*HEADER    ANTIMICROBIAL PROTEIN                   06-JUN-05   1ZWU              
*TITLE     30 NMR STRUCTURES OF ACAMP2-LIKE PEPTIDE WITH NON NATURAL             
*TITLE    2 BETA-(2-NAPHTHYL)-ALANINE RESIDUE.                                   
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: ANTIMICROBIAL PEPTIDE 2 (AMP2);                            
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES;                                                     
*COMPND   5 MUTATION: YES                                                        
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 OTHER_DETAILS: THE RESIDUE PHE 18 OF THE NATURAL ACAMP2              
*SOURCE   4 WAS CHANGED TO BETA-(2-NAPHTHYL)-ALANINE. THE AMINOACID              
*SOURCE   5 WAS MANUALLY ASSEMBLED BY SOLID PHASE SYNTHESIS USING FMOC           
*SOURCE   6 CHEMISTRY USING STANDARD PROTOCOLS.                                  
*KEYWDS    ALPHA-HELIX, ANTI-PARALLEL BETA-SHEET.                                
*EXPDTA    NMR, 30 STRUCTURES                                                    
*AUTHOR    M.I.CHAVEZ, C.ANDREU, P.VIDAL, F.FREIRE, N.ABOITIZ,                   
*AUTHOR   2 P.GROVES, J.L.ASENSIO, G.ASENSIO, M.MURAKI, F.J.CANADA,              
*AUTHOR   3 J.JIMENEZ-BARBERO                                                    
*REVDAT   1   06-DEC-05 1ZWU    0                                                


?? 1 VAL
  HA      3 GLU  HN      5.00
  HA      2 GLY  HN      3.50
  HA      1 VAL  QG1     5.00
  HA      1 VAL  QG2     5.00
  HB      2 GLY  HN      5.00
  HB      1 VAL  QG1     3.50
  HB      1 VAL  QG2     3.50
  QG1     2 GLY  HN      5.00
  QG2     2 GLY  HN      5.00
  QG1    20 TYR  CG      7.20
  QG1    27 TYR  CZ      7.20
  2 GLY
       HN      3 GLU  HN      5.00
  HA1     3 GLU  HN      5.00
       HA2     3 GLU  HN      5.00
  3 GLU
       HN      4 CYSS HN      5.00
  HN     20 TYR  CG      5.00
  HN     20 TYR  CZ      5.00
  HN      3 GLU  HB2 3.50
  HN      3 GLU  HG2 5.00
  HA      4 CYSS HN      2.50
  HA     20 TYR  CG      7.20
  HA     20 TYR  CZ      7.20
  HA     20 TYR  HA      5.00
  HA      3 GLU  HG2     5.00
  HB2     4 CYSS HN      5.00
  HB2    20 TYR  HA      5.00
  HB2    20 TYR  CG      7.20
  HB2    20 TYR  CZ      5.70
  HG2     4 CYSS HN      5.00
  HG2    20 TYR  CG      7.20
  HG2    20 TYR  CZ      7.20
  4 CYSS
  HN     21 CYSS HN      5.00
  HN      5 VAL  HN      5.00
  HN    20 TYR  HN      5.00
 #HN    20 TYR  CG      5.00
  HN     20 TYR  HA      3.50
  HN      4 CYSS HB2     5.00
  HN      4 CYSS HB3     3.50
 #HN      5 VAL  QG2     5.00
  HA      5 VAL  HN      2.50
  HA      8 ARG  HN      5.00
 #HA      5 VAL  QG1     5.00
  HA      5 VAL  QG2     5.00
  HB2     7 GLY  HN      5.00
  HB2     8 ARG  HN      5.00
  HB2     5 VAL  HN      3.50
   HB2     7 GLY  HA1     5.00
  HB2     7 GLY  HA2     5.00
 #HB2     5 VAL  QG2     5.00
  HB3     7 GLY  HN      5.00
  HB3     8 ARG  HN      5.00
  HB3     5 VAL  HN      5.00
  HB3     7 GLY  HA1     5.00
  HB3     7 GLY  HA2     5.00
  HB3     5 VAL  QG2     5.00
  5 VAL
  HN      6 ARG  HN      5.00
  HN      8 ARG  HN      3.50
  HN      8 ARG  HA      5.00
  HN      5 VAL  HB      3.50
  HN      5 VAL  QG1     5.00
  HN      5 VAL  QG2     3.50
  HA      6 ARG  HN      3.50
  HA      5 VAL  QG1     3.50
  HA      5 VAL  QG2     3.50 
  HB      6 ARG  HN      5.00
  HB      7 GLY  HN      5.00
  HB      5 VAL  QG1     2.50
  HB      5 VAL  QG2     2.50
       QG1     6 ARG  HN      5.00
  QG1     6 ARG  HB2     5.00
  QG1     6 ARG  HG2     3.50
  QG1     6 ARG  HG3     5.00
  QG1     6 ARG  HD2     5.00
  QG1     8 ARG  HD2     5.00 
  QG2     8 ARG  HN      5.00
  6 ARG       
     HN      7 GLY  HN      5.00
  HN      8 ARG  HN      5.00
  HN      6 ARG  HB3     5.00
  HN      6 ARG  HB2     5.00
  HN      6 ARG  HG2     3.50
  HA      8 ARG  HN      5.00
  HA      7 GLY  HN      3.50
  HA      6 ARG  HG2     3.50
  HB2     7 GLY  HN      5.00
  HB2     6 ARG  HE      5.00
  HB2     6 ARG  HD2     5.00
  HB3     7 GLY  HN      5.00
  HB3     6 ARG  HE      5.00
  HB3     6 ARG  HD2     5.00
  HG2     7 GLY  HN      5.00
  HG2     6 ARG  HD2     5.00
  HG2    6 ARG  HE 5.00
  HD2     6 ARG  HE      5.00
 7 GLY
       HN      8 ARG  HN      3.50
  HA1     8 ARG  HN      5.00
  HA2     8 ARG  HN      3.50
  8 ARG   
  HN      9 CYSS HN      5.00    
  HN      8 ARG  HB2     3.50
  HN      8 ARG  HB3     3.50
  HN      8 ARG  HG2     5.00
  HN      8 ARG  HG3     3.50
  HN      8 ARG  HD2     5.00
  HA      9 CYSS HN      2.50
   HA      8 ARG  HD2     5.00
  HA      8 ARG  HG2     3.50
  HA      8 ARG  HG3     5.00
  HB2     9 CYSS HN      5.00
  HB2     8 ARG  HE 5.00
   HB3     9 CYSS HN      3.50
  HG2     9 CYSS HN      5.00
  HG2     8 ARG  HE 5.00
   HG3     9 CYSS HN      5.00
  HG3     8 ARG  HE 5.00
  HD2     9 CYSS HN      5.00
  HD2     8 ARG  HE 5.00
  9 CYSS
  HN     10 PRO  HD3     5.00
  HN     10 PRO  HD2     5.00
  HN      9 CYSS HB2     5.00
  HN      9 CYSS HB3     5.00
 #HN     13 MET  HB3     5.00
  HA     10 PRO  HD3     5.00
  HA     10 PRO  HD2     5.00
  HB2    14 CYSS HN      5.00
  HB2    15 CYSS HN      5.00
  HB2    13 MET  HN      5.00
  HB2    10 PRO  HD3     5.00
  HB2    10 PRO  HD2     5.00
  HB2    13 MET  HB2     5.00
  HB3    14 CYSS HN      5.00  
  HB3    13 MET  HN  5.00
 #HB3    14 CYSS HA 5.00
  HB3    10 PRO  HD3     5.00
  HB3    10 PRO  HD2     3.50
  HB3    13 MET  HG2     5.00
 10 PRO
  HA     11 SER  HN      2.50
  HA     13 MET  HN      5.00 
  HA     11 SER  HB2     5.00
  HA     10 PRO  HG2     5.00
  HA     10 PRO  HG3     5.00
  HB2    11 SER  HN      5.00
  HB2   10 PRO  HD2     5.00
  HB2    10 PRO  HD3     5.00
  HB3    11 SER  HN      5.50
  HB3   10 PRO  HD2     5.00
  HB3    10 PRO  HD3     5.00
  HD2    13 MET  HG2     5.00
        
 11 SER
       HN     12 GLY  HN      5.00
  HN     11 SER  HB2     3.50
  HA     12 GLY  HN  2.50
  HA     13 MET  HN      5.00
  HB2    12 GLY  HN  5.00
 #HB2    13 MET  HN      5.00
 12 GLY
       HN      13 MET  HN     3.50
 #HN      13 MET  HB3    5.00
  HA1     13 MET  HN     5.00
  HA2     13 MET  HN     5.00
  HA2     13 MET  HG2 5.00
 13 MET
       HN      14 CYSS HN     5.00
  HN      13 MET  HB2    5.00
  HN      13 MET  HB3    3.50
  HN      13 MET  HG2    5.00
  HN      13 MET  HG3 5.00
  HA      14 CYSS HN     3.50
  HA      22 GLY  HN     5.00
  HA      23 LYS  HG2    5.00
  HA      23 LYS  HG3    5.00
  HB2     14 CYSS HN     3.50
  HB2     22 GLY  HN     5.00
  HB3     22 GLY  HN     5.00
  HB3     14 CYSS HN     3.50
  HG2     14 CYSS HN     5.00
  HG2     22 GLY  HN     5.00
 14 CYSS
       HN      15 CYSS HN     5.00
       HN      22 GLY  HN     3.50
  HN      21 CYSS HA     5.00
  HN      23 LYS  HA     5.00
  HN      14 CYSS HB3    5.00
    HN      22 GLY  HA2    5.00
  HN      27 TYR  HB3    5.00
  HN      27 TYR  HB2    5.00
  HN      14 CYSS HB2    3.50
  HA      15 CYSS HN     2.50
  HA      27 TYR  HB2    5.00
  HA      15 CYSS HB3 5.00
  HB2     15 CYSS HN     5.00
  HB2     28 CYSS HN     5.00
  HB2     22 GLY  HN     5.00
  HB2     23 LYS  HA     5.00
  HB2     27 TYR  HB2    3.50
  HB2     27 TYR  HB3    3.50
  HB2     28 CYSS HA 3.50
  HB3     28 CYSS HN     5.00
  HB3     15 CYSS HN     3.50
  HB3     28 CYSS HA     3.50
  HB3     28 CYSS HB3    5.00
  HB3     27 TYR  HB2    5.00
  HB3     27 TYR  HB3    5.00
 15 CYSS
       HN      16 SER  HN     5.00
  HN      21 CYSS HA     5.00
  HN      15 CYSS HB2    3.50
  HN      15 CYSS HB3    3.50
  HA      16 SER  HN     2.50
  HA      22 GLY  HN     5.00
  HA      21 CYSS HA     5.00
  HB2     16 SER  HN     5.00
  HB3     16 SER  HN     5.00

16 SER
       HN      17 GLN  HN     5.00
  HN      22 GLY  HN     5.00
  HN      19 GLY  HN     5.00
  HN      18 NAL  HN     5.00
  HN      20 TYR  HN     5.00
       HN      27 TYR  CG     7.20
  HN      21 CYSS HA     5.00
  HN      16 SER  HB2    3.50
  HN      27 TYR  HA     5.00
  HN      19 GLY  HA1    5.00
  HN    20 TYR  HB2    5.00
   HN      27 TYR  HB3    5.00
  HA      17 GLN  HN     5.00
  HA    19 GLY  HN     5.00
  HA      27 TYR  CG     7.20
  HA      20 TYR  HN     5.00
  HA      17 GLN  HA 5.00 
  HA      27 TYR  HA     5.00 
  HA      27 TYR  HB3    5.00 
   HB2     17 GLN  HN     3.50 
  HB2     19 GLY  HN     5.00 
  HB2     18 NAL  HN     3.50 
  HB2     18 NAL  HZ1    5.00
  HB2     18 NAL  HB2    5.00 
  HB2     27 TYR  CG     5.70 
  HB2     20 TYR  HN     5.00 
  HB2     27 TYR  HA     5.00 
  HB2     27 TYR  HB2    5.00
  HB2     27 TYR  HB3    5.00   
 17 GLN
       HN      19 GLY  HN     5.00
  HN      18 NAL  HN     5.00
  HN      18 NAL  HZ1    5.00
  HN      17 GLN  HE21   5.00
  HN      17 GLN  HE22   5.00
  HN      17 GLN  HA     5.00
  HN      27 TYR  HA     5.00
  HN      17 GLN  HB3    5.00
  HN      17 GLN  HB2    3.50
       HN      17 GLN  HG3    3.50
       HN      17 GLN  HG2    5.00
  HE21    18 NAL  HH1    5.00
  HE21    18 NAL  HH2    5.00
  HE21    18 NAL  HZ1    5.00
  HE21    18 NAL  HP     5.00
  HE22    18 NAL  HH1    5.00
  HE22    18 NAL  HH2    5.00
  HE22    18 NAL  HZ1    5.00
  HE22    18 NAL  HP     5.00
  HA      18 NAL  HN     5.00
       HA      17 GLN  HG2    5.00
  HA      17 GLN  HG3    5.00
  HB2     18 NAL  HN     5.00
 #HB2     18 NAL  HH2    5.00
  HB2     17 GLN  HE22   5.00
  HB2     17 GLN  HE21   5.00
  HB3     18 NAL  HN     5.00
  HB3     17 GLN  HE22   5.00
  HB3     17 GLN  HE21   5.00
  HG2     18 NAL  HH2    5.00
  HG2     18 NAL  HZ1 5.00
  HG2     17 GLN  HE22   5.00
  HG2     17 GLN  HE21   5.00
  HG3     18 NAL  HN     5.00
  HG3     18 NAL  HH2 5.00
  HG3     18 NAL  HZ1 5.00
  HG3     17 GLN  HE22   5.00
  HG3     17 GLN  HE21   5.00 
 18 NAL 
       HN      19 GLY  HN     5.00
  HN      20 TYR  HN     5.00
  HN      19 GLY  HA1    5.00
  HN      18 NAL  HB3    5.00
  HN      18 NAL  HB2    3.50
  HE2     18 NAL  HH2    2.50
       HE2     18 NAL  HD2    2.50
  HE2     18 NAL  HA     5.00
       HH2     18 NAL  HP     3.50
  HH2     18 NAL  HD2    5.00
  HH2     18 NAL  HH1    5.00
       HZ1     18 NAL  HD1    3.50 
  HZ1     18 NAL  HH1    2.50
  HZ1     18 NAL  HB2    5.00
  HD1     18 NAL  HD2    5.00
  HD1     18 NAL  HA     5.00
  HD1     18 NAL  HB3    5.00
  HD1     18 NAL  HB2    3.50
       HD2     18 NAL  HA     3.50
  HD2     18 NAL  HB3    3.50
  HD2     18 NAL  HB2    5.00
  HP    18 NAL  HH1    2.50 
  HA      19 GLY  HN     5.00
  HB2     19 GLY  HN     5.00
  HB2     20 TYR  CG  5.70
  HB2     20 TYR  CZ 7.20
  HB3     19 GLY  HN     5.00
  HB3     20 TYR  CG  5.70
  HB3     20 TYR  CZ 7.20
 19 GLY
 
       HN      20 TYR  HN     3.50
  HN      20 TYR  CG     7.20
  HA1     20 TYR  HN     3.50
  HA1     20 TYR  CG 7.20
  HA1     20 TYR  CZ 7.20
  HA2     20 TYR  HN     5.00
  HA2    20 TYR  CG     7.20
  
 20 TYR
 
  HN      20 TYR  CG     7.20
  HN      20 TYR  CZ     7.20
  HN      20 TYR  HB3    5.00
  HN      20 TYR  HB2    3.50
  CG      20 TYR  CZ     3.50
  CG      20 TYR  HA     5.70
  CG      20 TYR  HB3    4.70
  CG      20 TYR  HB2    4.70
  CZ      20 TYR  HA     7.20
  CZ      20 TYR  HB3    7.20
  CZ      20 TYR  HB2    5.00
  HA      21 CYSS HN     3.50
  HB2     21 CYSS HN     5.00
  HB2     27 TYR  CZ     5.00
  HB3     21 CYSS HN     5.00
 21 CYSS
       HN      21 CYSS HB2    3.50
  HA      22 GLY  HN     2.50
  HA      27 TYR  CG     7.20
  HB2     22 GLY  HN     5.00
         
 22 GLY  
  HN      23 LYS  HN     5.00
  HN      27 TYR  CG     5.00
  HN      27 TYR  HB3    5.00
  HN      27 TYR  HB2    5.00
  HA1     23 LYS  HN     3.50
  HA2     23 LYS  HN  3.50
 23 LYS
       HN      27 TYR  CG     7.20
       HA      24 GLY  HN     2.50
  HA      28 CYSS HN     5.00
  HA      24 GLY  HA1    5.00
  HA     27 TYR  HB2 5.00
  HA      27 TYR  HB3 5.00
  HA      23 LYS  HG2 5.00
  HA      23 LYS  HG3 3.50
  HB2     24 GLY  HN     5.00
  HB2    23 LYS  HE2    5.00
  HB3     24 GLY  HN     3.50
  HB3    23 LYS  HE2    5.00
  HG2     24 GLY  HN     5.00
  HG2    23 LYS  HE2    5.00
  HG3     24 GLY  HN     5.00
  HG3    23 LYS  HE2    5.00  
 24 GLY 
  HA1     25 PRO  HD2    3.50
  HA1     26 LYS  HN     5.00
  HA1     25 PRO  HD3    5.00
  HA2     26 LYS  HN     5.00
  HA2     25 PRO  HD2    3.50
  HA2     25 PRO  HD3    3.50
 25 PRO  
       HA      26 LYS  HN     3.50
       HA      28 CYSS HN     5.00
  HA      29 GLY  HN     3.50
       HA      27 TYR  HN     5.00
       HA      25 PRO  HD2 5.00
       HA      25 PRO  HD3    5.00
       HA      25 PRO  HG2    5.00
  HB2     26 LYS  HN     5.00
       HB2     25 PRO  HD2 5.00
  HB2     25 PRO  HD3 5.00
  HB3     26 LYS  HN     5.00
  HB3     25 PRO  HD2 5.00
  HG2     26 LYS  HN     5.00
  HG3     26 LYS  HN     5.00
  HD2     26 LYS  HN     5.00
 26 LYS
       HN      28 CYSS HN     5.00
  HN      27 TYR  HN     3.50
  HN      27 TYR  CG     7.20
  HN      26 LYS  HE2    5.00
  HN      26 LYS  HD2    5.00
  HN      26 LYS  HB2    3.50
  HN      26 LYS  HB3    3.50
  HN      26 LYS  HG2    5.00
  HA      27 TYR  HN     5.00
  HA      26 LYS  HG2 5.00
  HB2     27 TYR  HN     5.00
   HB2     27 TYR  CG     5.00
  HB2     27 TYR  CZ 5.00  
  HB3     27 TYR  HN     5.00
  HB3     27 TYR  CG     5.00
  HB3     27 TYR  CZ     5.00           
 27 TYR
       HN      28 CYSS HN     2.50
  HN      29 GLY  HN     5.00
  HN      27 TYR  CG     5.70
  HN      27 TYR  HB3    5.00
  HN      27 TYR  HB2    3.50
  HN      28 CYSS HA 5.00
  HN      28 CYSS HB2    5.00
  CG      27 TYR  CZ     3.50
  CG      28 CYSS HN     7.20
  CG      27 TYR  HA     7.20
  CG      27 TYR  HB3    5.70
  CG      27 TYR  HB2    5.70
  HA      28 CYSS HN     5.00
  HB2     28 CYSS HN     3.50
  HB3     28 CYSS HN     5.00
 28 CYSS
  HN      29 GLY  HN     3.50
  HN      28 CYSS HB3    3.50
  HN      28 CYSS HB2    3.50
  HA      29 GLY  HN     5.00
  HB2     29 GLY  HN     5.00
  HB3     29 GLY  HN     5.00
 29 GLY
  HN      30 ARG  HN     5.00
  HA1     30 ARG  HN     3.50          
 30 ARG
       HN      30 ARG  HB3    5.00
       HN      30 ARG  HB2    3.50
  HN      30 ARG  HG3    5.00
  HN      30 ARG  HG2    5.00
  HA      30 ARG  HD2    5.00
  
  
  4 CYSS CB      15 CYSS SG     3.10   
  4 CYSS SG      15 CYSS CB     3.10                
  4 CYSS SG      15 CYSS SG     2.10                
  9 CYSS CB      21 CYSS SG     3.10  
  9 CYSS SG      21 CYSS CB     3.10                
  9 CYSS SG      21 CYSS SG     2.10   
 14 CYSS CB      28 CYSS SG     3.10   
 14 CYSS SG      28 CYSS CB     3.10                
 14 CYSS SG      28 CYSS SG     2.10  
 

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    VAL   1           H1       VAL   1   5.377  -3.019   0.752
    2   2H    VAL   1           H2       VAL   1   6.713  -2.750   1.706
    3   3H    VAL   1           H3       VAL   1   5.757  -1.495   1.284
    4    HA   VAL   1           HA       VAL   1   3.940  -2.346   2.567
    5    HB   VAL   1           HB       VAL   1   4.425  -4.711   2.322
    6   1HG1  VAL   1          1HG1      VAL   1   6.684  -4.316   4.335
    7   2HG1  VAL   1          2HG1      VAL   1   6.073  -5.864   3.727
    8   3HG1  VAL   1          3HG1      VAL   1   6.883  -4.750   2.621
    9   1HG2  VAL   1          1HG2      VAL   1   4.335  -3.882   5.257
   10   2HG2  VAL   1          2HG2      VAL   1   2.951  -3.889   4.145
   11   3HG2  VAL   1          3HG2      VAL   1   3.764  -5.404   4.559
   12    H    GLY   2           HN       GLY   2   3.678  -1.410   4.553
   13   1HA   GLY   2          HA2       GLY   2   4.282   0.319   6.055
   14   2HA   GLY   2          HA1       GLY   2   6.009   0.078   5.677
   15    H    GLU   3           HN       GLU   3   6.866   1.262   3.924
   16    HA   GLU   3           HA       GLU   3   5.306   3.183   2.417
   17   1HB   GLU   3          HB1       GLU   3   7.770   3.149   2.914
   18   2HB   GLU   3          HB2       GLU   3   7.945   2.034   1.733
   19   1HG   GLU   3          HG1       GLU   3   6.856   3.721   0.257
   20   2HG   GLU   3          HG2       GLU   3   7.217   4.792   1.436
   21    H    CYS   4           HN       CYS   4   4.541   3.058   0.248
   22    HA   CYS   4           HA       CYS   4   4.576   0.502  -1.232
   23   1HB   CYS   4          HB1       CYS   4   3.843   3.178  -2.218
   24   2HB   CYS   4          HB2       CYS   4   3.507   1.738  -2.913
   25    H    VAL   5           HN       VAL   5   6.584  -0.095  -1.904
   26    HA   VAL   5           HA       VAL   5   8.828   1.726  -1.883
   27    HB   VAL   5           HB       VAL   5   8.608  -1.147  -2.844
   28   1HG1  VAL   5          1HG1      VAL   5  11.129   0.534  -2.414
   29   2HG1  VAL   5          2HG1      VAL   5  11.080  -1.202  -2.756
   30   3HG1  VAL   5          3HG1      VAL   5  10.547  -0.062  -3.988
   31   1HG2  VAL   5          1HG2      VAL   5   9.781   0.151  -0.340
   32   2HG2  VAL   5          2HG2      VAL   5   8.280  -0.793  -0.406
   33   3HG2  VAL   5          3HG2      VAL   5   9.834  -1.586  -0.718
   34    H    ARG   6           HN       ARG   6   8.946   3.288  -3.326
   35    HA   ARG   6           HA       ARG   6   8.772   4.512  -5.299
   36   1HB   ARG   6          HB1       ARG   6   9.834   1.965  -6.307
   37   2HB   ARG   6          HB2       ARG   6   9.479   3.177  -7.343
   38   1HG   ARG   6          HG1       ARG   6  11.778   3.108  -6.858
   39   2HG   ARG   6          HG2       ARG   6  11.112   4.527  -6.399
   40   1HD   ARG   6          HD1       ARG   6  11.490   2.561  -4.391
   41   2HD   ARG   6          HD2       ARG   6  12.809   3.362  -4.925
   42    HE   ARG   6           HE       ARG   6  11.492   5.459  -4.359
   43   1HH1  ARG   6          2HH2      ARG   6  11.409   2.537  -2.438
   44   2HH1  ARG   6          1HH2      ARG   6  10.767   3.361  -1.056
   45   1HH2  ARG   6          2HH1      ARG   6  10.534   6.428  -2.608
   46   2HH2  ARG   6          1HH1      ARG   6  10.279   5.527  -1.151
   47    H    GLY   7           HN       GLY   7   6.423   3.156  -4.198
   48   1HA   GLY   7          HA2       GLY   7   4.161   3.282  -4.784
   49   2HA   GLY   7          HA1       GLY   7   4.561   3.318  -6.490
   50    H    ARG   8           HN       ARG   8   6.327   0.662  -5.323
   51    HA   ARG   8           HA       ARG   8   4.224  -1.208  -6.217
   52   1HB   ARG   8          HB1       ARG   8   7.140  -1.392  -5.830
   53   2HB   ARG   8          HB2       ARG   8   6.240  -2.750  -5.944
   54   1HG   ARG   8          HG1       ARG   8   6.776  -2.601  -8.062
   55   2HG   ARG   8          HG2       ARG   8   5.485  -1.602  -8.109
   56   1HD   ARG   8          HD1       ARG   8   8.104  -0.522  -7.735
   57   2HD   ARG   8          HD2       ARG   8   7.576  -0.872  -9.240
   58    HE   ARG   8           HE       ARG   8   7.023   1.453  -7.819
   59   1HH1  ARG   8          2HH2      ARG   8   5.361  -0.648 -10.123
   60   2HH1  ARG   8          1HH2      ARG   8   4.381   0.667 -10.680
   61   1HH2  ARG   8          2HH1      ARG   8   5.771   3.008  -8.557
   62   2HH2  ARG   8          1HH1      ARG   8   4.611   2.705  -9.807
   63    H    CYS   9           HN       CYS   9   4.158  -3.320  -5.139
   64    HA   CYS   9           HA       CYS   9   4.357  -3.279  -2.192
   65   1HB   CYS   9          HB1       CYS   9   1.985  -3.716  -3.864
   66   2HB   CYS   9          HB2       CYS   9   2.129  -4.569  -2.479
   67    HA   PRO  10           HA       PRO  10   5.711  -7.511  -3.090
   68   1HB   PRO  10          HB1       PRO  10   5.518  -8.610  -0.694
   69   2HB   PRO  10          HB2       PRO  10   6.629  -7.440  -0.946
   70   1HG   PRO  10          HG1       PRO  10   4.028  -7.134   0.297
   71   2HG   PRO  10          HG2       PRO  10   5.448  -6.532   0.834
   72   1HD   PRO  10          HD1       PRO  10   3.802  -5.051  -0.588
   73   2HD   PRO  10          HD2       PRO  10   5.417  -4.812  -0.648
   74    H    SER  11           HN       SER  11   4.881  -9.823  -2.636
   75    HA   SER  11           HA       SER  11   2.978 -10.610  -4.143
   76   1HB   SER  11          HB1       SER  11   3.455 -11.857  -1.515
   77   2HB   SER  11          HB2       SER  11   2.904 -12.608  -2.857
   78    HG   SER  11           HG       SER  11   5.102 -12.953  -2.663
   79    H    GLY  12           HN       GLY  12   1.148  -9.376  -4.376
   80   1HA   GLY  12          HA2       GLY  12  -1.157  -9.297  -4.313
   81   2HA   GLY  12          HA1       GLY  12  -1.148 -10.404  -2.943
   82    H    MET  13           HN       MET  13   0.789  -7.695  -2.128
   83    HA   MET  13           HA       MET  13  -1.372  -6.562  -0.454
   84   1HB   MET  13          HB1       MET  13   1.489  -5.895  -0.717
   85   2HB   MET  13          HB2       MET  13   0.462  -5.069   0.248
   86   1HG   MET  13          HG1       MET  13  -0.035  -7.215   1.332
   87   2HG   MET  13          HG2       MET  13   1.251  -7.820   0.527
   88   1HE   MET  13          HE1       MET  13   2.388  -8.752   2.690
   89   2HE   MET  13          HE2       MET  13   2.627  -7.755   4.143
   90   3HE   MET  13          HE3       MET  13   0.981  -8.164   3.608
   91    H    CYS  14           HN       CYS  14  -1.489  -4.116  -0.350
   92    HA   CYS  14           HA       CYS  14  -1.902  -2.990  -3.092
   93   1HB   CYS  14          HB1       CYS  14  -3.796  -2.870  -0.838
   94   2HB   CYS  14          HB2       CYS  14  -4.056  -2.387  -2.376
   95    H    CYS  15           HN       CYS  15  -2.186  -0.616  -3.089
   96    HA   CYS  15           HA       CYS  15  -0.480   0.663  -1.010
   97   1HB   CYS  15          HB1       CYS  15   0.430   0.507  -3.238
   98   2HB   CYS  15          HB2       CYS  15  -0.814   1.371  -3.851
   99    H    SER  16           HN       SER  16  -1.425   2.018   0.310
  100    HA   SER  16           HA       SER  16  -4.081   3.133  -0.035
  101   1HB   SER  16          HB1       SER  16  -3.637   4.152   2.063
  102   2HB   SER  16          HB2       SER  16  -3.137   2.599   2.134
  103    HG   SER  16           HG       SER  16  -1.021   3.353   1.648
  104    H    GLN  17           HN       GLN  17  -4.584   5.393   0.202
  105    HA   GLN  17           HA       GLN  17  -3.471   7.152  -1.728
  106   1HB   GLN  17          HB1       GLN  17  -4.893   8.767  -0.639
  107   2HB   GLN  17          HB2       GLN  17  -5.693   7.365  -0.883
  108   1HG   GLN  17          HG1       GLN  17  -4.590   7.727   1.703
  109   2HG   GLN  17          HG2       GLN  17  -5.879   8.660   1.335
  110   1HE2  GLN  17          1HE2      GLN  17  -7.720   7.836   2.386
  111   2HE2  GLN  17          2HE2      GLN  17  -8.129   6.121   2.119
  112    H1   NAL  18           HD1      NAL  18  -3.082   6.049   4.275
  113    H3   NAL  18           HD2      NAL  18  -2.151  10.043   3.536
  114    H4   NAL  18           HE2      NAL  18  -4.389  10.690   4.123
  115    H5   NAL  18           HH2      NAL  18  -6.656  10.075   4.799
  116    H6   NAL  18           HP       NAL  18  -8.227   8.405   5.529
  117    H7   NAL  18           HH1      NAL  18  -7.555   6.103   5.663
  118    H8   NAL  18           HZ1      NAL  18  -5.326   5.452   5.035
  119   1H9   NAL  18          HB1       NAL  18  -0.897   6.522   3.510
  120   2H9   NAL  18          HB2       NAL  18  -0.296   8.121   3.942
  121    H10  NAL  18           HA       NAL  18  -0.841   8.990   1.738
  122   1HN   NAL  18          HN        NAL  18  -2.307   6.447   1.428
  123    H    GLY  19           HN       GLY  19  -0.275   6.397  -0.194
  124   1HA   GLY  19          HA2       GLY  19   1.669   5.672  -1.242
  125   2HA   GLY  19          HA1       GLY  19   2.612   6.829  -0.290
  126    H    TYR  20           HN       TYR  20   0.511   4.672   1.438
  127    HA   TYR  20           HA       TYR  20   2.848   3.036   2.305
  128   1HB   TYR  20          HB1       TYR  20   0.834   4.382   3.834
  129   2HB   TYR  20          HB2       TYR  20   1.048   2.826   4.282
  130    HD1  TYR  20           HD1      TYR  20   3.336   5.540   3.230
  131    HD2  TYR  20           HD2      TYR  20   2.347   2.597   6.231
  132    HE1  TYR  20           HE1      TYR  20   5.400   6.111   4.462
  133    HE2  TYR  20           HE2      TYR  20   4.422   3.198   7.484
  134    HH   TYR  20           HH       TYR  20   6.688   5.682   6.318
  135    H    CYS  21           HN       CYS  21   2.693   0.924   2.402
  136    HA   CYS  21           HA       CYS  21   0.555  -0.336   0.758
  137   1HB   CYS  21          HB1       CYS  21   2.665  -0.290  -0.294
  138   2HB   CYS  21          HB2       CYS  21   3.442  -0.867   1.022
  139    H    GLY  22           HN       GLY  22  -0.413  -2.157   1.417
  140   1HA   GLY  22          HA2       GLY  22   0.442  -3.964   3.475
  141   2HA   GLY  22          HA1       GLY  22  -0.701  -2.775   4.133
  142    H    LYS  23           HN       LYS  23  -2.115  -4.670   4.492
  143    HA   LYS  23           HA       LYS  23  -3.797  -5.162   2.104
  144   1HB   LYS  23          HB1       LYS  23  -2.301  -7.125   2.716
  145   2HB   LYS  23          HB2       LYS  23  -3.238  -7.324   4.038
  146   1HG   LYS  23          HG1       LYS  23  -4.148  -8.762   2.518
  147   2HG   LYS  23          HG2       LYS  23  -5.143  -7.469   2.460
  148   1HD   LYS  23          HD1       LYS  23  -3.929  -6.692   0.514
  149   2HD   LYS  23          HD2       LYS  23  -3.077  -8.085   0.538
  150   1HE   LYS  23          HE1       LYS  23  -4.989  -9.339   0.073
  151   2HE   LYS  23          HE2       LYS  23  -5.950  -8.034   0.273
  152   1HZ   LYS  23          HZ1       LYS  23  -5.095  -7.053  -1.662
  153   2HZ   LYS  23          HZ2       LYS  23  -3.978  -8.231  -1.809
  154   3HZ   LYS  23          HZ3       LYS  23  -5.576  -8.586  -2.051
  155    H    GLY  24           HN       GLY  24  -5.829  -4.623   2.473
  156   1HA   GLY  24          HA2       GLY  24  -7.649  -5.086   4.358
  157   2HA   GLY  24          HA1       GLY  24  -6.682  -3.862   5.193
  158    HA   PRO  25           HA       PRO  25 -10.289  -2.155   2.610
  159   1HB   PRO  25          HB1       PRO  25 -10.477  -0.539   5.068
  160   2HB   PRO  25          HB2       PRO  25 -11.680  -1.077   4.103
  161   1HG   PRO  25          HG1       PRO  25 -11.175  -2.392   6.270
  162   2HG   PRO  25          HG2       PRO  25 -11.513  -3.240   4.916
  163   1HD   PRO  25          HD1       PRO  25  -8.927  -2.744   6.076
  164   2HD   PRO  25          HD2       PRO  25  -9.442  -4.111   5.345
  165    H    LYS  26           HN       LYS  26  -8.173  -0.101   4.618
  166    HA   LYS  26           HA       LYS  26  -8.193   2.120   2.727
  167   1HB   LYS  26          HB1       LYS  26  -6.953   1.555   5.292
  168   2HB   LYS  26          HB2       LYS  26  -6.163   2.639   4.360
  169   1HG   LYS  26          HG1       LYS  26  -7.686   3.736   5.808
  170   2HG   LYS  26          HG2       LYS  26  -8.087   3.988   4.245
  171   1HD   LYS  26          HD1       LYS  26  -9.806   2.305   4.480
  172   2HD   LYS  26          HD2       LYS  26  -9.460   2.234   6.074
  173   1HE   LYS  26          HE1       LYS  26 -11.260   3.649   5.956
  174   2HE   LYS  26          HE2       LYS  26  -9.981   4.648   6.141
