HA2      GLY  23 -15.430   1.303   8.715
  174    HA3  GLY  23           HA3      GLY  23 -16.960   2.125   8.426
  175    H    SER  24           H        SER  24 -14.855   2.438   5.790
  176    HA   SER  24           HA       SER  24 -16.523   0.889   4.064
  177    HB2  SER  24           HB2      SER  24 -13.820   2.157   3.600
  178    HB3  SER  24           HB3      SER  24 -14.817   1.440   2.345
  179    HG   SER  24           HG       SER  24 -14.931   3.874   3.135
  180    H    LYS  25           H        LYS  25 -15.613  -0.782   2.588
  181    HA   LYS  25           HA       LYS  25 -14.780  -3.053   4.002
  182    HB2  LYS  25           HB2      LYS  25 -16.009  -3.078   1.831
  183    HB3  LYS  25           HB3      LYS  25 -14.537  -2.546   1.024
  184    HG2  LYS  25           HG2      LYS  25 -14.643  -4.936   0.768
  185    HG3  LYS  25           HG3      LYS  25 -13.396  -4.610   1.968
  186    HD2  LYS  25           HD2      LYS  25 -14.954  -5.119   3.784
  187    HD3  LYS  25           HD3      LYS  25 -16.265  -5.346   2.626
  188    HE2  LYS  25           HE2      LYS  25 -15.030  -7.221   1.597
  189    HE3  LYS  25           HE3      LYS  25 -13.724  -6.996   2.758
  190    HZ1  LYS  25           HZ1      LYS  25 -15.220  -8.741   3.471
  191    HZ2  LYS  25           HZ2      LYS  25 -16.540  -7.671   3.418
  192    HZ3  LYS  25           HZ3      LYS  25 -15.294  -7.432   4.548
  193    H    ASP  26           H        ASP  26 -12.823  -4.098   4.242
  194    HA   ASP  26           HA       ASP  26 -10.497  -2.651   4.568
  195    HB2  ASP  26           HB2      ASP  26 -10.790  -5.594   3.942
  196    HB3  ASP  26           HB3      ASP  26  -9.340  -4.835   4.596
  197    H    LEU  27           H        LEU  27  -8.707  -2.207   3.374
  198    HA   LEU  27           HA       LEU  27  -8.905  -2.671   0.462
  199    HB2  LEU  27           HB2      LEU  27  -7.475  -0.496   2.014
  200    HB3  LEU  27           HB3      LEU  27  -7.444  -0.672   0.261
  201    HG   LEU  27           HG       LEU  27 -10.017  -0.367   1.839
  202   HD11  LEU  27          HD11      LEU  27  -9.934   2.006   0.939
  203   HD12  LEU  27          HD12      LEU  27  -8.248   1.711   0.519
  204   HD13  LEU  27          HD13      LEU  27  -8.759   1.654   2.206
  205   HD21  LEU  27          HD21      LEU  27  -9.291  -0.072  -1.097
  206   HD22  LEU  27          HD22      LEU  27 -10.867   0.329  -0.416
  207   HD23  LEU  27          HD23      LEU  27 -10.291  -1.339  -0.387
  208    H    PHE  28           H        PHE  28  -7.146  -3.396  -0.684
  209    HA   PHE  28           HA       PHE  28  -5.195  -4.973   0.757
  210    HB2  PHE  28           HB2      PHE  28  -5.617  -4.391  -2.186
  211    HB3  PHE  28           HB3      PHE  28  -4.351  -5.458  -1.572
  212    HD1  PHE  28           HD1      PHE  28  -8.005  -4.976  -1.903
  213    HD2  PHE  28           HD2      PHE  28  -4.868  -7.649  -0.693
  214    HE1  PHE  28           HE1      PHE  28  -9.636  -6.841  -1.796
  215    HE2  PHE  28           HE2      PHE  28  -6.500  -9.513  -0.584
  216    HZ   PHE  28           HZ       PHE  28  -8.883  -9.110  -1.135
  217    H    VAL  29           H        VAL  29  -3.217  -4.328   1.359
  218    HA   VAL  29           HA       VAL  29  -1.976  -2.029  -0.012
  219    HB   VAL  29           HB       VAL  29  -2.141  -2.442   2.989
  220   HG11  VAL  29          HG11      VAL  29  -0.660  -0.411   1.300
  221   HG12  VAL  29          HG12      VAL  29   0.023  -1.507   2.502
  222   HG13  VAL  29          HG13      VAL  29  -1.000  -0.164   3.014
  223   HG21  VAL  29          HG21      VAL  29  -3.357  -0.274   2.924
  224   HG22  VAL  29          HG22      VAL  29  -4.204  -1.534   2.027
  225   HG23  VAL  29          HG23      VAL  29  -3.280  -0.306   1.162
  226    H    HIS  30           H        HIS  30   0.130  -2.328  -0.517
  227    HA   HIS  30           HA       HIS  30   1.417  -4.816   0.427
  228    HB2  HIS  30           HB2      HIS  30   1.777  -3.207  -2.106
  229    HB3  HIS  30           HB3      HIS  30   2.830  -4.544  -1.642
  230    HD2  HIS  30           HD2      HIS  30   1.756  -7.091  -2.108
  231    HE1  HIS  30           HE1      HIS  30  -2.065  -5.820  -3.373
  232    HE2  HIS  30           HE2      HIS  30  -0.530  -7.828  -3.129
  233    H    HIS  31           H        HIS  31   3.634  -4.812   0.923
  234    HA   HIS  31           HA       HIS  31   4.551  -2.633   2.480
  235    HB2  HIS  31           HB2      HIS  31   5.253  -5.022   2.772
  236    HB3  HIS  31           HB3      HIS  31   6.209  -4.878   1.297
  237    HD2  HIS  31           HD2      HIS  31   6.426  -3.850   5.053
  238    HE1  HIS  31           HE1      HIS  31   9.846  -2.309   3.120
  239    HE2  HIS  31           HE2      HIS  31   8.747  -2.698   5.375
  240    H    SER  32           H        SER  32   5.439  -3.773  -0.750
  241    HA   SER  32           HA       SER  32   7.391  -1.750  -1.251
  242    HB2  SER  32           HB2      SER  32   7.401  -2.609  -3.525
  243    HB3  SER  32           HB3      SER  32   7.372  -3.949  -2.382
  244    HG   SER  32           HG       SER  32   5.716  -4.515  -3.577
  245    H    GLU  33           H        GLU  33   4.026  -1.517  -1.148
  246    HA   GLU  33           HA       GLU  33   3.507   0.169  -3.370
  247    HB2  GLU  33           HB2      GLU  33   1.800  -1.112  -2.036
  248    HB3  GLU  33           HB3      GLU  33   1.991   0.084  -0.758
  249    HG2  GLU  33           HG2      GLU  33   0.082   0.685  -2.145
  250    HG3  GLU  33           HG3      GLU  33   1.362   1.872  -2.368
  251    H    ILE  34           H        ILE  34   4.788   0.832  -0.160
  252    HA   ILE  34           HA       ILE  34   4.272   3.665  -0.253
  253    HB   ILE  34           HB       ILE  34   4.503   2.479   1.897
  254   HG12  ILE  34          HG12      ILE  34   6.827   4.403   1.625
  255   HG13  ILE  34          HG13      ILE  34   5.154   4.948   1.565
  256   HG21  ILE  34          HG21      ILE  34   7.482   2.266   1.469
  257   HG22  ILE  34          HG22      ILE  34   6.426   0.987   0.882
  258   HG23  ILE  34          HG23      ILE  34   6.449   1.384   2.596
  259   HD11  ILE  34          HD11      ILE  34   4.808   3.755   3.789
  260   HD12  ILE  34          HD12      ILE  34   5.862   5.168   3.851
  261   HD13  ILE  34          HD13      ILE  34   6.558   3.548   3.854
  262    H    GLN  35           H        GLN  35   5.272   5.042  -1.547
  263    HA   GLN  35           HA       GLN  35   7.568   4.432  -3.089
  264    HB2  GLN  35           HB2      GLN  35   5.843   6.142  -3.691
  265    HB3  GLN  35           HB3      GLN  35   6.466   7.171  -2.402
  266    HG2  GLN  35           HG2      GLN  35   8.665   7.244  -3.479
  267    HG3  GLN  35           HG3      GLN  35   8.108   6.141  -4.735
  268   HE21  GLN  35          HE21      GLN  35   8.311   7.639  -6.501
  269   HE22  GLN  35          HE22      GLN  35   7.347   9.031  -6.628
  270    H    SER  36           H        SER  36   7.100   6.240  -0.079
  271    HA   SER  36           HA       SER  36   9.855   5.781   0.699
  272    HB2  SER  36           HB2      SER  36  10.436   8.118   0.990
  273    HB3  SER  36           HB3      SER  36   9.985   7.848  -0.690
  274    HG   SER  36           HG       SER  36   8.933   9.555   1.027
  275    H    GLY  37           H        GLY  37  10.256   6.490   2.933
  276    HA2  GLY  37           HA2      GLY  37   8.273   7.505   4.654
  277    HA3  GLY  37           HA3      GLY  37   8.197   5.746   4.697
  278    H    GLY  38           H        GLY  38  10.707   8.284   4.715
  279    HA2  GLY  38           HA2      GLY  38  12.601   8.566   5.989
  280    HA3  GLY  38           HA3      GLY  38  11.721   7.742   7.274
  281    H    GLU  39           H        GLU  39  13.081   6.254   8.069
  282    HA   GLU  39           HA       GLU  39  14.188   4.254   6.206
  283    HB2  GLU  39           HB2      GLU  39  15.715   5.574   8.464
  284    HB3  GLU  39           HB3      GLU  39  16.291   4.211   7.506
  285    HG2  GLU  39           HG2      GLU  39  16.127   5.590   5.458
  286    HG3  GLU  39           HG3      GLU  39  15.581   6.955   6.429
  287    H    TYR  40           H        TYR  40  14.390   2.179   7.028
  288    HA   TYR  40           HA       TYR  40  13.756   0.354   8.266
  289    HB2  TYR  40           HB2      TYR  40  14.279   2.284  10.541
  290    HB3  TYR  40           HB3      TYR  40  14.082   0.543  10.722
  291    HD1  TYR  40           HD1      TYR  40  16.291   3.230   9.549
  292    HD2  TYR  40           HD2      TYR  40  15.762  -1.023   9.825
  293    HE1  TYR  40           HE1      TYR  40  18.686   2.897   9.000
  294    HE2  TYR  40           HE2      TYR  40  18.160  -1.356   9.277
  295    HH   TYR  40           HH       TYR  40  20.032   0.766   7.866
  296    H    ALA  41           H        ALA  41  11.640   2.111   7.313
  297    HA   ALA  41           HA       ALA  41   9.651   2.557   9.273
  298    HB1  ALA  41           HB1      ALA  41   9.584   2.213   6.283
  299    HB2  ALA  41           HB2      ALA  41   9.320   3.676   7.232
  300    HB3  ALA  41           HB3      ALA  41   8.096   2.405   7.210
  301    H    THR  42           H        THR  42   8.303   1.212  10.286
  302    HA   THR  42           HA       THR  42   7.920  -1.519   9.211
  303    HB   THR  42           HB       THR  42   7.962  -2.382  11.522
  304    HG1  THR  42           HG1      THR  42   8.104  -1.071  13.155
  305   HG21  THR  42          HG21      THR  42  10.029  -2.617  10.388
  306   HG22  THR  42          HG22      THR  42  10.453  -1.902  11.944
  307   HG23  THR  42          HG23      THR  42  10.380  -0.892  10.501
  308    H    LEU  43           H        LEU  43   5.987  -2.594   9.976
  309    HA   LEU  43           HA       LEU  43   3.885  -0.891  11.092
  310    HB2  LEU  43           HB2      LEU  43   3.554  -2.374   8.471
  311    HB3  LEU  43           HB3      LEU  43   2.284  -1.527   9.342
  312    HG   LEU  43           HG       LEU  43   4.058   0.509   9.164
  313   HD11  LEU  43          HD11      LEU  43   5.654  -1.059   7.894
  314   HD12  LEU  43          HD12      LEU  43   5.321   0.498   7.145
  315   HD13  LEU  43          HD13      LEU  43   4.519  -0.955   6.554
  316   HD21  LEU  43          HD21      LEU  43   2.128  -0.411   7.012
  317   HD22  LEU  43          HD22      LEU  43   2.864   1.190   7.046
  318   HD23  LEU  43          HD23      LEU  43   1.789   0.687   8.350
  319    H    ALA  44           H        ALA  44   2.135  -2.086  11.973
  320    HA   ALA  44           HA       ALA  44   2.377  -5.005  12.076
  321    HB1  ALA  44           HB1      ALA  44   3.759  -3.897  13.948
  322    HB2  ALA  44           HB2      ALA  44   2.598  -5.132  14.436
  323    HB3  ALA  44           HB3      ALA  44   2.208  -3.424  14.647
  324    H    ASP  45           H        ASP  45   0.465  -5.049  14.417
  325    HA   ASP  45           HA       ASP  45  -1.959  -4.641  12.873
  326    HB2  ASP  45           HB2      ASP  45  -3.062  -5.787  14.765
  327    HB3  ASP  45           HB3      ASP  45  -1.729  -6.725  14.106
  328    H    GLY  46           H        GLY  46  -2.886  -2.713  12.854
  329    HA2  GLY  46           HA2      GLY  46  -4.250  -1.100  13.995
  330    HA3  GLY  46           HA3      GLY  46  -3.220  -1.274  15.407
  331    H    GLN  47           H        GLN  47  -1.230  -1.128  12.712
  332    HA   GLN  47           HA       GLN  47  -0.107   1.369  13.373
  333    HB2  GLN  47           HB2      GLN  47   1.040  -0.479  12.118
  334    HB3  GLN  47           HB3      GLN  47   0.060  -0.069  10.710
  335    HG2  GLN  47           HG2      GLN  47   2.239   1.022  10.531