  175   1HZ   LYS  26          HZ1       LYS  26 -11.436   5.456   4.402
  176   2HZ   LYS  26          HZ2       LYS  26  -9.973   5.015   3.736
  177   3HZ   LYS  26          HZ3       LYS  26 -11.162   4.045   3.561
  178    H    TYR  27           HN       TYR  27  -6.531  -0.778   2.499
  179    HA   TYR  27           HA       TYR  27  -4.297   0.441   0.933
  180   1HB   TYR  27          HB1       TYR  27  -4.641  -2.301   1.974
  181   2HB   TYR  27          HB2       TYR  27  -3.356  -1.775   1.113
  182    HD1  TYR  27           HD1      TYR  27  -4.711  -2.173   4.359
  183    HD2  TYR  27           HD2      TYR  27  -1.922   0.142   2.021
  184    HE1  TYR  27           HE1      TYR  27  -3.596  -1.394   6.448
  185    HE2  TYR  27           HE2      TYR  27  -0.826   0.933   4.105
  186    HH   TYR  27           HH       TYR  27  -0.834   0.851   6.406
  187    H    CYS  28           HN       CYS  28  -6.775  -2.194   0.677
  188    HA   CYS  28           HA       CYS  28  -6.363  -2.283  -2.247
  189   1HB   CYS  28          HB1       CYS  28  -7.978  -3.968  -0.454
  190   2HB   CYS  28          HB2       CYS  28  -7.623  -4.283  -2.017
  191    H    GLY  29           HN       GLY  29  -8.745  -1.028   0.017
  192   1HA   GLY  29          HA2       GLY  29 -10.404  -0.045  -2.251
  193   2HA   GLY  29          HA1       GLY  29 -10.890  -0.071  -0.539
  194    H    ARG  30           HN       ARG  30 -10.864   2.116   0.166
  195    HA   ARG  30           HA       ARG  30  -8.352   3.567   0.132
  196   1HB   ARG  30          HB1       ARG  30 -10.020   4.152  -1.878
  197   2HB   ARG  30          HB2       ARG  30 -10.685   5.108  -0.733
  198   1HG   ARG  30          HG1       ARG  30  -9.237   6.560  -1.571
  199   2HG   ARG  30          HG2       ARG  30  -8.272   5.873  -0.446
  200   1HD   ARG  30          HD1       ARG  30  -8.213   5.388  -3.283
  201   2HD   ARG  30          HD2       ARG  30  -7.012   6.024  -2.377
  202    HE   ARG  30           HE       ARG  30  -7.820   3.288  -1.893
  203   1HH1  ARG  30          2HH2      ARG  30  -5.071   5.233  -3.044
  204   2HH1  ARG  30          1HH2      ARG  30  -4.054   3.833  -2.956
  205   1HH2  ARG  30          2HH1      ARG  30  -6.465   1.708  -1.828
  206   2HH2  ARG  30          1HH1      ARG  30  -4.812   1.921  -2.297
  Start of MODEL    2
    1   1H    VAL   1           H1       VAL   1   7.510  -1.794   1.064
    2   2H    VAL   1           H2       VAL   1   8.042  -0.593   2.075
    3   3H    VAL   1           H3       VAL   1   6.847  -0.279   1.068
    4    HA   VAL   1           HA       VAL   1   5.309  -1.667   2.064
    5    HB   VAL   1           HB       VAL   1   6.761  -3.485   2.621
    6   1HG1  VAL   1          1HG1      VAL   1   8.040  -3.670   4.620
    7   2HG1  VAL   1          2HG1      VAL   1   8.623  -2.233   3.776
    8   3HG1  VAL   1          3HG1      VAL   1   7.553  -2.080   5.197
    9   1HG2  VAL   1          1HG2      VAL   1   5.547  -4.210   4.615
   10   2HG2  VAL   1          2HG2      VAL   1   5.063  -2.542   4.970
   11   3HG2  VAL   1          3HG2      VAL   1   4.466  -3.352   3.509
   12    H    GLY   2           HN       GLY   2   7.579  -0.164   4.396
   13   1HA   GLY   2          HA2       GLY   2   5.509   1.432   5.678
   14   2HA   GLY   2          HA1       GLY   2   7.253   1.519   5.948
   15    H    GLU   3           HN       GLU   3   5.526   1.818   2.979
   16    HA   GLU   3           HA       GLU   3   5.493   4.262   1.905
   17   1HB   GLU   3          HB1       GLU   3   7.707   4.338   0.814
   18   2HB   GLU   3          HB2       GLU   3   7.639   4.843   2.365
   19   1HG   GLU   3          HG1       GLU   3   9.668   3.796   2.012
   20   2HG   GLU   3          HG2       GLU   3   8.786   2.883   3.039
   21    H    CYS   4           HN       CYS   4   4.747   3.916  -0.215
   22    HA   CYS   4           HA       CYS   4   4.733   1.213  -1.299
   23   1HB   CYS   4          HB1       CYS   4   4.010   3.747  -2.598
   24   2HB   CYS   4          HB2       CYS   4   3.751   2.260  -3.223
   25    H    VAL   5           HN       VAL   5   6.222   0.234  -2.364
   26    HA   VAL   5           HA       VAL   5   8.934   1.124  -2.394
   27    HB   VAL   5           HB       VAL   5   7.747  -1.369  -3.674
   28   1HG1  VAL   5          1HG1      VAL   5  10.073  -0.892  -4.407
   29   2HG1  VAL   5          2HG1      VAL   5  10.575  -0.709  -2.709
   30   3HG1  VAL   5          3HG1      VAL   5  10.027  -2.282  -3.325
   31   1HG2  VAL   5          1HG2      VAL   5   8.446  -2.481  -1.547
   32   2HG2  VAL   5          2HG2      VAL   5   8.793  -0.876  -0.856
   33   3HG2  VAL   5          3HG2      VAL   5   7.129  -1.326  -1.317
   34    H    ARG   6           HN       ARG   6   8.922   2.903  -3.591
   35    HA   ARG   6           HA       ARG   6   8.687   4.429  -5.259
   36   1HB   ARG   6          HB1       ARG   6   9.798   2.507  -7.166
   37   2HB   ARG   6          HB2       ARG   6  10.016   4.124  -7.093
   38   1HG   ARG   6          HG1       ARG   6  11.272   2.145  -5.436
   39   2HG   ARG   6          HG2       ARG   6  12.013   3.151  -6.487
   40   1HD   ARG   6          HD1       ARG   6  12.340   4.651  -4.932
   41   2HD   ARG   6          HD2       ARG   6  10.776   4.597  -4.464
   42    HE   ARG   6           HE       ARG   6  12.860   2.826  -3.474
   43   1HH1  ARG   6          2HH2      ARG   6   9.759   4.374  -2.711
   44   2HH1  ARG   6          1HH2      ARG   6   9.578   3.407  -1.286
   45   1HH2  ARG   6          2HH1      ARG   6  12.385   1.564  -1.680
   46   2HH2  ARG   6          1HH1      ARG   6  10.974   1.913  -0.740
   47    H    GLY   7           HN       GLY   7   6.436   3.253  -4.598
   48   1HA   GLY   7          HA2       GLY   7   4.218   3.529  -5.374
   49   2HA   GLY   7          HA1       GLY   7   4.749   3.377  -7.038
   50    H    ARG   8           HN       ARG   8   6.225   0.676  -5.846
   51    HA   ARG   8           HA       ARG   8   3.909  -1.095  -6.369
   52   1HB   ARG   8          HB1       ARG   8   6.817  -1.543  -6.036
   53   2HB   ARG   8          HB2       ARG   8   5.744  -2.767  -6.166
   54   1HG   ARG   8          HG1       ARG   8   6.292  -2.705  -8.279
   55   2HG   ARG   8          HG2       ARG   8   5.199  -1.493  -8.342
   56   1HD   ARG   8          HD1       ARG   8   7.936  -0.841  -7.882
   57   2HD   ARG   8          HD2       ARG   8   7.456  -1.179  -9.406
   58    HE   ARG   8           HE       ARG   8   7.154   1.263  -8.094
   59   1HH1  ARG   8          2HH2      ARG   8   5.418  -0.687 -10.478
   60   2HH1  ARG   8          1HH2      ARG   8   4.680   0.721 -11.165
   61   1HH2  ARG   8          2HH1      ARG   8   6.181   2.952  -9.011
   62   2HH2  ARG   8          1HH1      ARG   8   5.104   2.740 -10.351
   63    H    CYS   9           HN       CYS   9   3.950  -3.148  -4.876
   64    HA   CYS   9           HA       CYS   9   4.702  -2.589  -2.123
   65   1HB   CYS   9          HB1       CYS   9   1.925  -3.053  -2.992
   66   2HB   CYS   9          HB2       CYS   9   2.406  -3.483  -1.492
   67    HA   PRO  10           HA       PRO  10   5.821  -6.887  -2.019
   68   1HB   PRO  10          HB1       PRO  10   4.204  -7.172   0.422
   69   2HB   PRO  10          HB2       PRO  10   5.756  -7.609   0.165
   70   1HG   PRO  10          HG1       PRO  10   5.271  -5.443   1.501
   71   2HG   PRO  10          HG2       PRO  10   6.529  -5.460   0.460
   72   1HD   PRO  10          HD1       PRO  10   3.922  -4.317   0.043
   73   2HD   PRO  10          HD2       PRO  10   5.359  -3.722  -0.455
   74    H    SER  11           HN       SER  11   4.992  -9.163  -1.949
   75    HA   SER  11           HA       SER  11   3.215  -9.809  -3.809
   76   1HB   SER  11          HB1       SER  11   3.759 -11.430  -1.403
   77   2HB   SER  11          HB2       SER  11   3.300 -11.992  -2.866
   78    HG   SER  11           HG       SER  11   5.509 -12.198  -2.662
   79    H    GLY  12           HN       GLY  12   1.223  -8.899  -3.956
   80   1HA   GLY  12          HA2       GLY  12  -1.098  -9.080  -3.808
   81   2HA   GLY  12          HA1       GLY  12  -0.939 -10.092  -2.374
   82    H    MET  13           HN       MET  13   0.926  -7.360  -1.781
   83    HA   MET  13           HA       MET  13  -1.203  -5.979  -0.250
   84   1HB   MET  13          HB1       MET  13   1.685  -5.409  -0.491
   85   2HB   MET  13          HB2       MET  13   0.638  -4.576   0.445
   86   1HG   MET  13          HG1       MET  13   0.264  -6.619   1.690
   87   2HG   MET  13          HG2       MET  13   1.496  -7.284   0.850
   88   1HE   MET  13          HE1       MET  13   3.128  -6.926   4.346
   89   2HE   MET  13          HE2       MET  13   1.456  -7.392   3.961
   90   3HE   MET  13          HE3       MET  13   2.806  -8.036   2.995
   91    H    CYS  14           HN       CYS  14  -1.409  -3.702  -0.488
   92    HA   CYS  14           HA       CYS  14  -1.089  -2.647  -3.272
   93   1HB   CYS  14          HB1       CYS  14  -3.565  -2.750  -1.656
   94   2HB   CYS  14          HB2       CYS  14  -3.426  -2.070  -3.135
   95    H    CYS  15           HN       CYS  15  -1.392  -0.347  -3.454
   96    HA   CYS  15           HA       CYS  15  -0.075   1.032  -1.235
   97   1HB   CYS  15          HB1       CYS  15   0.659   1.136  -3.581
   98   2HB   CYS  15          HB2       CYS  15  -0.682   1.986  -3.963
   99    H    SER  16           HN       SER  16  -1.230   2.040   0.265
  100    HA   SER  16           HA       SER  16  -4.016   2.789  -0.022
  101   1HB   SER  16          HB1       SER  16  -2.721   2.194   2.080
  102   2HB   SER  16          HB2       SER  16  -2.198   3.742   2.099
  103    HG   SER  16           HG       SER  16  -4.835   2.874   2.117
  104    H    GLN  17           HN       GLN  17  -4.751   5.003   0.683
  105    HA   GLN  17           HA       GLN  17  -4.124   6.900  -1.333
  106   1HB   GLN  17          HB1       GLN  17  -5.834   8.131  -0.283
  107   2HB   GLN  17          HB2       GLN  17  -6.264   6.557  -0.198
  108   1HG   GLN  17          HG1       GLN  17  -5.058   6.940   2.127
  109   2HG   GLN  17          HG2       GLN  17  -5.837   8.358   1.900
  110   1HE2  GLN  17          1HE2      GLN  17  -8.220   8.428   1.819
  111   2HE2  GLN  17          2HE2      GLN  17  -9.052   6.991   2.426
  112    H1   NAL  18           HD1      NAL  18  -3.273   6.882   4.599
  113    H3   NAL  18           HD2      NAL  18  -2.399  10.623   2.992
  114    H4   NAL  18           HE2      NAL  18  -4.598  11.405   3.575
  115    H5   NAL  18           HH2      NAL  18  -6.837  10.942   4.471
  116    H6   NAL  18           HP       NAL  18  -8.392   9.422   5.495
  117    H7   NAL  18           HH1      NAL  18  -7.716   7.171   6.009
  118    H8   NAL  18           HZ1      NAL  18  -5.483   6.437   5.494
  119   1H9   NAL  18          HB1       NAL  18  -1.126   7.181   3.713
  120   2H9   NAL  18          HB2       NAL  18  -0.534   8.839   3.696
  121    H10  NAL  18           HA       NAL  18  -1.136   9.110   1.373
  122   1HN   NAL  18          HN        NAL  18  -2.322   6.363   1.397
  123    H    GLY  19           HN       GLY  19  -0.548   6.267  -0.033
  124   1HA   GLY  19          HA2       GLY  19   1.400   5.610  -1.079
  125   2HA   GLY  19          HA1       GLY  19   2.293   6.844  -0.196
  126    H    TYR  20           HN       TYR  20   0.401   4.238   1.299
  127    HA   TYR  20           HA       TYR  20   2.890   2.913   2.313
  128   1HB   TYR  20          HB1       TYR  20   0.561   3.916   3.754
  129   2HB   TYR  20          HB2       TYR  20   1.172   2.489   4.259
  130    HD1  TYR  20           HD1      TYR  20   2.301   5.914   3.407
  131    HD2  TYR  20           HD2      TYR  20   2.856   2.409   5.881
  132    HE1  TYR  20           HE1      TYR  20   4.303   6.955   4.445
  133    HE2  TYR  20           HE2      TYR  20   4.824   3.501   6.953
  134    HH   TYR  20           HH       TYR  20   6.547   5.122   5.783
  135    H    CYS  21           HN       CYS  21   2.794   0.612   2.624
  136    HA   CYS  21           HA       CYS  21   0.828  -0.661   0.822
  137   1HB   CYS  21          HB1       CYS  21   3.308  -1.649   2.063
  138   2HB   CYS  21          HB2       CYS  21   2.368  -2.528   1.059
  139    H    GLY  22           HN       GLY  22  -0.468  -2.381   1.332
  140   1HA   GLY  22          HA2       GLY  22  -0.361  -4.045   3.618
  141   2HA   GLY  22          HA1       GLY  22  -1.477  -2.715   3.970
  142    H    LYS  23           HN       LYS  23  -3.074  -4.496   4.104
  143    HA   LYS  23           HA       LYS  23  -4.394  -5.004   1.499
  144   1HB   LYS  23          HB1       LYS  23  -3.782  -7.096   3.509
  145   2HB   LYS  23          HB2       LYS  23  -4.913  -7.285   2.345
  146   1HG   LYS  23          HG1       LYS  23  -3.084  -6.757   0.747
  147   2HG   LYS  23          HG2       LYS  23  -2.073  -7.055   1.995
  148   1HD   LYS  23          HD1       LYS  23  -2.207  -8.981   0.694
  149   2HD   LYS  23          HD2       LYS  23  -2.936  -9.279   2.125
  150   1HE   LYS  23          HE1       LYS  23  -4.091 -10.163   0.160
  151   2HE   LYS  23          HE2       LYS  23  -5.020  -9.283   1.175
  152   1HZ   LYS  23          HZ1       LYS  23  -5.218  -8.848  -1.266
  153   2HZ   LYS  23          HZ2       LYS  23  -5.226  -7.583  -0.241
  154   3HZ   LYS  23          HZ3       LYS  23  -3.811  -7.997  -1.069
  155    H    GLY  24           HN       GLY  24  -6.642  -5.768   1.806
  156   1HA   GLY  24          HA2       GLY  24  -8.728  -5.701   2.901
  157   2HA   GLY  24          HA1       GLY  24  -7.972  -5.007   4.336
  158    HA   PRO  25           HA       PRO  25 -10.820  -2.037   2.007
  159   1HB   PRO  25          HB1       PRO  25 -11.185  -1.203   4.806
  160   2HB   PRO  25          HB2       PRO  25 -12.283  -1.234   3.596
  161   1HG   PRO  25          HG1       PRO  25 -12.272  -3.203   5.263
  162   2HG   PRO  25          HG2       PRO  25 -12.470  -3.546   3.679
  163   1HD   PRO  25          HD1       PRO  25 -10.073  -3.813   5.244
  164   2HD   PRO  25          HD2       PRO  25 -10.597  -4.800   4.054
  165    H    LYS  26           HN       LYS  26  -8.421  -1.200   4.468
  166    HA   LYS  26           HA       LYS  26  -8.150   1.562   3.635
  167   1HB   LYS  26          HB1       LYS  26  -6.729  -0.238   5.475
  168   2HB   LYS  26          HB2       LYS  26  -5.992   1.157   5.055
  169   1HG   LYS  26          HG1       LYS  26  -8.584   1.015   6.294
  170   2HG   LYS  26          HG2       LYS  26  -7.206   1.353   7.103
  171   1HD   LYS  26          HD1       LYS  26  -8.478   3.059   5.166
  172   2HD   LYS  26          HD2       LYS  26  -8.384   3.340   6.772
  173   1HE   LYS  26          HE1       LYS  26  -6.745   4.682   6.095
  174   2HE   LYS  26          HE2       LYS  26  -5.877   3.313   6.291
  175   1HZ   LYS  26          HZ1       LYS  26  -6.801   4.428   3.789
  176   2HZ   LYS  26          HZ2       LYS  26  -5.258   4.138   4.212
  177   3HZ   LYS  26          HZ3       LYS  26  -6.237   2.886   3.898
  178    H    TYR  27           HN       TYR  27  -7.045  -1.194   2.048
  179    HA   TYR  27           HA       TYR  27  -4.868   0.342   0.659
  180   1HB   TYR  27          HB1       TYR  27  -4.672  -2.404   1.720
  181   2HB   TYR  27          HB2       TYR  27  -3.530  -1.651   0.827
  182    HD1  TYR  27           HD1      TYR  27  -1.992  -0.015   1.728
  183    HD2  TYR  27           HD2      TYR  27  -5.042  -1.906   4.110
  184    HE1  TYR  27           HE1      TYR  27  -0.912   0.843   3.811
  185    HE2  TYR  27           HE2      TYR  27  -3.945  -1.089   6.179
  186    HH   TYR  27           HH       TYR  27  -2.108   0.031   7.053
  187    H    CYS  28           HN       CYS  28  -6.922  -2.607   0.510
  188    HA   CYS  28           HA       CYS  28  -6.980  -2.364  -2.456
  189   1HB   CYS  28          HB1       CYS  28  -5.289  -4.068  -1.213
  190   2HB   CYS  28          HB2       CYS  28  -6.546  -5.047  -1.572
  191    H    GLY  29           HN       GLY  29  -8.913  -2.642   0.202
  192   1HA   GLY  29          HA2       GLY  29 -11.171  -3.344   0.420
  193   2HA   GLY  29          HA1       GLY  29 -11.087  -4.129  -1.150
  194    H    ARG  30           HN       ARG  30  -8.899  -5.777  -0.876
  195    HA   ARG  30           HA       ARG  30  -9.492  -7.589   1.417
  196   1HB   ARG  30          HB1       ARG  30  -9.817  -8.068  -1.384
  197   2HB   ARG  30          HB2       ARG  30  -8.837  -9.190  -0.714
  198   1HG   ARG  30          HG1       ARG  30 -11.312  -8.621   0.591
  199   2HG   ARG  30          HG2       ARG  30 -11.350  -9.565  -0.741
  200   1HD   ARG  30          HD1       ARG  30 -11.258 -10.736   1.441
  201   2HD   ARG  30          HD2       ARG  30 -10.222 -11.260   0.293
  202    HE   ARG  30           HE       ARG  30  -8.562  -9.672   1.415
  203   1HH1  ARG  30          2HH1      ARG  30 -10.784 -11.601   3.375
  204   2HH1  ARG  30          1HH1      ARG  30  -9.758 -11.396   4.755
  205   1HH2  ARG  30          2HH2      ARG  30  -7.426  -9.450   3.059
  206   2HH2  ARG  30          1HH2      ARG  30  -7.850 -10.173   4.575
  Start of MODEL    3
    1   1H    VAL   1           H1       VAL   1   5.597   3.860   8.073
    2   2H    VAL   1           H2       VAL   1   6.934   3.949   7.141
    3   3H    VAL   1           H3       VAL   1   7.099   3.855   8.778
    4    HA   VAL   1           HA       VAL   1   7.612   1.778   7.622
    5    HB   VAL   1           HB       VAL   1   6.934   1.703   9.944
    6   1HG1  VAL   1          1HG1      VAL   1   4.050   1.269   9.052
    7   2HG1  VAL   1          2HG1      VAL   1   4.683   1.207  10.701
    8   3HG1  VAL   1          3HG1      VAL   1   4.669   2.744   9.830
    9   1HG2  VAL   1          1HG2      VAL   1   7.395  -0.399   8.713
   10   2HG2  VAL   1          2HG2      VAL   1   6.255  -0.626  10.047
   11   3HG2  VAL   1          3HG2      VAL   1   5.653  -0.578   8.382
   12    H    GLY   2           HN       GLY   2   7.234   0.630   5.809
   13   1HA   GLY   2          HA2       GLY   2   5.942  -0.531   4.228
   14   2HA   GLY   2          HA1       GLY   2   4.471   0.196   4.865
   15    H    GLU   3           HN       GLU   3   6.841   2.617   4.267
   16    HA   GLU   3           HA       GLU   3   5.601   4.027   2.240
   17   1HB   GLU   3          HB1       GLU   3   8.447   3.779   2.967
   18   2HB   GLU   3          HB2       GLU   3   7.922   4.852   1.854
   19   1HG   GLU   3          HG1       GLU   3   8.163   6.046   3.780
   20   2HG   GLU   3          HG2       GLU   3   6.553   5.841   3.595
   21    H    CYS   4           HN       CYS   4   4.934   3.255   0.313
   22    HA   CYS   4           HA       CYS   4   5.519   0.821  -0.723
   23   1HB   CYS   4          HB1       CYS   4   4.743   3.151  -2.361
   24   2HB   CYS   4          HB2       CYS   4   4.508   1.585  -2.760
   25    H    VAL   5           HN       VAL   5   6.511  -0.043  -2.603
   26    HA   VAL   5           HA       VAL   5   9.227   0.913  -3.161
   27    HB   VAL   5           HB       VAL   5   7.746  -1.443  -4.379
   28   1HG1  VAL   5          1HG1      VAL   5  10.709  -0.684  -4.270
   29   2HG1  VAL   5          2HG1      VAL   5  10.058  -2.203  -4.922
   30   3HG1  VAL   5          3HG1      VAL   5   9.698  -0.675  -5.728
   31   1HG2  VAL   5          1HG2      VAL   5   9.665  -1.305  -2.015
   32   2HG2  VAL   5          2HG2      VAL   5   7.948  -1.768  -1.959
   33   3HG2  VAL   5          3HG2      VAL   5   9.106  -2.799  -2.801
   34    H    ARG   6           HN       ARG   6   8.369   2.824  -3.697
   35    HA   ARG   6           HA       ARG   6   7.479   4.598  -4.819
   36   1HB   ARG   6          HB1       ARG   6   9.261   3.606  -6.931
   37   2HB   ARG   6          HB2       ARG   6   8.848   5.157  -6.630
   38   1HG   ARG   6          HG1       ARG   6  10.572   3.511  -5.016
   39   2HG   ARG   6          HG2       ARG   6  11.018   4.837  -5.857
   40   1HD   ARG   6          HD1       ARG   6  10.959   5.793  -3.882
   41   2HD   ARG   6          HD2       ARG   6   9.364   5.934  -4.206
   42    HE   ARG   6           HE       ARG   6   8.823   4.289  -2.619
   43   1HH1  ARG   6          2HH2      ARG   6  12.295   4.885  -2.608
   44   2HH1  ARG   6          1HH2      ARG   6  12.471   4.050  -1.101
   45   1HH2  ARG   6          2HH1      ARG   6   9.147   3.207  -0.802
   46   2HH2  ARG   6          1HH1      ARG   6  10.728   3.121  -0.101
   47    H    GLY   7           HN       GLY   7   5.582   2.970  -4.724
   48   1HA   GLY   7          HA2       GLY   7   3.401   3.306  -5.830
   49   2HA   GLY   7          HA1       GLY   7   4.169   2.910  -7.363
   50    H    ARG   8           HN       ARG   8   5.694   0.620  -5.731
   51    HA   ARG   8           HA       ARG   8   3.532  -1.388  -6.096
   52   1HB   ARG   8          HB1       ARG   8   6.489  -1.571  -6.258
   53   2HB   ARG   8          HB2       ARG   8   5.462  -2.813  -6.524
   54   1HG   ARG   8          HG1       ARG   8   4.869  -2.058  -8.549
   55   2HG   ARG   8          HG2       ARG   8   5.168  -0.499  -8.162
   56   1HD   ARG   8          HD1       ARG   8   7.593  -1.324  -8.104
   57   2HD   ARG   8          HD2       ARG   8   7.009  -2.459  -9.123
   58    HE   ARG   8           HE       ARG   8   6.874  -0.950 -10.823
   59   1HH1  ARG   8          2HH2      ARG   8   7.331   0.794  -7.789
   60   2HH1  ARG   8          1HH2      ARG   8   7.353   2.333  -8.584
   61   1HH2  ARG   8          2HH1      ARG   8   6.849   1.107 -11.742
   62   2HH2  ARG   8          1HH1      ARG   8   7.089   2.504 -10.747
   63    H    CYS   9           HN       CYS   9   3.814  -3.435  -4.788
   64    HA   CYS   9           HA       CYS   9   4.810  -3.047  -2.055
   65   1HB   CYS   9          HB1       CYS   9   1.982  -3.474  -2.833
   66   2HB   CYS   9          HB2       CYS   9   2.531  -3.762  -1.321
   67    HA   PRO  10           HA       PRO  10   5.572  -7.451  -2.050
   68   1HB   PRO  10          HB1       PRO  10   3.790  -7.651   0.293
   69   2HB   PRO  10          HB2       PRO  10   5.282  -8.282   0.087
   70   1HG   PRO  10          HG1       PRO  10   5.046  -6.127   1.494
   71   2HG   PRO  10          HG2       PRO  10   6.317  -6.251   0.476
   72   1HD   PRO  10          HD1       PRO  10   3.867  -4.797   0.056
   73   2HD   PRO  10          HD2       PRO  10   5.376  -4.346  -0.377
   74    H    SER  11           HN       SER  11   4.664  -9.505  -2.543
   75    HA   SER  11           HA       SER  11   2.623  -9.650  -4.319
   76   1HB   SER  11          HB1       SER  11   3.601 -11.850  -2.607
   77   2HB   SER  11          HB2       SER  11   2.878 -12.011  -4.062
   78    HG   SER  11           HG       SER  11   5.091 -12.144  -4.314
   79    H    GLY  12           HN       GLY  12   0.667  -8.776  -3.792
   80   1HA   GLY  12          HA2       GLY  12  -1.624  -9.492  -3.374
   81   2HA   GLY  12          HA1       GLY  12  -1.084 -10.347  -1.935
   82    H    MET  13           HN       MET  13   0.584  -7.461  -1.829
   83    HA   MET  13           HA       MET  13  -1.511  -6.040  -0.242
   84   1HB   MET  13          HB1       MET  13   1.422  -5.674  -0.435
   85   2HB   MET  13          HB2       MET  13   0.435  -4.660   0.380
   86   1HG   MET  13          HG1       MET  13  -0.211  -6.513   1.780
   87   2HG   MET  13          HG2       MET  13   0.922  -7.419   1.030
   88   1HE   MET  13          HE1       MET  13   1.940  -8.152   3.366
   89   2HE   MET  13          HE2       MET  13   2.427  -6.963   4.597
   90   3HE   MET  13          HE3       MET  13   0.710  -7.144   4.167
   91    H    CYS  14           HN       CYS  14  -1.486  -3.689  -0.496
   92    HA   CYS  14           HA       CYS  14  -1.226  -2.779  -3.346
   93   1HB   CYS  14          HB1       CYS  14  -3.507  -2.296  -1.531
   94   2HB   CYS  14          HB2       CYS  14  -3.382  -1.801  -3.083
   95    H    CYS  15           HN       CYS  15  -0.694  -0.619  -3.653
   96    HA   CYS  15           HA       CYS  15   0.412   0.823  -1.349
   97   1HB   CYS  15          HB1       CYS  15   1.548   0.723  -3.524
   98   2HB   CYS  15          HB2       CYS  15   0.363   1.630  -4.188
   99    H    SER  16           HN       SER  16  -0.951   1.913  -0.119
  100    HA   SER  16           HA       SER  16  -3.525   2.936  -1.015
  101   1HB   SER  16          HB1       SER  16  -3.631   3.810   1.216
  102   2HB   SER  16          HB2       SER  16  -3.120   2.259   1.271
  103    HG   SER  16           HG       SER  16  -1.043   2.886   1.632
  104    H    GLN  17           HN       GLN  17  -4.215   5.180  -0.768
  105    HA   GLN  17           HA       GLN  17  -2.774   7.088  -2.224
  106   1HB   GLN  17          HB1       GLN  17  -4.512   8.531  -1.515
  107   2HB   GLN  17          HB2       GLN  17  -5.168   7.058  -1.776
  108   1HG   GLN  17          HG1       GLN  17  -5.037   6.734   0.673
  109   2HG   GLN  17          HG2       GLN  17  -4.751   8.339   0.768
  110   1HE2  GLN  17          1HE2      GLN  17  -7.140   6.540   1.675
  111   2HE2  GLN  17          2HE2      GLN  17  -8.451   7.405   0.857
  112    H1   NAL  18           HD1      NAL  18  -3.187   5.227   3.106
  113    H3   NAL  18           HD2      NAL  18  -2.602   9.186   4.250
  114    H4   NAL  18           HE2      NAL  18  -4.945   9.397   4.752
  115    H5   NAL  18           HH2      NAL  18  -7.199   8.417   4.799
  116    H6   NAL  18           HP       NAL  18  -8.672   6.567   4.352
  117    H7   NAL  18           HH1      NAL  18  -7.790   4.520   3.446
  118    H8   NAL  18           HZ1      NAL  18  -5.428   4.296   3.054
  119   1H9   NAL  18          HB1       NAL  18  -0.943   6.025   3.255
  120   2H9   NAL  18          HB2       NAL  18  -0.623   7.594   3.985
  121    H10  NAL  18           HA       NAL  18  -0.987   8.738   1.892
  122   1HN   NAL  18          HN        NAL  18  -2.272   6.229   1.067
  123    H    GLY  19           HN       GLY  19  -0.012   6.338  -0.235
  124   1HA   GLY  19          HA2       GLY  19   2.070   5.846  -1.126
  125   2HA   GLY  19          HA1       GLY  19   2.843   6.920   0.047
  126    H    TYR  20           HN       TYR  20   0.659   4.535   1.287
  127    HA   TYR  20           HA       TYR  20   2.935   2.984   2.480
  128   1HB   TYR  20          HB1       TYR  20   0.423   4.009   3.560
  129   2HB   TYR  20          HB2       TYR  20   0.986   2.595   4.152
  130    HD1  TYR  20           HD1      TYR  20   3.108   5.493   3.246
  131    HD2  TYR  20           HD2      TYR  20   1.311   3.171   6.421
  132    HE1  TYR  20           HE1      TYR  20   4.657   6.504   4.868
  133    HE2  TYR  20           HE2      TYR  20   2.853   4.239   8.052
  134    HH   TYR  20           HH       TYR  20   5.553   6.298   6.825
  135    H    CYS  21           HN       CYS  21   3.012   0.866   2.097
  136    HA   CYS  21           HA       CYS  21   1.000  -0.581   0.595
  137   1HB   CYS  21          HB1       CYS  21   3.440  -1.397   2.046
  138   2HB   CYS  21          HB2       CYS  21   2.508  -2.450   1.214