  336    HG3  GLN  47           HG3      GLN  47   0.989   2.235  10.771
  337   HE21  GLN  47          HE21      GLN  47   1.749   3.827  12.169
  338   HE22  GLN  47          HE22      GLN  47   2.699   3.541  13.546
  339    H    THR  48           H        THR  48  -0.623   3.401  12.822
  340    HA   THR  48           HA       THR  48  -3.006   3.873  11.204
  341    HB   THR  48           HB       THR  48  -1.227   5.835  12.688
  342    HG1  THR  48           HG1      THR  48  -2.279   4.273  14.011
  343   HG21  THR  48          HG21      THR  48  -4.094   6.193  11.790
  344   HG22  THR  48          HG22      THR  48  -2.725   6.717  10.810
  345   HG23  THR  48          HG23      THR  48  -2.990   7.424  12.405
  346    H    VAL  49           H        VAL  49  -2.970   4.420   9.111
  347    HA   VAL  49           HA       VAL  49  -0.564   5.709   8.009
  348    HB   VAL  49           HB       VAL  49  -0.566   4.189   6.056
  349   HG11  VAL  49          HG11      VAL  49   0.558   2.370   7.159
  350   HG12  VAL  49          HG12      VAL  49  -0.333   2.651   8.654
  351   HG13  VAL  49          HG13      VAL  49   0.869   3.822   8.109
  352   HG21  VAL  49          HG21      VAL  49  -2.850   3.385   6.072
  353   HG22  VAL  49          HG22      VAL  49  -2.654   2.715   7.692
  354   HG23  VAL  49          HG23      VAL  49  -1.793   1.997   6.330
  355    H    GLU  50           H        GLU  50  -0.888   6.472   5.768
  356    HA   GLU  50           HA       GLU  50  -3.647   7.487   5.381
  357    HB2  GLU  50           HB2      GLU  50  -1.030   8.653   4.361
  358    HB3  GLU  50           HB3      GLU  50  -2.633   9.355   4.156
  359    HG2  GLU  50           HG2      GLU  50  -2.833   9.584   6.617
  360    HG3  GLU  50           HG3      GLU  50  -1.215   8.916   6.804
  361    H    TYR  51           H        TYR  51  -4.588   7.125   3.334
  362    HA   TYR  51           HA       TYR  51  -2.942   6.010   1.202
  363    HB2  TYR  51           HB2      TYR  51  -4.272   3.965   0.967
  364    HB3  TYR  51           HB3      TYR  51  -3.476   4.024   2.534
  365    HD1  TYR  51           HD1      TYR  51  -6.697   4.331   0.760
  366    HD2  TYR  51           HD2      TYR  51  -4.758   4.297   4.591
  367    HE1  TYR  51           HE1      TYR  51  -8.901   4.100   1.872
  368    HE2  TYR  51           HE2      TYR  51  -6.963   4.063   5.702
  369    HH   TYR  51           HH       TYR  51  -9.928   4.493   4.008
  370    H    GLU  52           H        GLU  52  -4.136   5.579  -0.773
  371    HA   GLU  52           HA       GLU  52  -6.518   7.306  -1.081
  372    HB2  GLU  52           HB2      GLU  52  -4.460   8.267  -2.136
  373    HB3  GLU  52           HB3      GLU  52  -4.338   6.817  -3.132
  374    HG2  GLU  52           HG2      GLU  52  -6.550   7.277  -4.105
  375    HG3  GLU  52           HG3      GLU  52  -6.707   8.710  -3.089
  376    H    VAL  53           H        VAL  53  -8.252   6.315  -1.900
  377    HA   VAL  53           HA       VAL  53  -8.361   3.519  -2.260
  378    HB   VAL  53           HB       VAL  53 -10.296   4.909  -1.596
  379   HG11  VAL  53          HG11      VAL  53 -10.306   5.832  -4.486
  380   HG12  VAL  53          HG12      VAL  53  -9.849   6.830  -3.105
  381   HG13  VAL  53          HG13      VAL  53 -11.503   6.240  -3.258
  382   HG21  VAL  53          HG21      VAL  53 -10.817   3.463  -4.211
  383   HG22  VAL  53          HG22      VAL  53 -11.970   3.733  -2.902
  384   HG23  VAL  53          HG23      VAL  53 -10.597   2.652  -2.661
  385    H    GLY  54           H        GLY  54  -8.713   2.275  -4.110
  386    HA2  GLY  54           HA2      GLY  54  -8.139   3.462  -6.736
  387    HA3  GLY  54           HA3      GLY  54  -7.098   2.158  -6.164
  388    H    GLN  55           H        GLN  55  -8.576   1.878  -8.509
  389    HA   GLN  55           HA       GLN  55 -10.880   0.187  -7.794
  390    HB2  GLN  55           HB2      GLN  55 -11.094   2.013  -9.536
  391    HB3  GLN  55           HB3      GLN  55 -10.018   1.058 -10.557
  392    HG2  GLN  55           HG2      GLN  55 -12.492  -0.181  -9.351
  393    HG3  GLN  55           HG3      GLN  55 -12.587   0.748 -10.843
  394   HE21  GLN  55          HE21      GLN  55 -12.954  -2.219 -10.423
  395   HE22  GLN  55          HE22      GLN  55 -11.835  -2.954 -11.466
  396    H    GLY  56           H        GLY  56 -10.800  -1.970  -7.933
  397    HA2  GLY  56           HA2      GLY  56  -8.793  -3.270  -9.637
  398    HA3  GLY  56           HA3      GLY  56  -8.767  -3.639  -7.917
  399    H    GLN  57           H        GLN  57  -9.245  -5.475 -10.091
  400    HA   GLN  57           HA       GLN  57 -11.986  -6.105 -10.427
  401    HB2  GLN  57           HB2      GLN  57  -9.482  -7.781 -10.660
  402    HB3  GLN  57           HB3      GLN  57 -11.088  -8.373 -11.083
  403    HG2  GLN  57           HG2      GLN  57 -11.348  -6.532 -12.701
  404    HG3  GLN  57           HG3      GLN  57  -9.745  -5.932 -12.276
  405   HE21  GLN  57          HE21      GLN  57  -8.575  -6.378 -14.190
  406   HE22  GLN  57          HE22      GLN  57  -8.434  -7.928 -14.865
  407    H    LYS  58           H        LYS  58  -9.570  -7.135  -8.067
  408    HA   LYS  58           HA       LYS  58 -11.462  -8.903  -6.713
  409    HB2  LYS  58           HB2      LYS  58  -8.588  -8.207  -6.042
  410    HB3  LYS  58           HB3      LYS  58  -9.555  -9.443  -5.243
  411    HG2  LYS  58           HG2      LYS  58  -8.946  -9.450  -8.217
  412    HG3  LYS  58           HG3      LYS  58  -7.998 -10.334  -7.023
  413    HD2  LYS  58           HD2      LYS  58 -10.046 -11.571  -6.342
  414    HD3  LYS  58           HD3      LYS  58 -10.953 -10.725  -7.597
  415    HE2  LYS  58           HE2      LYS  58  -9.454 -11.658  -9.318
  416    HE3  LYS  58           HE3      LYS  58  -8.547 -12.510  -8.067
  417    HZ1  LYS  58           HZ1      LYS  58 -10.855 -13.451  -7.450
  418    HZ2  LYS  58           HZ2      LYS  58 -10.027 -14.101  -8.784
  419    HZ3  LYS  58           HZ3      LYS  58 -11.291 -12.990  -9.024
  420    H    GLY  59           H        GLY  59 -11.726  -5.878  -6.815
  421    HA2  GLY  59           HA2      GLY  59 -13.044  -4.710  -5.141
  422    HA3  GLY  59           HA3      GLY  59 -12.030  -5.449  -3.904
  423    HA   PRO  60           HA       PRO  60 -10.347  -1.207  -5.300
  424    HB2  PRO  60           HB2      PRO  60 -10.765   0.228  -3.013
  425    HB3  PRO  60           HB3      PRO  60 -11.945   0.142  -4.337
  426    HG2  PRO  60           HG2      PRO  60 -11.875  -1.369  -1.767
  427    HG3  PRO  60           HG3      PRO  60 -13.245  -0.612  -2.594
  428    HD2  PRO  60           HD2      PRO  60 -12.770  -3.287  -2.732
  429    HD3  PRO  60           HD3      PRO  60 -13.503  -2.384  -4.077
  430    H    CYS  61           H        CYS  61  -8.334  -0.419  -4.763
  431    HA   CYS  61           HA       CYS  61  -6.873  -1.855  -2.623
  432    HB2  CYS  61           HB2      CYS  61  -6.250  -2.319  -5.059
  433    HB3  CYS  61           HB3      CYS  61  -5.668  -0.657  -5.125
  434    HG   CYS  61           HG       CYS  61  -3.605  -1.425  -4.009
  435    H    ALA  62           H        ALA  62  -4.948  -0.568  -1.795
  436    HA   ALA  62           HA       ALA  62  -5.529   2.329  -1.756
  437    HB1  ALA  62           HB1      ALA  62  -4.354   1.895   0.675
  438    HB2  ALA  62           HB2      ALA  62  -5.268   0.402   0.473
  439    HB3  ALA  62           HB3      ALA  62  -6.098   1.955   0.418
  440    H    ASN  63           H        ASN  63  -3.755   3.663  -1.960
  441    HA   ASN  63           HA       ASN  63  -1.079   2.416  -1.955
  442    HB2  ASN  63           HB2      ASN  63  -0.511   3.668  -4.014
  443    HB3  ASN  63           HB3      ASN  63  -1.795   2.492  -4.285
  444   HD21  ASN  63          HD21      ASN  63  -3.209   3.440  -5.769
  445   HD22  ASN  63          HD22      ASN  63  -3.812   5.022  -5.650
  446    H    LYS  64           H        LYS  64   0.588   4.370  -2.377
  447    HA   LYS  64           HA       LYS  64   1.617   6.182  -1.410
  448    HB2  LYS  64           HB2      LYS  64  -1.218   7.258  -1.267
  449    HB3  LYS  64           HB3      LYS  64   0.248   8.211  -1.063
  450    HG2  LYS  64           HG2      LYS  64  -0.357   6.615  -3.570
  451    HG3  LYS  64           HG3      LYS  64  -0.788   8.312  -3.383
  452    HD2  LYS  64           HD2      LYS  64   1.598   8.864  -2.979
  453    HD3  LYS  64           HD3      LYS  64   2.018   7.167  -3.214
  454    HE2  LYS  64           HE2      LYS  64   2.401   8.390  -5.294
  455    HE3  LYS  64           HE3      LYS  64   1.048   7.277  -5.507
  456    HZ1  LYS  64           HZ1      LYS  64  -0.481   8.986  -5.442
  457    HZ2  LYS  64           HZ2      LYS  64   0.805   9.700  -6.291
  458    HZ3  LYS  64           HZ3      LYS  64   0.569  10.054  -4.647
  459    H    VAL  65           H        VAL  65   1.433   4.133   0.232
  460    HA   VAL  65           HA       VAL  65   0.043   4.635   2.683
  461    HB   VAL  65           HB       VAL  65   2.364   2.765   2.098
  462   HG11  VAL  65          HG11      VAL  65   0.348   2.731   4.369
  463   HG12  VAL  65          HG12      VAL  65   2.036   3.222   4.521
  464   HG13  VAL  65          HG13      VAL  65   1.636   1.554   4.104
  465   HG21  VAL  65          HG21      VAL  65   0.173   2.493   0.764
  466   HG22  VAL  65          HG22      VAL  65  -0.567   2.036   2.297
  467   HG23  VAL  65          HG23      VAL  65   0.761   1.079   1.638
  468    H    VAL  66           H        VAL  66   0.554   6.129   4.086
  469    HA   VAL  66           HA       VAL  66   3.408   6.822   4.530
  470    HB   VAL  66           HB       VAL  66   1.019   8.694   4.704
  471   HG11  VAL  66          HG11      VAL  66   2.750   9.264   6.348
  472   HG12  VAL  66          HG12      VAL  66   2.748  10.448   5.041
  473   HG13  VAL  66          HG13      VAL  66   3.988   9.195   5.094
  474   HG21  VAL  66          HG21      VAL  66   3.290   8.463   2.706
  475   HG22  VAL  66          HG22      VAL  66   2.196   9.843   2.795
  476   HG23  VAL  66          HG23      VAL  66   1.571   8.245   2.384
  477    H    ALA  67           H        ALA  67   4.083   6.282   6.500
  478    HA   ALA  67           HA       ALA  67   2.289   5.351   8.528
  479    HB1  ALA  67           HB1      ALA  67   4.488   4.360   8.327
  480    HB2  ALA  67           HB2      ALA  67   4.369   5.159   9.895
  481    HB3  ALA  67           HB3      ALA  67   5.260   5.926   8.580
  482    H    VAL  68           H        VAL  68   1.489   6.355  10.272
  483    HA   VAL  68           HA       VAL  68   2.580   8.902  11.182
  484    HB   VAL  68           HB       VAL  68   0.380  10.047  11.071
  485   HG11  VAL  68          HG11      VAL  68   2.141  10.284   9.290
  486   HG12  VAL  68          HG12      VAL  68   0.502  10.590   8.720
  487   HG13  VAL  68          HG13      VAL  68   1.288   9.054   8.356
  488   HG21  VAL  68          HG21      VAL  68  -1.458   9.133   9.831
  489   HG22  VAL  68          HG22      VAL  68  -0.934   7.855  10.926
  490   HG23  VAL  68          HG23      VAL  68  -0.474   7.799   9.225
  Start of MODEL   19
    1    H1   MET   1           HT1      MET   1  -6.184  14.192   5.887
    2    H2   MET   1           HT2      MET   1  -4.864  13.268   5.346
    3    H3   MET   1           HT3      MET   1  -6.171  12.513   6.131
    4    HA   MET   1           HA       MET   1  -7.614  13.348   4.257
    5    HB2  MET   1           HB2      MET   1  -4.835  13.837   3.153
    6    HB3  MET   1           HB3      MET   1  -6.272  13.714   2.138
    7    HG2  MET   1           HG2      MET   1  -7.308  15.552   3.522