  139    H    GLY  22           HN       GLY  22  -0.319  -2.266   1.274
  140   1HA   GLY  22          HA2       GLY  22  -0.239  -3.628   3.729
  141   2HA   GLY  22          HA1       GLY  22  -1.386  -2.292   3.926
  142    H    LYS  23           HN       LYS  23  -2.894  -4.134   4.257
  143    HA   LYS  23           HA       LYS  23  -4.242  -4.824   1.733
  144   1HB   LYS  23          HB1       LYS  23  -2.809  -6.745   3.006
  145   2HB   LYS  23          HB2       LYS  23  -4.286  -6.979   3.665
  146   1HG   LYS  23          HG1       LYS  23  -5.133  -6.901   1.327
  147   2HG   LYS  23          HG2       LYS  23  -3.576  -7.122   0.885
  148   1HD   LYS  23          HD1       LYS  23  -3.540  -9.216   1.985
  149   2HD   LYS  23          HD2       LYS  23  -5.074  -8.990   2.496
  150   1HE   LYS  23          HE1       LYS  23  -4.347  -9.153  -0.292
  151   2HE   LYS  23          HE2       LYS  23  -4.940 -10.421   0.549
  152   1HZ   LYS  23          HZ1       LYS  23  -7.014  -9.251   0.872
  153   2HZ   LYS  23          HZ2       LYS  23  -6.436  -7.965   0.202
  154   3HZ   LYS  23          HZ3       LYS  23  -6.651  -9.312  -0.747
  155    H    GLY  24           HN       GLY  24  -6.587  -5.671   2.222
  156   1HA   GLY  24          HA2       GLY  24  -8.572  -5.370   3.359
  157   2HA   GLY  24          HA1       GLY  24  -7.705  -4.700   4.742
  158    HA   PRO  25           HA       PRO  25 -10.684  -1.799   2.586
  159   1HB   PRO  25          HB1       PRO  25 -10.491  -0.630   5.285
  160   2HB   PRO  25          HB2       PRO  25 -11.786  -0.691   4.291
  161   1HG   PRO  25          HG1       PRO  25 -11.574  -2.505   6.119
  162   2HG   PRO  25          HG2       PRO  25 -12.081  -2.966   4.636
  163   1HD   PRO  25          HD1       PRO  25  -9.478  -3.315   5.786
  164   2HD   PRO  25          HD2       PRO  25 -10.248  -4.309   4.742
  165    H    LYS  26           HN       LYS  26  -8.036  -0.521   4.599
  166    HA   LYS  26           HA       LYS  26  -7.936   2.051   3.270
  167   1HB   LYS  26          HB1       LYS  26  -6.175   0.660   5.188
  168   2HB   LYS  26          HB2       LYS  26  -5.759   2.112   4.568
  169   1HG   LYS  26          HG1       LYS  26  -7.747   3.062   5.485
  170   2HG   LYS  26          HG2       LYS  26  -8.136   1.611   6.127
  171   1HD   LYS  26          HD1       LYS  26  -7.211   2.941   7.815
  172   2HD   LYS  26          HD2       LYS  26  -6.180   1.715   7.495
  173   1HE   LYS  26          HE1       LYS  26  -4.909   3.639   7.776
  174   2HE   LYS  26          HE2       LYS  26  -4.850   3.243   6.192
  175   1HZ   LYS  26          HZ1       LYS  26  -6.587   5.261   7.268
  176   2HZ   LYS  26          HZ2       LYS  26  -5.163   5.578   6.512
  177   3HZ   LYS  26          HZ3       LYS  26  -6.398   4.913   5.671
  178    H    TYR  27           HN       TYR  27  -6.838  -0.918   2.110
  179    HA   TYR  27           HA       TYR  27  -4.725   0.382   0.416
  180   1HB   TYR  27          HB1       TYR  27  -4.508  -2.234   1.759
  181   2HB   TYR  27          HB2       TYR  27  -3.361  -1.505   0.854
  182    HD1  TYR  27           HD1      TYR  27  -1.958   0.308   1.688
  183    HD2  TYR  27           HD2      TYR  27  -4.926  -1.657   4.101
  184    HE1  TYR  27           HE1      TYR  27  -0.999   1.360   3.749
  185    HE2  TYR  27           HE2      TYR  27  -3.929  -0.680   6.150
  186    HH   TYR  27           HH       TYR  27  -2.102   0.521   6.993
  187    H    CYS  28           HN       CYS  28  -6.456  -2.749   0.778
  188    HA   CYS  28           HA       CYS  28  -6.566  -3.049  -2.192
  189   1HB   CYS  28          HB1       CYS  28  -6.317  -4.965   0.034
  190   2HB   CYS  28          HB2       CYS  28  -6.615  -5.416  -1.508
  191    H    GLY  29           HN       GLY  29  -8.588  -2.330   0.398
  192   1HA   GLY  29          HA2       GLY  29 -10.933  -2.361   0.562
  193   2HA   GLY  29          HA1       GLY  29 -11.033  -3.325  -0.905
  194    H    ARG  30           HN       ARG  30  -9.401  -5.487  -0.238
  195    HA   ARG  30           HA       ARG  30 -10.334  -6.727   2.286
  196   1HB   ARG  30          HB1       ARG  30 -11.664  -7.285   0.042
  197   2HB   ARG  30          HB2       ARG  30 -10.446  -8.357  -0.147
  198   1HG   ARG  30          HG1       ARG  30 -11.800  -9.671   1.013
  199   2HG   ARG  30          HG2       ARG  30 -11.091  -8.926   2.282
  200   1HD   ARG  30          HD1       ARG  30 -13.700  -8.382   1.201
  201   2HD   ARG  30          HD2       ARG  30 -13.350  -8.868   2.721
  202    HE   ARG  30           HE       ARG  30 -12.301  -6.297   2.016
  203   1HH1  ARG  30          2HH2      ARG  30 -15.061  -7.845   3.579
  204   2HH1  ARG  30          1HH2      ARG  30 -15.563  -6.347   4.288
  205   1HH2  ARG  30          2HH1      ARG  30 -12.982  -4.495   2.929
  206   2HH2  ARG  30          1HH1      ARG  30 -14.400  -4.473   3.923
  Start of MODEL    4
    1   1H    VAL   1           H1       VAL   1   3.487  -0.749   4.056
    2   2H    VAL   1           H2       VAL   1   5.045  -1.247   3.778
    3   3H    VAL   1           H3       VAL   1   4.564   0.219   3.242
    4    HA   VAL   1           HA       VAL   1   4.232   0.964   5.522
    5    HB   VAL   1           HB       VAL   1   5.321  -0.351   7.318
    6   1HG1  VAL   1          1HG1      VAL   1   2.968  -1.784   6.011
    7   2HG1  VAL   1          2HG1      VAL   1   3.428  -1.815   7.719
    8   3HG1  VAL   1          3HG1      VAL   1   2.857  -0.305   6.993
    9   1HG2  VAL   1          1HG2      VAL   1   5.684  -2.750   7.084
   10   2HG2  VAL   1          2HG2      VAL   1   5.231  -2.714   5.376
   11   3HG2  VAL   1          3HG2      VAL   1   6.713  -1.896   5.931
   12    H    GLY   2           HN       GLY   2   5.981   2.199   6.485
   13   1HA   GLY   2          HA2       GLY   2   7.864   3.489   6.120
   14   2HA   GLY   2          HA1       GLY   2   8.540   2.256   5.047
   15    H    GLU   3           HN       GLU   3   6.768   1.879   3.141
   16    HA   GLU   3           HA       GLU   3   5.490   4.269   2.063
   17   1HB   GLU   3          HB1       GLU   3   6.815   4.193   0.033
   18   2HB   GLU   3          HB2       GLU   3   7.723   4.609   1.325
   19   1HG   GLU   3          HG1       GLU   3   8.629   2.378   1.355
   20   2HG   GLU   3          HG2       GLU   3   7.792   2.051  -0.009
   21    H    CYS   4           HN       CYS   4   4.705   3.635  -0.255
   22    HA   CYS   4           HA       CYS   4   4.363   0.714  -0.746
   23   1HB   CYS   4          HB1       CYS   4   3.496   2.975  -2.454
   24   2HB   CYS   4          HB2       CYS   4   3.208   1.390  -2.725
   25    H    VAL   5           HN       VAL   5   5.879  -0.202  -2.011
   26    HA   VAL   5           HA       VAL   5   8.489   0.913  -1.991
   27    HB   VAL   5           HB       VAL   5   7.494  -1.512  -3.539
   28   1HG1  VAL   5          1HG1      VAL   5   9.844  -2.289  -3.287
   29   2HG1  VAL   5          2HG1      VAL   5   9.763  -0.804  -4.235
   30   3HG1  VAL   5          3HG1      VAL   5  10.278  -0.739  -2.534
   31   1HG2  VAL   5          1HG2      VAL   5   8.552  -1.277  -0.687
   32   2HG2  VAL   5          2HG2      VAL   5   6.912  -1.766  -1.170
   33   3HG2  VAL   5          3HG2      VAL   5   8.283  -2.802  -1.556
   34    H    ARG   6           HN       ARG   6   8.669   2.775  -3.062
   35    HA   ARG   6           HA       ARG   6   8.290   4.418  -4.596
   36   1HB   ARG   6          HB1       ARG   6   9.528   2.503  -6.478
   37   2HB   ARG   6          HB2       ARG   6   9.521   4.130  -6.617
   38   1HG   ARG   6          HG1       ARG   6  10.933   2.661  -4.576
   39   2HG   ARG   6          HG2       ARG   6  11.638   3.371  -5.867
   40   1HD   ARG   6          HD1       ARG   6  11.833   5.254  -4.788
   41   2HD   ARG   6          HD2       ARG   6  10.237   5.268  -4.442
   42    HE   ARG   6           HE       ARG   6  10.622   4.073  -2.397
   43   1HH1  ARG   6          2HH2      ARG   6  13.601   5.243  -3.921
   44   2HH1  ARG   6          1HH2      ARG   6  14.461   5.200  -2.418
   45   1HH2  ARG   6          2HH1      ARG   6  11.806   4.131  -0.531
   46   2HH2  ARG   6          1HH1      ARG   6  13.476   4.591  -0.560
   47    H    GLY   7           HN       GLY   7   6.043   3.257  -4.060
   48   1HA   GLY   7          HA2       GLY   7   3.846   3.721  -4.853
   49   2HA   GLY   7          HA1       GLY   7   4.390   3.572  -6.517
   50    H    ARG   8           HN       ARG   8   5.741   0.834  -5.274
   51    HA   ARG   8           HA       ARG   8   3.410  -0.802  -6.087
   52   1HB   ARG   8          HB1       ARG   8   6.330  -1.259  -6.079
   53   2HB   ARG   8          HB2       ARG   8   5.245  -2.421  -6.454
   54   1HG   ARG   8          HG1       ARG   8   5.951  -1.691  -8.467
   55   2HG   ARG   8          HG2       ARG   8   4.515  -0.938  -8.270
   56   1HD   ARG   8          HD1       ARG   8   5.559   1.097  -7.867
   57   2HD   ARG   8          HD2       ARG   8   7.027   0.385  -7.786
   58    HE   ARG   8           HE       ARG   8   6.108  -0.243 -10.260
   59   1HH1  ARG   8          2HH2      ARG   8   6.930   2.828  -8.707
   60   2HH1  ARG   8          1HH2      ARG   8   7.278   3.574 -10.231
   61   1HH2  ARG   8          2HH1      ARG   8   6.578   0.813 -12.139
   62   2HH2  ARG   8          1HH1      ARG   8   7.086   2.469 -12.114
   63    H    CYS   9           HN       CYS   9   3.740  -3.158  -5.228
   64    HA   CYS   9           HA       CYS   9   4.206  -3.284  -2.315
   65   1HB   CYS   9          HB1       CYS   9   1.691  -3.821  -3.742
   66   2HB   CYS   9          HB2       CYS   9   2.051  -4.679  -2.400
   67    HA   PRO  10           HA       PRO  10   5.627  -7.399  -3.603
   68   1HB   PRO  10          HB1       PRO  10   5.350  -8.769  -1.336
   69   2HB   PRO  10          HB2       PRO  10   6.540  -7.662  -1.497
   70   1HG   PRO  10          HG1       PRO  10   3.995  -7.306  -0.162
   71   2HG   PRO  10          HG2       PRO  10   5.463  -6.840   0.381
   72   1HD   PRO  10          HD1       PRO  10   3.889  -5.123  -0.819
   73   2HD   PRO  10          HD2       PRO  10   5.511  -5.002  -0.966
   74    H    SER  11           HN       SER  11   4.810  -9.607  -3.817
   75    HA   SER  11           HA       SER  11   2.362  -9.653  -5.135
   76   1HB   SER  11          HB1       SER  11   2.819 -12.012  -5.298
   77   2HB   SER  11          HB2       SER  11   4.192 -11.164  -5.546
   78    HG   SER  11           HG       SER  11   3.467 -12.203  -3.112
   79    H    GLY  12           HN       GLY  12   0.664  -8.965  -3.893
   80   1HA   GLY  12          HA2       GLY  12  -1.394 -10.158  -3.090
   81   2HA   GLY  12          HA1       GLY  12  -0.398 -10.861  -1.821
   82    H    MET  13           HN       MET  13   0.901  -7.844  -1.888
   83    HA   MET  13           HA       MET  13  -1.069  -6.773   0.094
   84   1HB   MET  13          HB1       MET  13   1.707  -5.989  -0.494
   85   2HB   MET  13          HB2       MET  13   0.732  -5.190   0.544
   86   1HG   MET  13          HG1       MET  13   0.537  -7.258   1.806
   87   2HG   MET  13          HG2       MET  13   1.709  -7.877   0.851
   88   1HE   MET  13          HE1       MET  13   3.608  -7.512   4.214
   89   2HE   MET  13          HE2       MET  13   1.917  -8.005   3.964
   90   3HE   MET  13          HE3       MET  13   3.194  -8.621   2.888
   91    H    CYS  14           HN       CYS  14  -1.308  -4.324   0.032
   92    HA   CYS  14           HA       CYS  14  -1.643  -3.241  -2.697
   93   1HB   CYS  14          HB1       CYS  14  -4.005  -2.803  -2.019
   94   2HB   CYS  14          HB2       CYS  14  -3.627  -4.325  -2.475
   95    H    CYS  15           HN       CYS  15  -2.548  -0.908  -2.558
   96    HA   CYS  15           HA       CYS  15  -0.636   0.412  -0.680
   97   1HB   CYS  15          HB1       CYS  15   0.175   0.161  -2.891
   98   2HB   CYS  15          HB2       CYS  15  -1.144   0.875  -3.539
   99    H    SER  16           HN       SER  16  -1.578   1.720   0.717
  100    HA   SER  16           HA       SER  16  -4.220   2.878   0.399
  101   1HB   SER  16          HB1       SER  16  -3.766   3.836   2.525
  102   2HB   SER  16          HB2       SER  16  -3.302   2.270   2.549
  103    HG   SER  16           HG       SER  16  -1.181   2.827   2.400
  104    H    GLN  17           HN       GLN  17  -4.702   5.215   0.724
  105    HA   GLN  17           HA       GLN  17  -3.682   6.660  -1.477
  106   1HB   GLN  17          HB1       GLN  17  -5.131   8.356  -0.746
  107   2HB   GLN  17          HB2       GLN  17  -5.882   6.933  -0.467
  108   1HG   GLN  17          HG1       GLN  17  -4.555   8.077   1.753
  109   2HG   GLN  17          HG2       GLN  17  -5.905   8.848   1.253
  110   1HE2  GLN  17          1HE2      GLN  17  -7.528   8.422   2.681
  111   2HE2  GLN  17          2HE2      GLN  17  -7.776   6.804   3.297
  112    H1   NAL  18           HD1      NAL  18  -3.089   6.106   4.092
  113    H3   NAL  18           HD2      NAL  18  -1.873  10.091   4.170
  114    H4   NAL  18           HE2      NAL  18  -3.959  10.723   5.183
  115    H5   NAL  18           HH2      NAL  18  -6.157  10.098   6.066
  116    H6   NAL  18           HP       NAL  18  -7.780   8.401   6.596
  117    H7   NAL  18           HH1      NAL  18  -7.339   6.101   6.046
  118    H8   NAL  18           HZ1      NAL  18  -5.288   5.497   4.944
  119   1H9   NAL  18          HB1       NAL  18  -0.806   6.598   3.540
  120   2H9   NAL  18          HB2       NAL  18  -0.177   8.204   3.886
  121    H10  NAL  18           HA       NAL  18  -1.046   9.052   1.752
  122   1HN   NAL  18          HN        NAL  18  -2.501   6.527   1.743
  123    H    GLY  19           HN       GLY  19  -0.487   6.250  -0.021
  124   1HA   GLY  19          HA2       GLY  19   1.435   5.550  -1.164
  125   2HA   GLY  19          HA1       GLY  19   2.373   6.841  -0.386
  126    H    TYR  20           HN       TYR  20   0.381   4.352   1.156
  127    HA   TYR  20           HA       TYR  20   2.799   3.122   2.404
  128   1HB   TYR  20          HB1       TYR  20   0.830   4.588   3.687
  129   2HB   TYR  20          HB2       TYR  20   0.585   3.033   4.122
  130    HD1  TYR  20           HD1      TYR  20   1.704   2.138   5.992
  131    HD2  TYR  20           HD2      TYR  20   3.294   5.484   3.773
  132    HE1  TYR  20           HE1      TYR  20   3.562   2.374   7.655
  133    HE2  TYR  20           HE2      TYR  20   5.130   5.715   5.418
  134    HH   TYR  20           HH       TYR  20   5.990   4.947   7.411
  135    H    CYS  21           HN       CYS  21   2.978   1.109   1.680
  136    HA   CYS  21           HA       CYS  21   0.701  -0.420   0.728
  137   1HB   CYS  21          HB1       CYS  21   2.896  -0.572  -0.234
  138   2HB   CYS  21          HB2       CYS  21   3.512  -1.195   1.144
  139    H    GLY  22           HN       GLY  22  -0.178  -2.306   1.567
  140   1HA   GLY  22          HA2       GLY  22   0.525  -3.722   3.918
  141   2HA   GLY  22          HA1       GLY  22  -0.627  -2.442   4.359
  142    H    LYS  23           HN       LYS  23  -2.277  -4.005   4.852
  143    HA   LYS  23           HA       LYS  23  -3.851  -4.620   2.475
  144   1HB   LYS  23          HB1       LYS  23  -3.273  -6.720   4.483
  145   2HB   LYS  23          HB2       LYS  23  -4.522  -6.803   3.433
  146   1HG   LYS  23          HG1       LYS  23  -2.851  -6.619   1.639
  147   2HG   LYS  23          HG2       LYS  23  -1.720  -6.887   2.787
  148   1HD   LYS  23          HD1       LYS  23  -2.106  -8.923   1.779
  149   2HD   LYS  23          HD2       LYS  23  -2.809  -9.002   3.251
  150   1HE   LYS  23          HE1       LYS  23  -4.234  -9.976   1.644
  151   2HE   LYS  23          HE2       LYS  23  -4.937  -8.633   2.251
  152   1HZ   LYS  23          HZ1       LYS  23  -3.491  -8.670  -0.230
  153   2HZ   LYS  23          HZ2       LYS  23  -5.135  -8.806  -0.148
  154   3HZ   LYS  23          HZ3       LYS  23  -4.382  -7.421   0.336
  155    H    GLY  24           HN       GLY  24  -6.062  -4.902   2.925
  156   1HA   GLY  24          HA2       GLY  24  -7.854  -4.800   4.745
  157   2HA   GLY  24          HA1       GLY  24  -7.012  -3.333   5.275
  158    HA   PRO  25           HA       PRO  25 -10.281  -2.654   1.890
  159   1HB   PRO  25          HB1       PRO  25 -11.908  -1.002   3.271
  160   2HB   PRO  25          HB2       PRO  25 -12.105  -2.623   3.245
  161   1HG   PRO  25          HG1       PRO  25 -10.859  -1.048   5.323
  162   2HG   PRO  25          HG2       PRO  25 -11.877  -2.311   5.515
  163   1HD   PRO  25          HD1       PRO  25  -9.305  -2.680   5.747
  164   2HD   PRO  25          HD2       PRO  25 -10.236  -3.852   5.092
  165    H    LYS  26           HN       LYS  26  -8.784  -0.338   4.117
  166    HA   LYS  26           HA       LYS  26  -8.851   1.857   2.256
  167   1HB   LYS  26          HB1       LYS  26  -7.587   1.352   4.849
  168   2HB   LYS  26          HB2       LYS  26  -6.953   2.565   3.958
  169   1HG   LYS  26          HG1       LYS  26  -9.772   2.523   4.423
  170   2HG   LYS  26          HG2       LYS  26  -8.790   3.086   5.601
  171   1HD   LYS  26          HD1       LYS  26  -9.504   4.943   4.482
  172   2HD   LYS  26          HD2       LYS  26  -7.964   4.711   3.989
  173   1HE   LYS  26          HE1       LYS  26 -10.002   3.649   2.332
  174   2HE   LYS  26          HE2       LYS  26  -9.818   5.272   2.324
  175   1HZ   LYS  26          HZ1       LYS  26  -7.532   4.983   1.637
  176   2HZ   LYS  26          HZ2       LYS  26  -7.752   3.381   1.559
  177   3HZ   LYS  26          HZ3       LYS  26  -8.606   4.361   0.554
  178    H    TYR  27           HN       TYR  27  -6.935  -0.887   2.155
  179    HA   TYR  27           HA       TYR  27  -4.700   0.479   0.700
  180   1HB   TYR  27          HB1       TYR  27  -4.858  -2.207   1.923
  181   2HB   TYR  27          HB2       TYR  27  -3.572  -1.631   1.098
  182    HD1  TYR  27           HD1      TYR  27  -1.863  -0.297   2.087
  183    HD2  TYR  27           HD2      TYR  27  -5.504  -1.277   4.177
  184    HE1  TYR  27           HE1      TYR  27  -0.908   0.619   4.207
  185    HE2  TYR  27           HE2      TYR  27  -4.561  -0.355   6.273
  186    HH   TYR  27           HH       TYR  27  -2.731   0.647   7.259
  187    H    CYS  28           HN       CYS  28  -6.943  -2.299   0.565
  188    HA   CYS  28           HA       CYS  28  -6.297  -2.826  -2.269
  189   1HB   CYS  28          HB1       CYS  28  -7.762  -4.189  -0.143
  190   2HB   CYS  28          HB2       CYS  28  -8.003  -4.632  -1.696
  191    H    GLY  29           HN       GLY  29  -8.757  -1.052  -0.529
  192   1HA   GLY  29          HA2       GLY  29  -9.992  -0.382  -3.150
  193   2HA   GLY  29          HA1       GLY  29 -10.715  -0.041  -1.563
  194    H    ARG  30           HN       ARG  30 -10.258   2.065  -3.323
  195    HA   ARG  30           HA       ARG  30  -7.661   3.167  -3.053
  196   1HB   ARG  30          HB1       ARG  30  -9.140   3.729  -4.868
  197   2HB   ARG  30          HB2       ARG  30 -10.115   4.578  -3.869
  198   1HG   ARG  30          HG1       ARG  30  -8.746   6.018  -5.156
  199   2HG   ARG  30          HG2       ARG  30  -8.457   6.198  -3.558
  200   1HD   ARG  30          HD1       ARG  30  -6.705   4.622  -5.213
  201   2HD   ARG  30          HD2       ARG  30  -6.470   6.226  -5.015
  202    HE   ARG  30           HE       ARG  30  -6.702   5.300  -2.494
  203   1HH1  ARG  30          2HH2      ARG  30  -4.273   4.189  -4.833
  204   2HH1  ARG  30          1HH2      ARG  30  -3.675   3.088  -3.637
  205   1HH2  ARG  30          2HH1      ARG  30  -5.997   3.894  -1.260
  206   2HH2  ARG  30          1HH1      ARG  30  -4.625   2.924  -1.680
  Start of MODEL    5
    1   1H    VAL   1           H1       VAL   1   4.428  -1.438   4.116
    2   2H    VAL   1           H2       VAL   1   4.216  -0.039   3.305
    3   3H    VAL   1           H3       VAL   1   2.931  -0.730   4.107
    4    HA   VAL   1           HA       VAL   1   3.761   1.136   5.355
    5    HB   VAL   1           HB       VAL   1   4.370   0.049   7.486
    6   1HG1  VAL   1          1HG1      VAL   1   2.256  -1.032   7.854
    7   2HG1  VAL   1          2HG1      VAL   1   1.992   0.313   6.736
    8   3HG1  VAL   1          3HG1      VAL   1   2.035  -1.359   6.132
    9   1HG2  VAL   1          1HG2      VAL   1   4.397  -2.379   7.719
   10   2HG2  VAL   1          2HG2      VAL   1   4.203  -2.604   5.976
   11   3HG2  VAL   1          3HG2      VAL   1   5.695  -1.883   6.628
   12    H    GLY   2           HN       GLY   2   5.563   2.173   6.474
   13   1HA   GLY   2          HA2       GLY   2   7.744   2.992   6.399
   14   2HA   GLY   2          HA1       GLY   2   8.280   1.561   5.508
   15    H    GLU   3           HN       GLU   3   6.754   1.419   3.350
   16    HA   GLU   3           HA       GLU   3   6.047   3.990   2.166
   17   1HB   GLU   3          HB1       GLU   3   8.506   3.251   1.609
   18   2HB   GLU   3          HB2       GLU   3   7.773   2.327   0.480
   19   1HG   GLU   3          HG1       GLU   3   6.739   4.313  -0.407
   20   2HG   GLU   3          HG2       GLU   3   7.602   5.200   0.659
   21    H    CYS   4           HN       CYS   4   5.145   3.479  -0.121
   22    HA   CYS   4           HA       CYS   4   4.427   0.647  -0.688
   23   1HB   CYS   4          HB1       CYS   4   3.801   3.015  -2.347
   24   2HB   CYS   4          HB2       CYS   4   3.192   1.507  -2.497
   25    H    VAL   5           HN       VAL   5   6.233  -0.324  -1.669
   26    HA   VAL   5           HA       VAL   5   8.676   1.085  -1.861
   27    HB   VAL   5           HB       VAL   5   8.020  -1.660  -2.988
   28   1HG1  VAL   5          1HG1      VAL   5  10.672  -0.334  -2.265
   29   2HG1  VAL   5          2HG1      VAL   5  10.458  -2.038  -2.719
   30   3HG1  VAL   5          3HG1      VAL   5  10.129  -0.774  -3.902
   31   1HG2  VAL   5          1HG2      VAL   5   7.539  -1.565  -0.570
   32   2HG2  VAL   5          2HG2      VAL   5   9.017  -2.479  -0.864
   33   3HG2  VAL   5          3HG2      VAL   5   9.118  -0.808  -0.270
   34    H    ARG   6           HN       ARG   6   8.820   2.704  -3.197
   35    HA   ARG   6           HA       ARG   6   8.761   4.041  -5.089
   36   1HB   ARG   6          HB1       ARG   6   9.484   1.584  -6.562
   37   2HB   ARG   6          HB2       ARG   6   9.682   3.115  -7.095
   38   1HG   ARG   6          HG1       ARG   6  11.103   2.274  -4.775
   39   2HG   ARG   6          HG2       ARG   6  11.662   1.835  -6.246
   40   1HD   ARG   6          HD1       ARG   6  12.811   3.735  -5.431
   41   2HD   ARG   6          HD2       ARG   6  12.020   4.080  -6.818
   42    HE   ARG   6           HE       ARG   6  11.024   5.794  -5.776
   43   1HH1  ARG   6          2HH2      ARG   6  11.671   3.377  -3.305
   44   2HH1  ARG   6          1HH2      ARG   6  10.868   4.309  -2.087
   45   1HH2  ARG   6          2HH1      ARG   6   9.896   6.839  -4.166
   46   2HH2  ARG   6          1HH1      ARG   6   9.898   6.199  -2.556
   47    H    GLY   7           HN       GLY   7   6.294   2.829  -4.231
   48   1HA   GLY   7          HA2       GLY   7   4.180   3.635  -5.098
   49   2HA   GLY   7          HA1       GLY   7   4.626   3.092  -6.705
   50    H    ARG   8           HN       ARG   8   5.571   0.334  -5.100
   51    HA   ARG   8           HA       ARG   8   2.841  -0.796  -4.920
   52   1HB   ARG   8          HB1       ARG   8   3.474  -2.389  -6.521
   53   2HB   ARG   8          HB2       ARG   8   3.807  -0.932  -7.180
   54   1HG   ARG   8          HG1       ARG   8   6.155  -1.431  -6.352
   55   2HG   ARG   8          HG2       ARG   8   5.636  -2.979  -6.411
   56   1HD   ARG   8          HD1       ARG   8   6.783  -2.393  -8.413
   57   2HD   ARG   8          HD2       ARG   8   5.229  -2.783  -8.727
   58    HE   ARG   8           HE       ARG   8   4.896  -0.754  -9.643
   59   1HH1  ARG   8          2HH2      ARG   8   7.618  -0.423  -7.422
   60   2HH1  ARG   8          1HH2      ARG   8   7.708   1.287  -7.683
   61   1HH2  ARG   8          2HH1      ARG   8   5.056   1.497  -9.792
   62   2HH2  ARG   8          1HH1      ARG   8   6.330   2.321  -8.957
   63    H    CYS   9           HN       CYS   9   3.013  -3.227  -4.285
   64    HA   CYS   9           HA       CYS   9   5.341  -3.831  -2.604
   65   1HB   CYS   9          HB1       CYS   9   2.700  -3.158  -1.550
   66   2HB   CYS   9          HB2       CYS   9   3.548  -4.330  -0.792
   67    HA   PRO  10           HA       PRO  10   4.609  -7.848  -4.033
   68   1HB   PRO  10          HB1       PRO  10   5.810  -9.357  -2.210
   69   2HB   PRO  10          HB2       PRO  10   6.674  -8.273  -3.074
   70   1HG   PRO  10          HG1       PRO  10   5.651  -7.930  -0.379
   71   2HG   PRO  10          HG2       PRO  10   7.164  -7.602  -0.901
   72   1HD   PRO  10          HD1       PRO  10   5.396  -5.688  -0.755
   73   2HD   PRO  10          HD2       PRO  10   6.517  -5.675  -1.943
   74    H    SER  11           HN       SER  11   3.916 -10.169  -3.357
   75    HA   SER  11           HA       SER  11   2.253 -11.581  -2.819
   76   1HB   SER  11          HB1       SER  11   1.782 -11.736  -0.470
   77   2HB   SER  11          HB2       SER  11   3.344 -11.279  -0.616
   78    HG   SER  11           HG       SER  11   2.338  -9.054  -0.481
   79    H    GLY  12           HN       GLY  12   1.405  -9.300  -4.088
   80   1HA   GLY  12          HA2       GLY  12  -0.528  -8.087  -4.749
   81   2HA   GLY  12          HA1       GLY  12  -1.474  -9.396  -4.029
   82    H    MET  13           HN       MET  13   0.821  -7.188  -2.344
   83    HA   MET  13           HA       MET  13  -1.266  -6.030  -0.622
   84   1HB   MET  13          HB1       MET  13   1.585  -5.426  -1.108
   85   2HB   MET  13          HB2       MET  13   0.647  -4.482  -0.160
   86   1HG   MET  13          HG1       MET  13   0.311  -6.242   1.338
   87   2HG   MET  13          HG2       MET  13   1.108  -7.274   0.354
   88   1HE   MET  13          HE1       MET  13   1.742  -7.242   3.378
   89   2HE   MET  13          HE2       MET  13   2.637  -8.261   2.224
   90   3HE   MET  13          HE3       MET  13   3.520  -7.227   3.368
   91    H    CYS  14           HN       CYS  14  -1.410  -3.646  -0.599
   92    HA   CYS  14           HA       CYS  14  -1.472  -2.334  -3.262
   93   1HB   CYS  14          HB1       CYS  14  -3.807  -1.642  -2.497
   94   2HB   CYS  14          HB2       CYS  14  -3.591  -3.072  -3.254
   95    H    CYS  15           HN       CYS  15  -1.662  -0.068  -3.171
   96    HA   CYS  15           HA       CYS  15  -0.199   1.060  -0.907
   97   1HB   CYS  15          HB1       CYS  15   0.470   1.317  -3.235
   98   2HB   CYS  15          HB2       CYS  15  -0.846   2.240  -3.526
   99    H    SER  16           HN       SER  16  -1.097   2.282   0.714
  100    HA   SER  16           HA       SER  16  -3.765   3.463   0.410
  101   1HB   SER  16          HB1       SER  16  -3.462   4.309   2.549