    8    HG3  MET   1           HG3      MET   1  -5.747  15.751   4.317
    9    HE1  MET   1           HE1      MET   1  -3.714  16.481   3.416
   10    HE2  MET   1           HE2      MET   1  -3.363  17.073   1.793
   11    HE3  MET   1           HE3      MET   1  -3.557  15.343   2.070
   12    H    SER   2           H        SER   2  -8.418  11.354   4.043
   13    HA   SER   2           HA       SER   2  -8.605   9.112   3.589
   14    HB2  SER   2           HB2      SER   2  -7.745  10.178   1.360
   15    HB3  SER   2           HB3      SER   2  -6.245   9.345   1.751
   16    HG   SER   2           HG       SER   2  -7.344   7.824   0.696
   17    H    LYS   3           H        LYS   3  -8.008   8.328   5.600
   18    HA   LYS   3           HA       LYS   3  -5.601   6.735   5.657
   19    HB2  LYS   3           HB2      LYS   3  -4.639   7.752   7.671
   20    HB3  LYS   3           HB3      LYS   3  -4.700   8.913   6.349
   21    HG2  LYS   3           HG2      LYS   3  -6.780   9.874   7.294
   22    HG3  LYS   3           HG3      LYS   3  -6.690   8.726   8.631
   23    HD2  LYS   3           HD2      LYS   3  -4.472   9.655   9.256
   24    HD3  LYS   3           HD3      LYS   3  -4.625  10.842   7.960
   25    HE2  LYS   3           HE2      LYS   3  -6.570  10.544  10.268
   26    HE3  LYS   3           HE3      LYS   3  -5.304  11.768  10.170
   27    HZ1  LYS   3           HZ1      LYS   3  -6.322  12.525   8.071
   28    HZ2  LYS   3           HZ2      LYS   3  -7.353  12.702   9.409
   29    HZ3  LYS   3           HZ3      LYS   3  -7.593  11.429   8.311
   30    H    GLY   4           H        GLY   4  -5.655   5.121   7.228
   31    HA2  GLY   4           HA2      GLY   4  -7.950   5.043   9.061
   32    HA3  GLY   4           HA3      GLY   4  -7.784   3.747   7.880
   33    H    ILE   5           H        ILE   5  -7.710   2.423   9.872
   34    HA   ILE   5           HA       ILE   5  -4.974   2.345  11.009
   35    HB   ILE   5           HB       ILE   5  -6.038   1.112  12.943
   36   HG12  ILE   5          HG12      ILE   5  -8.639   2.301  11.941
   37   HG13  ILE   5          HG13      ILE   5  -8.192   0.637  11.581
   38   HG21  ILE   5          HG21      ILE   5  -6.896   3.964  12.372
   39   HG22  ILE   5          HG22      ILE   5  -5.389   3.454  13.135
   40   HG23  ILE   5          HG23      ILE   5  -6.926   3.211  13.967
   41   HD11  ILE   5          HD11      ILE   5  -7.959   0.196  14.018
   42   HD12  ILE   5          HD12      ILE   5  -9.591   0.709  13.595
   43   HD13  ILE   5          HD13      ILE   5  -8.476   1.849  14.348
   44    H    VAL   6           H        VAL   6  -3.802   0.620  10.625
   45    HA   VAL   6           HA       VAL   6  -4.712  -1.371   8.830
   46    HB   VAL   6           HB       VAL   6  -2.180  -1.281  10.490
   47   HG11  VAL   6          HG11      VAL   6  -2.366  -3.525   9.754
   48   HG12  VAL   6          HG12      VAL   6  -1.369  -2.762   8.516
   49   HG13  VAL   6          HG13      VAL   6  -3.081  -3.052   8.214
   50   HG21  VAL   6          HG21      VAL   6  -2.523  -0.586   7.563
   51   HG22  VAL   6          HG22      VAL   6  -1.152  -0.226   8.613
   52   HG23  VAL   6          HG23      VAL   6  -2.679   0.627   8.832
   53    H    LYS   7           H        LYS   7  -5.809  -3.130   9.210
   54    HA   LYS   7           HA       LYS   7  -6.566  -4.019  11.806
   55    HB2  LYS   7           HB2      LYS   7  -7.930  -4.414   9.757
   56    HB3  LYS   7           HB3      LYS   7  -6.689  -5.518   9.167
   57    HG2  LYS   7           HG2      LYS   7  -7.027  -6.968  11.129
   58    HG3  LYS   7           HG3      LYS   7  -8.253  -5.859  11.746
   59    HD2  LYS   7           HD2      LYS   7  -9.620  -6.241   9.729
   60    HD3  LYS   7           HD3      LYS   7  -8.396  -7.350   9.109
   61    HE2  LYS   7           HE2      LYS   7  -8.718  -8.810  11.067
   62    HE3  LYS   7           HE3      LYS   7  -9.934  -7.702  11.697
   63    HZ1  LYS   7           HZ1      LYS   7 -10.177  -8.869   8.997
   64    HZ2  LYS   7           HZ2      LYS   7 -11.390  -8.193   9.975
   65    HZ3  LYS   7           HZ3      LYS   7 -10.727  -9.707  10.365
   66    H    TRP   8           H        TRP   8  -4.261  -5.193   9.380
   67    HA   TRP   8           HA       TRP   8  -2.472  -6.226  11.380
   68    HB2  TRP   8           HB2      TRP   8  -4.351  -7.996  11.065
   69    HB3  TRP   8           HB3      TRP   8  -3.613  -8.286   9.492
   70    HD1  TRP   8           HD1      TRP   8  -0.971  -9.030   9.533
   71    HE1  TRP   8           HE1      TRP   8   0.300 -10.449  11.270
   72    HE3  TRP   8           HE3      TRP   8  -4.173  -8.657  13.492
   73    HZ2  TRP   8           HZ2      TRP   8  -0.005 -11.319  13.978
   74    HZ3  TRP   8           HZ3      TRP   8  -3.662  -9.793  15.634
   75    HH2  TRP   8           HH2      TRP   8  -1.584 -11.122  15.883
   76    H    PHE   9           H        PHE   9  -0.438  -6.046  10.567
   77    HA   PHE   9           HA       PHE   9  -0.168  -5.903   7.606
   78    HB2  PHE   9           HB2      PHE   9   0.370  -3.797   8.963
   79    HB3  PHE   9           HB3      PHE   9   1.769  -4.683   9.576
   80    HD1  PHE   9           HD1      PHE   9   0.321  -2.945   6.724
   81    HD2  PHE   9           HD2      PHE   9   3.506  -5.542   7.976
   82    HE1  PHE   9           HE1      PHE   9   1.547  -2.448   4.629
   83    HE2  PHE   9           HE2      PHE   9   4.734  -5.039   5.879
   84    HZ   PHE   9           HZ       PHE   9   3.756  -3.495   4.208
   85    H    ASN  10           H        ASN  10   0.963  -7.492   6.674
   86    HA   ASN  10           HA       ASN  10   2.919  -8.988   8.328
   87    HB2  ASN  10           HB2      ASN  10   1.101 -10.055   6.156
   88    HB3  ASN  10           HB3      ASN  10   2.353 -10.985   6.977
   89   HD21  ASN  10          HD21      ASN  10  -0.822 -10.940   7.002
   90   HD22  ASN  10          HD22      ASN  10  -1.163 -11.054   8.661
   91    H    SER  11           H        SER  11   4.727  -7.831   7.645
   92    HA   SER  11           HA       SER  11   5.338  -7.135   4.997
   93    HB2  SER  11           HB2      SER  11   7.155  -7.672   7.355
   94    HB3  SER  11           HB3      SER  11   7.673  -6.939   5.840
   95    HG   SER  11           HG       SER  11   6.837  -5.131   6.483
   96    H    ASP  12           H        ASP  12   6.042 -10.061   6.879
   97    HA   ASP  12           HA       ASP  12   7.859 -11.285   5.122
   98    HB2  ASP  12           HB2      ASP  12   5.811 -12.471   7.009
   99    HB3  ASP  12           HB3      ASP  12   6.981 -13.447   6.124
  100    H    LYS  13           H        LYS  13   4.315 -11.355   5.220
  101    HA   LYS  13           HA       LYS  13   4.035 -13.060   2.922
  102    HB2  LYS  13           HB2      LYS  13   2.095 -11.246   4.373
  103    HB3  LYS  13           HB3      LYS  13   1.640 -12.289   3.027
  104    HG2  LYS  13           HG2      LYS  13   2.426 -14.262   4.279
  105    HG3  LYS  13           HG3      LYS  13   2.880 -13.222   5.632
  106    HD2  LYS  13           HD2      LYS  13   0.524 -12.493   5.852
  107    HD3  LYS  13           HD3      LYS  13   0.076 -13.560   4.517
  108    HE2  LYS  13           HE2      LYS  13   1.362 -14.480   7.107
  109    HE3  LYS  13           HE3      LYS  13  -0.359 -14.592   6.744
  110    HZ1  LYS  13           HZ1      LYS  13   0.562 -15.774   4.607
  111    HZ2  LYS  13           HZ2      LYS  13   0.325 -16.632   6.056
  112    HZ3  LYS  13           HZ3      LYS  13   1.881 -16.102   5.622
  113    H    GLY  14           H        GLY  14   4.354  -9.649   3.522
  114    HA2  GLY  14           HA2      GLY  14   5.116  -8.054   1.957
  115    HA3  GLY  14           HA3      GLY  14   4.602  -9.114   0.654
  116    H    PHE  15           H        PHE  15   2.151  -8.887   2.986
  117    HA   PHE  15           HA       PHE  15   0.976  -6.428   2.010
  118    HB2  PHE  15           HB2      PHE  15  -1.058  -7.475   1.095
  119    HB3  PHE  15           HB3      PHE  15   0.378  -7.912   0.174
  120    HD1  PHE  15           HD1      PHE  15  -2.171  -9.109   2.564
  121    HD2  PHE  15           HD2      PHE  15   1.240 -10.184   0.184
  122    HE1  PHE  15           HE1      PHE  15  -2.682 -11.510   2.915
  123    HE2  PHE  15           HE2      PHE  15   0.731 -12.585   0.538
  124    HZ   PHE  15           HZ       PHE  15  -1.231 -13.249   1.904
  125    H    GLY  16           H        GLY  16  -1.311  -6.181   2.879
  126    HA2  GLY  16           HA2      GLY  16  -1.968  -7.631   5.288
  127    HA3  GLY  16           HA3      GLY  16  -1.367  -6.003   5.588
  128    H    PHE  17           H        PHE  17  -3.814  -6.383   6.453
  129    HA   PHE  17           HA       PHE  17  -5.618  -5.225   4.404
  130    HB2  PHE  17           HB2      PHE  17  -6.277  -6.948   6.810
  131    HB3  PHE  17           HB3      PHE  17  -7.473  -6.173   5.774
  132    HD1  PHE  17           HD1      PHE  17  -4.892  -8.800   5.980
  133    HD2  PHE  17           HD2      PHE  17  -7.888  -6.963   3.511
  134    HE1  PHE  17           HE1      PHE  17  -4.769 -10.714   4.407
  135    HE2  PHE  17           HE2      PHE  17  -7.764  -8.875   1.939
  136    HZ   PHE  17           HZ       PHE  17  -6.204 -10.750   2.386
  137    H    ILE  18           H        ILE  18  -6.588  -3.292   4.885
  138    HA   ILE  18           HA       ILE  18  -6.034  -2.188   7.563
  139    HB   ILE  18           HB       ILE  18  -4.787  -1.034   5.786
  140   HG12  ILE  18          HG12      ILE  18  -7.008   0.795   6.718
  141   HG13  ILE  18          HG13      ILE  18  -5.804   0.158   7.838
  142   HG21  ILE  18          HG21      ILE  18  -6.218   0.404   4.199
  143   HG22  ILE  18          HG22      ILE  18  -7.556  -0.659   4.635
  144   HG23  ILE  18          HG23      ILE  18  -6.126  -1.321   3.847
  145   HD11  ILE  18          HD11      ILE  18  -5.048   1.606   5.289
  146   HD12  ILE  18          HD12      ILE  18  -4.011   1.223   6.664
  147   HD13  ILE  18          HD13      ILE  18  -5.275   2.443   6.824
  148    H    THR  19           H        THR  19  -7.567  -1.006   8.623
  149    HA   THR  19           HA       THR  19 -10.323  -1.553   7.791
  150    HB   THR  19           HB       THR  19  -9.239  -0.770  10.500
  151    HG1  THR  19           HG1      THR  19  -9.986  -3.261   9.375
  152   HG21  THR  19          HG21      THR  19 -11.628  -0.187  10.122
  153   HG22  THR  19          HG22      THR  19 -11.444  -1.467  11.322
  154   HG23  THR  19          HG23      THR  19 -11.948  -1.863   9.679
  155    HA   PRO  20           HA       PRO  20 -10.268   2.942   6.701
  156    HB2  PRO  20           HB2      PRO  20 -13.146   2.208   6.295
  157    HB3  PRO  20           HB3      PRO  20 -12.091   3.188   5.262
  158    HG2  PRO  20           HG2      PRO  20 -12.640   0.732   4.564
  159    HG3  PRO  20           HG3      PRO  20 -10.977   1.329   4.427
  160    HD2  PRO  20           HD2      PRO  20 -12.155  -0.490   6.507
  161    HD3  PRO  20           HD3      PRO  20 -10.556  -0.553   5.727
  162    H    GLU  21           H        GLU  21 -10.538   4.568   8.155
  163    HA   GLU  21           HA       GLU  21 -11.684   4.160  10.706
  164    HB2  GLU  21           HB2      GLU  21 -11.325   6.570  11.045
  165    HB3  GLU  21           HB3      GLU  21  -9.913   5.813  10.310
  166    HG2  GLU  21           HG2      GLU  21 -10.690   6.583   8.075
  167    HG3  GLU  21           HG3      GLU  21 -12.056   7.384   8.840
  168    H    ASP  22           H        ASP  22 -13.012   5.370   7.711
  169    HA   ASP  22           HA       ASP  22 -15.369   6.567   8.796