  102   2HB   SER  16          HB2       SER  16  -2.948   2.759   2.583
  103    HG   SER  16           HG       SER  16  -0.806   3.601   2.262
  104    H    GLN  17           HN       GLN  17  -4.216   5.664   0.342
  105    HA   GLN  17           HA       GLN  17  -2.725   7.367  -1.326
  106   1HB   GLN  17          HB1       GLN  17  -4.341   9.016  -0.445
  107   2HB   GLN  17          HB2       GLN  17  -5.025   7.658  -1.044
  108   1HG   GLN  17          HG1       GLN  17  -4.625   7.678   1.752
  109   2HG   GLN  17          HG2       GLN  17  -5.769   8.704   1.200
  110   1HE2  GLN  17          1HE2      GLN  17  -7.474   7.615   2.289
  111   2HE2  GLN  17          2HE2      GLN  17  -7.993   6.044   1.712
  112    H1   NAL  18           HD1      NAL  18  -2.895   5.851   4.262
  113    H3   NAL  18           HD2      NAL  18  -2.270   9.946   4.712
  114    H4   NAL  18           HE2      NAL  18  -4.618  10.269   5.125
  115    H5   NAL  18           HH2      NAL  18  -6.891   9.356   5.236
  116    H6   NAL  18           HP       NAL  18  -8.383   7.468   5.109
  117    H7   NAL  18           HH1      NAL  18  -7.509   5.279   4.647
  118    H8   NAL  18           HZ1      NAL  18  -5.147   4.952   4.348
  119   1H9   NAL  18          HB2       NAL  18  -0.666   6.634   4.140
  120   2H9   NAL  18          HB1       NAL  18  -0.298   8.257   4.713
  121    H10  NAL  18           HA       NAL  18  -0.688   9.219   2.551
  122   1HN   NAL  18          HN        NAL  18  -2.113   6.713   1.984
  123    H    GLY  19           HN       GLY  19   0.059   6.634   0.570
  124   1HA   GLY  19          HA2       GLY  19   2.073   6.183  -0.499
  125   2HA   GLY  19          HA1       GLY  19   2.930   7.243   0.625
  126    H    TYR  20           HN       TYR  20   0.861   4.802   1.974
  127    HA   TYR  20           HA       TYR  20   3.195   3.067   2.729
  128   1HB   TYR  20          HB1       TYR  20   1.165   4.330   4.364
  129   2HB   TYR  20          HB2       TYR  20   1.462   2.764   4.716
  130    HD1  TYR  20           HD1      TYR  20   3.836   5.436   3.728
  131    HD2  TYR  20           HD2      TYR  20   2.476   2.775   6.851
  132    HE1  TYR  20           HE1      TYR  20   5.794   6.035   5.076
  133    HE2  TYR  20           HE2      TYR  20   4.457   3.421   8.230
  134    HH   TYR  20           HH       TYR  20   6.953   5.643   6.999
  135    H    CYS  21           HN       CYS  21   2.972   1.051   1.855
  136    HA   CYS  21           HA       CYS  21   0.346   0.205   0.931
  137   1HB   CYS  21          HB1       CYS  21   1.488  -1.532  -0.064
  138   2HB   CYS  21          HB2       CYS  21   2.472  -0.236  -0.201
  139    H    GLY  22           HN       GLY  22  -0.527  -1.933   1.270
  140   1HA   GLY  22          HA2       GLY  22  -0.110  -3.600   3.550
  141   2HA   GLY  22          HA1       GLY  22  -1.357  -2.388   3.908
  142    H    LYS  23           HN       LYS  23  -3.056  -3.966   3.950
  143    HA   LYS  23           HA       LYS  23  -4.083  -4.711   1.282
  144   1HB   LYS  23          HB1       LYS  23  -3.698  -6.615   3.507
  145   2HB   LYS  23          HB2       LYS  23  -4.833  -6.865   2.359
  146   1HG   LYS  23          HG1       LYS  23  -3.163  -6.976   0.690
  147   2HG   LYS  23          HG2       LYS  23  -2.009  -6.632   1.793
  148   1HD   LYS  23          HD1       LYS  23  -2.443  -8.684   2.907
  149   2HD   LYS  23          HD2       LYS  23  -3.627  -9.024   1.835
  150   1HE   LYS  23          HE1       LYS  23  -0.915  -8.681   0.957
  151   2HE   LYS  23          HE2       LYS  23  -1.445 -10.138   1.468
  152   1HZ   LYS  23          HZ1       LYS  23  -2.446  -8.694  -0.828
  153   2HZ   LYS  23          HZ2       LYS  23  -1.553 -10.060  -0.850
  154   3HZ   LYS  23          HZ3       LYS  23  -3.092 -10.111  -0.262
  155    H    GLY  24           HN       GLY  24  -6.384  -4.942   1.256
  156   1HA   GLY  24          HA2       GLY  24  -8.517  -5.056   2.256
  157   2HA   GLY  24          HA1       GLY  24  -7.853  -4.437   3.761
  158    HA   PRO  25           HA       PRO  25 -10.621  -1.504   1.500
  159   1HB   PRO  25          HB1       PRO  25 -12.144  -0.726   3.545
  160   2HB   PRO  25          HB2       PRO  25 -12.355  -2.171   2.813
  161   1HG   PRO  25          HG1       PRO  25 -10.924  -1.664   5.283
  162   2HG   PRO  25          HG2       PRO  25 -12.019  -2.844   5.008
  163   1HD   PRO  25          HD1       PRO  25  -9.485  -3.388   4.819
  164   2HD   PRO  25          HD2       PRO  25 -10.540  -4.102   3.797
  165    H    LYS  26           HN       LYS  26  -8.077  -0.717   3.513
  166    HA   LYS  26           HA       LYS  26  -8.394   2.213   3.053
  167   1HB   LYS  26          HB1       LYS  26  -7.063   0.724   5.249
  168   2HB   LYS  26          HB2       LYS  26  -7.037   2.348   5.081
  169   1HG   LYS  26          HG1       LYS  26  -9.571   1.090   5.374
  170   2HG   LYS  26          HG2       LYS  26  -8.642   1.247   6.708
  171   1HD   LYS  26          HD1       LYS  26 -10.177   2.993   6.645
  172   2HD   LYS  26          HD2       LYS  26  -8.673   3.598   6.448
  173   1HE   LYS  26          HE1       LYS  26 -10.100   4.734   5.024
  174   2HE   LYS  26          HE2       LYS  26  -9.103   3.815   4.113
  175   1HZ   LYS  26          HZ1       LYS  26 -11.838   3.130   4.700
  176   2HZ   LYS  26          HZ2       LYS  26 -11.270   3.754   3.270
  177   3HZ   LYS  26          HZ3       LYS  26 -10.807   2.277   3.698
  178    H    TYR  27           HN       TYR  27  -6.983  -0.305   1.736
  179    HA   TYR  27           HA       TYR  27  -4.513   1.160   0.905
  180   1HB   TYR  27          HB1       TYR  27  -4.638  -1.713   1.588
  181   2HB   TYR  27          HB2       TYR  27  -3.351  -0.961   0.920
  182    HD1  TYR  27           HD1      TYR  27  -5.228  -1.476   3.982
  183    HD2  TYR  27           HD2      TYR  27  -1.856   0.486   2.167
  184    HE1  TYR  27           HE1      TYR  27  -4.319  -0.980   6.234
  185    HE2  TYR  27           HE2      TYR  27  -0.939   1.000   4.437
  186    HH   TYR  27           HH       TYR  27  -2.617   0.034   7.421
  187    H    CYS  28           HN       CYS  28  -6.748  -1.554   0.203
  188    HA   CYS  28           HA       CYS  28  -6.332  -1.304  -2.727
  189   1HB   CYS  28          HB1       CYS  28  -7.759  -3.168  -0.947
  190   2HB   CYS  28          HB2       CYS  28  -7.994  -3.175  -2.564
  191    H    GLY  29           HN       GLY  29  -9.023  -1.359  -0.365
  192   1HA   GLY  29          HA2       GLY  29 -10.700   0.577  -1.817
  193   2HA   GLY  29          HA1       GLY  29 -10.918   0.014  -0.152
  194    H    ARG  30           HN       ARG  30 -11.247   2.673  -0.498
  195    HA   ARG  30           HA       ARG  30  -8.622   3.998   0.017
  196   1HB   ARG  30          HB1       ARG  30 -11.042   5.363  -0.922
  197   2HB   ARG  30          HB2       ARG  30  -9.499   5.897  -0.955
  198   1HG   ARG  30          HG1       ARG  30 -10.824   4.210  -2.811
  199   2HG   ARG  30          HG2       ARG  30  -9.901   5.524  -3.110
  200   1HD   ARG  30          HD1       ARG  30  -9.043   2.830  -2.734
  201   2HD   ARG  30          HD2       ARG  30  -8.686   3.838  -3.969
  202    HE   ARG  30           HE       ARG  30  -7.487   4.990  -1.825
  203   1HH1  ARG  30          2HH2      ARG  30  -7.161   1.796  -3.314
  204   2HH1  ARG  30          1HH2      ARG  30  -5.540   1.632  -2.724
  205   1HH2  ARG  30          2HH1      ARG  30  -5.450   4.667  -1.144
  206   2HH2  ARG  30          1HH1      ARG  30  -4.604   3.207  -1.533
  Start of MODEL    6
    1   1H    VAL   1           H1       VAL   1   6.546  -0.193   1.545
    2   2H    VAL   1           H2       VAL   1   7.011  -1.766   1.707
    3   3H    VAL   1           H3       VAL   1   7.418  -0.617   2.838
    4    HA   VAL   1           HA       VAL   1   4.649  -1.335   2.193
    5    HB   VAL   1           HB       VAL   1   6.273  -2.425   4.516
    6   1HG1  VAL   1          1HG1      VAL   1   4.197  -3.655   5.105
    7   2HG1  VAL   1          2HG1      VAL   1   3.950  -1.915   5.240
    8   3HG1  VAL   1          3HG1      VAL   1   3.310  -2.794   3.835
    9   1HG2  VAL   1          1HG2      VAL   1   6.690  -3.660   2.411
   10   2HG2  VAL   1          2HG2      VAL   1   5.693  -4.627   3.496
   11   3HG2  VAL   1          3HG2      VAL   1   4.932  -3.790   2.133
   12    H    GLY   2           HN       GLY   2   6.439  -0.348   5.117
   13   1HA   GLY   2          HA2       GLY   2   5.444   2.375   5.147
   14   2HA   GLY   2          HA1       GLY   2   7.038   1.794   5.678
   15    H    GLU   3           HN       GLU   3   5.461   3.522   3.397
   16    HA   GLU   3           HA       GLU   3   5.798   4.396   1.348
   17   1HB   GLU   3          HB1       GLU   3   8.279   4.262   1.801
   18   2HB   GLU   3          HB2       GLU   3   8.288   2.932   0.853
   19   1HG   GLU   3          HG1       GLU   3   7.072   4.423  -0.789
   20   2HG   GLU   3          HG2       GLU   3   7.732   5.634   0.087
   21    H    CYS   4           HN       CYS   4   4.578   3.770  -0.347
   22    HA   CYS   4           HA       CYS   4   4.425   1.076  -1.440
   23   1HB   CYS   4          HB1       CYS   4   4.024   3.640  -2.827
   24   2HB   CYS   4          HB2       CYS   4   3.524   2.168  -3.327
   25    H    VAL   5           HN       VAL   5   6.211   0.069  -2.018
   26    HA   VAL   5           HA       VAL   5   8.791   1.214  -1.904
   27    HB   VAL   5           HB       VAL   5   8.009  -1.515  -3.000
   28   1HG1  VAL   5          1HG1      VAL   5  10.293  -2.151  -2.254
   29   2HG1  VAL   5          2HG1      VAL   5  10.358  -0.912  -3.506
   30   3HG1  VAL   5          3HG1      VAL   5  10.620  -0.464  -1.804
   31   1HG2  VAL   5          1HG2      VAL   5   8.631  -0.610  -0.159
   32   2HG2  VAL   5          2HG2      VAL   5   7.084  -1.263  -0.758
   33   3HG2  VAL   5          3HG2      VAL   5   8.508  -2.306  -0.685
   34    H    ARG   6           HN       ARG   6   9.194   2.779  -3.356
   35    HA   ARG   6           HA       ARG   6   9.418   3.922  -5.388
   36   1HB   ARG   6          HB1       ARG   6  10.141   1.316  -6.577
   37   2HB   ARG   6          HB2       ARG   6  10.517   2.794  -7.162
   38   1HG   ARG   6          HG1       ARG   6  11.606   1.957  -4.667
   39   2HG   ARG   6          HG2       ARG   6  12.294   1.447  -6.058
   40   1HD   ARG   6          HD1       ARG   6  13.473   3.288  -5.170
   41   2HD   ARG   6          HD2       ARG   6  12.843   3.658  -6.631
   42    HE   ARG   6           HE       ARG   6  11.866   5.448  -5.710
   43   1HH1  ARG   6          2HH2      ARG   6  12.115   3.042  -3.156
   44   2HH1  ARG   6          1HH2      ARG   6  11.303   4.067  -2.020
   45   1HH2  ARG   6          2HH1      ARG   6  10.736   6.631  -4.203
   46   2HH2  ARG   6          1HH1      ARG   6  10.550   6.024  -2.591
   47    H    GLY   7           HN       GLY   7   6.820   2.933  -4.676
   48   1HA   GLY   7          HA2       GLY   7   4.720   3.295  -5.646
   49   2HA   GLY   7          HA1       GLY   7   5.373   3.069  -7.257
   50    H    ARG   8           HN       ARG   8   6.491   0.360  -5.502
   51    HA   ARG   8           HA       ARG   8   4.178  -1.286  -6.400
   52   1HB   ARG   8          HB1       ARG   8   7.025  -1.853  -5.849
   53   2HB   ARG   8          HB2       ARG   8   5.928  -3.056  -5.973
   54   1HG   ARG   8          HG1       ARG   8   6.547  -3.109  -8.063
   55   2HG   ARG   8          HG2       ARG   8   5.522  -1.848  -8.227
   56   1HD   ARG   8          HD1       ARG   8   8.266  -1.321  -7.659
   57   2HD   ARG   8          HD2       ARG   8   7.835  -1.685  -9.192
   58    HE   ARG   8           HE       ARG   8   7.625   0.817  -7.987
   59   1HH1  ARG   8          2HH2      ARG   8   5.840  -1.114 -10.344
   60   2HH1  ARG   8          1HH2      ARG   8   5.240   0.311 -11.126
   61   1HH2  ARG   8          2HH1      ARG   8   6.835   2.523  -9.017
   62   2HH2  ARG   8          1HH1      ARG   8   5.794   2.333 -10.388
   63    H    CYS   9           HN       CYS   9   3.659  -3.203  -5.028
   64    HA   CYS   9           HA       CYS   9   4.223  -2.891  -2.162
   65   1HB   CYS   9          HB1       CYS   9   1.539  -2.847  -3.347
   66   2HB   CYS   9          HB2       CYS   9   1.772  -3.343  -1.809
   67    HA   PRO  10           HA       PRO  10   4.785  -7.235  -2.958
   68   1HB   PRO  10          HB1       PRO  10   5.636  -8.001  -0.573
   69   2HB   PRO  10          HB2       PRO  10   6.537  -6.954  -1.444
   70   1HG   PRO  10          HG1       PRO  10   4.729  -6.302   0.730
   71   2HG   PRO  10          HG2       PRO  10   6.253  -5.750   0.525
   72   1HD   PRO  10          HD1       PRO  10   4.197  -4.324  -0.271
   73   2HD   PRO  10          HD2       PRO  10   5.622  -4.246  -1.063
   74    H    SER  11           HN       SER  11   4.098  -9.425  -2.134
   75    HA   SER  11           HA       SER  11   2.464 -10.920  -1.677
   76   1HB   SER  11          HB1       SER  11   1.740 -10.863   0.628
   77   2HB   SER  11          HB2       SER  11   3.309 -10.413   0.553
   78    HG   SER  11           HG       SER  11   2.146  -8.199   0.362
   79    H    GLY  12           HN       GLY  12   1.582  -8.916  -3.278
   80   1HA   GLY  12          HA2       GLY  12  -0.313  -7.908  -4.248
   81   2HA   GLY  12          HA1       GLY  12  -1.242  -9.235  -3.544
   82    H    MET  13           HN       MET  13   0.600  -6.807  -1.646
   83    HA   MET  13           HA       MET  13  -1.792  -5.680  -0.377
   84   1HB   MET  13          HB1       MET  13   1.062  -4.913  -0.439
   85   2HB   MET  13          HB2       MET  13  -0.070  -4.003   0.308
   86   1HG   MET  13          HG1       MET  13  -0.524  -5.759   1.806
   87   2HG   MET  13          HG2       MET  13   0.550  -6.716   1.034
   88   1HE   MET  13          HE1       MET  13   1.795  -7.406   3.242
   89   2HE   MET  13          HE2       MET  13   2.342  -6.206   4.435
   90   3HE   MET  13          HE3       MET  13   0.603  -6.430   4.133
   91    H    CYS  14           HN       CYS  14  -2.112  -3.352  -0.512
   92    HA   CYS  14           HA       CYS  14  -2.169  -2.351  -3.320
   93   1HB   CYS  14          HB1       CYS  14  -4.179  -1.294  -1.671
   94   2HB   CYS  14          HB2       CYS  14  -4.329  -2.125  -3.070
   95    H    CYS  15           HN       CYS  15  -1.463  -0.284  -3.668
   96    HA   CYS  15           HA       CYS  15  -0.112   1.164  -1.513
   97   1HB   CYS  15          HB1       CYS  15   0.745   1.136  -3.781
   98   2HB   CYS  15          HB2       CYS  15  -0.590   1.893  -4.341
   99    H    SER  16           HN       SER  16  -0.849   2.910  -0.451
  100    HA   SER  16           HA       SER  16  -3.662   3.766  -0.917
  101   1HB   SER  16          HB1       SER  16  -3.762   3.961   1.434
  102   2HB   SER  16          HB2       SER  16  -3.211   2.469   1.062
  103    HG   SER  16           HG       SER  16  -1.215   2.916   1.735
  104    H    GLN  17           HN       GLN  17  -4.313   5.866  -0.068
  105    HA   GLN  17           HA       GLN  17  -2.893   8.048  -1.212
  106   1HB   GLN  17          HB1       GLN  17  -4.553   9.364  -0.126
  107   2HB   GLN  17          HB2       GLN  17  -5.276   8.009  -0.682
  108   1HG   GLN  17          HG1       GLN  17  -5.195   7.110   1.552
  109   2HG   GLN  17          HG2       GLN  17  -4.605   8.542   2.071
  110   1HE2  GLN  17          1HE2      GLN  17  -7.472   7.073   0.519
  111   2HE2  GLN  17          2HE2      GLN  17  -8.529   8.255   1.315
  112    H1   NAL  18           HD1      NAL  18  -3.403   5.080   3.410
  113    H3   NAL  18           HD2      NAL  18  -2.780   8.553   5.618
  114    H4   NAL  18           HE2      NAL  18  -5.151   8.765   5.966
  115    H5   NAL  18           HH2      NAL  18  -7.439   8.003   5.482
  116    H6   NAL  18           HP       NAL  18  -8.934   6.482   4.375
  117    H7   NAL  18           HH1      NAL  18  -8.050   4.689   3.034
  118    H8   NAL  18           HZ1      NAL  18  -5.671   4.392   2.846
  119   1H9   NAL  18          HB1       NAL  18  -1.136   5.725   3.877
  120   2H9   NAL  18          HB2       NAL  18  -0.817   7.061   4.978
  121    H10  NAL  18           HA       NAL  18  -1.072   8.693   3.227
  122   1HN   NAL  18          HN        NAL  18  -2.553   6.590   1.890
  123    H    GLY  19           HN       GLY  19  -0.209   6.915   0.555
  124   1HA   GLY  19          HA2       GLY  19   1.794   6.742  -0.549
  125   2HA   GLY  19          HA1       GLY  19   2.634   7.457   0.832
  126    H    TYR  20           HN       TYR  20   0.632   4.773   1.613
  127    HA   TYR  20           HA       TYR  20   3.050   3.042   2.067
  128   1HB   TYR  20          HB1       TYR  20   0.912   3.938   3.842
  129   2HB   TYR  20          HB2       TYR  20   1.460   2.413   4.042
  130    HD1  TYR  20           HD1      TYR  20   3.532   5.400   3.286
  131    HD2  TYR  20           HD2      TYR  20   2.316   2.479   6.226
  132    HE1  TYR  20           HE1      TYR  20   5.315   6.183   4.807
  133    HE2  TYR  20           HE2      TYR  20   4.057   3.322   7.772
  134    HH   TYR  20           HH       TYR  20   5.733   4.883   8.093
  135    H    CYS  21           HN       CYS  21   2.669   0.807   2.227
  136    HA   CYS  21           HA       CYS  21   0.460  -0.236   0.541
  137   1HB   CYS  21          HB1       CYS  21   2.719  -1.631   1.832
  138   2HB   CYS  21          HB2       CYS  21   1.670  -2.292   0.769
  139    H    GLY  22           HN       GLY  22  -1.003  -1.783   1.279
  140   1HA   GLY  22          HA2       GLY  22  -0.564  -3.369   3.573
  141   2HA   GLY  22          HA1       GLY  22  -1.800  -2.177   3.983
  142    H    LYS  23           HN       LYS  23  -3.058  -4.405   4.116
  143    HA   LYS  23           HA       LYS  23  -4.158  -5.070   1.415
  144   1HB   LYS  23          HB1       LYS  23  -2.584  -6.740   2.689
  145   2HB   LYS  23          HB2       LYS  23  -3.974  -7.163   3.436
  146   1HG   LYS  23          HG1       LYS  23  -4.954  -7.717   1.354
  147   2HG   LYS  23          HG2       LYS  23  -3.608  -7.224   0.569
  148   1HD   LYS  23          HD1       LYS  23  -2.355  -8.961   1.609
  149   2HD   LYS  23          HD2       LYS  23  -3.689  -9.446   2.419
  150   1HE   LYS  23          HE1       LYS  23  -3.563 -10.926   0.697
  151   2HE   LYS  23          HE2       LYS  23  -4.683  -9.854   0.184
  152   1HZ   LYS  23          HZ1       LYS  23  -1.913  -9.871  -0.641
  153   2HZ   LYS  23          HZ2       LYS  23  -3.185 -10.346  -1.560
  154   3HZ   LYS  23          HZ3       LYS  23  -3.014  -8.767  -1.152
  155    H    GLY  24           HN       GLY  24  -6.337  -5.622   1.322
  156   1HA   GLY  24          HA2       GLY  24  -8.580  -5.661   2.043
  157   2HA   GLY  24          HA1       GLY  24  -8.070  -5.249   3.683
  158    HA   PRO  25           HA       PRO  25 -10.054  -1.822   1.130
  159   1HB   PRO  25          HB1       PRO  25 -12.000  -1.108   2.851
  160   2HB   PRO  25          HB2       PRO  25 -12.172  -2.313   1.762
  161   1HG   PRO  25          HG1       PRO  25 -11.534  -2.575   4.571
  162   2HG   PRO  25          HG2       PRO  25 -12.583  -3.483   3.708
  163   1HD   PRO  25          HD1       PRO  25 -10.190  -4.390   4.161
  164   2HD   PRO  25          HD2       PRO  25 -10.907  -4.701   2.727
  165    H    LYS  26           HN       LYS  26  -8.797  -1.693   4.389
  166    HA   LYS  26           HA       LYS  26  -8.577   1.102   4.810
  167   1HB   LYS  26          HB1       LYS  26  -8.003  -0.648   6.398
  168   2HB   LYS  26          HB2       LYS  26  -6.697  -1.076   5.517
  169   1HG   LYS  26          HG1       LYS  26  -5.880   0.053   7.306
  170   2HG   LYS  26          HG2       LYS  26  -5.749   1.083   6.045
  171   1HD   LYS  26          HD1       LYS  26  -7.904   1.280   7.919
  172   2HD   LYS  26          HD2       LYS  26  -6.483   2.046   8.170
  173   1HE   LYS  26          HE1       LYS  26  -8.358   2.627   6.070
  174   2HE   LYS  26          HE2       LYS  26  -8.014   3.589   7.345
  175   1HZ   LYS  26          HZ1       LYS  26  -6.280   2.976   5.143
  176   2HZ   LYS  26          HZ2       LYS  26  -6.917   4.436   5.461
  177   3HZ   LYS  26          HZ3       LYS  26  -5.772   3.817   6.480
  178    H    TYR  27           HN       TYR  27  -6.989  -0.886   2.496
  179    HA   TYR  27           HA       TYR  27  -5.135   1.329   1.682
  180   1HB   TYR  27          HB1       TYR  27  -4.528  -1.558   1.733
  181   2HB   TYR  27          HB2       TYR  27  -3.494  -0.343   1.384
  182    HD1  TYR  27           HD1      TYR  27  -2.626   1.210   3.138
  183    HD2  TYR  27           HD2      TYR  27  -4.999  -2.287   3.988
  184    HE1  TYR  27           HE1      TYR  27  -1.885   1.290   5.501
  185    HE2  TYR  27           HE2      TYR  27  -4.238  -2.221   6.366
  186    HH   TYR  27           HH       TYR  27  -1.941   0.226   7.547
  187    H    CYS  28           HN       CYS  28  -6.841  -1.675   0.586
  188    HA   CYS  28           HA       CYS  28  -6.596  -1.005  -2.230
  189   1HB   CYS  28          HB1       CYS  28  -8.012  -2.981  -0.650
  190   2HB   CYS  28          HB2       CYS  28  -8.591  -2.676  -2.147
  191    H    GLY  29           HN       GLY  29  -8.657   0.342   0.249
  192   1HA   GLY  29          HA2       GLY  29 -10.556   1.514  -1.644
  193   2HA   GLY  29          HA1       GLY  29 -10.315   1.933   0.051
  194    H    ARG  30           HN       ARG  30  -7.271   1.957  -1.268
  195    HA   ARG  30           HA       ARG  30  -5.719   3.419  -1.642
  196   1HB   ARG  30          HB1       ARG  30  -6.645   3.532  -3.771
  197   2HB   ARG  30          HB2       ARG  30  -7.747   4.662  -3.348
  198   1HG   ARG  30          HG1       ARG  30  -5.006   5.354  -3.121
  199   2HG   ARG  30          HG2       ARG  30  -5.649   5.302  -4.621
  200   1HD   ARG  30          HD1       ARG  30  -6.522   7.063  -2.515
  201   2HD   ARG  30          HD2       ARG  30  -5.638   7.518  -3.811
  202    HE   ARG  30           HE       ARG  30  -7.472   7.452  -5.192
  203   1HH1  ARG  30          2HH2      ARG  30  -8.449   6.523  -1.913
  204   2HH1  ARG  30          1HH2      ARG  30 -10.126   6.717  -2.299
  205   1HH2  ARG  30          2HH1      ARG  30  -9.645   7.627  -5.557
  206   2HH2  ARG  30          1HH1      ARG  30 -10.778   7.317  -4.284
  Start of MODEL    7
    1   1H    VAL   1           H1       VAL   1   2.606  -0.018   4.706
    2   2H    VAL   1           H2       VAL   1   4.176  -0.562   4.746
    3   3H    VAL   1           H3       VAL   1   3.754   0.637   3.723
    4    HA   VAL   1           HA       VAL   1   3.266   2.094   5.591
    5    HB   VAL   1           HB       VAL   1   2.801   0.255   7.170
    6   1HG1  VAL   1          1HG1      VAL   1   4.612  -0.865   8.384
    7   2HG1  VAL   1          2HG1      VAL   1   4.679  -1.283   6.671
    8   3HG1  VAL   1          3HG1      VAL   1   5.828  -0.104   7.348
    9   1HG2  VAL   1          1HG2      VAL   1   4.951   2.135   8.222
   10   2HG2  VAL   1          2HG2      VAL   1   3.236   2.561   7.976
   11   3HG2  VAL   1          3HG2      VAL   1   3.686   1.317   9.145
   12    H    GLY   2           HN       GLY   2   4.982   3.582   6.219
   13   1HA   GLY   2          HA2       GLY   2   7.093   4.510   6.092
   14   2HA   GLY   2          HA1       GLY   2   7.762   2.971   5.549
   15    H    GLU   3           HN       GLU   3   6.326   2.434   3.254
   16    HA   GLU   3           HA       GLU   3   6.113   4.787   1.508
   17   1HB   GLU   3          HB1       GLU   3   8.545   3.791   1.691
   18   2HB   GLU   3          HB2       GLU   3   7.979   2.715   0.601
   19   1HG   GLU   3          HG1       GLU   3   7.387   4.639  -0.803
   20   2HG   GLU   3          HG2       GLU   3   8.270   5.552   0.224
   21    H    CYS   4           HN       CYS   4   5.229   4.187  -0.617
   22    HA   CYS   4           HA       CYS   4   4.882   1.292  -1.203
   23   1HB   CYS   4          HB1       CYS   4   3.864   3.592  -2.745
   24   2HB   CYS   4          HB2       CYS   4   3.641   2.015  -3.107
   25    H    VAL   5           HN       VAL   5   6.619   0.499  -2.182
   26    HA   VAL   5           HA       VAL   5   9.057   1.966  -2.306
   27    HB   VAL   5           HB       VAL   5   8.432  -0.796  -3.410
   28   1HG1  VAL   5          1HG1      VAL   5  10.548   0.081  -4.330
   29   2HG1  VAL   5          2HG1      VAL   5  11.083   0.553  -2.699
   30   3HG1  VAL   5          3HG1      VAL   5  10.883  -1.160  -3.126
   31   1HG2  VAL   5          1HG2      VAL   5   9.517   0.097  -0.700
   32   2HG2  VAL   5          2HG2      VAL   5   7.948  -0.681  -0.998
   33   3HG2  VAL   5          3HG2      VAL   5   9.438  -1.584  -1.272
   34    H    ARG   6           HN       ARG   6   9.049   3.624  -3.641
   35    HA   ARG   6           HA       ARG   6   8.945   4.947  -5.475
   36   1HB   ARG   6          HB1       ARG   6   9.892   2.694  -7.104
   37   2HB   ARG   6          HB2       ARG   6  10.178   4.287  -7.318
   38   1HG   ARG   6          HG1       ARG   6  11.397   2.581  -5.358
   39   2HG   ARG   6          HG2       ARG   6  12.150   3.331  -6.598
   40   1HD   ARG   6          HD1       ARG   6  12.707   4.924  -5.225
   41   2HD   ARG   6          HD2       ARG   6  11.127   5.318  -5.096
   42    HE   ARG   6           HE       ARG   6  10.968   4.373  -3.002
   43   1HH1  ARG   6          2HH2      ARG   6  14.063   3.459  -4.448
   44   2HH1  ARG   6          1HH2      ARG   6  14.634   2.771  -2.965
   45   1HH2  ARG   6          2HH1      ARG   6  11.800   3.460  -1.158
   46   2HH2  ARG   6          1HH1      ARG   6  13.389   2.771  -1.157
   47    H    GLY   7           HN       GLY   7   6.573   3.536  -4.777
   48   1HA   GLY   7          HA2       GLY   7   4.394   4.003  -5.702
   49   2HA   GLY   7          HA1       GLY   7   4.999   3.667  -7.319
   50    H    ARG   8           HN       ARG   8   6.354   1.122  -5.687
   51    HA   ARG   8           HA       ARG   8   3.997  -0.585  -6.292
   52   1HB   ARG   8          HB1       ARG   8   6.679  -0.802  -6.975
   53   2HB   ARG   8          HB2       ARG   8   6.438  -1.992  -5.883
   54   1HG   ARG   8          HG1       ARG   8   4.396  -2.483  -7.313
   55   2HG   ARG   8          HG2       ARG   8   5.252  -1.704  -8.466
   56   1HD   ARG   8          HD1       ARG   8   5.828  -3.849  -8.861
   57   2HD   ARG   8          HD2       ARG   8   7.056  -3.365  -7.900
   58    HE   ARG   8           HE       ARG   8   5.438  -4.346  -6.044
   59   1HH1  ARG   8          2HH2      ARG   8   6.431  -5.919  -9.049
   60   2HH1  ARG   8          1HH2      ARG   8   6.025  -7.477  -8.411
   61   1HH2  ARG   8          2HH1      ARG   8   4.929  -6.288  -5.366
   62   2HH2  ARG   8          1HH1      ARG   8   5.189  -7.681  -6.362
   63    H    CYS   9           HN       CYS   9   3.927  -2.684  -5.053
   64    HA   CYS   9           HA       CYS   9   4.841  -2.514  -2.261
   65   1HB   CYS   9          HB1       CYS   9   2.053  -2.956  -3.158
   66   2HB   CYS   9          HB2       CYS   9   2.567  -3.370  -1.664
   67    HA   PRO  10           HA       PRO  10   5.831  -6.869  -2.624
   68   1HB   PRO  10          HB1       PRO  10   3.939  -7.359  -0.416
   69   2HB   PRO  10          HB2       PRO  10   5.459  -7.926  -0.606
   70   1HG   PRO  10          HG1       PRO  10   5.078  -5.929   0.996
   71   2HG   PRO  10          HG2       PRO  10   6.408  -5.923   0.048
   72   1HD   PRO  10          HD1       PRO  10   3.960  -4.466  -0.355
   73   2HD   PRO  10          HD2       PRO  10   5.480  -3.963  -0.677
   74    H    SER  11           HN       SER  11   5.032  -8.738  -3.636
   75    HA   SER  11           HA       SER  11   2.776  -8.395  -5.323
   76   1HB   SER  11          HB1       SER  11   4.419 -10.795  -4.812
   77   2HB   SER  11          HB2       SER  11   3.375 -10.621  -6.056
   78    HG   SER  11           HG       SER  11   5.522 -10.189  -6.620
   79    H    GLY  12           HN       GLY  12   1.089  -8.025  -3.862
   80   1HA   GLY  12          HA2       GLY  12  -1.019  -9.641  -3.527
   81   2HA   GLY  12          HA1       GLY  12   0.005 -10.243  -2.220
   82    H    MET  13           HN       MET  13   1.030  -7.248  -2.021
   83    HA   MET  13           HA       MET  13  -1.043  -6.250  -0.167
   84   1HB   MET  13          HB1       MET  13   1.656  -5.317  -0.925
   85   2HB   MET  13          HB2       MET  13   0.674  -4.466   0.065
   86   1HG   MET  13          HG1       MET  13   1.562  -7.144   0.630
   87   2HG   MET  13          HG2       MET  13   2.270  -5.813   1.257
   88   1HE   MET  13          HE1       MET  13   1.346  -8.304   2.987
   89   2HE   MET  13          HE2       MET  13   2.150  -6.881   3.695
   90   3HE   MET  13          HE3       MET  13   0.623  -7.475   4.382
   91    H    CYS  14           HN       CYS  14  -1.376  -3.768  -0.377
   92    HA   CYS  14           HA       CYS  14  -1.739  -2.819  -3.171
   93   1HB   CYS  14          HB1       CYS  14  -3.582  -2.373  -0.912
   94   2HB   CYS  14          HB2       CYS  14  -3.735  -1.755  -2.416
   95    H    CYS  15           HN       CYS  15  -1.833  -0.387  -3.211
   96    HA   CYS  15           HA       CYS  15  -0.022   0.845  -1.193
   97   1HB   CYS  15          HB1       CYS  15   0.728   0.923  -3.486
   98   2HB   CYS  15          HB2       CYS  15  -0.636   1.688  -3.956
   99    H    SER  16           HN       SER  16  -0.984   2.109   0.278
  100    HA   SER  16           HA       SER  16  -3.791   2.693   0.134
  101   1HB   SER  16          HB1       SER  16  -3.396   3.794   2.240
  102   2HB   SER  16          HB2       SER  16  -2.610   2.362   2.228
  103    HG   SER  16           HG       SER  16  -0.727   3.416   1.681
  104    H    GLN  17           HN       GLN  17  -4.761   4.660   0.599
  105    HA   GLN  17           HA       GLN  17  -4.413   6.979  -0.928
  106   1HB   GLN  17          HB1       GLN  17  -6.025   7.807   0.630
  107   2HB   GLN  17          HB2       GLN  17  -6.394   6.256   0.273
  108   1HG   GLN  17          HG1       GLN  17  -5.220   5.713   2.423
  109   2HG   GLN  17          HG2       GLN  17  -5.431   7.295   2.770
  110   1HE2  GLN  17          1HE2      GLN  17  -6.860   4.222   3.113
  111   2HE2  GLN  17          2HE2      GLN  17  -8.532   4.864   3.226
  112    H1   NAL  18           HD1      NAL  18  -2.514   5.037   4.470
  113    H3   NAL  18           HD2      NAL  18  -2.795   9.194   4.439
  114    H4   NAL  18           HE2      NAL  18  -4.910   9.072   5.581
  115    H5   NAL  18           HH2      NAL  18  -6.686   7.732   6.602
  116    H6   NAL  18           HP       NAL  18  -7.535   5.590   7.293
  117    H7   NAL  18           HH1      NAL  18  -6.314   3.586   6.770
  118    H8   NAL  18           HZ1      NAL  18  -4.277   3.707   5.495
  119   1H9   NAL  18          HB2       NAL  18  -0.676   6.223   3.647
  120   2H9   NAL  18          HB1       NAL  18  -0.483   7.881   4.193
  121    H10  NAL  18           HA       NAL  18  -1.453   8.767   2.201
  122   1HN   NAL  18          HN        NAL  18  -2.332   5.981   1.594
  123    H    GLY  19           HN       GLY  19  -0.688   6.382  -0.024
  124   1HA   GLY  19          HA2       GLY  19   1.228   6.004  -1.276
  125   2HA   GLY  19          HA1       GLY  19   2.041   7.318  -0.420
  126    H    TYR  20           HN       TYR  20   0.602   4.747   1.368
  127    HA   TYR  20           HA       TYR  20   3.214   3.434   2.056
  128   1HB   TYR  20          HB1       TYR  20   0.950   4.298   3.702
  129   2HB   TYR  20          HB2       TYR  20   1.781   2.968   4.158
  130    HD1  TYR  20           HD1      TYR  20   2.061   4.065   6.367
  131    HD2  TYR  20           HD2      TYR  20   3.762   5.658   2.726
  132    HE1  TYR  20           HE1      TYR  20   3.714   5.400   7.686
  133    HE2  TYR  20           HE2      TYR  20   5.341   6.983   4.028
  134    HH   TYR  20           HH       TYR  20   6.167   7.442   6.106
  135    H    CYS  21           HN       CYS  21   3.264   1.231   1.588
  136    HA   CYS  21           HA       CYS  21   1.053  -0.173   0.580
  137   1HB   CYS  21          HB1       CYS  21   3.459  -1.250   1.907
  138   2HB   CYS  21          HB2       CYS  21   2.418  -2.149   1.027
  139    H    GLY  22           HN       GLY  22  -0.244  -1.890   1.305
  140   1HA   GLY  22          HA2       GLY  22  -0.130  -3.243   3.754
  141   2HA   GLY  22          HA1       GLY  22  -1.296  -1.935   3.986
  142    H    LYS  23           HN       LYS  23  -2.964  -3.657   4.219
  143    HA   LYS  23           HA       LYS  23  -4.175  -4.212   1.622
  144   1HB   LYS  23          HB1       LYS  23  -2.940  -6.299   3.026
  145   2HB   LYS  23          HB2       LYS  23  -4.550  -6.553   3.133
  146   1HG   LYS  23          HG1       LYS  23  -3.172  -6.196   0.627
  147   2HG   LYS  23          HG2       LYS  23  -3.539  -7.663   1.246
  148   1HD   LYS  23          HD1       LYS  23  -5.894  -6.963   1.135
  149   2HD   LYS  23          HD2       LYS  23  -5.382  -5.713   0.217
  150   1HE   LYS  23          HE1       LYS  23  -5.107  -8.491  -0.502
  151   2HE   LYS  23          HE2       LYS  23  -6.210  -7.472  -1.144
  152   1HZ   LYS  23          HZ1       LYS  23  -4.519  -7.650  -2.686
  153   2HZ   LYS  23          HZ2       LYS  23  -4.331  -6.166  -1.999
  154   3HZ   LYS  23          HZ3       LYS  23  -3.372  -7.443  -1.552
  155    H    GLY  24           HN       GLY  24  -6.418  -5.249   2.035
  156   1HA   GLY  24          HA2       GLY  24  -8.571  -4.932   2.930
  157   2HA   GLY  24          HA1       GLY  24  -7.892  -3.986   4.263
  158    HA   PRO  25           HA       PRO  25  -9.798  -1.482   0.660
  159   1HB   PRO  25          HB1       PRO  25 -11.716  -0.195   2.070
  160   2HB   PRO  25          HB2       PRO  25 -11.971  -1.606   1.289
  161   1HG   PRO  25          HG1       PRO  25 -11.458  -1.235   4.108
  162   2HG   PRO  25          HG2       PRO  25 -12.528  -2.261   3.425
  163   1HD   PRO  25          HD1       PRO  25 -10.224  -3.163   4.235
  164   2HD   PRO  25          HD2       PRO  25 -10.906  -3.787   2.889
  165    H    LYS  26           HN       LYS  26  -9.159  -0.453   3.975
  166    HA   LYS  26           HA       LYS  26  -8.528   2.261   3.626
  167   1HB   LYS  26          HB1       LYS  26  -7.599   0.189   5.521
  168   2HB   LYS  26          HB2       LYS  26  -7.104   1.739   5.661
  169   1HG   LYS  26          HG1       LYS  26  -9.912   1.158   5.553
  170   2HG   LYS  26          HG2       LYS  26  -9.121   1.033   6.976
  171   1HD   LYS  26          HD1       LYS  26  -8.769   3.268   7.118
  172   2HD   LYS  26          HD2       LYS  26  -8.927   3.485   5.506
  173   1HE   LYS  26          HE1       LYS  26 -11.213   2.685   7.037
  174   2HE   LYS  26          HE2       LYS  26 -10.797   4.264   6.995
  175   1HZ   LYS  26          HZ1       LYS  26 -12.424   3.770   5.301
  176   2HZ   LYS  26          HZ2       LYS  26 -10.981   4.244   4.614
  177   3HZ   LYS  26          HZ3       LYS  26 -11.337   2.732   4.582
  178    H    TYR  27           HN       TYR  27  -6.632  -0.478   2.622
  179    HA   TYR  27           HA       TYR  27  -4.411   1.346   1.849
  180   1HB   TYR  27          HB1       TYR  27  -4.303  -1.499   2.574
  181   2HB   TYR  27          HB2       TYR  27  -3.048  -0.672   1.935
  182    HD1  TYR  27           HD1      TYR  27  -1.560   0.684   3.247
  183    HD2  TYR  27           HD2      TYR  27  -5.195  -0.968   4.881
  184    HE1  TYR  27           HE1      TYR  27  -0.905   1.469   5.511
  185    HE2  TYR  27           HE2      TYR  27  -4.535  -0.191   7.139
  186    HH   TYR  27           HH       TYR  27  -2.938   0.921   8.383
  187    H    CYS  28           HN       CYS  28  -7.007  -0.234   0.523
  188    HA   CYS  28           HA       CYS  28  -5.613  -0.517  -2.105
  189   1HB   CYS  28          HB1       CYS  28  -6.492  -2.562  -0.713
  190   2HB   CYS  28          HB2       CYS  28  -7.872  -2.231  -1.522
  191    H    GLY  29           HN       GLY  29  -8.055   1.240  -0.545
  192   1HA   GLY  29          HA2       GLY  29  -8.666   2.579  -3.039
  193   2HA   GLY  29          HA1       GLY  29 -10.025   1.604  -2.490
  194    H    ARG  30           HN       ARG  30  -9.990   2.066   0.330
  195    HA   ARG  30           HA       ARG  30 -10.273   4.967   0.674
  196   1HB   ARG  30          HB1       ARG  30 -12.292   3.765  -0.509
  197   2HB   ARG  30          HB2       ARG  30 -12.722   3.416   1.028
  198   1HG   ARG  30          HG1       ARG  30 -12.355   6.078   0.013
  199   2HG   ARG  30          HG2       ARG  30 -13.809   5.366   0.227
  200   1HD   ARG  30          HD1       ARG  30 -13.720   6.639   2.055
  201   2HD   ARG  30          HD2       ARG  30 -13.082   5.256   2.644
  202    HE   ARG  30           HE       ARG  30 -10.931   6.134   2.647
  203   1HH1  ARG  30          2HH2      ARG  30 -13.378   8.573   1.856
  204   2HH1  ARG  30          1HH2      ARG  30 -12.268   9.883   2.082
  205   1HH2  ARG  30          2HH1      ARG  30  -9.574   7.925   2.869
  206   2HH2  ARG  30          1HH1      ARG  30 -10.188   9.528   2.636
  Start of MODEL    8
    1   1H    VAL   1           H1       VAL   1   0.287   0.328   6.552
    2   2H    VAL   1           H2       VAL   1   1.077  -1.126   6.548
    3   3H    VAL   1           H3       VAL   1   0.932  -0.302   5.158
    4    HA   VAL   1           HA       VAL   1   2.371   1.460   5.989
    5    HB   VAL   1           HB       VAL   1   3.654   1.022   8.062
    6   1HG1  VAL   1          1HG1      VAL   1   1.963   1.830   9.593
    7   2HG1  VAL   1          2HG1      VAL   1   1.731   2.584   8.011
    8   3HG1  VAL   1          3HG1      VAL   1   0.655   1.268   8.542
    9   1HG2  VAL   1          1HG2      VAL   1   3.244  -1.437   8.284
   10   2HG2  VAL   1          2HG2      VAL   1   2.860  -0.534   9.751
   11   3HG2  VAL   1          3HG2      VAL   1   1.549  -1.099   8.710
   12    H    GLY   2           HN       GLY   2   4.779   1.233   6.067
   13   1HA   GLY   2          HA2       GLY   2   6.565   0.327   4.758
   14   2HA   GLY   2          HA1       GLY   2   5.504  -0.974   4.199
   15    H    GLU   3           HN       GLU   3   6.778   2.023   3.444
   16    HA   GLU   3           HA       GLU   3   5.127   3.447   1.760
   17   1HB   GLU   3          HB1       GLU   3   7.538   3.757   2.199
   18   2HB   GLU   3          HB2       GLU   3   7.891   2.549   1.157
   19   1HG   GLU   3          HG1       GLU   3   6.718   3.982  -0.536
   20   2HG   GLU   3          HG2       GLU   3   6.977   5.188   0.534
   21    H    CYS   4           HN       CYS   4   4.268   3.223  -0.338
   22    HA   CYS   4           HA       CYS   4   4.446   0.694  -1.802
   23   1HB   CYS   4          HB1       CYS   4   3.736   3.307  -2.933
   24   2HB   CYS   4          HB2       CYS   4   3.350   1.826  -3.504
   25    H    VAL   5           HN       VAL   5   6.523   0.163  -1.996
   26    HA   VAL   5           HA       VAL   5   8.732   1.803  -1.780
   27    HB   VAL   5           HB       VAL   5   8.749  -0.969  -3.034
   28   1HG1  VAL   5          1HG1      VAL   5  10.916   0.215  -3.262
   29   2HG1  VAL   5          2HG1      VAL   5  10.888   0.617  -1.528
   30   3HG1  VAL   5          3HG1      VAL   5  11.037  -1.072  -2.062
   31   1HG2  VAL   5          1HG2      VAL   5   8.834  -0.109  -0.110
   32   2HG2  VAL   5          2HG2      VAL   5   7.587  -1.100  -0.895
   33   3HG2  VAL   5          3HG2      VAL   5   9.215  -1.743  -0.698
   34    H    ARG   6           HN       ARG   6   8.827   3.491  -3.097
   35    HA   ARG   6           HA       ARG   6   8.853   4.805  -4.963
   36   1HB   ARG   6          HB1       ARG   6  10.605   2.785  -6.199
   37   2HB   ARG   6          HB2       ARG   6  10.598   4.397  -6.462
   38   1HG   ARG   6          HG1       ARG   6  11.558   3.093  -4.082
   39   2HG   ARG   6          HG2       ARG   6  12.488   3.837  -5.200
   40   1HD   ARG   6          HD1       ARG   6  12.351   5.709  -4.102
   41   2HD   ARG   6          HD2       ARG   6  10.722   5.678  -4.210
   42    HE   ARG   6           HE       ARG   6  10.497   4.785  -2.074
   43   1HH1  ARG   6          2HH2      ARG   6  13.926   4.977  -2.920
   44   2HH1  ARG   6          1HH2      ARG   6  14.413   4.769  -1.271
   45   1HH2  ARG   6          2HH1      ARG   6  11.228   4.611   0.004
   46   2HH2  ARG   6          1HH1      ARG   6  12.927   4.568   0.337
   47    H    GLY   7           HN       GLY   7   6.638   3.214  -4.778
   48   1HA   GLY   7          HA2       GLY   7   4.798   3.707  -6.259
   49   2HA   GLY   7          HA1       GLY   7   5.713   3.099  -7.620
   50    H    ARG   8           HN       ARG   8   6.262   0.671  -5.342
   51    HA   ARG   8           HA       ARG   8   3.816  -0.799  -6.154
   52   1HB   ARG   8          HB1       ARG   8   5.297  -2.536  -6.813
   53   2HB   ARG   8          HB2       ARG   8   5.756  -1.166  -7.575
   54   1HG   ARG   8          HG1       ARG   8   7.464  -0.962  -5.790
   55   2HG   ARG   8          HG2       ARG   8   7.133  -2.527  -5.460
   56   1HD   ARG   8          HD1       ARG   8   9.086  -2.222  -6.838
   57   2HD   ARG   8          HD2       ARG   8   7.969  -3.214  -7.498
   58    HE   ARG   8           HE       ARG   8   7.930  -1.930  -9.315
   59   1HH1  ARG   8          2HH2      ARG   8   8.824   0.281  -6.690
   60   2HH1  ARG   8          1HH2      ARG   8   8.858   1.628  -7.777
   61   1HH2  ARG   8          2HH1      ARG   8   7.960  -0.110 -10.564
   62   2HH2  ARG   8          1HH1      ARG   8   8.390   1.418  -9.871
   63    H    CYS   9           HN       CYS   9   3.641  -3.012  -5.121
   64    HA   CYS   9           HA       CYS   9   4.496  -3.025  -2.297
   65   1HB   CYS   9          HB1       CYS   9   1.752  -3.414  -3.335
   66   2HB   CYS   9          HB2       CYS   9   2.207  -3.791  -1.812
   67    HA   PRO  10           HA       PRO  10   5.319  -7.395  -2.942
   68   1HB   PRO  10          HB1       PRO  10   3.670  -7.885  -0.554
   69   2HB   PRO  10          HB2       PRO  10   5.164  -8.448  -0.899
   70   1HG   PRO  10          HG1       PRO  10   4.933  -6.478   0.768
   71   2HG   PRO  10          HG2       PRO  10   6.175  -6.464  -0.293
   72   1HD   PRO  10          HD1       PRO  10   3.700  -5.004  -0.470
   73   2HD   PRO  10          HD2       PRO  10   5.192  -4.483  -0.883
   74    H    SER  11           HN       SER  11   4.334  -9.339  -3.667
   75    HA   SER  11           HA       SER  11   2.315  -9.169  -5.408
   76   1HB   SER  11          HB1       SER  11   3.126 -11.627  -3.989
   77   2HB   SER  11          HB2       SER  11   2.430 -11.551  -5.465
   78    HG   SER  11           HG       SER  11   4.640 -11.771  -5.695
   79    H    GLY  12           HN       GLY  12   0.417  -8.228  -4.780
   80   1HA   GLY  12          HA2       GLY  12  -1.918  -8.762  -4.569
   81   2HA   GLY  12          HA1       GLY  12  -1.534  -9.997  -3.376
   82    H    MET  13           HN       MET  13   0.366  -7.467  -2.385
   83    HA   MET  13           HA       MET  13  -1.665  -6.369  -0.517
   84   1HB   MET  13          HB1       MET  13   1.205  -5.732  -0.845
   85   2HB   MET  13          HB2       MET  13   0.220  -5.062   0.272
   86   1HG   MET  13          HG1       MET  13  -0.110  -7.215   1.243
   87   2HG   MET  13          HG2       MET  13   0.929  -7.849   0.153
   88   1HE   MET  13          HE1       MET  13   0.463  -5.807   3.349
   89   2HE   MET  13          HE2       MET  13   2.104  -5.217   3.699
   90   3HE   MET  13          HE3       MET  13   1.202  -4.546   2.327
   91    H    CYS  14           HN       CYS  14  -1.887  -4.069  -0.365
   92    HA   CYS  14           HA       CYS  14  -2.328  -2.938  -3.096
   93   1HB   CYS  14          HB1       CYS  14  -4.102  -2.821  -0.746
   94   2HB   CYS  14          HB2       CYS  14  -4.464  -2.388  -2.279
   95    H    CYS  15           HN       CYS  15  -1.489  -1.014  -3.485
   96    HA   CYS  15           HA       CYS  15  -0.283   0.657  -1.458
   97   1HB   CYS  15          HB1       CYS  15   0.526   0.515  -3.745
   98   2HB   CYS  15          HB2       CYS  15  -0.837   1.217  -4.309
   99    H    SER  16           HN       SER  16  -1.558   1.704  -0.041
  100    HA   SER  16           HA       SER  16  -4.178   2.790  -0.774
  101   1HB   SER  16          HB1       SER  16  -4.211   3.605   1.443
  102   2HB   SER  16          HB2       SER  16  -3.708   2.051   1.470
  103    HG   SER  16           HG       SER  16  -1.718   2.584   2.041
  104    H    GLN  17           HN       GLN  17  -4.771   5.006  -0.650
  105    HA   GLN  17           HA       GLN  17  -3.336   6.712  -2.355
  106   1HB   GLN  17          HB1       GLN  17  -5.023   8.288  -1.745
  107   2HB   GLN  17          HB2       GLN  17  -5.699   6.817  -1.964
  108   1HG   GLN  17          HG1       GLN  17  -5.138   7.568   0.716
  109   2HG   GLN  17          HG2       GLN  17  -6.395   8.318  -0.009
  110   1HE2  GLN  17          1HE2      GLN  17  -8.381   7.449   0.641
  111   2HE2  GLN  17          2HE2      GLN  17  -8.501   5.698   0.828
  112    H1   NAL  18           HD1      NAL  18  -3.689   5.367   2.921
  113    H3   NAL  18           HD2      NAL  18  -3.036   9.299   4.127
  114    H4   NAL  18           HE2      NAL  18  -5.359   9.515   4.716
  115    H5   NAL  18           HH2      NAL  18  -7.613   8.549   4.831
  116    H6   NAL  18           HP       NAL  18  -9.089   6.672   4.537
  117    H7   NAL  18           HH1      NAL  18  -8.246   4.611   3.626
  118    H8   NAL  18           HZ1      NAL  18  -5.930   4.427   3.009
  119   1H9   NAL  18          HB1       NAL  18  -1.410   6.157   3.081
  120   2H9   NAL  18          HB2       NAL  18  -1.086   7.757   3.734
  121    H10  NAL  18           HA       NAL  18  -1.571   8.810   1.601
  122   1HN   NAL  18          HN        NAL  18  -2.833   6.253   0.982
  123    H    GLY  19           HN       GLY  19  -0.530   6.165  -0.277
  124   1HA   GLY  19          HA2       GLY  19   1.572   5.970  -1.314
  125   2HA   GLY  19          HA1       GLY  19   2.315   6.979  -0.074
  126    H    TYR  20           HN       TYR  20   0.268   4.375   1.014
  127    HA   TYR  20           HA       TYR  20   2.671   2.766   1.804
  128   1HB   TYR  20          HB1       TYR  20   0.494   3.723   3.545
  129   2HB   TYR  20          HB2       TYR  20   1.501   2.511   3.972
  130    HD1  TYR  20           HD1      TYR  20   3.869   2.873   4.489
  131    HD2  TYR  20           HD2      TYR  20   1.192   6.080   3.479
  132    HE1  TYR  20           HE1      TYR  20   5.592   4.541   5.216
  133    HE2  TYR  20           HE2      TYR  20   2.891   7.734   4.168
  134    HH   TYR  20           HH       TYR  20   5.039   8.041   4.948
  135    H    CYS  21           HN       CYS  21   2.518   0.644   1.742
  136    HA   CYS  21           HA       CYS  21   0.347  -0.680   0.374
  137   1HB   CYS  21          HB1       CYS  21   2.729  -1.708   1.795
  138   2HB   CYS  21          HB2       CYS  21   1.774  -2.594   0.809
  139    H    GLY  22           HN       GLY  22  -0.970  -2.368   1.172
  140   1HA   GLY  22          HA2       GLY  22  -0.679  -3.641   3.684
  141   2HA   GLY  22          HA1       GLY  22  -1.894  -2.384   3.868
  142    H    LYS  23           HN       LYS  23  -3.295  -4.169   4.361
  143    HA   LYS  23           HA       LYS  23  -4.855  -5.055   2.059
  144   1HB   LYS  23          HB1       LYS  23  -3.195  -6.886   3.072
  145   2HB   LYS  23          HB2       LYS  23  -4.450  -7.102   4.094
  146   1HG   LYS  23          HG1       LYS  23  -4.952  -8.569   2.457
  147   2HG   LYS  23          HG2       LYS  23  -5.823  -7.265   2.001
  148   1HD   LYS  23          HD1       LYS  23  -4.100  -6.683   0.444
  149   2HD   LYS  23          HD2       LYS  23  -3.273  -8.023   0.878
  150   1HE   LYS  23          HE1       LYS  23  -4.341  -8.761  -0.971
  151   2HE   LYS  23          HE2       LYS  23  -5.379  -9.234   0.197
  152   1HZ   LYS  23          HZ1       LYS  23  -6.783  -7.396  -0.226
  153   2HZ   LYS  23          HZ2       LYS  23  -5.686  -6.816  -1.320
  154   3HZ   LYS  23          HZ3       LYS  23  -6.512  -8.200  -1.623
  155    H    GLY  24           HN       GLY  24  -7.045  -6.003   3.042
  156   1HA   GLY  24          HA2       GLY  24  -8.892  -5.581   4.356
  157   2HA   GLY  24          HA1       GLY  24  -7.806  -5.008   5.629
  158    HA   PRO  25           HA       PRO  25 -10.817  -2.026   3.818
  159   1HB   PRO  25          HB1       PRO  25 -11.455  -0.678   6.096
  160   2HB   PRO  25          HB2       PRO  25 -12.226  -2.009   5.547
  161   1HG   PRO  25          HG1       PRO  25 -10.190  -1.882   7.586
  162   2HG   PRO  25          HG2       PRO  25 -11.520  -2.828   7.571
  163   1HD   PRO  25          HD1       PRO  25  -9.237  -3.857   6.904
  164   2HD   PRO  25          HD2       PRO  25 -10.584  -4.327   6.108
  165    H    LYS  26           HN       LYS  26  -8.241  -0.889   5.984
  166    HA   LYS  26           HA       LYS  26  -8.328   1.810   4.923
  167   1HB   LYS  26          HB1       LYS  26  -7.217   0.832   7.127
  168   2HB   LYS  26          HB2       LYS  26  -5.866   0.930   6.213
  169   1HG   LYS  26          HG1       LYS  26  -6.815   3.269   5.714
  170   2HG   LYS  26          HG2       LYS  26  -7.506   3.052   7.177
  171   1HD   LYS  26          HD1       LYS  26  -5.521   4.290   7.399
  172   2HD   LYS  26          HD2       LYS  26  -5.377   2.857   8.170
  173   1HE   LYS  26          HE1       LYS  26  -3.395   3.479   6.955
  174   2HE   LYS  26          HE2       LYS  26  -3.989   2.024   6.508
  175   1HZ   LYS  26          HZ1       LYS  26  -4.403   4.453   5.025
  176   2HZ   LYS  26          HZ2       LYS  26  -3.324   3.275   4.609
  177   3HZ   LYS  26          HZ3       LYS  26  -4.926   2.955   4.576
  178    H    TYR  27           HN       TYR  27  -7.288  -0.880   3.327
  179    HA   TYR  27           HA       TYR  27  -5.314   0.666   1.685
  180   1HB   TYR  27          HB1       TYR  27  -4.874  -2.057   2.731
  181   2HB   TYR  27          HB2       TYR  27  -3.849  -1.219   1.773
  182    HD1  TYR  27           HD1      TYR  27  -2.420   0.580   2.597
  183    HD2  TYR  27           HD2      TYR  27  -5.006  -1.728   5.149
  184    HE1  TYR  27           HE1      TYR  27  -1.159   1.374   4.578
  185    HE2  TYR  27           HE2      TYR  27  -3.706  -1.016   7.130
  186    HH   TYR  27           HH       TYR  27  -1.997   0.321   7.894
  187    H    CYS  28           HN       CYS  28  -7.469  -2.166   1.802
  188    HA   CYS  28           HA       CYS  28  -7.583  -2.135  -1.173
  189   1HB   CYS  28          HB1       CYS  28  -6.004  -3.793   0.135
  190   2HB   CYS  28          HB2       CYS  28  -7.365  -4.696   0.171
  191    H    GLY  29           HN       GLY  29  -9.482  -1.958   1.546
  192   1HA   GLY  29          HA2       GLY  29 -11.745  -2.455   1.954
  193   2HA   GLY  29          HA1       GLY  29 -11.857  -3.260   0.391
  194    H    ARG  30           HN       ARG  30 -10.246  -5.235   0.298
  195    HA   ARG  30           HA       ARG  30 -10.601  -6.953   2.718
  196   1HB   ARG  30          HB1       ARG  30 -12.091  -7.606   0.995
  197   2HB   ARG  30          HB2       ARG  30 -10.910  -7.652  -0.132
  198   1HG   ARG  30          HG1       ARG  30 -11.605  -9.822   0.456
  199   2HG   ARG  30          HG2       ARG  30 -10.028  -9.595   0.817
  200   1HD   ARG  30          HD1       ARG  30 -12.067  -9.418   2.843
  201   2HD   ARG  30          HD2       ARG  30 -11.320 -10.830   2.500
  202    HE   ARG  30           HE       ARG  30  -9.339  -8.956   2.909
  203   1HH1  ARG  30          2HH2      ARG  30 -11.637 -10.429   5.139
  204   2HH1  ARG  30          1HH2      ARG  30 -10.746  -9.799   6.483
  205   1HH2  ARG  30          2HH1      ARG  30  -8.370  -8.214   4.481
  206   2HH2  ARG  30          1HH1      ARG  30  -8.878  -8.530   6.106
  Start of MODEL    9
    1   1H    VAL   1           H1       VAL   1   5.638   4.202   6.943
    2   2H    VAL   1           H2       VAL   1   7.248   3.935   7.048
    3   3H    VAL   1           H3       VAL   1   6.357   4.141   8.429
    4    HA   VAL   1           HA       VAL   1   6.894   1.852   8.189
    5    HB   VAL   1           HB       VAL   1   4.689   0.825   8.189
    6   1HG1  VAL   1          1HG1      VAL   1   5.548   2.049  10.172
    7   2HG1  VAL   1          2HG1      VAL   1   4.655   3.500   9.646
    8   3HG1  VAL   1          3HG1      VAL   1   3.785   2.021  10.073
    9   1HG2  VAL   1          1HG2      VAL   1   3.537   2.040   6.372
   10   2HG2  VAL   1          2HG2      VAL   1   2.638   2.142   7.882
   11   3HG2  VAL   1          3HG2      VAL   1   3.572   3.540   7.332
   12    H    GLY   2           HN       GLY   2   5.161   0.088   6.401
   13   1HA   GLY   2          HA2       GLY   2   7.080  -0.275   4.317
   14   2HA   GLY   2          HA1       GLY   2   5.528  -1.094   4.492
   15    H    GLU   3           HN       GLU   3   7.021   1.920   3.351
   16    HA   GLU   3           HA       GLU   3   4.988   3.064   1.864
   17   1HB   GLU   3          HB1       GLU   3   6.759   3.988   0.502
   18   2HB   GLU   3          HB2       GLU   3   7.051   4.130   2.102
   19   1HG   GLU   3          HG1       GLU   3   8.829   2.771   2.032
   20   2HG   GLU   3          HG2       GLU   3   8.264   1.940   0.744
   21    H    CYS   4           HN       CYS   4   4.356   3.161  -0.293
   22    HA   CYS   4           HA       CYS   4   4.502   0.729  -1.918
   23   1HB   CYS   4          HB1       CYS   4   3.663   3.417  -2.772
   24   2HB   CYS   4          HB2       CYS   4   3.290   1.988  -3.470
   25    H    VAL   5           HN       VAL   5   6.550   0.223  -2.394
   26    HA   VAL   5           HA       VAL   5   8.729   1.989  -2.242
   27    HB   VAL   5           HB       VAL   5   8.772  -0.779  -3.501