  170    HB2  ASP  22           HB2      ASP  22 -14.649   5.588   6.031
  171    HB3  ASP  22           HB3      ASP  22 -16.188   6.355   6.404
  172    H    GLY  23           H        GLY  23 -14.442   3.297   8.205
  173    HA2  GLY  23           HA2      GLY  23 -15.703   1.481   9.160
  174    HA3  GLY  23           HA3      GLY  23 -17.177   2.388   8.844
  175    H    SER  24           H        SER  24 -15.032   2.620   6.234
  176    HA   SER  24           HA       SER  24 -16.726   1.123   4.491
  177    HB2  SER  24           HB2      SER  24 -14.003   2.363   4.047
  178    HB3  SER  24           HB3      SER  24 -15.012   1.679   2.782
  179    HG   SER  24           HG       SER  24 -15.305   4.019   4.257
  180    H    LYS  25           H        LYS  25 -15.877  -0.564   3.041
  181    HA   LYS  25           HA       LYS  25 -15.023  -2.835   4.436
  182    HB2  LYS  25           HB2      LYS  25 -16.322  -2.872   2.315
  183    HB3  LYS  25           HB3      LYS  25 -14.887  -2.328   1.451
  184    HG2  LYS  25           HG2      LYS  25 -14.994  -4.719   1.191
  185    HG3  LYS  25           HG3      LYS  25 -13.694  -4.389   2.333
  186    HD2  LYS  25           HD2      LYS  25 -15.169  -4.909   4.217
  187    HD3  LYS  25           HD3      LYS  25 -16.526  -5.148   3.116
  188    HE2  LYS  25           HE2      LYS  25 -15.326  -7.013   2.036
  189    HE3  LYS  25           HE3      LYS  25 -13.965  -6.775   3.134
  190    HZ1  LYS  25           HZ1      LYS  25 -16.648  -7.153   4.261
  191    HZ2  LYS  25           HZ2      LYS  25 -15.134  -7.570   4.910
  192    HZ3  LYS  25           HZ3      LYS  25 -15.817  -8.509   3.671
  193    H    ASP  26           H        ASP  26 -13.078  -3.876   4.653
  194    HA   ASP  26           HA       ASP  26 -10.730  -2.426   4.851
  195    HB2  ASP  26           HB2      ASP  26 -11.061  -5.396   4.393
  196    HB3  ASP  26           HB3      ASP  26  -9.591  -4.615   4.971
  197    H    LEU  27           H        LEU  27  -8.954  -2.107   3.594
  198    HA   LEU  27           HA       LEU  27  -9.227  -2.761   0.719
  199    HB2  LEU  27           HB2      LEU  27  -7.779  -0.443   2.028
  200    HB3  LEU  27           HB3      LEU  27  -7.857  -0.753   0.297
  201    HG   LEU  27           HG       LEU  27 -10.308  -0.311   2.036
  202   HD11  LEU  27          HD11      LEU  27  -8.739   1.613   0.292
  203   HD12  LEU  27          HD12      LEU  27  -8.995   1.732   2.034
  204   HD13  LEU  27          HD13      LEU  27 -10.352   1.946   0.924
  205   HD21  LEU  27          HD21      LEU  27  -9.845  -0.401  -0.965
  206   HD22  LEU  27          HD22      LEU  27 -11.347   0.150  -0.221
  207   HD23  LEU  27          HD23      LEU  27 -10.819  -1.519  -0.010
  208    H    PHE  28           H        PHE  28  -7.401  -3.447  -0.427
  209    HA   PHE  28           HA       PHE  28  -5.460  -4.934   1.116
  210    HB2  PHE  28           HB2      PHE  28  -5.845  -4.487  -1.853
  211    HB3  PHE  28           HB3      PHE  28  -4.541  -5.473  -1.185
  212    HD1  PHE  28           HD1      PHE  28  -8.204  -5.171  -1.592
  213    HD2  PHE  28           HD2      PHE  28  -4.980  -7.633  -0.183
  214    HE1  PHE  28           HE1      PHE  28  -9.755  -7.097  -1.410
  215    HE2  PHE  28           HE2      PHE  28  -6.530  -9.559   0.000
  216    HZ   PHE  28           HZ       PHE  28  -8.916  -9.292  -0.613
  217    H    VAL  29           H        VAL  29  -3.421  -4.343   1.619
  218    HA   VAL  29           HA       VAL  29  -2.258  -1.969   0.306
  219    HB   VAL  29           HB       VAL  29  -2.294  -2.542   3.282
  220   HG11  VAL  29          HG11      VAL  29  -0.176  -1.537   2.772
  221   HG12  VAL  29          HG12      VAL  29  -1.203  -0.239   3.380
  222   HG13  VAL  29          HG13      VAL  29  -0.921  -0.403   1.649
  223   HG21  VAL  29          HG21      VAL  29  -4.393  -1.582   2.165
  224   HG22  VAL  29          HG22      VAL  29  -3.427  -0.146   1.829
  225   HG23  VAL  29          HG23      VAL  29  -3.717  -0.643   3.496
  226    H    HIS  30           H        HIS  30  -0.162  -2.215  -0.293
  227    HA   HIS  30           HA       HIS  30   1.202  -4.711   0.520
  228    HB2  HIS  30           HB2      HIS  30   1.571  -3.009  -1.958
  229    HB3  HIS  30           HB3      HIS  30   2.522  -4.441  -1.566
  230    HD2  HIS  30           HD2      HIS  30  -0.745  -3.592  -3.353
  231    HE1  HIS  30           HE1      HIS  30  -0.972  -7.707  -2.433
  232    HE2  HIS  30           HE2      HIS  30  -2.036  -5.826  -3.767
  233    H    HIS  31           H        HIS  31   3.302  -4.682   1.191
  234    HA   HIS  31           HA       HIS  31   4.216  -2.426   2.648
  235    HB2  HIS  31           HB2      HIS  31   4.808  -4.811   3.165
  236    HB3  HIS  31           HB3      HIS  31   5.853  -4.814   1.745
  237    HD2  HIS  31           HD2      HIS  31   5.872  -3.473   5.411
  238    HE1  HIS  31           HE1      HIS  31   9.479  -2.249   3.594
  239    HE2  HIS  31           HE2      HIS  31   8.215  -2.390   5.792
  240    H    SER  32           H        SER  32   5.309  -3.826  -0.433
  241    HA   SER  32           HA       SER  32   7.399  -1.982  -0.911
  242    HB2  SER  32           HB2      SER  32   5.811  -3.712  -2.807
  243    HB3  SER  32           HB3      SER  32   7.244  -2.797  -3.272
  244    HG   SER  32           HG       SER  32   7.144  -4.673  -1.140
  245    H    GLU  33           H        GLU  33   4.006  -1.568  -1.188
  246    HA   GLU  33           HA       GLU  33   3.929   0.297  -3.333
  247    HB2  GLU  33           HB2      GLU  33   1.979  -1.015  -2.433
  248    HB3  GLU  33           HB3      GLU  33   1.965   0.078  -1.052
  249    HG2  GLU  33           HG2      GLU  33   0.356   0.845  -2.719
  250    HG3  GLU  33           HG3      GLU  33   1.678   2.002  -2.600
  251    H    ILE  34           H        ILE  34   4.705   0.657   0.066
  252    HA   ILE  34           HA       ILE  34   4.067   3.313   0.538
  253    HB   ILE  34           HB       ILE  34   5.818   3.370   2.223
  254   HG12  ILE  34          HG12      ILE  34   6.859   0.749   1.093
  255   HG13  ILE  34          HG13      ILE  34   7.597   2.301   0.753
  256   HG21  ILE  34          HG21      ILE  34   5.306   1.090   3.340
  257   HG22  ILE  34          HG22      ILE  34   4.298   0.780   1.929
  258   HG23  ILE  34          HG23      ILE  34   3.947   2.154   2.977
  259   HD11  ILE  34          HD11      ILE  34   7.375   0.901   3.420
  260   HD12  ILE  34          HD12      ILE  34   7.757   2.619   3.292
  261   HD13  ILE  34          HD13      ILE  34   8.837   1.420   2.579
  262    H    GLN  35           H        GLN  35   4.930   5.288   0.078
  263    HA   GLN  35           HA       GLN  35   7.247   5.352  -1.769
  264    HB2  GLN  35           HB2      GLN  35   4.695   6.965  -1.856
  265    HB3  GLN  35           HB3      GLN  35   6.138   7.388  -2.777
  266    HG2  GLN  35           HG2      GLN  35   6.087   5.271  -3.952
  267    HG3  GLN  35           HG3      GLN  35   4.782   4.682  -2.928
  268   HE21  GLN  35          HE21      GLN  35   4.805   5.087  -5.917
  269   HE22  GLN  35          HE22      GLN  35   3.510   6.136  -6.234
  270    H    SER  36           H        SER  36   6.830   5.832   1.269
  271    HA   SER  36           HA       SER  36   7.256   8.567   1.823
  272    HB2  SER  36           HB2      SER  36   8.035   7.799   4.013
  273    HB3  SER  36           HB3      SER  36   6.588   6.920   3.531
  274    HG   SER  36           HG       SER  36   8.770   5.844   4.291
  275    H    GLY  37           H        GLY  37   9.483   5.932   1.059
  276    HA2  GLY  37           HA2      GLY  37  11.652   6.007   0.256
  277    HA3  GLY  37           HA3      GLY  37  11.537   7.764   0.225
  278    H    GLY  38           H        GLY  38  13.814   7.513   1.012
  279    HA2  GLY  38           HA2      GLY  38  15.384   7.722   2.679
  280    HA3  GLY  38           HA3      GLY  38  14.047   8.217   3.714
  281    H    GLU  39           H        GLU  39  14.157   7.087   5.537
  282    HA   GLU  39           HA       GLU  39  15.319   4.498   5.779
  283    HB2  GLU  39           HB2      GLU  39  13.553   6.089   7.655
  284    HB3  GLU  39           HB3      GLU  39  14.329   4.564   8.085
  285    HG2  GLU  39           HG2      GLU  39  15.844   6.187   8.874
  286    HG3  GLU  39           HG3      GLU  39  16.535   5.701   7.330
  287    H    TYR  40           H        TYR  40  14.291   2.515   6.292
  288    HA   TYR  40           HA       TYR  40  11.980   1.944   4.729
  289    HB2  TYR  40           HB2      TYR  40  13.416   0.315   6.835
  290    HB3  TYR  40           HB3      TYR  40  12.123  -0.307   5.812
  291    HD1  TYR  40           HD1      TYR  40  15.620   0.813   5.915
  292    HD2  TYR  40           HD2      TYR  40  12.438  -0.583   3.390
  293    HE1  TYR  40           HE1      TYR  40  17.252   0.380   4.099
  294    HE2  TYR  40           HE2      TYR  40  14.070  -1.016   1.573
  295    HH   TYR  40           HH       TYR  40  16.390  -1.371   1.234
  296    H    ALA  41           H        ALA  41   9.890   1.527   5.324
  297    HA   ALA  41           HA       ALA  41   9.059   2.609   7.919
  298    HB1  ALA  41           HB1      ALA  41   8.055   3.256   5.599
  299    HB2  ALA  41           HB2      ALA  41   6.966   3.002   6.964
  300    HB3  ALA  41           HB3      ALA  41   7.173   1.737   5.752
  301    H    THR  42           H        THR  42   8.020   1.445   9.449
  302    HA   THR  42           HA       THR  42   7.773  -1.468   8.998
  303    HB   THR  42           HB       THR  42   9.413  -0.923  10.728
  304    HG1  THR  42           HG1      THR  42   8.616  -2.324  12.153
  305   HG21  THR  42          HG21      THR  42   8.607   1.272  11.424
  306   HG22  THR  42          HG22      THR  42   8.660   0.203  12.827
  307   HG23  THR  42          HG23      THR  42   7.119   0.559  12.047
  308    H    LEU  43           H        LEU  43   5.892  -2.521   9.561
  309    HA   LEU  43           HA       LEU  43   3.680  -0.944  10.672
  310    HB2  LEU  43           HB2      LEU  43   3.590  -2.434   8.048
  311    HB3  LEU  43           HB3      LEU  43   2.152  -1.935   8.927
  312    HG   LEU  43           HG       LEU  43   3.433   0.445   8.884
  313   HD11  LEU  43          HD11      LEU  43   5.330  -0.784   7.551
  314   HD12  LEU  43          HD12      LEU  43   4.804   0.808   7.014
  315   HD13  LEU  43          HD13      LEU  43   4.234  -0.638   6.181
  316   HD21  LEU  43          HD21      LEU  43   2.186   0.890   6.683
  317   HD22  LEU  43          HD22      LEU  43   1.218   0.252   8.013
  318   HD23  LEU  43          HD23      LEU  43   1.741  -0.818   6.711
  319    H    ALA  44           H        ALA  44   2.090  -2.179  11.694
  320    HA   ALA  44           HA       ALA  44   2.407  -5.084  11.836
  321    HB1  ALA  44           HB1      ALA  44   2.758  -5.162  14.183
  322    HB2  ALA  44           HB2      ALA  44   2.351  -3.458  14.383
  323    HB3  ALA  44           HB3      ALA  44   3.868  -3.916  13.608
  324    H    ASP  45           H        ASP  45   0.640  -5.187  14.250
  325    HA   ASP  45           HA       ASP  45  -1.896  -4.843  12.874
  326    HB2  ASP  45           HB2      ASP  45  -1.427  -6.897  14.158
  327    HB3  ASP  45           HB3      ASP  45  -1.238  -5.942  15.621
  328    H    GLY  46           H        GLY  46  -2.802  -2.860  12.905
  329    HA2  GLY  46           HA2      GLY  46  -4.126  -1.281  14.141
  330    HA3  GLY  46           HA3      GLY  46  -3.030  -1.477  15.500
  331    H    GLN  47           H        GLN  47  -1.101  -1.274  12.801
  332    HA   GLN  47           HA       GLN  47  -0.033   1.251  13.443
  333    HB2  GLN  47           HB2      GLN  47   1.160  -0.576  12.222
  334    HB3  GLN  47           HB3      GLN  47   0.171  -0.229  10.807
  335    HG2  GLN  47           HG2      GLN  47   2.329   0.910  10.607
  336    HG3  GLN  47           HG3      GLN  47   1.046   2.092  10.790
  337   HE21  GLN  47          HE21      GLN  47   1.736   3.752  12.149
  338   HE22  GLN  47          HE22      GLN  47   2.689   3.541  13.537
  339    H    THR  48           H        THR  48  -0.607   3.262  12.904
  340    HA   THR  48           HA       THR  48  -2.956   3.686  11.220
  341    HB   THR  48           HB       THR  48  -1.274   5.670  12.791
  342    HG1  THR  48           HG1      THR  48  -2.622   5.296  14.413
  343   HG21  THR  48          HG21      THR  48  -2.615   6.686  10.964
  344   HG22  THR  48          HG22      THR  48  -3.224   7.148  12.553
  345   HG23  THR  48          HG23      THR  48  -4.062   5.913  11.614
  346    H    VAL  49           H        VAL  49  -2.854   4.293   9.139
  347    HA   VAL  49           HA       VAL  49  -0.418   5.621   8.143
  348    HB   VAL  49           HB       VAL  49  -0.341   4.130   6.169
  349   HG11  VAL  49          HG11      VAL  49   0.997   3.763   8.311
  350   HG12  VAL  49          HG12      VAL  49   0.806   2.354   7.270
  351   HG13  VAL  49          HG13      VAL  49  -0.181   2.516   8.722
  352   HG21  VAL  49          HG21      VAL  49  -2.694   3.347   6.226
  353   HG22  VAL  49          HG22      VAL  49  -2.366   2.481   7.727
  354   HG23  VAL  49          HG23      VAL  49  -1.572   1.988   6.232
  355    H    GLU  50           H        GLU  50  -0.679   6.429   5.908
  356    HA   GLU  50           HA       GLU  50  -3.457   7.354   5.431
  357    HB2  GLU  50           HB2      GLU  50  -0.883   8.697   4.546
  358    HB3  GLU  50           HB3      GLU  50  -2.513   9.321   4.343
  359    HG2  GLU  50           HG2      GLU  50  -2.763   9.409   6.817
  360    HG3  GLU  50           HG3      GLU  50  -1.102   8.851   6.987
  361    H    TYR  51           H        TYR  51  -4.296   7.016   3.386
  362    HA   TYR  51           HA       TYR  51  -2.592   6.087   1.217
  363    HB2  TYR  51           HB2      TYR  51  -3.814   3.964   0.916
  364    HB3  TYR  51           HB3      TYR  51  -2.953   4.006   2.448
  365    HD1  TYR  51           HD1      TYR  51  -6.261   4.099   0.832
  366    HD2  TYR  51           HD2      TYR  51  -4.159   4.191   4.575
  367    HE1  TYR  51           HE1      TYR  51  -8.387   3.687   2.036
  368    HE2  TYR  51           HE2      TYR  51  -6.286   3.777   5.779
  369    HH   TYR  51           HH       TYR  51  -9.207   4.256   4.570
  370    H    GLU  52           H        GLU  52  -3.804   5.644  -0.770
  371    HA   GLU  52           HA       GLU  52  -6.321   7.194  -0.937
  372    HB2  GLU  52           HB2      GLU  52  -4.036   7.055  -2.919
  373    HB3  GLU  52           HB3      GLU  52  -5.612   7.763  -3.278
  374    HG2  GLU  52           HG2      GLU  52  -5.325   9.363  -1.429
  375    HG3  GLU  52           HG3      GLU  52  -3.764   8.651  -1.041
  376    H    VAL  53           H        VAL  53  -7.985   6.206  -1.926
  377    HA   VAL  53           HA       VAL  53  -7.947   3.411  -2.336
  378    HB   VAL  53           HB       VAL  53  -9.966   4.693  -1.696
  379   HG11  VAL  53          HG11      VAL  53 -10.110   5.617  -4.574
  380   HG12  VAL  53          HG12      VAL  53  -9.457   6.624  -3.281
  381   HG13  VAL  53          HG13      VAL  53 -11.140   6.101  -3.226
  382   HG21  VAL  53          HG21      VAL  53 -11.535   3.433  -3.011
  383   HG22  VAL  53          HG22      VAL  53 -10.082   2.442  -2.869
  384   HG23  VAL  53          HG23      VAL  53 -10.408   3.322  -4.363
  385    H    GLY  54           H        GLY  54  -8.197   2.196  -4.214
  386    HA2  GLY  54           HA2      GLY  54  -7.668   3.434  -6.818
  387    HA3  GLY  54           HA3      GLY  54  -6.518   2.226  -6.241
  388    H    GLN  55           H        GLN  55  -7.831   1.661  -8.575
  389    HA   GLN  55           HA       GLN  55  -9.989  -0.208  -7.801
  390    HB2  GLN  55           HB2      GLN  55 -10.703  -0.106 -10.163
  391    HB3  GLN  55           HB3      GLN  55 -10.707   1.487  -9.406
  392    HG2  GLN  55           HG2      GLN  55  -8.472   1.939 -10.410
  393    HG3  GLN  55           HG3      GLN  55  -8.544   0.376 -11.223
  394   HE21  GLN  55          HE21      GLN  55  -9.046   3.593 -11.817
  395   HE22  GLN  55          HE22      GLN  55 -10.227   3.478 -13.030
  396    H    GLY  56           H        GLY  56 -10.029  -2.306  -8.622
  397    HA2  GLY  56           HA2      GLY  56  -7.905  -3.369 -10.251
  398    HA3  GLY  56           HA3      GLY  56  -7.758  -3.827  -8.557
  399    H    GLN  57           H        GLN  57  -8.111  -5.742 -10.514
  400    HA   GLN  57           HA       GLN  57 -10.791  -6.516 -10.998
  401    HB2  GLN  57           HB2      GLN  57  -8.210  -8.083 -10.959
  402    HB3  GLN  57           HB3      GLN  57  -9.756  -8.774 -11.449
  403    HG2  GLN  57           HG2      GLN  57  -9.982  -7.048 -13.192
  404    HG3  GLN  57           HG3      GLN  57  -8.444  -6.346 -12.699
  405   HE21  GLN  57          HE21      GLN  57  -7.125  -6.845 -14.502
  406   HE22  GLN  57          HE22      GLN  57  -6.865  -8.423 -15.069
  407    H    LYS  58           H        LYS  58  -8.512  -7.304  -8.414
  408    HA   LYS  58           HA       LYS  58 -10.425  -9.088  -7.117
  409    HB2  LYS  58           HB2      LYS  58  -7.611  -8.250  -6.391
  410    HB3  LYS  58           HB3      LYS  58  -8.587  -9.376  -5.444
  411    HG2  LYS  58           HG2      LYS  58  -8.796 -10.853  -7.413
  412    HG3  LYS  58           HG3      LYS  58  -7.811  -9.734  -8.354
  413    HD2  LYS  58           HD2      LYS  58  -5.938 -10.058  -6.773
  414    HD3  LYS  58           HD3      LYS  58  -6.920 -11.199  -5.853
  415    HE2  LYS  58           HE2      LYS  58  -6.171 -11.526  -8.775
  416    HE3  LYS  58           HE3      LYS  58  -5.373 -12.345  -7.433
  417    HZ1  LYS  58           HZ1      LYS  58  -6.995 -13.814  -8.303
  418    HZ2  LYS  58           HZ2      LYS  58  -8.200 -12.616  -8.283
  419    HZ3  LYS  58           HZ3      LYS  58  -7.599 -13.245  -6.823
  420    H    GLY  59           H        GLY  59 -10.790  -6.065  -7.373
  421    HA2  GLY  59           HA2      GLY  59 -12.262  -4.856  -5.890
  422    HA3  GLY  59           HA3      GLY  59 -11.418  -5.584  -4.525
  423    HA   PRO  60           HA       PRO  60  -9.570  -1.353  -5.666
  424    HB2  PRO  60           HB2      PRO  60 -10.245   0.074  -3.450
  425    HB3  PRO  60           HB3      PRO  60 -11.303  -0.051  -4.870
  426    HG2  PRO  60           HG2      PRO  60 -11.402  -1.567  -2.303
  427    HG3  PRO  60           HG3      PRO  60 -12.720  -0.816  -3.218
  428    HD2  PRO  60           HD2      PRO  60 -12.204  -3.483  -3.357
  429    HD3  PRO  60           HD3      PRO  60 -12.838  -2.571  -4.746
  430    H    CYS  61           H        CYS  61  -7.659  -0.512  -4.868
  431    HA   CYS  61           HA       CYS  61  -6.458  -1.896  -2.543
  432    HB2  CYS  61           HB2      CYS  61  -5.098  -0.992  -5.094
  433    HB3  CYS  61           HB3      CYS  61  -4.293  -1.732  -3.710
  434    HG   CYS  61           HG       CYS  61  -6.043  -3.213  -5.769
  435    H    ALA  62           H        ALA  62  -4.384  -0.555  -1.856
  436    HA   ALA  62           HA       ALA  62  -5.085   2.316  -1.851
  437    HB1  ALA  62           HB1      ALA  62  -5.545   2.063   0.343
  438    HB2  ALA  62           HB2      ALA  62  -3.806   1.894   0.572
  439    HB3  ALA  62           HB3      ALA  62  -4.819   0.461   0.401
  440    H    ASN  63           H        ASN  63  -3.392   3.719  -2.123
  441    HA   ASN  63           HA       ASN  63  -0.667   2.580  -2.238
  442    HB2  ASN  63           HB2      ASN  63  -0.221   4.021  -4.203
  443    HB3  ASN  63           HB3      ASN  63  -1.468   2.819  -4.527
  444   HD21  ASN  63          HD21      ASN  63  -2.966   3.828  -5.882
  445   HD22  ASN  63          HD22      ASN  63  -3.625   5.370  -5.610
  446    H    LYS  64           H        LYS  64   0.950   4.565  -2.495
  447    HA   LYS  64           HA       LYS  64   1.960   6.309  -1.376
  448    HB2  LYS  64           HB2      LYS  64  -0.897   7.326  -1.315
  449    HB3  LYS  64           HB3      LYS  64   0.515   8.285  -0.874
  450    HG2  LYS  64           HG2      LYS  64   1.450   7.946  -3.134
  451    HG3  LYS  64           HG3      LYS  64   0.037   6.988  -3.576
  452    HD2  LYS  64           HD2      LYS  64  -1.417   8.938  -3.151
  453    HD3  LYS  64           HD3      LYS  64  -0.002   9.897  -2.718
  454    HE2  LYS  64           HE2      LYS  64   0.927   9.556  -4.978
  455    HE3  LYS  64           HE3      LYS  64  -0.482   8.591  -5.414
  456    HZ1  LYS  64           HZ1      LYS  64  -1.082  10.647  -6.178
  457    HZ2  LYS  64           HZ2      LYS  64  -0.285  11.480  -4.929
  458    HZ3  LYS  64           HZ3      LYS  64  -1.760  10.689  -4.624
  459    H    VAL  65           H        VAL  65   1.627   4.110   0.096
  460    HA   VAL  65           HA       VAL  65   0.248   4.596   2.577
  461    HB   VAL  65           HB       VAL  65   2.232   2.434   1.805
  462   HG11  VAL  65          HG11      VAL  65   0.253   2.550   4.106
  463   HG12  VAL  65          HG12      VAL  65   2.003   2.705   4.256
  464   HG13  VAL  65          HG13      VAL  65   1.297   1.185   3.709
  465   HG21  VAL  65          HG21      VAL  65  -0.017   2.666   0.508
  466   HG22  VAL  65          HG22      VAL  65  -0.767   2.111   2.003
  467   HG23  VAL  65          HG23      VAL  65   0.407   1.092   1.171
  468    H    VAL  66           H        VAL  66   0.970   5.806   4.136
  469    HA   VAL  66           HA       VAL  66   3.875   5.872   4.709
  470    HB   VAL  66           HB       VAL  66   3.751   8.280   5.249
  471   HG11  VAL  66          HG11      VAL  66   3.689   9.074   2.928
  472   HG12  VAL  66          HG12      VAL  66   2.837   7.612   2.435
  473   HG13  VAL  66          HG13      VAL  66   4.498   7.508   3.015
  474   HG21  VAL  66          HG21      VAL  66   1.223   8.230   5.631
  475   HG22  VAL  66          HG22      VAL  66   1.054   8.266   3.876
  476   HG23  VAL  66          HG23      VAL  66   1.837   9.608   4.714
  477    H    ALA  67           H        ALA  67   4.423   6.374   6.897
  478    HA   ALA  67           HA       ALA  67   2.568   5.200   8.777
  479    HB1  ALA  67           HB1      ALA  67   4.987   4.705   8.865
  480    HB2  ALA  67           HB2      ALA  67   4.405   5.397  10.377
  481    HB3  ALA  67           HB3      ALA  67   5.311   6.398   9.241
  482    H    VAL  68           H        VAL  68   1.215   6.228  10.067
  483    HA   VAL  68           HA       VAL  68   0.090   7.889  11.184
  484    HB   VAL  68           HB       VAL  68   2.784   9.293  11.248
  485   HG11  VAL  68          HG11      VAL  68   0.232   9.589  12.859
  486   HG12  VAL  68          HG12      VAL  68   1.043  10.822  11.892
  487   HG13  VAL  68          HG13      VAL  68   1.784  10.248  13.386
  488   HG21  VAL  68          HG21      VAL  68   3.043   7.092  12.223
  489   HG22  VAL  68          HG22      VAL  68   1.526   7.250  13.107
  490   HG23  VAL  68          HG23      VAL  68   2.912   8.246  13.551
  Start of MODEL   20
    1    H1   MET   1           HT1      MET   1  -6.286  14.233   3.577
    2    H2   MET   1           HT2      MET   1  -7.152  13.850   2.166
    3    H3   MET   1           HT3      MET   1  -5.676  14.686   2.061