   28   1HG1  VAL   5          1HG1      VAL   5  10.937   0.875  -2.113
   29   2HG1  VAL   5          2HG1      VAL   5  11.122  -0.789  -2.698
   30   3HG1  VAL   5          3HG1      VAL   5  10.872   0.519  -3.854
   31   1HG2  VAL   5          1HG2      VAL   5   9.413  -1.569  -1.231
   32   2HG2  VAL   5          2HG2      VAL   5   9.072   0.049  -0.582
   33   3HG2  VAL   5          3HG2      VAL   5   7.765  -0.942  -1.267
   34    H    ARG   6           HN       ARG   6   8.456   3.667  -3.605
   35    HA   ARG   6           HA       ARG   6   8.502   5.000  -5.459
   36   1HB   ARG   6          HB1       ARG   6   9.876   2.878  -6.952
   37   2HB   ARG   6          HB2       ARG   6   9.865   4.479  -7.275
   38   1HG   ARG   6          HG1       ARG   6  11.182   3.358  -4.984
   39   2HG   ARG   6          HG2       ARG   6  11.951   3.660  -6.393
   40   1HD   ARG   6          HD1       ARG   6  12.485   5.365  -4.925
   41   2HD   ARG   6          HD2       ARG   6  11.517   5.996  -6.079
   42    HE   ARG   6           HE       ARG   6  10.125   6.727  -4.488
   43   1HH1  ARG   6          2HH2      ARG   6  11.804   3.955  -3.121
   44   2HH1  ARG   6          1HH2      ARG   6  10.948   4.088  -1.622
   45   1HH2  ARG   6          2HH1      ARG   6   9.004   6.748  -2.585
   46   2HH2  ARG   6          1HH1      ARG   6   9.403   5.627  -1.326
   47    H    GLY   7           HN       GLY   7   6.301   3.245  -4.886
   48   1HA   GLY   7          HA2       GLY   7   4.272   4.058  -5.971
   49   2HA   GLY   7          HA1       GLY   7   4.877   3.483  -7.515
   50    H    ARG   8           HN       ARG   8   5.698   0.856  -5.753
   51    HA   ARG   8           HA       ARG   8   3.017  -0.376  -5.909
   52   1HB   ARG   8          HB1       ARG   8   4.243  -2.229  -6.996
   53   2HB   ARG   8          HB2       ARG   8   3.969  -0.893  -7.895
   54   1HG   ARG   8          HG1       ARG   8   6.050  -1.600  -8.474
   55   2HG   ARG   8          HG2       ARG   8   6.287  -0.293  -7.524
   56   1HD   ARG   8          HD1       ARG   8   6.470  -2.210  -5.753
   57   2HD   ARG   8          HD2       ARG   8   7.086  -2.955  -7.070
   58    HE   ARG   8           HE       ARG   8   8.140  -0.509  -5.893
   59   1HH1  ARG   8          2HH2      ARG   8   8.937  -3.295  -7.921
   60   2HH1  ARG   8          1HH2      ARG   8  10.559  -2.723  -8.122
   61   1HH2  ARG   8          2HH1      ARG   8  10.100   0.127  -6.204
   62   2HH2  ARG   8          1HH1      ARG   8  11.212  -0.797  -7.157
   63    H    CYS   9           HN       CYS   9   3.111  -2.731  -5.155
   64    HA   CYS   9           HA       CYS   9   4.401  -2.855  -2.484
   65   1HB   CYS   9          HB1       CYS   9   1.573  -3.299  -3.254
   66   2HB   CYS   9          HB2       CYS   9   2.184  -3.714  -1.797
   67    HA   PRO  10           HA       PRO  10   5.367  -7.018  -3.577
   68   1HB   PRO  10          HB1       PRO  10   5.148  -8.341  -1.253
   69   2HB   PRO  10          HB2       PRO  10   6.362  -7.284  -1.531
   70   1HG   PRO  10          HG1       PRO  10   3.932  -6.799  -0.036
   71   2HG   PRO  10          HG2       PRO  10   5.447  -6.346   0.372
   72   1HD   PRO  10          HD1       PRO  10   3.837  -4.633  -0.766
   73   2HD   PRO  10          HD2       PRO  10   5.440  -4.580  -1.077
   74    H    SER  11           HN       SER  11   4.592  -9.196  -3.855
   75    HA   SER  11           HA       SER  11   1.966  -9.347  -4.846
   76   1HB   SER  11          HB1       SER  11   2.575 -11.651  -5.223
   77   2HB   SER  11          HB2       SER  11   3.814 -10.673  -5.644
   78    HG   SER  11           HG       SER  11   3.594 -11.884  -3.190
   79    H    GLY  12           HN       GLY  12   0.469  -8.865  -3.300
   80   1HA   GLY  12          HA2       GLY  12  -1.200 -10.444  -2.033
   81   2HA   GLY  12          HA1       GLY  12   0.145 -10.612  -0.905
   82    H    MET  13           HN       MET  13   0.755  -7.564  -1.684
   83    HA   MET  13           HA       MET  13  -1.307  -6.350   0.122
   84   1HB   MET  13          HB1       MET  13   1.507  -5.548  -0.297
   85   2HB   MET  13          HB2       MET  13   0.428  -4.754   0.637
   86   1HG   MET  13          HG1       MET  13   1.320  -7.434   1.168
   87   2HG   MET  13          HG2       MET  13   1.942  -6.114   1.902
   88   1HE   MET  13          HE1       MET  13   0.952  -8.679   3.459
   89   2HE   MET  13          HE2       MET  13   1.655  -7.261   4.275
   90   3HE   MET  13          HE3       MET  13   0.094  -7.920   4.818
   91    H    CYS  14           HN       CYS  14  -1.699  -4.087  -0.270
   92    HA   CYS  14           HA       CYS  14  -1.610  -3.259  -3.146
   93   1HB   CYS  14          HB1       CYS  14  -3.905  -3.075  -1.291
   94   2HB   CYS  14          HB2       CYS  14  -3.891  -2.626  -2.861
   95    H    CYS  15           HN       CYS  15  -1.620  -0.967  -3.486
   96    HA   CYS  15           HA       CYS  15  -0.297   0.526  -1.332
   97   1HB   CYS  15          HB1       CYS  15   0.424   0.605  -3.670
   98   2HB   CYS  15          HB2       CYS  15  -0.967   1.349  -4.092
   99    H    SER  16           HN       SER  16  -1.022   2.420  -0.405
  100    HA   SER  16           HA       SER  16  -3.892   3.172  -0.810
  101   1HB   SER  16          HB1       SER  16  -3.908   3.778   1.482
  102   2HB   SER  16          HB2       SER  16  -3.434   2.220   1.359
  103    HG   SER  16           HG       SER  16  -1.407   2.674   1.882
  104    H    GLN  17           HN       GLN  17  -4.471   5.358  -0.272
  105    HA   GLN  17           HA       GLN  17  -2.998   7.332  -1.699
  106   1HB   GLN  17          HB1       GLN  17  -4.657   8.806  -0.864
  107   2HB   GLN  17          HB2       GLN  17  -5.376   7.405  -1.294
  108   1HG   GLN  17          HG1       GLN  17  -4.787   7.743   1.462
  109   2HG   GLN  17          HG2       GLN  17  -6.030   8.613   0.859
  110   1HE2  GLN  17          1HE2      GLN  17  -8.023   7.702   1.395
  111   2HE2  GLN  17          2HE2      GLN  17  -8.180   5.944   1.336
  112    H1   NAL  18           HD1      NAL  18  -3.463   5.069   3.409
  113    H3   NAL  18           HD2      NAL  18  -2.586   8.777   5.092
  114    H4   NAL  18           HE2      NAL  18  -4.892   9.046   5.722
  115    H5   NAL  18           HH2      NAL  18  -7.208   8.222   5.693
  116    H6   NAL  18           HP       NAL  18  -8.802   6.526   5.088
  117    H7   NAL  18           HH1      NAL  18  -8.081   4.574   3.885
  118    H8   NAL  18           HZ1      NAL  18  -5.760   4.288   3.329
  119   1H9   NAL  18          HB1       NAL  18  -1.154   5.723   3.579
  120   2H9   NAL  18          HB2       NAL  18  -0.734   7.179   4.474
  121    H10  NAL  18           HA       NAL  18  -1.180   8.586   2.551
  122   1HN   NAL  18          HN        NAL  18  -2.541   6.215   1.503
  123    H    GLY  19           HN       GLY  19  -0.279   6.388   0.166
  124   1HA   GLY  19          HA2       GLY  19   1.775   6.146  -0.890
  125   2HA   GLY  19          HA1       GLY  19   2.584   6.996   0.430
  126    H    TYR  20           HN       TYR  20   0.490   4.432   1.413
  127    HA   TYR  20           HA       TYR  20   2.862   2.713   2.037
  128   1HB   TYR  20          HB1       TYR  20   0.675   3.614   3.797
  129   2HB   TYR  20          HB2       TYR  20   1.627   2.342   4.175
  130    HD1  TYR  20           HD1      TYR  20   4.213   2.821   3.887
  131    HD2  TYR  20           HD2      TYR  20   1.202   5.711   4.836
  132    HE1  TYR  20           HE1      TYR  20   5.993   4.371   4.708
  133    HE2  TYR  20           HE2      TYR  20   2.926   7.195   5.820
  134    HH   TYR  20           HH       TYR  20   5.238   7.536   6.070
  135    H    CYS  21           HN       CYS  21   2.659   0.542   2.116
  136    HA   CYS  21           HA       CYS  21   0.492  -0.632   0.562
  137   1HB   CYS  21          HB1       CYS  21   2.917  -1.752   1.824
  138   2HB   CYS  21          HB2       CYS  21   1.903  -2.605   0.870
  139    H    GLY  22           HN       GLY  22  -0.859  -2.326   1.256
  140   1HA   GLY  22          HA2       GLY  22  -0.636  -3.753   3.710
  141   2HA   GLY  22          HA1       GLY  22  -1.769  -2.418   3.955
  142    H    LYS  23           HN       LYS  23  -3.242  -4.179   4.405
  143    HA   LYS  23           HA       LYS  23  -4.894  -4.780   2.066
  144   1HB   LYS  23          HB1       LYS  23  -3.809  -6.832   3.880
  145   2HB   LYS  23          HB2       LYS  23  -5.327  -7.027   3.311
  146   1HG   LYS  23          HG1       LYS  23  -2.937  -6.896   1.702
  147   2HG   LYS  23          HG2       LYS  23  -3.858  -8.225   1.932
  148   1HD   LYS  23          HD1       LYS  23  -5.629  -6.616   0.904
  149   2HD   LYS  23          HD2       LYS  23  -4.284  -6.078   0.150
  150   1HE   LYS  23          HE1       LYS  23  -3.955  -8.090  -0.905
  151   2HE   LYS  23          HE2       LYS  23  -5.018  -8.855   0.072
  152   1HZ   LYS  23          HZ1       LYS  23  -6.052  -8.510  -2.003
  153   2HZ   LYS  23          HZ2       LYS  23  -6.788  -7.559  -0.869
  154   3HZ   LYS  23          HZ3       LYS  23  -5.708  -6.897  -1.919
  155    H    GLY  24           HN       GLY  24  -7.096  -5.714   2.934
  156   1HA   GLY  24          HA2       GLY  24  -8.999  -5.164   4.128
  157   2HA   GLY  24          HA1       GLY  24  -8.039  -4.246   5.290
  158    HA   PRO  25           HA       PRO  25 -10.972  -1.694   2.610
  159   1HB   PRO  25          HB1       PRO  25 -11.066  -0.274   5.191
  160   2HB   PRO  25          HB2       PRO  25 -12.258  -0.479   4.094
  161   1HG   PRO  25          HG1       PRO  25 -12.193  -2.077   6.120
  162   2HG   PRO  25          HG2       PRO  25 -12.540  -2.712   4.656
  163   1HD   PRO  25          HD1       PRO  25 -10.038  -2.823   6.068
  164   2HD   PRO  25          HD2       PRO  25 -10.697  -3.979   5.122
  165    H    LYS  26           HN       LYS  26  -8.615  -0.254   4.843
  166    HA   LYS  26           HA       LYS  26  -8.148   2.200   3.529
  167   1HB   LYS  26          HB1       LYS  26  -6.549   0.523   5.354
  168   2HB   LYS  26          HB2       LYS  26  -5.958   1.939   4.793
  169   1HG   LYS  26          HG1       LYS  26  -7.871   3.036   5.803
  170   2HG   LYS  26          HG2       LYS  26  -8.244   1.609   6.505
  171   1HD   LYS  26          HD1       LYS  26  -7.092   2.667   8.144
  172   2HD   LYS  26          HD2       LYS  26  -5.952   1.709   7.473
  173   1HE   LYS  26          HE1       LYS  26  -6.194   4.449   6.669
  174   2HE   LYS  26          HE2       LYS  26  -5.317   4.052   7.988
  175   1HZ   LYS  26          HZ1       LYS  26  -3.894   4.309   6.159
  176   2HZ   LYS  26          HZ2       LYS  26  -3.879   2.719   6.594
  177   3HZ   LYS  26          HZ3       LYS  26  -4.759   3.224   5.302
  178    H    TYR  27           HN       TYR  27  -7.169  -0.860   2.328
  179    HA   TYR  27           HA       TYR  27  -5.015   0.431   0.659
  180   1HB   TYR  27          HB1       TYR  27  -4.847  -2.178   2.041
  181   2HB   TYR  27          HB2       TYR  27  -3.695  -1.523   1.086
  182    HD1  TYR  27           HD1      TYR  27  -2.209   0.270   1.826
  183    HD2  TYR  27           HD2      TYR  27  -5.225  -1.468   4.355
  184    HE1  TYR  27           HE1      TYR  27  -1.276   1.497   3.781
  185    HE2  TYR  27           HE2      TYR  27  -4.279  -0.267   6.321
  186    HH   TYR  27           HH       TYR  27  -1.354   1.615   6.152
  187    H    CYS  28           HN       CYS  28  -7.325  -2.309   0.903
  188    HA   CYS  28           HA       CYS  28  -7.330  -2.432  -2.070
  189   1HB   CYS  28          HB1       CYS  28  -5.819  -4.098  -0.617
  190   2HB   CYS  28          HB2       CYS  28  -7.172  -4.997  -0.792
  191    H    GLY  29           HN       GLY  29  -9.365  -1.942   0.389
  192   1HA   GLY  29          HA2       GLY  29 -11.655  -2.389   0.701
  193   2HA   GLY  29          HA1       GLY  29 -11.647  -3.458  -0.701
  194    H    ARG  30           HN       ARG  30  -9.995  -5.421  -0.287
  195    HA   ARG  30           HA       ARG  30 -10.009  -6.351   2.512
  196   1HB   ARG  30          HB1       ARG  30 -11.826  -7.540   1.581
  197   2HB   ARG  30          HB2       ARG  30 -10.994  -7.963   0.241
  198   1HG   ARG  30          HG1       ARG  30 -11.187  -9.805   1.732
  199   2HG   ARG  30          HG2       ARG  30  -9.620  -9.397   1.513
  200   1HD   ARG  30          HD1       ARG  30  -9.781  -8.149   3.622
  201   2HD   ARG  30          HD2       ARG  30 -11.217  -8.891   3.856
  202    HE   ARG  30           HE       ARG  30 -10.206 -10.854   4.392
  203   1HH1  ARG  30          2HH1      ARG  30  -7.720  -8.627   3.176
  204   2HH1  ARG  30          1HH1      ARG  30  -6.443  -9.654   3.737
  205   1HH2  ARG  30          2HH2      ARG  30  -8.483 -12.066   5.060
  206   2HH2  ARG  30          1HH2      ARG  30  -6.861 -11.535   4.767
  Start of MODEL   10
    1   1H    VAL   1           H1       VAL   1   1.057  -0.695   5.181
    2   2H    VAL   1           H2       VAL   1   0.626  -0.276   6.726
    3   3H    VAL   1           H3       VAL   1   1.142  -1.805   6.355
    4    HA   VAL   1           HA       VAL   1   2.808   0.623   6.294
    5    HB   VAL   1           HB       VAL   1   4.160  -0.525   8.002
    6   1HG1  VAL   1          1HG1      VAL   1   1.258  -0.180   8.877
    7   2HG1  VAL   1          2HG1      VAL   1   2.705  -0.081   9.889
    8   3HG1  VAL   1          3HG1      VAL   1   2.433   1.138   8.638
    9   1HG2  VAL   1          1HG2      VAL   1   3.491  -2.891   7.548
   10   2HG2  VAL   1          2HG2      VAL   1   3.324  -2.442   9.247
   11   3HG2  VAL   1          3HG2      VAL   1   1.881  -2.554   8.233
   12    H    GLY   2           HN       GLY   2   5.149   0.098   5.991
   13   1HA   GLY   2          HA2       GLY   2   6.707  -0.667   4.365
   14   2HA   GLY   2          HA1       GLY   2   5.463  -1.705   3.644
   15    H    GLU   3           HN       GLU   3   7.008   1.327   3.465
   16    HA   GLU   3           HA       GLU   3   5.048   2.918   2.152
   17   1HB   GLU   3          HB1       GLU   3   6.820   4.273   1.600
   18   2HB   GLU   3          HB2       GLU   3   7.232   3.629   3.043
   19   1HG   GLU   3          HG1       GLU   3   9.194   3.496   2.023
   20   2HG   GLU   3          HG2       GLU   3   8.585   2.042   1.599
   21    H    CYS   4           HN       CYS   4   4.610   3.297  -0.072
   22    HA   CYS   4           HA       CYS   4   4.660   0.882  -1.666
   23   1HB   CYS   4          HB1       CYS   4   3.826   3.550  -2.559
   24   2HB   CYS   4          HB2       CYS   4   3.427   2.115  -3.229
   25    H    VAL   5           HN       VAL   5   6.641   0.282  -2.219
   26    HA   VAL   5           HA       VAL   5   8.917   1.831  -2.606
   27    HB   VAL   5           HB       VAL   5   8.499  -0.994  -3.629
   28   1HG1  VAL   5          1HG1      VAL   5  10.957  -1.166  -3.326
   29   2HG1  VAL   5          2HG1      VAL   5  10.557   0.045  -4.542
   30   3HG1  VAL   5          3HG1      VAL   5  11.028   0.557  -2.903
   31   1HG2  VAL   5          1HG2      VAL   5   9.563  -1.635  -1.456
   32   2HG2  VAL   5          2HG2      VAL   5   9.436   0.059  -0.926
   33   3HG2  VAL   5          3HG2      VAL   5   7.975  -0.897  -1.244
   34    H    ARG   6           HN       ARG   6   8.568   3.413  -3.884
   35    HA   ARG   6           HA       ARG   6   8.001   4.783  -5.597
   36   1HB   ARG   6          HB1       ARG   6   9.735   3.085  -7.255
   37   2HB   ARG   6          HB2       ARG   6   9.404   4.671  -7.464
   38   1HG   ARG   6          HG1       ARG   6  10.927   3.659  -5.249
   39   2HG   ARG   6          HG2       ARG   6  11.612   4.237  -6.614
   40   1HD   ARG   6          HD1       ARG   6  11.792   5.824  -4.908
   41   2HD   ARG   6          HD2       ARG   6  10.833   6.405  -6.095
   42    HE   ARG   6           HE       ARG   6   9.225   6.782  -4.594
   43   1HH1  ARG   6          2HH2      ARG   6  11.176   4.184  -3.221
   44   2HH1  ARG   6          1HH2      ARG   6  10.111   4.022  -1.865
   45   1HH2  ARG   6          2HH1      ARG   6   7.842   6.363  -2.955
   46   2HH2  ARG   6          1HH1      ARG   6   8.265   5.225  -1.720
   47    H    GLY   7           HN       GLY   7   6.092   3.123  -4.992
   48   1HA   GLY   7          HA2       GLY   7   3.889   3.103  -5.935
   49   2HA   GLY   7          HA1       GLY   7   4.547   2.705  -7.510
   50    H    ARG   8           HN       ARG   8   6.274   0.548  -5.702
   51    HA   ARG   8           HA       ARG   8   4.352  -1.612  -6.286
   52   1HB   ARG   8          HB1       ARG   8   7.213  -1.584  -5.497
   53   2HB   ARG   8          HB2       ARG   8   6.372  -2.950  -5.806
   54   1HG   ARG   8          HG1       ARG   8   6.351  -2.591  -8.019
   55   2HG   ARG   8          HG2       ARG   8   6.443  -0.969  -7.853
   56   1HD   ARG   8          HD1       ARG   8   8.790  -1.428  -7.050
   57   2HD   ARG   8          HD2       ARG   8   8.601  -2.861  -7.812
   58    HE   ARG   8           HE       ARG   8   8.860  -1.872  -9.846
   59   1HH1  ARG   8          2HH2      ARG   8   8.219   0.609  -7.435
   60   2HH1  ARG   8          1HH2      ARG   8   8.275   1.887  -8.602
   61   1HH2  ARG   8          2HH1      ARG   8   8.839  -0.147 -11.308
   62   2HH2  ARG   8          1HH1      ARG   8   8.616   1.472 -10.732
   63    H    CYS   9           HN       CYS   9   4.059  -3.440  -4.760
   64    HA   CYS   9           HA       CYS   9   4.463  -2.826  -1.936
   65   1HB   CYS   9          HB1       CYS   9   1.845  -3.279  -3.222
   66   2HB   CYS   9          HB2       CYS   9   2.075  -3.586  -1.634
   67    HA   PRO  10           HA       PRO  10   5.367  -7.149  -1.563
   68   1HB   PRO  10          HB1       PRO  10   3.528  -7.269   0.722
   69   2HB   PRO  10          HB2       PRO  10   5.089  -7.741   0.634
   70   1HG   PRO  10          HG1       PRO  10   4.509  -5.503   1.815
   71   2HG   PRO  10          HG2       PRO  10   5.873  -5.600   0.922
   72   1HD   PRO  10          HD1       PRO  10   3.362  -4.423   0.167
   73   2HD   PRO  10          HD2       PRO  10   4.861  -3.886  -0.197
   74    H    SER  11           HN       SER  11   4.480  -9.363  -1.447
   75    HA   SER  11           HA       SER  11   2.863 -10.118  -3.408
   76   1HB   SER  11          HB1       SER  11   3.164 -11.559  -0.847
   77   2HB   SER  11          HB2       SER  11   2.818 -12.226  -2.297
   78    HG   SER  11           HG       SER  11   5.001 -12.444  -1.870
   79    H    GLY  12           HN       GLY  12   0.888  -9.282  -3.830
   80   1HA   GLY  12          HA2       GLY  12  -1.433  -9.413  -3.837
   81   2HA   GLY  12          HA1       GLY  12  -1.385 -10.349  -2.346
   82    H    MET  13           HN       MET  13   0.379  -7.423  -1.954
   83    HA   MET  13           HA       MET  13  -1.861  -6.136  -0.496
   84   1HB   MET  13          HB1       MET  13   0.976  -5.355  -0.784
   85   2HB   MET  13          HB2       MET  13  -0.122  -4.585   0.147
   86   1HG   MET  13          HG1       MET  13  -0.360  -6.742   1.334
   87   2HG   MET  13          HG2       MET  13   1.033  -7.166   0.594
   88   1HE   MET  13          HE1       MET  13   2.201  -6.664   4.264
   89   2HE   MET  13          HE2       MET  13   0.650  -7.334   3.708
   90   3HE   MET  13          HE3       MET  13   2.164  -7.791   2.889
   91    H    CYS  14           HN       CYS  14  -2.167  -3.839  -0.773
   92    HA   CYS  14           HA       CYS  14  -1.743  -2.771  -3.545
   93   1HB   CYS  14          HB1       CYS  14  -4.095  -2.494  -1.784
   94   2HB   CYS  14          HB2       CYS  14  -3.847  -1.586  -3.119
   95    H    CYS  15           HN       CYS  15  -1.368  -0.497  -3.616
   96    HA   CYS  15           HA       CYS  15  -0.155   0.731  -1.253
   97   1HB   CYS  15          HB1       CYS  15   0.603   1.078  -3.567
   98   2HB   CYS  15          HB2       CYS  15  -0.773   1.893  -3.899
   99    H    SER  16           HN       SER  16  -0.943   2.644  -0.215
  100    HA   SER  16           HA       SER  16  -3.736   3.467  -0.834
  101   1HB   SER  16          HB1       SER  16  -4.312   3.421   1.412
  102   2HB   SER  16          HB2       SER  16  -3.657   1.961   1.085
  103    HG   SER  16           HG       SER  16  -1.698   2.654   2.025
  104    H    GLN  17           HN       GLN  17  -4.309   5.442   0.756
  105    HA   GLN  17           HA       GLN  17  -3.294   7.340  -1.037
  106   1HB   GLN  17          HB1       GLN  17  -4.827   8.797  -0.021
  107   2HB   GLN  17          HB2       GLN  17  -5.514   7.317  -0.084
  108   1HG   GLN  17          HG1       GLN  17  -4.322   8.098   2.373
  109   2HG   GLN  17          HG2       GLN  17  -5.759   8.770   1.986
  110   1HE2  GLN  17          1HE2      GLN  17  -7.654   7.734   2.538
  111   2HE2  GLN  17          2HE2      GLN  17  -7.626   6.060   3.059
  112    H1   NAL  18           HD1      NAL  18  -2.689   6.398   5.002
  113    H3   NAL  18           HD2      NAL  18  -1.901  10.374   4.029
  114    H4   NAL  18           HE2      NAL  18  -4.146  10.981   4.639
  115    H5   NAL  18           HH2      NAL  18  -6.391  10.317   5.380
  116    H6   NAL  18           HP       NAL  18  -7.900   8.620   6.169
  117    H7   NAL  18           HH1      NAL  18  -7.147   6.346   6.389
  118    H8   NAL  18           HZ1      NAL  18  -4.889   5.763   5.795
  119   1H9   NAL  18          HB2       NAL  18  -0.543   6.887   4.185
  120   2H9   NAL  18          HB1       NAL  18   0.019   8.530   4.478
  121    H10  NAL  18           HA       NAL  18  -0.558   9.212   2.241
  122   1HN   NAL  18          HN        NAL  18  -1.989   6.608   2.028
  123    H    GLY  19           HN       GLY  19  -0.030   6.539   0.445
  124   1HA   GLY  19          HA2       GLY  19   1.925   6.041  -0.738
  125   2HA   GLY  19          HA1       GLY  19   2.898   6.926   0.438
  126    H    TYR  20           HN       TYR  20   0.591   4.501   1.540
  127    HA   TYR  20           HA       TYR  20   2.835   2.613   2.127
  128   1HB   TYR  20          HB1       TYR  20   0.868   3.671   4.039
  129   2HB   TYR  20          HB2       TYR  20   1.715   2.304   4.321
  130    HD1  TYR  20           HD1      TYR  20   1.883   5.912   4.097
  131    HD2  TYR  20           HD2      TYR  20   4.129   2.300   4.781
  132    HE1  TYR  20           HE1      TYR  20   3.793   7.264   4.878
  133    HE2  TYR  20           HE2      TYR  20   6.061   3.669   5.597
  134    HH   TYR  20           HH       TYR  20   5.967   7.221   5.647
  135    H    CYS  21           HN       CYS  21   2.492   0.548   2.039
  136    HA   CYS  21           HA       CYS  21   0.288  -0.466   0.522
  137   1HB   CYS  21          HB1       CYS  21   2.620  -1.759   1.799
  138   2HB   CYS  21          HB2       CYS  21   1.652  -2.473   0.695
  139    H    GLY  22           HN       GLY  22  -1.049  -2.255   1.041
  140   1HA   GLY  22          HA2       GLY  22  -0.848  -3.868   3.366
  141   2HA   GLY  22          HA1       GLY  22  -2.026  -2.602   3.721
  142    H    LYS  23           HN       LYS  23  -3.433  -4.484   3.999
  143    HA   LYS  23           HA       LYS  23  -4.825  -5.295   1.502
  144   1HB   LYS  23          HB1       LYS  23  -4.106  -7.096   3.749
  145   2HB   LYS  23          HB2       LYS  23  -5.178  -7.483   2.578
  146   1HG   LYS  23          HG1       LYS  23  -3.302  -6.968   1.005
  147   2HG   LYS  23          HG2       LYS  23  -2.346  -7.138   2.319
  148   1HD   LYS  23          HD1       LYS  23  -2.340  -9.122   1.070
  149   2HD   LYS  23          HD2       LYS  23  -3.022  -9.389   2.530
  150   1HE   LYS  23          HE1       LYS  23  -4.141 -10.458   0.630
  151   2HE   LYS  23          HE2       LYS  23  -5.114  -9.604   1.627
  152   1HZ   LYS  23          HZ1       LYS  23  -5.630  -9.152  -0.678
  153   2HZ   LYS  23          HZ2       LYS  23  -5.290  -7.878   0.152
  154   3HZ   LYS  23          HZ3       LYS  23  -4.083  -8.504  -0.842
  155    H    GLY  24           HN       GLY  24  -7.040  -6.105   1.970
  156   1HA   GLY  24          HA2       GLY  24  -9.133  -5.836   2.967
  157   2HA   GLY  24          HA1       GLY  24  -8.378  -5.107   4.385
  158    HA   PRO  25           HA       PRO  25 -11.044  -2.218   1.762
  159   1HB   PRO  25          HB1       PRO  25 -11.780  -1.337   4.475
  160   2HB   PRO  25          HB2       PRO  25 -12.721  -1.445   3.144
  161   1HG   PRO  25          HG1       PRO  25 -12.844  -3.359   4.871
  162   2HG   PRO  25          HG2       PRO  25 -12.846  -3.756   3.287
  163   1HD   PRO  25          HD1       PRO  25 -10.632  -3.879   5.123
  164   2HD   PRO  25          HD2       PRO  25 -10.991  -4.933   3.929
  165    H    LYS  26           HN       LYS  26  -8.932  -1.317   4.453
  166    HA   LYS  26           HA       LYS  26  -8.716   1.479   3.806
  167   1HB   LYS  26          HB1       LYS  26  -7.809  -0.152   5.807
  168   2HB   LYS  26          HB2       LYS  26  -6.425   0.368   5.113
  169   1HG   LYS  26          HG1       LYS  26  -8.452   2.113   6.169
  170   2HG   LYS  26          HG2       LYS  26  -7.076   1.726   6.960
  171   1HD   LYS  26          HD1       LYS  26  -7.167   3.260   4.526
  172   2HD   LYS  26          HD2       LYS  26  -6.958   3.903   6.013
  173   1HE   LYS  26          HE1       LYS  26  -4.801   3.473   6.001
  174   2HE   LYS  26          HE2       LYS  26  -5.028   1.964   5.420
  175   1HZ   LYS  26          HZ1       LYS  26  -3.808   3.210   3.789
  176   2HZ   LYS  26          HZ2       LYS  26  -5.307   2.828   3.265
  177   3HZ   LYS  26          HZ3       LYS  26  -5.014   4.350   3.754
  178    H    TYR  27           HN       TYR  27  -7.416  -1.202   2.144
  179    HA   TYR  27           HA       TYR  27  -5.387   0.527   0.742
  180   1HB   TYR  27          HB1       TYR  27  -4.946  -2.233   1.697
  181   2HB   TYR  27          HB2       TYR  27  -3.870  -1.311   0.885
  182    HD1  TYR  27           HD1      TYR  27  -5.394  -1.961   4.096
  183    HD2  TYR  27           HD2      TYR  27  -2.463   0.340   1.953
  184    HE1  TYR  27           HE1      TYR  27  -4.338  -1.331   6.245
  185    HE2  TYR  27           HE2      TYR  27  -1.445   1.052   4.110
  186    HH   TYR  27           HH       TYR  27  -2.689  -0.078   7.255
  187    H    CYS  28           HN       CYS  28  -7.125  -2.579   0.638
  188    HA   CYS  28           HA       CYS  28  -6.683  -2.737  -2.306
  189   1HB   CYS  28          HB1       CYS  28  -5.235  -3.906  -0.464
  190   2HB   CYS  28          HB2       CYS  28  -6.427  -5.021  -0.496
  191    H    GLY  29           HN       GLY  29  -9.093  -2.817   0.004
  192   1HA   GLY  29          HA2       GLY  29 -11.336  -3.518  -0.086
  193   2HA   GLY  29          HA1       GLY  29 -11.027  -4.372  -1.604
  194    H    ARG  30           HN       ARG  30  -9.306  -6.155  -1.288
  195    HA   ARG  30           HA       ARG  30  -9.223  -7.455   1.332
  196   1HB   ARG  30          HB1       ARG  30  -9.600  -9.652  -0.023
  197   2HB   ARG  30          HB2       ARG  30 -10.759  -8.892   0.842