    4    HA   MET   1           HA       MET   1  -5.519  12.299   1.467
    5    HB2  MET   1           HB2      MET   1  -3.661  13.811   2.509
    6    HB3  MET   1           HB3      MET   1  -3.942  12.873   3.975
    7    HG2  MET   1           HG2      MET   1  -2.146  11.810   2.752
    8    HG3  MET   1           HG3      MET   1  -3.571  10.782   2.616
    9    HE1  MET   1           HE1      MET   1  -1.121  10.454   0.586
   10    HE2  MET   1           HE2      MET   1  -2.137  10.109  -0.812
   11    HE3  MET   1           HE3      MET   1  -2.612   9.520   0.778
   12    H    SER   2           H        SER   2  -6.818  10.614   1.828
   13    HA   SER   2           HA       SER   2  -8.133  10.067   4.288
   14    HB2  SER   2           HB2      SER   2  -7.665   8.306   1.872
   15    HB3  SER   2           HB3      SER   2  -8.757   7.922   3.200
   16    HG   SER   2           HG       SER   2 -10.159   9.233   2.360
   17    H    LYS   3           H        LYS   3  -7.780   8.435   5.803
   18    HA   LYS   3           HA       LYS   3  -5.504   6.682   5.656
   19    HB2  LYS   3           HB2      LYS   3  -4.309   7.597   7.610
   20    HB3  LYS   3           HB3      LYS   3  -4.347   8.755   6.285
   21    HG2  LYS   3           HG2      LYS   3  -6.272   9.896   7.360
   22    HG3  LYS   3           HG3      LYS   3  -6.179   8.750   8.699
   23    HD2  LYS   3           HD2      LYS   3  -3.913   9.506   9.232
   24    HD3  LYS   3           HD3      LYS   3  -3.931  10.598   7.848
   25    HE2  LYS   3           HE2      LYS   3  -4.442  11.854   9.883
   26    HE3  LYS   3           HE3      LYS   3  -5.873  11.791   8.855
   27    HZ1  LYS   3           HZ1      LYS   3  -5.428   9.763  10.951
   28    HZ2  LYS   3           HZ2      LYS   3  -6.885  10.231  10.211
   29    HZ3  LYS   3           HZ3      LYS   3  -6.129  11.260  11.332
   30    H    GLY   4           H        GLY   4  -5.596   5.022   7.140
   31    HA2  GLY   4           HA2      GLY   4  -7.774   5.088   9.126
   32    HA3  GLY   4           HA3      GLY   4  -7.677   3.763   7.970
   33    H    ILE   5           H        ILE   5  -7.572   2.473   9.968
   34    HA   ILE   5           HA       ILE   5  -4.811   2.350  11.044
   35    HB   ILE   5           HB       ILE   5  -5.894   1.154  13.016
   36   HG12  ILE   5          HG12      ILE   5  -8.441   2.517  12.102
   37   HG13  ILE   5          HG13      ILE   5  -8.105   0.844  11.671
   38   HG21  ILE   5          HG21      ILE   5  -6.466   4.062  12.406
   39   HG22  ILE   5          HG22      ILE   5  -5.109   3.395  13.313
   40   HG23  ILE   5          HG23      ILE   5  -6.734   3.349  13.996
   41   HD11  ILE   5          HD11      ILE   5  -9.416   0.845  13.710
   42   HD12  ILE   5          HD12      ILE   5  -8.319   2.002  14.465
   43   HD13  ILE   5          HD13      ILE   5  -7.773   0.360  14.126
   44    H    VAL   6           H        VAL   6  -3.690   0.602  10.648
   45    HA   VAL   6           HA       VAL   6  -4.692  -1.432   8.943
   46    HB   VAL   6           HB       VAL   6  -2.095  -1.302  10.495
   47   HG11  VAL   6          HG11      VAL   6  -1.341  -2.871   8.605
   48   HG12  VAL   6          HG12      VAL   6  -3.054  -3.125   8.275
   49   HG13  VAL   6          HG13      VAL   6  -2.380  -3.581   9.838
   50   HG21  VAL   6          HG21      VAL   6  -1.142  -0.337   8.530
   51   HG22  VAL   6          HG22      VAL   6  -2.646   0.544   8.795
   52   HG23  VAL   6          HG23      VAL   6  -2.568  -0.713   7.561
   53    H    LYS   7           H        LYS   7  -5.775  -3.174   9.411
   54    HA   LYS   7           HA       LYS   7  -6.418  -4.009  12.062
   55    HB2  LYS   7           HB2      LYS   7  -7.879  -4.419  10.077
   56    HB3  LYS   7           HB3      LYS   7  -6.681  -5.562   9.465
   57    HG2  LYS   7           HG2      LYS   7  -6.970  -6.979  11.437
   58    HG3  LYS   7           HG3      LYS   7  -8.079  -5.810  12.149
   59    HD2  LYS   7           HD2      LYS   7  -9.457  -7.503  11.175
   60    HD3  LYS   7           HD3      LYS   7  -9.538  -6.128  10.077
   61    HE2  LYS   7           HE2      LYS   7  -7.853  -7.157   8.621
   62    HE3  LYS   7           HE3      LYS   7  -7.692  -8.512   9.738
   63    HZ1  LYS   7           HZ1      LYS   7  -9.157  -9.196   8.038
   64    HZ2  LYS   7           HZ2      LYS   7 -10.062  -7.762   8.127
   65    HZ3  LYS   7           HZ3      LYS   7 -10.127  -8.892   9.395
   66    H    TRP   8           H        TRP   8  -4.235  -5.205   9.545
   67    HA   TRP   8           HA       TRP   8  -2.346  -6.219  11.449
   68    HB2  TRP   8           HB2      TRP   8  -4.213  -8.016  11.278
   69    HB3  TRP   8           HB3      TRP   8  -3.589  -8.310   9.655
   70    HD1  TRP   8           HD1      TRP   8  -1.068  -9.215   9.452
   71    HE1  TRP   8           HE1      TRP   8   0.405 -10.519  11.119
   72    HE3  TRP   8           HE3      TRP   8  -3.668  -8.381  13.764
   73    HZ2  TRP   8           HZ2      TRP   8   0.467 -11.133  13.910
   74    HZ3  TRP   8           HZ3      TRP   8  -2.883  -9.339  15.911
   75    HH2  TRP   8           HH2      TRP   8  -0.820 -10.713  15.990
   76    H    PHE   9           H        PHE   9  -0.362  -6.089  10.519
   77    HA   PHE   9           HA       PHE   9  -0.261  -5.857   7.557
   78    HB2  PHE   9           HB2      PHE   9   0.463  -3.857   8.963
   79    HB3  PHE   9           HB3      PHE   9   1.827  -4.843   9.491
   80    HD1  PHE   9           HD1      PHE   9   0.365  -2.942   6.742
   81    HD2  PHE   9           HD2      PHE   9   3.494  -5.682   7.825
   82    HE1  PHE   9           HE1      PHE   9   1.562  -2.405   4.639
   83    HE2  PHE   9           HE2      PHE   9   4.692  -5.139   5.720
   84    HZ   PHE   9           HZ       PHE   9   3.725  -3.501   4.130
   85    H    ASN  10           H        ASN  10   0.625  -7.542   6.519
   86    HA   ASN  10           HA       ASN  10   2.566  -9.236   7.986
   87    HB2  ASN  10           HB2      ASN  10   0.713 -10.009   5.719
   88    HB3  ASN  10           HB3      ASN  10   1.849 -11.081   6.532
   89   HD21  ASN  10          HD21      ASN  10   1.470 -11.358   8.963
   90   HD22  ASN  10          HD22      ASN  10  -0.133 -11.311   9.517
   91    H    SER  11           H        SER  11   4.354  -7.880   7.330
   92    HA   SER  11           HA       SER  11   4.962  -7.229   4.663
   93    HB2  SER  11           HB2      SER  11   7.221  -6.803   5.489
   94    HB3  SER  11           HB3      SER  11   6.036  -6.188   6.640
   95    HG   SER  11           HG       SER  11   6.295  -8.278   7.716
   96    H    ASP  12           H        ASP  12   5.446 -10.169   6.516
   97    HA   ASP  12           HA       ASP  12   7.420 -11.413   4.934
   98    HB2  ASP  12           HB2      ASP  12   5.167 -12.556   6.598
   99    HB3  ASP  12           HB3      ASP  12   6.381 -13.559   5.809
  100    H    LYS  13           H        LYS  13   3.894 -11.295   4.673
  101    HA   LYS  13           HA       LYS  13   3.872 -12.915   2.255
  102    HB2  LYS  13           HB2      LYS  13   1.672 -11.451   3.732
  103    HB3  LYS  13           HB3      LYS  13   1.423 -12.462   2.310
  104    HG2  LYS  13           HG2      LYS  13   2.476 -14.374   3.537
  105    HG3  LYS  13           HG3      LYS  13   2.558 -13.356   4.976
  106    HD2  LYS  13           HD2      LYS  13  -0.034 -13.917   3.509
  107    HD3  LYS  13           HD3      LYS  13   0.540 -14.907   4.851
  108    HE2  LYS  13           HE2      LYS  13   0.601 -12.877   6.291
  109    HE3  LYS  13           HE3      LYS  13  -0.050 -11.931   4.952
  110    HZ1  LYS  13           HZ1      LYS  13  -2.041 -13.170   4.982
  111    HZ2  LYS  13           HZ2      LYS  13  -1.721 -12.759   6.598
  112    HZ3  LYS  13           HZ3      LYS  13  -1.403 -14.331   6.041
  113    H    GLY  14           H        GLY  14   4.277  -9.612   3.056
  114    HA2  GLY  14           HA2      GLY  14   4.850  -7.880   1.599
  115    HA3  GLY  14           HA3      GLY  14   4.298  -8.858   0.248
  116    H    PHE  15           H        PHE  15   1.933  -8.811   2.677
  117    HA   PHE  15           HA       PHE  15   0.715  -6.298   1.921
  118    HB2  PHE  15           HB2      PHE  15  -1.351  -7.279   1.007
  119    HB3  PHE  15           HB3      PHE  15   0.052  -7.634   0.002
  120    HD1  PHE  15           HD1      PHE  15  -2.380  -9.031   2.411
  121    HD2  PHE  15           HD2      PHE  15   0.893  -9.892  -0.232
  122    HE1  PHE  15           HE1      PHE  15  -2.878 -11.454   2.585
  123    HE2  PHE  15           HE2      PHE  15   0.399 -12.316  -0.055
  124    HZ   PHE  15           HZ       PHE  15  -1.486 -13.096   1.354
  125    H    GLY  16           H        GLY  16  -1.564  -6.148   2.872
  126    HA2  GLY  16           HA2      GLY  16  -2.108  -7.762   5.204
  127    HA3  GLY  16           HA3      GLY  16  -1.523  -6.144   5.588
  128    H    PHE  17           H        PHE  17  -3.905  -6.551   6.535
  129    HA   PHE  17           HA       PHE  17  -5.829  -5.389   4.603
  130    HB2  PHE  17           HB2      PHE  17  -6.340  -7.100   7.054
  131    HB3  PHE  17           HB3      PHE  17  -7.597  -6.340   6.078
  132    HD1  PHE  17           HD1      PHE  17  -5.066  -8.999   6.220
  133    HD2  PHE  17           HD2      PHE  17  -8.050  -7.098   3.784
  134    HE1  PHE  17           HE1      PHE  17  -5.009 -10.919   4.653
  135    HE2  PHE  17           HE2      PHE  17  -7.991  -9.019   2.216
  136    HZ   PHE  17           HZ       PHE  17  -6.470 -10.929   2.651
  137    H    ILE  18           H        ILE  18  -6.732  -3.448   5.109
  138    HA   ILE  18           HA       ILE  18  -6.068  -2.333   7.755
  139    HB   ILE  18           HB       ILE  18  -4.837  -1.215   5.963
  140   HG12  ILE  18          HG12      ILE  18  -7.016   0.688   6.851
  141   HG13  ILE  18          HG13      ILE  18  -5.853   0.031   8.001
  142   HG21  ILE  18          HG21      ILE  18  -6.168  -1.495   4.030
  143   HG22  ILE  18          HG22      ILE  18  -6.279   0.230   4.372
  144   HG23  ILE  18          HG23      ILE  18  -7.604  -0.846   4.818
  145   HD11  ILE  18          HD11      ILE  18  -5.301   2.299   6.859
  146   HD12  ILE  18          HD12      ILE  18  -4.907   1.319   5.445
  147   HD13  ILE  18          HD13      ILE  18  -4.034   1.078   6.956
  148    H    THR  19           H        THR  19  -7.530  -1.112   8.847
  149    HA   THR  19           HA       THR  19 -10.323  -1.600   8.131
  150    HB   THR  19           HB       THR  19  -9.123  -0.674  10.746
  151    HG1  THR  19           HG1      THR  19  -8.957  -2.721  11.235
  152   HG21  THR  19          HG21      THR  19 -11.902  -1.579   9.949
  153   HG22  THR  19          HG22      THR  19 -11.438  -0.012  10.612
  154   HG23  THR  19          HG23      THR  19 -11.364  -1.454  11.624
  155    HA   PRO  20           HA       PRO  20 -10.145   2.781   6.707
  156    HB2  PRO  20           HB2      PRO  20 -13.073   2.188   6.481
  157    HB3  PRO  20           HB3      PRO  20 -12.002   3.008   5.328
  158    HG2  PRO  20           HG2      PRO  20 -12.732   0.537   4.877
  159    HG3  PRO  20           HG3      PRO  20 -11.046   1.018   4.611
  160    HD2  PRO  20           HD2      PRO  20 -12.216  -0.539   6.899
  161    HD3  PRO  20           HD3      PRO  20 -10.666  -0.764   6.056
  162    H    GLU  21           H        GLU  21 -10.381   4.591   7.857
  163    HA   GLU  21           HA       GLU  21 -11.239   4.621  10.534
  164    HB2  GLU  21           HB2      GLU  21  -9.607   6.214   9.606
  165    HB3  GLU  21           HB3      GLU  21 -10.861   6.917   8.587