  198   1HG   ARG  30          HG1       ARG  30 -11.936  -9.404  -0.938
  199   2HG   ARG  30          HG2       ARG  30 -11.386  -7.942  -1.417
  200   1HD   ARG  30          HD1       ARG  30 -10.401 -10.494  -2.314
  201   2HD   ARG  30          HD2       ARG  30 -11.194  -9.393  -3.223
  202    HE   ARG  30           HE       ARG  30  -8.486  -9.153  -2.233
  203   1HH1  ARG  30          2HH2      ARG  30 -10.893  -7.485  -4.211
  204   2HH1  ARG  30          1HH2      ARG  30  -9.764  -6.208  -4.516
  205   1HH2  ARG  30          2HH1      ARG  30  -7.238  -7.597  -2.621
  206   2HH2  ARG  30          1HH1      ARG  30  -7.722  -6.268  -3.620
  Start of MODEL   11
    1   1H    VAL   1           H1       VAL   1   1.546   1.693   4.915
    2   2H    VAL   1           H2       VAL   1   0.778   0.691   5.978
    3   3H    VAL   1           H3       VAL   1   1.641   0.080   4.705
    4    HA   VAL   1           HA       VAL   1   2.781   1.610   6.954
    5    HB   VAL   1           HB       VAL   1   3.966  -0.488   7.523
    6   1HG1  VAL   1          1HG1      VAL   1   2.120  -1.489   8.725
    7   2HG1  VAL   1          2HG1      VAL   1   1.915   0.267   8.716
    8   3HG1  VAL   1          3HG1      VAL   1   0.932  -0.759   7.639
    9   1HG2  VAL   1          1HG2      VAL   1   3.139  -2.657   6.752
   10   2HG2  VAL   1          2HG2      VAL   1   1.994  -1.885   5.644
   11   3HG2  VAL   1          3HG2      VAL   1   3.744  -1.734   5.374
   12    H    GLY   2           HN       GLY   2   4.988   2.075   6.852
   13   1HA   GLY   2          HA2       GLY   2   7.081   2.322   6.031
   14   2HA   GLY   2          HA1       GLY   2   6.781   0.962   4.951
   15    H    GLU   3           HN       GLU   3   5.424   1.511   2.990
   16    HA   GLU   3           HA       GLU   3   5.430   4.105   1.785
   17   1HB   GLU   3          HB1       GLU   3   7.915   3.278   1.841
   18   2HB   GLU   3          HB2       GLU   3   7.465   2.360   0.567
   19   1HG   GLU   3          HG1       GLU   3   6.820   4.343  -0.606
   20   2HG   GLU   3          HG2       GLU   3   7.336   5.241   0.657
   21    H    CYS   4           HN       CYS   4   4.565   3.891  -0.482
   22    HA   CYS   4           HA       CYS   4   4.036   1.128  -1.506
   23   1HB   CYS   4          HB1       CYS   4   3.734   3.721  -2.883
   24   2HB   CYS   4          HB2       CYS   4   3.274   2.258  -3.447
   25    H    VAL   5           HN       VAL   5   5.988   0.174  -1.919
   26    HA   VAL   5           HA       VAL   5   8.428   1.565  -1.662
   27    HB   VAL   5           HB       VAL   5   8.000  -1.241  -2.758
   28   1HG1  VAL   5          1HG1      VAL   5  10.308  -0.440  -3.158
   29   2HG1  VAL   5          2HG1      VAL   5  10.434   0.084  -1.463
   30   3HG1  VAL   5          3HG1      VAL   5  10.292  -1.639  -1.867
   31   1HG2  VAL   5          1HG2      VAL   5   6.942  -1.006  -0.545
   32   2HG2  VAL   5          2HG2      VAL   5   8.426  -1.948  -0.409
   33   3HG2  VAL   5          3HG2      VAL   5   8.413  -0.245   0.099
   34    H    ARG   6           HN       ARG   6   8.780   3.167  -3.058
   35    HA   ARG   6           HA       ARG   6   8.832   4.404  -4.966
   36   1HB   ARG   6          HB1       ARG   6  10.322   2.151  -6.155
   37   2HB   ARG   6          HB2       ARG   6  10.438   3.731  -6.554
   38   1HG   ARG   6          HG1       ARG   6  11.390   2.559  -4.100
   39   2HG   ARG   6          HG2       ARG   6  12.335   3.089  -5.322
   40   1HD   ARG   6          HD1       ARG   6  12.426   5.071  -4.429
   41   2HD   ARG   6          HD2       ARG   6  10.797   5.186  -4.458
   42    HE   ARG   6           HE       ARG   6  10.611   4.452  -2.238
   43   1HH1  ARG   6          2HH2      ARG   6  14.008   4.542  -3.230
   44   2HH1  ARG   6          1HH2      ARG   6  14.556   4.514  -1.587
   45   1HH2  ARG   6          2HH1      ARG   6  11.423   4.497  -0.184
   46   2HH2  ARG   6          1HH1      ARG   6  13.134   4.489   0.087
   47    H    GLY   7           HN       GLY   7   6.479   3.086  -4.628
   48   1HA   GLY   7          HA2       GLY   7   4.470   3.138  -5.856
   49   2HA   GLY   7          HA1       GLY   7   5.340   2.915  -7.361
   50    H    ARG   8           HN       ARG   8   6.592   0.471  -5.366
   51    HA   ARG   8           HA       ARG   8   4.688  -1.508  -6.471
   52   1HB   ARG   8          HB1       ARG   8   7.432  -1.658  -5.397
   53   2HB   ARG   8          HB2       ARG   8   6.536  -3.006  -5.620
   54   1HG   ARG   8          HG1       ARG   8   7.548  -3.064  -7.553
   55   2HG   ARG   8          HG2       ARG   8   6.383  -2.005  -7.989
   56   1HD   ARG   8          HD1       ARG   8   8.869  -0.994  -7.028
   57   2HD   ARG   8          HD2       ARG   8   8.773  -1.512  -8.574
   58    HE   ARG   8           HE       ARG   8   7.980   0.981  -7.637
   59   1HH1  ARG   8          2HH2      ARG   8   6.911  -1.353 -10.065
   60   2HH1  ARG   8          1HH2      ARG   8   6.224  -0.096 -11.039
   61   1HH2  ARG   8          2HH1      ARG   8   7.100   2.468  -8.909
   62   2HH2  ARG   8          1HH1      ARG   8   6.330   2.026 -10.397
   63    H    CYS   9           HN       CYS   9   4.413  -3.499  -5.115
   64    HA   CYS   9           HA       CYS   9   4.186  -3.162  -2.236
   65   1HB   CYS   9          HB1       CYS   9   1.956  -3.420  -4.096
   66   2HB   CYS   9          HB2       CYS   9   1.890  -4.359  -2.761
   67    HA   PRO  10           HA       PRO  10   5.330  -7.574  -2.589
   68   1HB   PRO  10          HB1       PRO  10   3.715  -7.872  -0.158
   69   2HB   PRO  10          HB2       PRO  10   5.237  -8.388  -0.447
   70   1HG   PRO  10          HG1       PRO  10   4.880  -6.286   1.037
   71   2HG   PRO  10          HG2       PRO  10   6.146  -6.319   0.005
   72   1HD   PRO  10          HD1       PRO  10   3.608  -5.006  -0.375
   73   2HD   PRO  10          HD2       PRO  10   5.087  -4.440  -0.776
   74    H    SER  11           HN       SER  11   4.277  -9.699  -2.741
   75    HA   SER  11           HA       SER  11   2.313  -9.962  -4.543
   76   1HB   SER  11          HB1       SER  11   2.927 -11.903  -2.400
   77   2HB   SER  11          HB2       SER  11   2.280 -12.250  -3.859
   78    HG   SER  11           HG       SER  11   4.478 -12.653  -3.898
   79    H    GLY  12           HN       GLY  12   0.336  -9.056  -4.473
   80   1HA   GLY  12          HA2       GLY  12  -1.961  -9.169  -4.065
   81   2HA   GLY  12          HA1       GLY  12  -1.673 -10.208  -2.670
   82    H    MET  13           HN       MET  13   0.314  -7.451  -2.370
   83    HA   MET  13           HA       MET  13  -1.648  -6.088  -0.600
   84   1HB   MET  13          HB1       MET  13   1.232  -5.558  -0.908
   85   2HB   MET  13          HB2       MET  13   0.236  -4.920   0.218
   86   1HG   MET  13          HG1       MET  13  -0.082  -7.206   1.039
   87   2HG   MET  13          HG2       MET  13   1.175  -7.628   0.085
   88   1HE   MET  13          HE1       MET  13   2.789  -7.940   3.588
   89   2HE   MET  13          HE2       MET  13   1.127  -8.368   3.115
   90   3HE   MET  13          HE3       MET  13   2.490  -8.762   2.039
   91    H    CYS  14           HN       CYS  14  -1.679  -3.709  -0.674
   92    HA   CYS  14           HA       CYS  14  -1.910  -2.756  -3.497
   93   1HB   CYS  14          HB1       CYS  14  -3.812  -2.478  -1.251
   94   2HB   CYS  14          HB2       CYS  14  -4.052  -1.983  -2.789
   95    H    CYS  15           HN       CYS  15  -1.295  -0.691  -3.883
   96    HA   CYS  15           HA       CYS  15  -0.132   0.959  -1.772
   97   1HB   CYS  15          HB1       CYS  15   0.755   0.946  -4.016
   98   2HB   CYS  15          HB2       CYS  15  -0.648   1.509  -4.633
   99    H    SER  16           HN       SER  16  -1.019   2.746  -0.831
  100    HA   SER  16           HA       SER  16  -3.868   3.395  -1.442
  101   1HB   SER  16          HB1       SER  16  -4.078   3.851   0.860
  102   2HB   SER  16          HB2       SER  16  -3.436   2.357   0.709
  103    HG   SER  16           HG       SER  16  -1.511   2.984   1.412
  104    H    GLN  17           HN       GLN  17  -4.602   5.523  -0.837
  105    HA   GLN  17           HA       GLN  17  -3.237   7.621  -2.165
  106   1HB   GLN  17          HB1       GLN  17  -5.015   8.949  -1.306
  107   2HB   GLN  17          HB2       GLN  17  -5.616   7.519  -1.817
  108   1HG   GLN  17          HG1       GLN  17  -5.123   7.776   0.966
  109   2HG   GLN  17          HG2       GLN  17  -6.412   8.580   0.366
  110   1HE2  GLN  17          1HE2      GLN  17  -8.355   7.511   0.777
  111   2HE2  GLN  17          2HE2      GLN  17  -8.385   5.751   0.652
  112    H1   NAL  18           HD1      NAL  18  -3.697   5.221   2.817
  113    H3   NAL  18           HD2      NAL  18  -3.217   8.952   4.601
  114    H4   NAL  18           HE2      NAL  18  -5.557   8.991   5.162
  115    H5   NAL  18           HH2      NAL  18  -7.770   7.910   5.117
  116    H6   NAL  18           HP       NAL  18  -9.158   6.045   4.509
  117    H7   NAL  18           HH1      NAL  18  -8.222   4.196   3.286
  118    H8   NAL  18           HZ1      NAL  18  -5.898   4.221   2.669
  119   1H9   NAL  18          HB1       NAL  18  -1.463   6.031   3.151
  120   2H9   NAL  18          HB2       NAL  18  -1.196   7.495   4.087
  121    H10  NAL  18           HA       NAL  18  -1.613   8.898   2.159
  122   1HN   NAL  18          HN        NAL  18  -2.783   6.468   1.023
  123    H    GLY  19           HN       GLY  19  -0.477   6.874  -0.252
  124   1HA   GLY  19          HA2       GLY  19   1.635   6.726  -1.203
  125   2HA   GLY  19          HA1       GLY  19   2.320   7.652   0.138
  126    H    TYR  20           HN       TYR  20   0.369   4.900   0.896
  127    HA   TYR  20           HA       TYR  20   2.758   3.359   1.865
  128   1HB   TYR  20          HB1       TYR  20   0.433   4.425   3.220
  129   2HB   TYR  20          HB2       TYR  20   0.817   2.888   3.616
  130    HD1  TYR  20           HD1      TYR  20   0.919   3.612   5.979
  131    HD2  TYR  20           HD2      TYR  20   3.570   5.177   2.940
  132    HE1  TYR  20           HE1      TYR  20   2.599   4.224   7.723
  133    HE2  TYR  20           HE2      TYR  20   5.178   5.819   4.669
  134    HH   TYR  20           HH       TYR  20   5.722   5.706   6.880
  135    H    CYS  21           HN       CYS  21   2.785   1.203   1.438
  136    HA   CYS  21           HA       CYS  21   0.605  -0.097   0.049
  137   1HB   CYS  21          HB1       CYS  21   3.018  -0.519  -0.220
  138   2HB   CYS  21          HB2       CYS  21   3.056  -1.219   1.255
  139    H    GLY  22           HN       GLY  22  -0.734  -1.792   0.825
  140   1HA   GLY  22          HA2       GLY  22  -0.311  -3.300   3.171
  141   2HA   GLY  22          HA1       GLY  22  -1.418  -2.000   3.610
  142    H    LYS  23           HN       LYS  23  -2.981  -3.748   4.051
  143    HA   LYS  23           HA       LYS  23  -4.531  -4.566   1.656
  144   1HB   LYS  23          HB1       LYS  23  -3.566  -6.430   3.754
  145   2HB   LYS  23          HB2       LYS  23  -4.796  -6.793   2.742
  146   1HG   LYS  23          HG1       LYS  23  -3.207  -6.313   0.909
  147   2HG   LYS  23          HG2       LYS  23  -2.039  -6.387   2.048
  148   1HD   LYS  23          HD1       LYS  23  -2.178  -8.446   0.911
  149   2HD   LYS  23          HD2       LYS  23  -2.591  -8.649   2.478
  150   1HE   LYS  23          HE1       LYS  23  -4.014  -9.838   0.899
  151   2HE   LYS  23          HE2       LYS  23  -4.824  -8.883   1.948
  152   1HZ   LYS  23          HZ1       LYS  23  -4.190  -8.102  -0.763
  153   2HZ   LYS  23          HZ2       LYS  23  -5.714  -8.622  -0.209
  154   3HZ   LYS  23          HZ3       LYS  23  -5.158  -7.260   0.326
  155    H    GLY  24           HN       GLY  24  -6.688  -5.457   2.247
  156   1HA   GLY  24          HA2       GLY  24  -8.711  -5.301   3.364
  157   2HA   GLY  24          HA1       GLY  24  -7.838  -4.867   4.841
  158    HA   PRO  25           HA       PRO  25 -10.724  -1.504   3.187
  159   1HB   PRO  25          HB1       PRO  25 -10.958  -1.111   6.096
  160   2HB   PRO  25          HB2       PRO  25 -12.107  -0.955   4.946
  161   1HG   PRO  25          HG1       PRO  25 -12.044  -3.147   6.309
  162   2HG   PRO  25          HG2       PRO  25 -12.332  -3.250   4.704
  163   1HD   PRO  25          HD1       PRO  25  -9.860  -3.768   6.080
  164   2HD   PRO  25          HD2       PRO  25 -10.462  -4.562   4.786
  165    H    LYS  26           HN       LYS  26  -8.120  -1.131   5.559
  166    HA   LYS  26           HA       LYS  26  -7.903   1.741   5.206
  167   1HB   LYS  26          HB1       LYS  26  -6.401  -0.319   6.645
  168   2HB   LYS  26          HB2       LYS  26  -5.613   1.078   6.332
  169   1HG   LYS  26          HG1       LYS  26  -8.105   0.918   7.763
  170   2HG   LYS  26          HG2       LYS  26  -6.649   1.088   8.485
  171   1HD   LYS  26          HD1       LYS  26  -7.949   3.073   6.855
  172   2HD   LYS  26          HD2       LYS  26  -7.747   3.156   8.473
  173   1HE   LYS  26          HE1       LYS  26  -6.061   4.466   7.917
  174   2HE   LYS  26          HE2       LYS  26  -5.270   3.044   7.770
  175   1HZ   LYS  26          HZ1       LYS  26  -4.867   4.424   5.891
  176   2HZ   LYS  26          HZ2       LYS  26  -5.652   3.072   5.407
  177   3HZ   LYS  26          HZ3       LYS  26  -6.470   4.474   5.576
  178    H    TYR  27           HN       TYR  27  -7.000  -0.663   3.064
  179    HA   TYR  27           HA       TYR  27  -5.114   1.214   1.675
  180   1HB   TYR  27          HB1       TYR  27  -4.532  -1.619   2.273
  181   2HB   TYR  27          HB2       TYR  27  -3.615  -0.649   1.333
  182    HD1  TYR  27           HD1      TYR  27  -4.438  -1.563   4.731
  183    HD2  TYR  27           HD2      TYR  27  -2.250   1.177   2.241
  184    HE1  TYR  27           HE1      TYR  27  -3.055  -0.919   6.682
  185    HE2  TYR  27           HE2      TYR  27  -0.966   1.932   4.213
  186    HH   TYR  27           HH       TYR  27  -1.448   0.565   7.453
  187    H    CYS  28           HN       CYS  28  -7.025  -1.775   1.410
  188    HA   CYS  28           HA       CYS  28  -7.213  -1.400  -1.552
  189   1HB   CYS  28          HB1       CYS  28  -5.658  -3.144  -0.438
  190   2HB   CYS  28          HB2       CYS  28  -7.020  -4.037  -0.324
  191    H    GLY  29           HN       GLY  29  -8.946  -2.269   1.381
  192   1HA   GLY  29          HA2       GLY  29 -11.086  -3.135   1.774
  193   2HA   GLY  29          HA1       GLY  29 -11.470  -2.941   0.066
  194    H    ARG  30           HN       ARG  30  -8.565  -4.671   0.436
  195    HA   ARG  30           HA       ARG  30  -9.764  -7.339   0.163
  196   1HB   ARG  30          HB1       ARG  30  -9.085  -5.592  -2.007
  197   2HB   ARG  30          HB2       ARG  30  -8.227  -6.979  -2.105
  198   1HG   ARG  30          HG1       ARG  30 -11.050  -7.168  -1.713
  199   2HG   ARG  30          HG2       ARG  30 -10.506  -6.829  -3.215
  200   1HD   ARG  30          HD1       ARG  30 -10.963  -9.209  -2.735
  201   2HD   ARG  30          HD2       ARG  30  -9.526  -8.884  -3.439
  202    HE   ARG  30           HE       ARG  30  -8.583  -8.915  -1.100
  203   1HH1  ARG  30          2HH2      ARG  30 -11.226 -11.134  -1.858
  204   2HH1  ARG  30          1HH2      ARG  30 -10.851 -12.077  -0.454
  205   1HH2  ARG  30          2HH1      ARG  30  -8.214 -10.036   0.533
  206   2HH2  ARG  30          1HH1      ARG  30  -9.140 -11.451   0.905
  Start of MODEL   12
    1   1H    VAL   1           H1       VAL   1   1.443  -0.641   6.573
    2   2H    VAL   1           H2       VAL   1   1.425   0.145   5.157
    3   3H    VAL   1           H3       VAL   1   0.484   0.697   6.405
    4    HA   VAL   1           HA       VAL   1   2.519   2.079   6.158
    5    HB   VAL   1           HB       VAL   1   2.571   0.307   8.652
    6   1HG1  VAL   1          1HG1      VAL   1   3.673   3.116   8.165
    7   2HG1  VAL   1          2HG1      VAL   1   3.585   2.313   9.743
    8   3HG1  VAL   1          3HG1      VAL   1   4.623   1.646   8.492
    9   1HG2  VAL   1          1HG2      VAL   1   1.063   2.912   8.132
   10   2HG2  VAL   1          2HG2      VAL   1   0.343   1.312   8.438
   11   3HG2  VAL   1          3HG2      VAL   1   1.236   2.128   9.711
   12    H    GLY   2           HN       GLY   2   4.638   2.242   5.847
   13   1HA   GLY   2          HA2       GLY   2   6.749   1.237   5.091
   14   2HA   GLY   2          HA1       GLY   2   5.869  -0.272   4.787
   15    H    GLU   3           HN       GLU   3   6.915   2.549   3.456
   16    HA   GLU   3           HA       GLU   3   5.368   3.576   1.520
   17   1HB   GLU   3          HB1       GLU   3   7.798   3.890   1.878
   18   2HB   GLU   3          HB2       GLU   3   8.087   2.589   0.933
   19   1HG   GLU   3          HG1       GLU   3   6.818   3.812  -0.820
   20   2HG   GLU   3          HG2       GLU   3   7.031   5.132   0.119
   21    H    CYS   4           HN       CYS   4   4.316   3.072  -0.344
   22    HA   CYS   4           HA       CYS   4   4.377   0.426  -1.577
   23   1HB   CYS   4          HB1       CYS   4   3.558   2.945  -2.859
   24   2HB   CYS   4          HB2       CYS   4   3.095   1.427  -3.244
   25    H    VAL   5           HN       VAL   5   6.393  -0.162  -2.143
   26    HA   VAL   5           HA       VAL   5   8.639   1.399  -2.166
   27    HB   VAL   5           HB       VAL   5   8.279  -1.310  -3.504
   28   1HG1  VAL   5          1HG1      VAL   5  10.825   0.105  -2.588
   29   2HG1  VAL   5          2HG1      VAL   5  10.717  -1.604  -3.068
   30   3HG1  VAL   5          3HG1      VAL   5  10.403  -0.348  -4.259
   31   1HG2  VAL   5          1HG2      VAL   5   7.639  -1.341  -1.129
   32   2HG2  VAL   5          2HG2      VAL   5   9.172  -2.183  -1.359
   33   3HG2  VAL   5          3HG2      VAL   5   9.157  -0.535  -0.689
   34    H    ARG   6           HN       ARG   6   8.663   3.192  -3.369
   35    HA   ARG   6           HA       ARG   6   8.307   4.627  -5.097
   36   1HB   ARG   6          HB1       ARG   6  10.180   2.844  -6.526
   37   2HB   ARG   6          HB2       ARG   6   9.949   4.436  -6.808
   38   1HG   ARG   6          HG1       ARG   6  11.124   3.371  -4.402
   39   2HG   ARG   6          HG2       ARG   6  11.976   4.046  -5.621
   40   1HD   ARG   6          HD1       ARG   6  11.673   6.058  -4.821
   41   2HD   ARG   6          HD2       ARG   6  10.066   5.817  -4.658
   42    HE   ARG   6           HE       ARG   6  10.344   4.943  -2.478
   43   1HH1  ARG   6          2HH2      ARG   6  13.390   6.220  -3.754
   44   2HH1  ARG   6          1HH2      ARG   6  14.060   6.389  -2.166
   45   1HH2  ARG   6          2HH1      ARG   6  11.257   5.290  -0.507
   46   2HH2  ARG   6          1HH1      ARG   6  12.882   5.875  -0.375
   47    H    GLY   7           HN       GLY   7   6.256   2.873  -4.911
   48   1HA   GLY   7          HA2       GLY   7   4.226   2.947  -6.173
   49   2HA   GLY   7          HA1       GLY   7   5.111   2.717  -7.664
   50    H    ARG   8           HN       ARG   8   6.481   0.360  -5.633
   51    HA   ARG   8           HA       ARG   8   4.604  -1.709  -6.602
   52   1HB   ARG   8          HB1       ARG   8   7.376  -1.595  -5.792
   53   2HB   ARG   8          HB2       ARG   8   6.606  -2.934  -5.263
   54   1HG   ARG   8          HG1       ARG   8   7.630  -3.377  -7.331
   55   2HG   ARG   8          HG2       ARG   8   6.008  -3.477  -7.486
   56   1HD   ARG   8          HD1       ARG   8   6.884  -2.391  -9.364
   57   2HD   ARG   8          HD2       ARG   8   5.995  -1.321  -8.507
   58    HE   ARG   8           HE       ARG   8   8.859  -1.388  -8.117
   59   1HH1  ARG   8          2HH2      ARG   8   6.098   0.534  -9.203
   60   2HH1  ARG   8          1HH2      ARG   8   7.004   2.006  -9.091
   61   1HH2  ARG   8          2HH1      ARG   8   9.881   0.582  -7.947
   62   2HH2  ARG   8          1HH1      ARG   8   9.054   2.032  -8.410
   63    H    CYS   9           HN       CYS   9   4.166  -3.602  -5.208
   64    HA   CYS   9           HA       CYS   9   4.082  -3.210  -2.345
   65   1HB   CYS   9          HB1       CYS   9   1.712  -3.306  -4.021
   66   2HB   CYS   9          HB2       CYS   9   1.685  -4.297  -2.722
   67    HA   PRO  10           HA       PRO  10   5.143  -7.613  -2.721
   68   1HB   PRO  10          HB1       PRO  10   3.567  -7.909  -0.255
   69   2HB   PRO  10          HB2       PRO  10   5.064  -8.470  -0.588
   70   1HG   PRO  10          HG1       PRO  10   4.838  -6.362   0.898
   71   2HG   PRO  10          HG2       PRO  10   6.042  -6.411  -0.205
   72   1HD   PRO  10          HD1       PRO  10   3.503  -5.066  -0.439
   73   2HD   PRO  10          HD2       PRO  10   4.964  -4.515  -0.918
   74    H    SER  11           HN       SER  11   4.109  -9.780  -2.787
   75    HA   SER  11           HA       SER  11   2.179 -10.101  -4.609
   76   1HB   SER  11          HB1       SER  11   2.777 -11.995  -2.424
   77   2HB   SER  11          HB2       SER  11   2.164 -12.375  -3.889
   78    HG   SER  11           HG       SER  11   4.364 -12.746  -3.890
   79    H    GLY  12           HN       GLY  12   0.252  -9.041  -4.505
   80   1HA   GLY  12          HA2       GLY  12  -2.048  -9.013  -4.140
   81   2HA   GLY  12          HA1       GLY  12  -1.872 -10.273  -2.920
   82    H    MET  13           HN       MET  13   0.192  -7.540  -2.361
   83    HA   MET  13           HA       MET  13  -1.673  -6.352  -0.360
   84   1HB   MET  13          HB1       MET  13   1.180  -5.876  -0.967
   85   2HB   MET  13          HB2       MET  13   0.319  -4.948   0.065
   86   1HG   MET  13          HG1       MET  13  -0.161  -7.006   1.309
   87   2HG   MET  13          HG2       MET  13   0.984  -7.725   0.392
   88   1HE   MET  13          HE1       MET  13   2.769  -7.561   3.835
   89   2HE   MET  13          HE2       MET  13   1.048  -7.882   3.520
   90   3HE   MET  13          HE3       MET  13   2.297  -8.624   2.489
   91    H    CYS  14           HN       CYS  14  -1.656  -3.915  -0.388
   92    HA   CYS  14           HA       CYS  14  -1.982  -2.752  -3.091
   93   1HB   CYS  14          HB1       CYS  14  -4.254  -2.065  -2.214
   94   2HB   CYS  14          HB2       CYS  14  -4.067  -3.565  -2.834
   95    H    CYS  15           HN       CYS  15  -2.606  -0.391  -2.937
   96    HA   CYS  15           HA       CYS  15  -0.650   0.789  -1.027
   97   1HB   CYS  15          HB1       CYS  15   0.061   0.586  -3.316
   98   2HB   CYS  15          HB2       CYS  15  -1.200   1.482  -3.838
   99    H    SER  16           HN       SER  16  -1.477   2.126   0.400
  100    HA   SER  16           HA       SER  16  -4.088   3.380   0.185
  101   1HB   SER  16          HB1       SER  16  -3.543   4.314   2.284
  102   2HB   SER  16          HB2       SER  16  -3.120   2.737   2.300
  103    HG   SER  16           HG       SER  16  -1.039   3.171   2.274
  104    H    GLN  17           HN       GLN  17  -4.520   5.647   0.374
  105    HA   GLN  17           HA       GLN  17  -3.305   7.318  -1.561
  106   1HB   GLN  17          HB1       GLN  17  -4.695   9.006  -0.516
  107   2HB   GLN  17          HB2       GLN  17  -5.527   7.633  -0.811
  108   1HG   GLN  17          HG1       GLN  17  -4.540   7.910   1.822
  109   2HG   GLN  17          HG2       GLN  17  -5.750   8.927   1.413
  110   1HE2  GLN  17          1HE2      GLN  17  -7.677   8.228   2.313
  111   2HE2  GLN  17          2HE2      GLN  17  -8.151   6.528   2.226
  112    H1   NAL  18           HD1      NAL  18  -2.673   5.854   3.938
  113    H3   NAL  18           HD2      NAL  18  -1.720   9.882   4.400
  114    H4   NAL  18           HE2      NAL  18  -3.940  10.328   5.213
  115    H5   NAL  18           HH2      NAL  18  -6.219   9.548   5.669
  116    H6   NAL  18           HP       NAL  18  -7.839   7.769   5.705
  117    H7   NAL  18           HH1      NAL  18  -7.200   5.548   5.041
  118    H8   NAL  18           HZ1      NAL  18  -4.938   5.086   4.371
  119   1H9   NAL  18          HB1       NAL  18  -0.434   6.517   3.496
  120   2H9   NAL  18          HB2       NAL  18   0.106   8.113   4.009
  121    H10  NAL  18           HA       NAL  18  -0.630   9.126   1.945
  122   1HN   NAL  18          HN        NAL  18  -2.200   6.669   1.629
  123    H    GLY  19           HN       GLY  19  -0.241   6.509  -0.117
  124   1HA   GLY  19          HA2       GLY  19   1.596   5.800  -1.346
  125   2HA   GLY  19          HA1       GLY  19   2.641   6.914  -0.454
  126    H    TYR  20           HN       TYR  20   0.636   4.804   1.449
  127    HA   TYR  20           HA       TYR  20   3.006   3.095   2.152
  128   1HB   TYR  20          HB1       TYR  20   0.733   4.064   3.740
  129   2HB   TYR  20          HB2       TYR  20   1.554   2.724   4.184
  130    HD1  TYR  20           HD1      TYR  20   4.045   4.816   2.913
  131    HD2  TYR  20           HD2      TYR  20   1.363   4.392   6.278
  132    HE1  TYR  20           HE1      TYR  20   5.597   6.102   4.302
  133    HE2  TYR  20           HE2      TYR  20   2.954   5.708   7.681
  134    HH   TYR  20           HH       TYR  20   5.974   7.051   6.371
  135    H    CYS  21           HN       CYS  21   2.917   1.018   1.863
  136    HA   CYS  21           HA       CYS  21   0.667  -0.219   0.476
  137   1HB   CYS  21          HB1       CYS  21   3.078  -0.562  -0.001
  138   2HB   CYS  21          HB2       CYS  21   3.216  -1.388   1.401
  139    H    GLY  22           HN       GLY  22  -0.301  -2.194   1.246
  140   1HA   GLY  22          HA2       GLY  22   0.038  -3.477   3.733
  141   2HA   GLY  22          HA1       GLY  22  -1.196  -2.221   3.951
  142    H    LYS  23           HN       LYS  23  -2.733  -4.030   4.324
  143    HA   LYS  23           HA       LYS  23  -3.888  -4.966   1.774
  144   1HB   LYS  23          HB1       LYS  23  -2.401  -6.713   2.950
  145   2HB   LYS  23          HB2       LYS  23  -3.656  -6.893   3.981
  146   1HG   LYS  23          HG1       LYS  23  -5.065  -7.457   2.112
  147   2HG   LYS  23          HG2       LYS  23  -3.763  -7.363   1.131
  148   1HD   LYS  23          HD1       LYS  23  -2.729  -9.146   2.344
  149   2HD   LYS  23          HD2       LYS  23  -4.044  -9.248   3.307
  150   1HE   LYS  23          HE1       LYS  23  -4.423 -10.921   1.839
  151   2HE   LYS  23          HE2       LYS  23  -5.286  -9.701   1.180
  152   1HZ   LYS  23          HZ1       LYS  23  -2.663 -10.504   0.329
  153   2HZ   LYS  23          HZ2       LYS  23  -4.054 -10.795  -0.493
  154   3HZ   LYS  23          HZ3       LYS  23  -3.492  -9.261  -0.341
  155    H    GLY  24           HN       GLY  24  -6.149  -5.469   1.959
  156   1HA   GLY  24          HA2       GLY  24  -8.249  -5.538   3.035
  157   2HA   GLY  24          HA1       GLY  24  -7.536  -4.861   4.500
  158    HA   PRO  25           HA       PRO  25 -10.519  -2.093   2.168
  159   1HB   PRO  25          HB1       PRO  25 -10.929  -1.193   4.947
  160   2HB   PRO  25          HB2       PRO  25 -12.029  -1.333   3.748