  166    HG2  GLU  21           HG2      GLU  21 -10.570   8.316  10.556
  167    HG3  GLU  21           HG3      GLU  21 -12.143   7.518  10.632
  168    H    ASP  22           H        ASP  22 -12.820   5.675   7.537
  169    HA   ASP  22           HA       ASP  22 -15.137   6.787   8.724
  170    HB2  ASP  22           HB2      ASP  22 -14.314   7.133   6.356
  171    HB3  ASP  22           HB3      ASP  22 -14.983   5.545   5.979
  172    H    GLY  23           H        GLY  23 -14.169   3.556   8.650
  173    HA2  GLY  23           HA2      GLY  23 -15.354   1.776   9.639
  174    HA3  GLY  23           HA3      GLY  23 -16.854   2.667   9.406
  175    H    SER  24           H        SER  24 -14.942   2.717   6.601
  176    HA   SER  24           HA       SER  24 -16.811   1.137   5.113
  177    HB2  SER  24           HB2      SER  24 -15.648   2.985   4.039
  178    HB3  SER  24           HB3      SER  24 -14.090   2.230   4.356
  179    HG   SER  24           HG       SER  24 -16.172   1.011   2.867
  180    H    LYS  25           H        LYS  25 -16.021  -0.676   3.659
  181    HA   LYS  25           HA       LYS  25 -15.145  -2.848   5.244
  182    HB2  LYS  25           HB2      LYS  25 -15.378  -2.542   2.242
  183    HB3  LYS  25           HB3      LYS  25 -15.046  -4.070   3.059
  184    HG2  LYS  25           HG2      LYS  25 -17.154  -3.857   4.325
  185    HG3  LYS  25           HG3      LYS  25 -17.489  -2.330   3.510
  186    HD2  LYS  25           HD2      LYS  25 -17.483  -3.502   1.328
  187    HD3  LYS  25           HD3      LYS  25 -17.184  -5.030   2.159
  188    HE2  LYS  25           HE2      LYS  25 -19.596  -3.250   2.632
  189    HE3  LYS  25           HE3      LYS  25 -19.598  -4.698   1.627
  190    HZ1  LYS  25           HZ1      LYS  25 -19.395  -4.456   4.539
  191    HZ2  LYS  25           HZ2      LYS  25 -18.596  -5.751   3.785
  192    HZ3  LYS  25           HZ3      LYS  25 -20.274  -5.565   3.606
  193    H    ASP  26           H        ASP  26 -13.209  -4.067   5.168
  194    HA   ASP  26           HA       ASP  26 -10.838  -2.634   5.211
  195    HB2  ASP  26           HB2      ASP  26 -11.372  -5.585   4.896
  196    HB3  ASP  26           HB3      ASP  26  -9.753  -4.922   5.094
  197    H    LEU  27           H        LEU  27  -9.171  -2.305   3.855
  198    HA   LEU  27           HA       LEU  27  -9.556  -3.036   1.011
  199    HB2  LEU  27           HB2      LEU  27  -8.189  -0.589   2.171
  200    HB3  LEU  27           HB3      LEU  27  -8.317  -0.971   0.457
  201    HG   LEU  27           HG       LEU  27 -10.716  -0.587   2.278
  202   HD11  LEU  27          HD11      LEU  27  -9.396   1.342   0.343
  203   HD12  LEU  27          HD12      LEU  27  -9.445   1.506   2.097
  204   HD13  LEU  27          HD13      LEU  27 -10.934   1.620   1.159
  205   HD21  LEU  27          HD21      LEU  27 -11.204  -1.923   0.284
  206   HD22  LEU  27          HD22      LEU  27 -10.395  -0.739  -0.740
  207   HD23  LEU  27          HD23      LEU  27 -11.896  -0.313   0.081
  208    H    PHE  28           H        PHE  28  -7.673  -3.569  -0.191
  209    HA   PHE  28           HA       PHE  28  -5.654  -4.960   1.341
  210    HB2  PHE  28           HB2      PHE  28  -6.072  -4.543  -1.627
  211    HB3  PHE  28           HB3      PHE  28  -4.732  -5.477  -0.956
  212    HD1  PHE  28           HD1      PHE  28  -8.378  -5.340  -1.459
  213    HD2  PHE  28           HD2      PHE  28  -5.115  -7.610   0.174
  214    HE1  PHE  28           HE1      PHE  28  -9.860  -7.317  -1.247
  215    HE2  PHE  28           HE2      PHE  28  -6.599  -9.586   0.385
  216    HZ   PHE  28           HZ       PHE  28  -8.970  -9.440  -0.326
  217    H    VAL  29           H        VAL  29  -3.595  -4.339   1.749
  218    HA   VAL  29           HA       VAL  29  -2.603  -1.834   0.521
  219    HB   VAL  29           HB       VAL  29  -2.314  -2.675   3.420
  220   HG11  VAL  29          HG11      VAL  29  -1.110  -0.636   3.779
  221   HG12  VAL  29          HG12      VAL  29  -1.481  -0.058   2.154
  222   HG13  VAL  29          HG13      VAL  29  -0.367  -1.405   2.378
  223   HG21  VAL  29          HG21      VAL  29  -3.736  -0.210   2.415
  224   HG22  VAL  29          HG22      VAL  29  -3.845  -0.973   3.999
  225   HG23  VAL  29          HG23      VAL  29  -4.587  -1.743   2.598
  226    H    HIS  30           H        HIS  30  -0.571  -2.005  -0.312
  227    HA   HIS  30           HA       HIS  30   0.911  -4.509   0.211
  228    HB2  HIS  30           HB2      HIS  30   1.015  -2.626  -2.152
  229    HB3  HIS  30           HB3      HIS  30   2.042  -4.047  -1.956
  230    HD2  HIS  30           HD2      HIS  30  -1.400  -3.185  -3.376
  231    HE1  HIS  30           HE1      HIS  30  -1.419  -7.362  -2.763
  232    HE2  HIS  30           HE2      HIS  30  -2.656  -5.426  -3.846
  233    H    HIS  31           H        HIS  31   2.962  -4.491   0.892
  234    HA   HIS  31           HA       HIS  31   3.991  -2.256   2.300
  235    HB2  HIS  31           HB2      HIS  31   4.506  -4.665   2.797
  236    HB3  HIS  31           HB3      HIS  31   5.527  -4.693   1.361
  237    HD2  HIS  31           HD2      HIS  31   5.665  -3.402   5.040
  238    HE1  HIS  31           HE1      HIS  31   9.250  -2.224   3.149
  239    HE2  HIS  31           HE2      HIS  31   8.043  -2.379   5.377
  240    H    SER  32           H        SER  32   4.920  -3.723  -0.788
  241    HA   SER  32           HA       SER  32   7.134  -2.195  -1.434
  242    HB2  SER  32           HB2      SER  32   6.417  -4.176  -2.688
  243    HB3  SER  32           HB3      SER  32   5.048  -3.277  -3.333
  244    HG   SER  32           HG       SER  32   6.622  -3.066  -4.834
  245    H    GLU  33           H        GLU  33   3.799  -1.191  -1.498
  246    HA   GLU  33           HA       GLU  33   4.045   0.895  -3.404
  247    HB2  GLU  33           HB2      GLU  33   2.058   0.390  -1.194
  248    HB3  GLU  33           HB3      GLU  33   1.921   1.746  -2.312
  249    HG2  GLU  33           HG2      GLU  33   2.087  -1.166  -3.141
  250    HG3  GLU  33           HG3      GLU  33   0.595  -0.234  -3.051
  251    H    ILE  34           H        ILE  34   4.911   0.782  -0.005
  252    HA   ILE  34           HA       ILE  34   4.750   3.537   0.557
  253    HB   ILE  34           HB       ILE  34   5.086   1.794   2.297
  254   HG12  ILE  34          HG12      ILE  34   7.359   3.789   2.387
  255   HG13  ILE  34          HG13      ILE  34   5.674   4.282   2.569
  256   HG21  ILE  34          HG21      ILE  34   6.994   0.696   0.790
  257   HG22  ILE  34          HG22      ILE  34   7.035   0.558   2.546
  258   HG23  ILE  34          HG23      ILE  34   8.038   1.759   1.731
  259   HD11  ILE  34          HD11      ILE  34   5.477   2.584   4.437
  260   HD12  ILE  34          HD12      ILE  34   6.561   3.931   4.785
  261   HD13  ILE  34          HD13      ILE  34   7.222   2.361   4.331
  262    H    GLN  35           H        GLN  35   5.699   5.160  -0.426
  263    HA   GLN  35           HA       GLN  35   8.299   4.736  -1.763
  264    HB2  GLN  35           HB2      GLN  35   6.128   6.791  -2.190
  265    HB3  GLN  35           HB3      GLN  35   7.712   6.877  -2.961
  266    HG2  GLN  35           HG2      GLN  35   7.366   4.755  -4.063
  267    HG3  GLN  35           HG3      GLN  35   5.881   4.473  -3.160
  268   HE21  GLN  35          HE21      GLN  35   6.269   4.714  -6.144
  269   HE22  GLN  35          HE22      GLN  35   5.229   5.967  -6.626
  270    H    SER  36           H        SER  36   7.442   5.680   1.193
  271    HA   SER  36           HA       SER  36   8.488   8.268   1.557
  272    HB2  SER  36           HB2      SER  36   8.378   5.931   3.474
  273    HB3  SER  36           HB3      SER  36   8.750   7.589   3.935
  274    HG   SER  36           HG       SER  36   6.709   8.201   3.223
  275    H    GLY  37           H        GLY  37  10.497   9.056   1.884
  276    HA2  GLY  37           HA2      GLY  37  12.753   7.270   1.306
  277    HA3  GLY  37           HA3      GLY  37  12.774   9.029   1.232
  278    H    GLY  38           H        GLY  38  14.846   8.481   2.443
  279    HA2  GLY  38           HA2      GLY  38  16.088   8.602   4.373
  280    HA3  GLY  38           HA3      GLY  38  14.663   9.331   5.106
  281    H    GLU  39           H        GLU  39  14.372   8.322   6.994
  282    HA   GLU  39           HA       GLU  39  15.029   5.578   7.469
  283    HB2  GLU  39           HB2      GLU  39  13.393   7.549   9.086
  284    HB3  GLU  39           HB3      GLU  39  13.889   5.955   9.654
  285    HG2  GLU  39           HG2      GLU  39  16.255   6.574   9.349
  286    HG3  GLU  39           HG3      GLU  39  15.768   8.166   8.770
  287    H    TYR  40           H        TYR  40  13.680   3.808   7.708
  288    HA   TYR  40           HA       TYR  40  10.970   4.112   6.553
  289    HB2  TYR  40           HB2      TYR  40  12.812   1.710   6.578
  290    HB3  TYR  40           HB3      TYR  40  11.172   1.716   5.937
  291    HD1  TYR  40           HD1      TYR  40  14.627   2.848   5.416
  292    HD2  TYR  40           HD2      TYR  40  10.607   2.976   3.904
  293    HE1  TYR  40           HE1      TYR  40  15.466   3.728   3.255
  294    HE2  TYR  40           HE2      TYR  40  11.448   3.856   1.742
  295    HH   TYR  40           HH       TYR  40  13.756   3.706   0.471
  296    H    ALA  41           H        ALA  41   9.282   3.662   7.791
  297    HA   ALA  41           HA       ALA  41   9.724   2.472  10.443
  298    HB1  ALA  41           HB1      ALA  41   7.353   3.940   9.258
  299    HB2  ALA  41           HB2      ALA  41   8.503   4.573  10.436
  300    HB3  ALA  41           HB3      ALA  41   7.401   3.272  10.891
  301    H    THR  42           H        THR  42   8.860   0.515  11.031
  302    HA   THR  42           HA       THR  42   7.947  -1.234   8.937
  303    HB   THR  42           HB       THR  42   7.846  -2.930  10.719
  304    HG1  THR  42           HG1      THR  42   8.471  -0.729  12.391
  305   HG21  THR  42          HG21      THR  42  10.026  -2.391   9.662
  306   HG22  THR  42          HG22      THR  42  10.218  -2.904  11.339
  307   HG23  THR  42          HG23      THR  42  10.325  -1.194  10.922
  308    H    LEU  43           H        LEU  43   5.994  -2.648   9.377
  309    HA   LEU  43           HA       LEU  43   3.772  -1.110  10.556
  310    HB2  LEU  43           HB2      LEU  43   3.687  -2.558   7.900
  311    HB3  LEU  43           HB3      LEU  43   2.309  -1.818   8.704
  312    HG   LEU  43           HG       LEU  43   3.907   0.341   8.684
  313   HD11  LEU  43          HD11      LEU  43   5.869  -0.616   7.690
  314   HD12  LEU  43          HD12      LEU  43   5.113   0.350   6.429
  315   HD13  LEU  43          HD13      LEU  43   4.927  -1.403   6.427
  316   HD21  LEU  43          HD21      LEU  43   2.789   1.074   6.653
  317   HD22  LEU  43          HD22      LEU  43   1.664   0.082   7.580
  318   HD23  LEU  43          HD23      LEU  43   2.482  -0.596   6.172
  319    H    ALA  44           H        ALA  44   2.276  -2.307  11.641
  320    HA   ALA  44           HA       ALA  44   2.389  -5.230  11.548
  321    HB1  ALA  44           HB1      ALA  44   3.997  -4.120  13.335
  322    HB2  ALA  44           HB2      ALA  44   3.048  -5.545  13.754
  323    HB3  ALA  44           HB3      ALA  44   2.503  -3.945  14.257
  324    H    ASP  45           H        ASP  45   0.786  -5.245  14.160
  325    HA   ASP  45           HA       ASP  45  -1.808  -4.806  12.935
  326    HB2  ASP  45           HB2      ASP  45  -1.336  -6.845  14.251
  327    HB3  ASP  45           HB3      ASP  45  -1.055  -5.854  15.675
  328    H    GLY  46           H        GLY  46  -2.629  -2.793  12.971
  329    HA2  GLY  46           HA2      GLY  46  -3.815  -1.132  14.236
  330    HA3  GLY  46           HA3      GLY  46  -2.656  -1.341  15.539
  331    H    GLN  47           H        GLN  47  -0.942  -1.258  12.660
  332    HA   GLN  47           HA       GLN  47   0.278   1.236  13.204
  333    HB2  GLN  47           HB2      GLN  47   1.324  -0.667  11.957
  334    HB3  GLN  47           HB3      GLN  47   0.270  -0.301  10.592
  335    HG2  GLN  47           HG2      GLN  47   2.451   0.746  10.245
  336    HG3  GLN  47           HG3      GLN  47   1.233   1.987  10.497
  337   HE21  GLN  47          HE21      GLN  47   2.079   3.626  11.788
  338   HE22  GLN  47          HE22      GLN  47   3.109   3.385  13.116
  339    H    THR  48           H        THR  48  -0.237   3.259  12.607
  340    HA   THR  48           HA       THR  48  -2.686   3.698  11.071
  341    HB   THR  48           HB       THR  48  -0.849   5.688  12.449
  342    HG1  THR  48           HG1      THR  48  -1.963   4.067  13.763
  343   HG21  THR  48          HG21      THR  48  -2.267   6.688  10.684
  344   HG22  THR  48          HG22      THR  48  -2.790   7.202  12.288
  345   HG23  THR  48          HG23      THR  48  -3.693   5.959  11.422
  346    H    VAL  49           H        VAL  49  -2.685   4.137   8.960
  347    HA   VAL  49           HA       VAL  49  -0.306   5.396   7.751
  348    HB   VAL  49           HB       VAL  49  -0.349   3.809   5.861
  349   HG11  VAL  49          HG11      VAL  49  -0.138   2.256   8.447
  350   HG12  VAL  49          HG12      VAL  49   1.054   3.465   7.975
  351   HG13  VAL  49          HG13      VAL  49   0.800   2.044   6.967
  352   HG21  VAL  49          HG21      VAL  49  -1.621   1.658   6.178
  353   HG22  VAL  49          HG22      VAL  49  -2.658   3.062   5.927
  354   HG23  VAL  49          HG23      VAL  49  -2.443   2.403   7.549
  355    H    GLU  50           H        GLU  50  -0.715   6.128   5.512
  356    HA   GLU  50           HA       GLU  50  -3.535   6.954   5.131
  357    HB2  GLU  50           HB2      GLU  50  -2.626   8.968   3.957
  358    HB3  GLU  50           HB3      GLU  50  -2.247   8.936   5.678
  359    HG2  GLU  50           HG2      GLU  50  -0.001   8.064   5.162
  360    HG3  GLU  50           HG3      GLU  50  -0.383   8.079   3.442
  361    H    TYR  51           H        TYR  51  -4.380   6.686   3.073
  362    HA   TYR  51           HA       TYR  51  -2.663   5.936   0.859
  363    HB2  TYR  51           HB2      TYR  51  -3.669   3.718   0.525
  364    HB3  TYR  51           HB3      TYR  51  -2.820   3.808   2.065
  365    HD1  TYR  51           HD1      TYR  51  -6.107   3.597   0.426
  366    HD2  TYR  51           HD2      TYR  51  -4.059   3.864   4.192
  367    HE1  TYR  51           HE1      TYR  51  -8.196   2.969   1.606
  368    HE2  TYR  51           HE2      TYR  51  -6.149   3.234   5.371
  369    HH   TYR  51           HH       TYR  51  -9.152   3.335   3.965
  370    H    GLU  52           H        GLU  52  -3.928   5.353  -1.098
  371    HA   GLU  52           HA       GLU  52  -6.488   6.844  -1.198
  372    HB2  GLU  52           HB2      GLU  52  -4.402   6.499  -3.376
  373    HB3  GLU  52           HB3      GLU  52  -5.953   7.322  -3.568
  374    HG2  GLU  52           HG2      GLU  52  -5.301   8.942  -1.813
  375    HG3  GLU  52           HG3      GLU  52  -3.746   8.130  -1.647
  376    H    VAL  53           H        VAL  53  -8.220   5.692  -1.813
  377    HA   VAL  53           HA       VAL  53  -7.979   2.875  -2.322
  378    HB   VAL  53           HB       VAL  53  -9.855   3.826  -1.033
  379   HG11  VAL  53          HG11      VAL  53 -10.974   4.905  -3.623
  380   HG12  VAL  53          HG12      VAL  53 -10.012   5.907  -2.537
  381   HG13  VAL  53          HG13      VAL  53 -11.530   5.206  -1.978
  382   HG21  VAL  53          HG21      VAL  53 -11.633   2.514  -2.055
  383   HG22  VAL  53          HG22      VAL  53 -10.104   1.662  -2.270
  384   HG23  VAL  53          HG23      VAL  53 -10.812   2.554  -3.615
  385    H    GLY  54           H        GLY  54  -7.409   2.047  -4.198
  386    HA2  GLY  54           HA2      GLY  54  -8.066   3.457  -6.702
  387    HA3  GLY  54           HA3      GLY  54  -6.758   2.288  -6.502
  388    H    GLN  55           H        GLN  55  -8.340   1.781  -8.574
  389    HA   GLN  55           HA       GLN  55 -10.300  -0.222  -7.644
  390    HB2  GLN  55           HB2      GLN  55 -11.177   1.597  -9.106
  391    HB3  GLN  55           HB3      GLN  55 -10.069   1.076 -10.376
  392    HG2  GLN  55           HG2      GLN  55 -11.136  -1.154 -10.392
  393    HG3  GLN  55           HG3      GLN  55 -12.250  -0.628  -9.130
  394   HE21  GLN  55          HE21      GLN  55 -14.241  -0.054  -9.988
  395   HE22  GLN  55          HE22      GLN  55 -14.477   0.680 -11.501
  396    H    GLY  56           H        GLY  56  -9.947  -2.309  -8.013
  397    HA2  GLY  56           HA2      GLY  56  -7.856  -3.113  -9.943
  398    HA3  GLY  56           HA3      GLY  56  -7.934  -3.814  -8.328
  399    H    GLN  57           H        GLN  57  -8.101  -5.312 -10.732
  400    HA   GLN  57           HA       GLN  57 -10.736  -5.923 -11.532
  401    HB2  GLN  57           HB2      GLN  57  -8.184  -7.544 -11.578
  402    HB3  GLN  57           HB3      GLN  57  -9.697  -8.093 -12.306
  403    HG2  GLN  57           HG2      GLN  57  -9.753  -6.194 -13.795
  404    HG3  GLN  57           HG3      GLN  57  -8.390  -5.442 -12.967
  405   HE21  GLN  57          HE21      GLN  57  -8.625  -6.313 -15.851
  406   HE22  GLN  57          HE22      GLN  57  -7.331  -7.386 -16.096
  407    H    LYS  58           H        LYS  58  -8.660  -7.284  -8.998
  408    HA   LYS  58           HA       LYS  58 -10.666  -9.217  -8.183
  409    HB2  LYS  58           HB2      LYS  58  -8.001  -8.425  -6.994
  410    HB3  LYS  58           HB3      LYS  58  -9.034  -9.699  -6.344
  411    HG2  LYS  58           HG2      LYS  58  -8.942 -10.883  -8.507
  412    HG3  LYS  58           HG3      LYS  58  -7.905  -9.614  -9.158
  413    HD2  LYS  58           HD2      LYS  58  -6.208 -10.113  -7.440
  414    HD3  LYS  58           HD3      LYS  58  -7.241 -11.384  -6.786
  415    HE2  LYS  58           HE2      LYS  58  -7.152 -12.575  -8.943
  416    HE3  LYS  58           HE3      LYS  58  -6.126 -11.304  -9.606
  417    HZ1  LYS  58           HZ1      LYS  58  -4.684 -12.998  -8.905
  418    HZ2  LYS  58           HZ2      LYS  58  -5.498 -13.208  -7.427
  419    HZ3  LYS  58           HZ3      LYS  58  -4.578 -11.806  -7.704
  420    H    GLY  59           H        GLY  59  -9.822  -5.954  -7.386
  421    HA2  GLY  59           HA2      GLY  59 -12.035  -5.190  -6.037
  422    HA3  GLY  59           HA3      GLY  59 -11.079  -5.956  -4.772
  423    HA   PRO  60           HA       PRO  60  -9.680  -1.474  -5.343
  424    HB2  PRO  60           HB2      PRO  60 -10.155  -0.552  -2.841
  425    HB3  PRO  60           HB3      PRO  60 -11.410  -0.575  -4.097
  426    HG2  PRO  60           HG2      PRO  60 -10.927  -2.511  -1.878
  427    HG3  PRO  60           HG3      PRO  60 -12.447  -1.784  -2.426
  428    HD2  PRO  60           HD2      PRO  60 -11.704  -4.299  -3.156
  429    HD3  PRO  60           HD3      PRO  60 -12.649  -3.244  -4.232
  430    H    CYS  61           H        CYS  61  -7.838  -0.431  -4.369
  431    HA   CYS  61           HA       CYS  61  -6.260  -2.051  -2.483
  432    HB2  CYS  61           HB2      CYS  61  -4.258  -1.851  -3.877
  433    HB3  CYS  61           HB3      CYS  61  -5.533  -2.690  -4.758
  434    HG   CYS  61           HG       CYS  61  -5.472  -0.893  -6.455
  435    H    ALA  62           H        ALA  62  -4.212  -0.783  -1.838
  436    HA   ALA  62           HA       ALA  62  -4.936   2.070  -1.499
  437    HB1  ALA  62           HB1      ALA  62  -4.926   1.331   0.678
  438    HB2  ALA  62           HB2      ALA  62  -3.206   1.680   0.506
  439    HB3  ALA  62           HB3      ALA  62  -3.790   0.026   0.340
  440    H    ASN  63           H        ASN  63  -3.568   3.530  -2.367
  441    HA   ASN  63           HA       ASN  63  -0.851   2.629  -3.123
  442    HB2  ASN  63           HB2      ASN  63  -2.640   4.644  -4.504
  443    HB3  ASN  63           HB3      ASN  63  -0.991   4.247  -4.981
  444   HD21  ASN  63          HD21      ASN  63  -3.826   3.744  -6.244
  445   HD22  ASN  63          HD22      ASN  63  -3.752   2.106  -6.681
  446    H    LYS  64           H        LYS  64   0.793   4.317  -3.132
  447    HA   LYS  64           HA       LYS  64   1.995   5.967  -2.083
  448    HB2  LYS  64           HB2      LYS  64  -0.714   7.324  -1.917
  449    HB3  LYS  64           HB3      LYS  64   0.841   8.110  -1.674
  450    HG2  LYS  64           HG2      LYS  64   0.054   6.693  -4.242
  451    HG3  LYS  64           HG3      LYS  64  -0.139   8.425  -3.986
  452    HD2  LYS  64           HD2      LYS  64   2.306   8.617  -3.569
  453    HD3  LYS  64           HD3      LYS  64   2.479   6.893  -3.901
  454    HE2  LYS  64           HE2      LYS  64   1.576   7.234  -6.171
  455    HE3  LYS  64           HE3      LYS  64   1.403   8.959  -5.844
  456    HZ1  LYS  64           HZ1      LYS  64   3.857   7.372  -6.184
  457    HZ2  LYS  64           HZ2      LYS  64   3.897   8.793  -5.253
  458    HZ3  LYS  64           HZ3      LYS  64   3.433   8.856  -6.888
  459    H    VAL  65           H        VAL  65   1.425   3.851  -0.500
  460    HA   VAL  65           HA       VAL  65   0.167   4.581   1.960
  461    HB   VAL  65           HB       VAL  65   1.106   2.460   2.831
  462   HG11  VAL  65          HG11      VAL  65  -0.017   0.984   1.077
  463   HG12  VAL  65          HG12      VAL  65  -0.251   2.452   0.129
  464   HG13  VAL  65          HG13      VAL  65  -1.000   2.301   1.718
  465   HG21  VAL  65          HG21      VAL  65   2.447   2.364   0.109
  466   HG22  VAL  65          HG22      VAL  65   2.300   0.979   1.186
  467   HG23  VAL  65          HG23      VAL  65   3.237   2.381   1.681
  468    H    VAL  66           H        VAL  66   0.929   5.822   3.466
  469    HA   VAL  66           HA       VAL  66   3.853   5.960   3.932
  470    HB   VAL  66           HB       VAL  66   1.966   8.338   3.930
  471   HG11  VAL  66          HG11      VAL  66   4.930   8.105   4.511
  472   HG12  VAL  66          HG12      VAL  66   3.674   8.639   5.625
  473   HG13  VAL  66          HG13      VAL  66   4.099   9.634   4.232
  474   HG21  VAL  66          HG21      VAL  66   3.251   9.091   1.994
  475   HG22  VAL  66          HG22      VAL  66   2.584   7.492   1.666
  476   HG23  VAL  66          HG23      VAL  66   4.285   7.665   2.098
  477    H    ALA  67           H        ALA  67   4.415   5.581   5.962
  478    HA   ALA  67           HA       ALA  67   2.489   4.959   7.966
  479    HB1  ALA  67           HB1      ALA  67   4.695   3.855   7.830
  480    HB2  ALA  67           HB2      ALA  67   4.420   4.580   9.413
  481    HB3  ALA  67           HB3      ALA  67   5.471   5.382   8.246
  482    H    VAL  68           H        VAL  68   1.816   6.079   9.728
  483    HA   VAL  68           HA       VAL  68   2.552   8.942   9.839
  484    HB   VAL  68           HB       VAL  68   0.095   7.574  10.989
  485   HG11  VAL  68          HG11      VAL  68  -0.722   9.972  11.095
  486   HG12  VAL  68          HG12      VAL  68   0.925  10.479  10.718
  487   HG13  VAL  68          HG13      VAL  68   0.595   9.596  12.208
  488   HG21  VAL  68          HG21      VAL  68  -1.072   8.838   9.119
  489   HG22  VAL  68          HG22      VAL  68  -0.066   7.492   8.580
  490   HG23  VAL  68          HG23      VAL  68   0.522   9.148   8.429