  161   1HG   PRO  25          HG1       PRO  25 -11.864  -3.247   5.475
  162   2HG   PRO  25          HG2       PRO  25 -12.068  -3.645   3.904
  163   1HD   PRO  25          HD1       PRO  25  -9.638  -3.734   5.435
  164   2HD   PRO  25          HD2       PRO  25 -10.111  -4.764   4.259
  165    H    LYS  26           HN       LYS  26  -8.412  -0.832   4.770
  166    HA   LYS  26           HA       LYS  26  -8.344   1.841   3.660
  167   1HB   LYS  26          HB1       LYS  26  -6.684   0.583   5.769
  168   2HB   LYS  26          HB2       LYS  26  -6.780   2.187   5.478
  169   1HG   LYS  26          HG1       LYS  26  -8.803   0.510   6.632
  170   2HG   LYS  26          HG2       LYS  26  -8.104   1.820   7.312
  171   1HD   LYS  26          HD1       LYS  26 -10.084   1.868   5.219
  172   2HD   LYS  26          HD2       LYS  26 -10.305   2.369   6.758
  173   1HE   LYS  26          HE1       LYS  26  -8.924   4.208   6.434
  174   2HE   LYS  26          HE2       LYS  26  -8.430   3.645   4.983
  175   1HZ   LYS  26          HZ1       LYS  26 -11.021   4.778   5.571
  176   2HZ   LYS  26          HZ2       LYS  26  -9.903   5.238   4.391
  177   3HZ   LYS  26          HZ3       LYS  26 -10.689   3.934   4.162
  178    H    TYR  27           HN       TYR  27  -6.841  -0.795   2.445
  179    HA   TYR  27           HA       TYR  27  -4.669   0.872   1.205
  180   1HB   TYR  27          HB1       TYR  27  -4.577  -1.974   1.985
  181   2HB   TYR  27          HB2       TYR  27  -3.428  -1.224   1.098
  182    HD1  TYR  27           HD1      TYR  27  -4.749  -1.723   4.421
  183    HD2  TYR  27           HD2      TYR  27  -1.963   0.507   2.018
  184    HE1  TYR  27           HE1      TYR  27  -3.605  -0.953   6.482
  185    HE2  TYR  27           HE2      TYR  27  -0.835   1.331   4.078
  186    HH   TYR  27           HH       TYR  27  -2.047   0.537   7.314
  187    H    CYS  28           HN       CYS  28  -7.006  -1.779   0.714
  188    HA   CYS  28           HA       CYS  28  -6.600  -1.734  -2.214
  189   1HB   CYS  28          HB1       CYS  28  -8.115  -3.373  -0.310
  190   2HB   CYS  28          HB2       CYS  28  -8.356  -3.510  -1.920
  191    H    GLY  29           HN       GLY  29  -8.882  -0.468   0.161
  192   1HA   GLY  29          HA2       GLY  29 -10.311   1.016  -1.979
  193   2HA   GLY  29          HA1       GLY  29 -10.953   0.711  -0.347
  194    H    ARG  30           HN       ARG  30 -11.025   3.066  -0.025
  195    HA   ARG  30           HA       ARG  30  -8.393   4.362   0.597
  196   1HB   ARG  30          HB1       ARG  30 -10.865   5.689  -0.348
  197   2HB   ARG  30          HB2       ARG  30  -9.495   6.449   0.114
  198   1HG   ARG  30          HG1       ARG  30  -9.715   4.820  -2.245
  199   2HG   ARG  30          HG2       ARG  30  -9.777   6.452  -2.249
  200   1HD   ARG  30          HD1       ARG  30  -7.650   5.976  -2.926
  201   2HD   ARG  30          HD2       ARG  30  -7.474   6.385  -1.355
  202    HE   ARG  30           HE       ARG  30  -7.790   3.755  -1.158
  203   1HH1  ARG  30          2HH2      ARG  30  -5.279   5.510  -2.966
  204   2HH1  ARG  30          1HH2      ARG  30  -4.256   4.115  -2.881
  205   1HH2  ARG  30          2HH1      ARG  30  -6.480   2.158  -1.185
  206   2HH2  ARG  30          1HH1      ARG  30  -4.912   2.289  -1.910
  Start of MODEL   13
    1   1H    VAL   1           H1       VAL   1   3.074  -0.473   3.788
    2   2H    VAL   1           H2       VAL   1   4.607  -1.068   3.583
    3   3H    VAL   1           H3       VAL   1   4.254   0.430   3.034
    4    HA   VAL   1           HA       VAL   1   3.872   1.190   5.299
    5    HB   VAL   1           HB       VAL   1   4.810  -0.230   7.127
    6   1HG1  VAL   1          1HG1      VAL   1   2.763  -1.456   7.509
    7   2HG1  VAL   1          2HG1      VAL   1   2.370   0.098   6.763
    8   3HG1  VAL   1          3HG1      VAL   1   2.331  -1.396   5.796
    9   1HG2  VAL   1          1HG2      VAL   1   6.033  -1.923   5.750
   10   2HG2  VAL   1          2HG2      VAL   1   4.901  -2.650   6.894
   11   3HG2  VAL   1          3HG2      VAL   1   4.470  -2.565   5.182
   12    H    GLY   2           HN       GLY   2   5.609   2.326   6.271
   13   1HA   GLY   2          HA2       GLY   2   7.658   3.402   6.098
   14   2HA   GLY   2          HA1       GLY   2   8.306   2.067   5.137
   15    H    GLU   3           HN       GLU   3   6.664   1.830   3.048
   16    HA   GLU   3           HA       GLU   3   5.982   4.407   1.783
   17   1HB   GLU   3          HB1       GLU   3   8.442   3.517   1.442
   18   2HB   GLU   3          HB2       GLU   3   7.740   2.600   0.287
   19   1HG   GLU   3          HG1       GLU   3   7.004   4.555  -0.830
   20   2HG   GLU   3          HG2       GLU   3   7.678   5.481   0.334
   21    H    CYS   4           HN       CYS   4   5.048   3.934  -0.463
   22    HA   CYS   4           HA       CYS   4   4.459   1.090  -1.057
   23   1HB   CYS   4          HB1       CYS   4   3.673   3.469  -2.635
   24   2HB   CYS   4          HB2       CYS   4   3.290   1.919  -2.977
   25    H    VAL   5           HN       VAL   5   6.221   0.165  -1.973
   26    HA   VAL   5           HA       VAL   5   8.658   1.590  -2.108
   27    HB   VAL   5           HB       VAL   5   8.026  -1.177  -3.194
   28   1HG1  VAL   5          1HG1      VAL   5  10.677   0.119  -2.396
   29   2HG1  VAL   5          2HG1      VAL   5  10.454  -1.591  -2.817
   30   3HG1  VAL   5          3HG1      VAL   5  10.195  -0.352  -4.043
   31   1HG2  VAL   5          1HG2      VAL   5   7.451  -1.035  -0.807
   32   2HG2  VAL   5          2HG2      VAL   5   8.937  -1.961  -1.010
   33   3HG2  VAL   5          3HG2      VAL   5   9.019  -0.276  -0.451
   34    H    ARG   6           HN       ARG   6   8.760   3.218  -3.467
   35    HA   ARG   6           HA       ARG   6   8.478   4.527  -5.301
   36   1HB   ARG   6          HB1       ARG   6   9.850   2.346  -6.750
   37   2HB   ARG   6          HB2       ARG   6   9.851   3.932  -7.139
   38   1HG   ARG   6          HG1       ARG   6  11.175   2.780  -4.855
   39   2HG   ARG   6          HG2       ARG   6  11.923   3.349  -6.191
   40   1HD   ARG   6          HD1       ARG   6  12.077   5.323  -5.292
   41   2HD   ARG   6          HD2       ARG   6  10.455   5.392  -5.114
   42    HE   ARG   6           HE       ARG   6  10.572   4.646  -2.892
   43   1HH1  ARG   6          2HH2      ARG   6  13.813   4.817  -4.308
   44   2HH1  ARG   6          1HH2      ARG   6  14.566   4.814  -2.748
   45   1HH2  ARG   6          2HH1      ARG   6  11.635   4.741  -0.960
   46   2HH2  ARG   6          1HH1      ARG   6  13.366   4.772  -0.907
   47    H    GLY   7           HN       GLY   7   6.223   3.276  -4.672
   48   1HA   GLY   7          HA2       GLY   7   4.100   3.618  -5.706
   49   2HA   GLY   7          HA1       GLY   7   4.759   3.157  -7.267
   50    H    ARG   8           HN       ARG   8   5.950   0.617  -5.460
   51    HA   ARG   8           HA       ARG   8   3.488  -0.950  -6.008
   52   1HB   ARG   8          HB1       ARG   8   4.864  -2.499  -6.951
   53   2HB   ARG   8          HB2       ARG   8   5.530  -1.095  -7.451
   54   1HG   ARG   8          HG1       ARG   8   7.007  -1.581  -5.361
   55   2HG   ARG   8          HG2       ARG   8   6.674  -3.106  -5.840
   56   1HD   ARG   8          HD1       ARG   8   8.698  -2.449  -6.826
   57   2HD   ARG   8          HD2       ARG   8   7.576  -2.587  -8.005
   58    HE   ARG   8           HE       ARG   8   7.963   0.034  -6.874
   59   1HH1  ARG   8          2HH2      ARG   8   8.882  -2.054  -9.561
   60   2HH1  ARG   8          1HH2      ARG   8   9.159  -0.721 -10.632
   61   1HH2  ARG   8          2HH1      ARG   8   8.207   1.712  -8.413
   62   2HH2  ARG   8          1HH1      ARG   8   8.789   1.342 -10.002
   63    H    CYS   9           HN       CYS   9   3.487  -3.171  -5.005
   64    HA   CYS   9           HA       CYS   9   4.280  -3.065  -2.152
   65   1HB   CYS   9          HB1       CYS   9   1.680  -4.002  -3.178
   66   2HB   CYS   9          HB2       CYS   9   2.121  -3.835  -1.614
   67    HA   PRO  10           HA       PRO  10   5.253  -7.495  -2.512
   68   1HB   PRO  10          HB1       PRO  10   3.512  -7.776  -0.150
   69   2HB   PRO  10          HB2       PRO  10   4.996  -8.408  -0.407
   70   1HG   PRO  10          HG1       PRO  10   4.791  -6.317   1.102
   71   2HG   PRO  10          HG2       PRO  10   6.053  -6.410   0.069
   72   1HD   PRO  10          HD1       PRO  10   3.617  -4.909  -0.268
   73   2HD   PRO  10          HD2       PRO  10   5.129  -4.454  -0.687
   74    H    SER  11           HN       SER  11   4.280  -9.546  -2.950
   75    HA   SER  11           HA       SER  11   2.311  -9.663  -4.782
   76   1HB   SER  11          HB1       SER  11   3.076 -11.841  -2.938
   77   2HB   SER  11          HB2       SER  11   2.420 -12.021  -4.423
   78    HG   SER  11           HG       SER  11   4.634 -12.284  -4.548
   79    H    GLY  12           HN       GLY  12   0.349  -8.730  -4.446
   80   1HA   GLY  12          HA2       GLY  12  -1.959  -9.150  -4.117
   81   2HA   GLY  12          HA1       GLY  12  -1.589 -10.262  -2.804
   82    H    MET  13           HN       MET  13   0.228  -7.445  -2.255
   83    HA   MET  13           HA       MET  13  -1.758  -6.283  -0.376
   84   1HB   MET  13          HB1       MET  13   1.058  -5.689  -1.034
   85   2HB   MET  13          HB2       MET  13   0.163  -4.683  -0.110
   86   1HG   MET  13          HG1       MET  13  -0.244  -6.603   1.356
   87   2HG   MET  13          HG2       MET  13   0.926  -7.379   0.522
   88   1HE   MET  13          HE1       MET  13   2.259  -7.987   2.712
   89   2HE   MET  13          HE2       MET  13   2.690  -6.762   3.927
   90   3HE   MET  13          HE3       MET  13   0.982  -7.173   3.648
   91    H    CYS  14           HN       CYS  14  -1.857  -3.836  -0.448
   92    HA   CYS  14           HA       CYS  14  -2.165  -2.700  -3.166
   93   1HB   CYS  14          HB1       CYS  14  -4.233  -1.637  -2.058
   94   2HB   CYS  14          HB2       CYS  14  -4.326  -3.060  -2.853
   95    H    CYS  15           HN       CYS  15  -2.314  -0.308  -3.134
   96    HA   CYS  15           HA       CYS  15  -0.421   0.814  -1.126
   97   1HB   CYS  15          HB1       CYS  15   0.462   0.767  -3.322
   98   2HB   CYS  15          HB2       CYS  15  -0.855   1.495  -3.958
   99    H    SER  16           HN       SER  16  -1.355   2.112   0.315
  100    HA   SER  16           HA       SER  16  -3.984   3.253  -0.046
  101   1HB   SER  16          HB1       SER  16  -3.516   4.333   2.032
  102   2HB   SER  16          HB2       SER  16  -3.045   2.772   2.131
  103    HG   SER  16           HG       SER  16  -0.923   3.416   1.741
  104    H    GLN  17           HN       GLN  17  -4.621   5.387  -0.243
  105    HA   GLN  17           HA       GLN  17  -3.162   7.259  -1.817
  106   1HB   GLN  17          HB1       GLN  17  -4.907   8.775  -1.065
  107   2HB   GLN  17          HB2       GLN  17  -5.512   7.365  -1.625
  108   1HG   GLN  17          HG1       GLN  17  -5.220   7.539   1.185
  109   2HG   GLN  17          HG2       GLN  17  -6.395   8.468   0.535
  110   1HE2  GLN  17          1HE2      GLN  17  -8.440   7.589   0.440
  111   2HE2  GLN  17          2HE2      GLN  17  -8.691   5.858   0.221
  112    H1   NAL  18           HD1      NAL  18  -3.682   5.580   3.845
  113    H3   NAL  18           HD2      NAL  18  -3.278   9.712   4.155
  114    H4   NAL  18           HE2      NAL  18  -5.669   9.945   4.298
  115    H5   NAL  18           HH2      NAL  18  -7.913   8.933   4.117
  116    H6   NAL  18           HP       NAL  18  -9.291   6.992   3.757
  117    H7   NAL  18           HH1      NAL  18  -8.269   4.835   3.459
  118    H8   NAL  18           HZ1      NAL  18  -5.885   4.601   3.591
  119   1H9   NAL  18          HB2       NAL  18  -1.527   6.529   3.780
  120   2H9   NAL  18          HB1       NAL  18  -1.283   8.044   4.339
  121    H10  NAL  18           HA       NAL  18  -1.455   9.036   2.225
  122   1HN   NAL  18          HN        NAL  18  -2.695   6.471   1.477
  123    H    GLY  19           HN       GLY  19  -0.448   6.574   0.237
  124   1HA   GLY  19          HA2       GLY  19   1.638   6.407  -0.759
  125   2HA   GLY  19          HA1       GLY  19   2.339   7.439   0.489
  126    H    TYR  20           HN       TYR  20   0.523   4.735   1.582
  127    HA   TYR  20           HA       TYR  20   2.984   3.149   2.253
  128   1HB   TYR  20          HB1       TYR  20   0.835   4.150   3.916
  129   2HB   TYR  20          HB2       TYR  20   1.257   2.597   4.196
  130    HD1  TYR  20           HD1      TYR  20   3.446   5.477   3.389
  131    HD2  TYR  20           HD2      TYR  20   2.185   2.609   6.364
  132    HE1  TYR  20           HE1      TYR  20   5.314   6.160   4.821
  133    HE2  TYR  20           HE2      TYR  20   4.077   3.332   7.829
  134    HH   TYR  20           HH       TYR  20   6.431   5.787   6.772
  135    H    CYS  21           HN       CYS  21   2.949   1.139   1.365
  136    HA   CYS  21           HA       CYS  21   0.508  -0.141   0.473
  137   1HB   CYS  21          HB1       CYS  21   3.254  -1.116   0.847
  138   2HB   CYS  21          HB2       CYS  21   2.050  -2.115   0.376
  139    H    GLY  22           HN       GLY  22  -0.426  -2.092   1.211
  140   1HA   GLY  22          HA2       GLY  22   0.252  -3.646   3.452
  141   2HA   GLY  22          HA1       GLY  22  -0.912  -2.433   4.008
  142    H    LYS  23           HN       LYS  23  -2.444  -4.325   4.345
  143    HA   LYS  23           HA       LYS  23  -3.952  -4.765   1.847
  144   1HB   LYS  23          HB1       LYS  23  -2.486  -6.743   2.297
  145   2HB   LYS  23          HB2       LYS  23  -3.391  -7.061   3.619
  146   1HG   LYS  23          HG1       LYS  23  -5.283  -7.450   2.321
  147   2HG   LYS  23          HG2       LYS  23  -4.546  -6.878   0.981
  148   1HD   LYS  23          HD1       LYS  23  -3.060  -8.736   0.997
  149   2HD   LYS  23          HD2       LYS  23  -3.774  -9.302   2.352
  150   1HE   LYS  23          HE1       LYS  23  -4.566 -10.518   0.495
  151   2HE   LYS  23          HE2       LYS  23  -5.795  -9.649   1.129
  152   1HZ   LYS  23          HZ1       LYS  23  -5.629  -8.075  -0.572
  153   2HZ   LYS  23          HZ2       LYS  23  -4.258  -8.760  -1.134
  154   3HZ   LYS  23          HZ3       LYS  23  -5.696  -9.561  -1.284
  155    H    GLY  24           HN       GLY  24  -6.103  -4.870   2.083
  156   1HA   GLY  24          HA2       GLY  24  -8.149  -5.086   3.483
  157   2HA   GLY  24          HA1       GLY  24  -7.260  -4.272   4.778
  158    HA   PRO  25           HA       PRO  25  -9.773  -1.419   1.943
  159   1HB   PRO  25          HB1       PRO  25 -11.143  -0.134   3.899
  160   2HB   PRO  25          HB2       PRO  25 -11.702  -1.465   3.134
  161   1HG   PRO  25          HG1       PRO  25 -10.428  -1.339   5.721
  162   2HG   PRO  25          HG2       PRO  25 -11.705  -2.261   5.289
  163   1HD   PRO  25          HD1       PRO  25  -9.332  -3.326   5.395
  164   2HD   PRO  25          HD2       PRO  25 -10.384  -3.815   4.246
  165    H    LYS  26           HN       LYS  26  -8.185  -0.581   5.013
  166    HA   LYS  26           HA       LYS  26  -7.564   2.113   4.445
  167   1HB   LYS  26          HB1       LYS  26  -6.021   0.184   6.086
  168   2HB   LYS  26          HB2       LYS  26  -5.925   1.812   6.190
  169   1HG   LYS  26          HG1       LYS  26  -8.029   0.124   7.143
  170   2HG   LYS  26          HG2       LYS  26  -7.146   1.198   8.001
  171   1HD   LYS  26          HD1       LYS  26  -9.299   1.813   6.200
  172   2HD   LYS  26          HD2       LYS  26  -9.281   2.063   7.814
  173   1HE   LYS  26          HE1       LYS  26  -7.931   3.889   7.629
  174   2HE   LYS  26          HE2       LYS  26  -7.434   3.472   6.131
  175   1HZ   LYS  26          HZ1       LYS  26 -10.052   4.473   6.793
  176   2HZ   LYS  26          HZ2       LYS  26  -8.909   5.249   5.874
  177   3HZ   LYS  26          HZ3       LYS  26  -9.638   3.891   5.317
  178    H    TYR  27           HN       TYR  27  -6.326  -0.569   2.838
  179    HA   TYR  27           HA       TYR  27  -4.076   1.055   1.714
  180   1HB   TYR  27          HB1       TYR  27  -4.185  -1.868   2.021
  181   2HB   TYR  27          HB2       TYR  27  -2.938  -1.005   1.415
  182    HD1  TYR  27           HD1      TYR  27  -4.492  -2.241   4.386
  183    HD2  TYR  27           HD2      TYR  27  -1.675   0.636   2.875
  184    HE1  TYR  27           HE1      TYR  27  -3.546  -1.968   6.676
  185    HE2  TYR  27           HE2      TYR  27  -0.741   0.935   5.155
  186    HH   TYR  27           HH       TYR  27  -0.920   0.334   7.376
  187    H    CYS  28           HN       CYS  28  -6.760  -1.135   0.988
  188    HA   CYS  28           HA       CYS  28  -6.332  -0.884  -1.902
  189   1HB   CYS  28          HB1       CYS  28  -8.205  -2.287  -0.160
  190   2HB   CYS  28          HB2       CYS  28  -8.479  -2.188  -1.767
  191    H    GLY  29           HN       GLY  29  -7.870   1.127   0.416
  192   1HA   GLY  29          HA2       GLY  29  -7.617   3.290  -0.918
  193   2HA   GLY  29          HA1       GLY  29  -8.968   2.725  -1.882
  194    H    ARG  30           HN       ARG  30  -9.576   1.960   1.423
  195    HA   ARG  30           HA       ARG  30 -11.421   4.306   1.547
  196   1HB   ARG  30          HB1       ARG  30 -12.029   1.570   1.331
  197   2HB   ARG  30          HB2       ARG  30 -12.550   2.071   2.796
  198   1HG   ARG  30          HG1       ARG  30 -13.265   3.600   0.490
  199   2HG   ARG  30          HG2       ARG  30 -14.103   2.236   0.815
  200   1HD   ARG  30          HD1       ARG  30 -15.167   4.257   1.636
  201   2HD   ARG  30          HD2       ARG  30 -14.932   3.125   2.791
  202    HE   ARG  30           HE       ARG  30 -12.791   4.459   3.279
  203   1HH1  ARG  30          2HH2      ARG  30 -15.856   6.077   2.608
  204   2HH1  ARG  30          1HH2      ARG  30 -15.292   7.499   3.420
  205   1HH2  ARG  30          2HH1      ARG  30 -12.184   6.142   4.191
  206   2HH2  ARG  30          1HH1      ARG  30 -13.205   7.535   4.320
  Start of MODEL   14
    1   1H    VAL   1           H1       VAL   1   0.976   0.216   6.906
    2   2H    VAL   1           H2       VAL   1   1.451  -1.368   6.864
    3   3H    VAL   1           H3       VAL   1   1.346  -0.522   5.472
    4    HA   VAL   1           HA       VAL   1   3.192   0.838   6.033
    5    HB   VAL   1           HB       VAL   1   4.541  -0.145   8.110
    6   1HG1  VAL   1          1HG1      VAL   1   2.373   1.961   8.239
    7   2HG1  VAL   1          2HG1      VAL   1   3.748   1.784   9.362
    8   3HG1  VAL   1          3HG1      VAL   1   4.052   2.130   7.653
    9   1HG2  VAL   1          1HG2      VAL   1   1.693  -0.437   9.146
   10   2HG2  VAL   1          2HG2      VAL   1   2.810  -1.790   8.785
   11   3HG2  VAL   1          3HG2      VAL   1   3.209  -0.612  10.042
   12    H    GLY   2           HN       GLY   2   5.640  -1.588   5.234
   13   1HA   GLY   2          HA2       GLY   2   5.607   1.106   6.255
   14   2HA   GLY   2          HA1       GLY   2   6.767   0.401   5.135
   15    H    GLU   3           HN       GLU   3   6.866   2.310   3.887
   16    HA   GLU   3           HA       GLU   3   4.792   3.599   2.492
   17   1HB   GLU   3          HB1       GLU   3   6.523   4.175   0.952
   18   2HB   GLU   3          HB2       GLU   3   7.044   4.367   2.488
   19   1HG   GLU   3          HG1       GLU   3   8.540   2.678   2.321
   20   2HG   GLU   3          HG2       GLU   3   7.746   1.978   1.077
   21    H    CYS   4           HN       CYS   4   4.276   3.413   0.155
   22    HA   CYS   4           HA       CYS   4   4.247   0.721  -1.043
   23   1HB   CYS   4          HB1       CYS   4   3.977   3.340  -2.354
   24   2HB   CYS   4          HB2       CYS   4   3.586   1.882  -2.977
   25    H    VAL   5           HN       VAL   5   6.032  -0.199  -1.772
   26    HA   VAL   5           HA       VAL   5   8.636   0.809  -1.264
   27    HB   VAL   5           HB       VAL   5   7.841  -1.573  -2.973
   28   1HG1  VAL   5          1HG1      VAL   5  10.211  -0.951  -3.309
   29   2HG1  VAL   5          2HG1      VAL   5  10.456  -0.880  -1.548
   30   3HG1  VAL   5          3HG1      VAL   5  10.096  -2.425  -2.348
   31   1HG2  VAL   5          1HG2      VAL   5   8.250  -2.875  -0.889
   32   2HG2  VAL   5          2HG2      VAL   5   8.450  -1.354   0.009
   33   3HG2  VAL   5          3HG2      VAL   5   6.884  -1.772  -0.715
   34    H    ARG   6           HN       ARG   6   9.132   2.661  -2.293
   35    HA   ARG   6           HA       ARG   6   9.202   4.310  -3.952
   36   1HB   ARG   6          HB1       ARG   6  10.261   2.140  -5.657
   37   2HB   ARG   6          HB2       ARG   6  10.400   3.739  -5.961
   38   1HG   ARG   6          HG1       ARG   6  11.625   2.607  -3.646
   39   2HG   ARG   6          HG2       ARG   6  12.382   2.542  -5.092
   40   1HD   ARG   6          HD1       ARG   6  13.242   4.327  -3.836
   41   2HD   ARG   6          HD2       ARG   6  12.474   4.909  -5.154
   42    HE   ARG   6           HE       ARG   6  11.198   6.190  -3.821
   43   1HH1  ARG   6          2HH2      ARG   6  12.215   3.423  -1.920
   44   2HH1  ARG   6          1HH2      ARG   6  11.236   3.892  -0.570
   45   1HH2  ARG   6          2HH1      ARG   6   9.845   6.624  -2.085
   46   2HH2  ARG   6          1HH1      ARG   6   9.938   5.644  -0.659
   47    H    GLY   7           HN       GLY   7   6.703   3.152  -3.600
   48   1HA   GLY   7          HA2       GLY   7   4.624   3.677  -4.619
   49   2HA   GLY   7          HA1       GLY   7   5.361   3.669  -6.205
   50    H    ARG   8           HN       ARG   8   6.465   0.749  -4.928
   51    HA   ARG   8           HA       ARG   8   4.233  -0.746  -6.177
   52   1HB   ARG   8          HB1       ARG   8   7.014  -1.404  -5.429
   53   2HB   ARG   8          HB2       ARG   8   5.949  -2.566  -5.855
   54   1HG   ARG   8          HG1       ARG   8   6.814  -2.292  -7.841
   55   2HG   ARG   8          HG2       ARG   8   5.763  -1.045  -7.929
   56   1HD   ARG   8          HD1       ARG   8   8.405  -0.534  -6.992
   57   2HD   ARG   8          HD2       ARG   8   8.163  -0.696  -8.599
   58    HE   ARG   8           HE       ARG   8   7.711   1.605  -7.103
   59   1HH1  ARG   8          2HH1      ARG   8   6.286  -0.043  -9.887
   60   2HH1  ARG   8          1HH1      ARG   8   5.697   1.452 -10.534
   61   1HH2  ARG   8          2HH2      ARG   8   6.936   3.413  -7.985
   62   2HH2  ARG   8          1HH2      ARG   8   6.059   3.371  -9.478
   63    H    CYS   9           HN       CYS   9   3.785  -2.918  -5.220
   64    HA   CYS   9           HA       CYS   9   4.190  -3.289  -2.358
   65   1HB   CYS   9          HB1       CYS   9   1.548  -3.206  -3.655
   66   2HB   CYS   9          HB2       CYS   9   1.801  -4.211  -2.392
   67    HA   PRO  10           HA       PRO  10   4.918  -7.347  -4.126
   68   1HB   PRO  10          HB1       PRO  10   4.649  -8.945  -2.022
   69   2HB   PRO  10          HB2       PRO  10   5.899  -7.897  -2.104
   70   1HG   PRO  10          HG1       PRO  10   3.422  -7.542  -0.642
   71   2HG   PRO  10          HG2       PRO  10   4.934  -7.260  -0.093
   72   1HD   PRO  10          HD1       PRO  10   3.483  -5.286  -1.016
   73   2HD   PRO  10          HD2       PRO  10   5.103  -5.279  -1.219
   74    H    SER  11           HN       SER  11   3.947  -9.379  -4.648
   75    HA   SER  11           HA       SER  11   1.464  -9.256  -5.732
   76   1HB   SER  11          HB1       SER  11   2.941 -11.706  -4.992
   77   2HB   SER  11          HB2       SER  11   1.817 -11.577  -6.169
   78    HG   SER  11           HG       SER  11   3.855 -11.455  -7.068
   79    H    GLY  12           HN       GLY  12  -0.089  -8.568  -4.264
   80   1HA   GLY  12          HA2       GLY  12  -2.188  -9.801  -3.483
   81   2HA   GLY  12          HA1       GLY  12  -1.137 -10.596  -2.315
   82    H    MET  13           HN       MET  13   0.200  -7.589  -2.354
   83    HA   MET  13           HA       MET  13  -1.651  -6.499  -0.260
   84   1HB   MET  13          HB1       MET  13   1.199  -5.970  -0.843
   85   2HB   MET  13          HB2       MET  13   0.321  -5.102   0.227
   86   1HG   MET  13          HG1       MET  13  -0.060  -7.050   1.513
   87   2HG   MET  13          HG2       MET  13   0.785  -7.937   0.434
   88   1HE   MET  13          HE1       MET  13   1.521  -4.508   2.199
   89   2HE   MET  13          HE2       MET  13   0.896  -5.604   3.459
   90   3HE   MET  13          HE3       MET  13   2.594  -5.074   3.496
   91    H    CYS  14           HN       CYS  14  -1.692  -4.063  -0.239
   92    HA   CYS  14           HA       CYS  14  -2.125  -2.958  -2.977
   93   1HB   CYS  14          HB1       CYS  14  -4.079  -1.845  -1.726
   94   2HB   CYS  14          HB2       CYS  14  -4.243  -3.298  -2.455
   95    H    CYS  15           HN       CYS  15  -1.568  -0.939  -3.351
   96    HA   CYS  15           HA       CYS  15  -0.060   0.569  -1.307
   97   1HB   CYS  15          HB1       CYS  15   0.949   0.354  -3.451
   98   2HB   CYS  15          HB2       CYS  15  -0.373   0.918  -4.227
   99    H    SER  16           HN       SER  16  -1.133   1.997  -0.106
  100    HA   SER  16           HA       SER  16  -3.794   2.937  -0.806
  101   1HB   SER  16          HB1       SER  16  -3.647   4.109   1.243
  102   2HB   SER  16          HB2       SER  16  -3.080   2.595   1.476
  103    HG   SER  16           HG       SER  16  -1.127   3.223   1.772
  104    H    GLN  17           HN       GLN  17  -4.467   5.044  -1.019
  105    HA   GLN  17           HA       GLN  17  -3.085   6.866  -2.722
  106   1HB   GLN  17          HB1       GLN  17  -4.957   8.278  -2.193
  107   2HB   GLN  17          HB2       GLN  17  -5.466   6.764  -2.535
  108   1HG   GLN  17          HG1       GLN  17  -5.214   7.467   0.211
  109   2HG   GLN  17          HG2       GLN  17  -6.495   8.067  -0.606
  110   1HE2  GLN  17          1HE2      GLN  17  -8.427   6.862  -0.573
  111   2HE2  GLN  17          2HE2      GLN  17  -8.334   5.122  -0.247
  112    H1   NAL  18           HD1      NAL  18  -3.743   5.538   2.882
  113    H3   NAL  18           HD2      NAL  18  -3.636   9.685   3.239
  114    H4   NAL  18           HE2      NAL  18  -6.033   9.736   3.444
  115    H5   NAL  18           HH2      NAL  18  -8.193   8.550   3.406
  116    H6   NAL  18           HP       NAL  18  -9.430   6.496   3.221
  117    H7   NAL  18           HH1      NAL  18  -8.270   4.417   2.863
  118    H8   NAL  18           HZ1      NAL  18  -5.871   4.394   2.715
  119   1H9   NAL  18          HB2       NAL  18  -1.616   6.567   3.020
  120   2H9   NAL  18          HB1       NAL  18  -1.501   8.252   3.508
  121    H10  NAL  18           HA       NAL  18  -1.667   9.030   1.255
  122   1HN   NAL  18          HN        NAL  18  -2.755   6.358   0.656
  123    H    GLY  19           HN       GLY  19  -0.429   6.357  -0.383
  124   1HA   GLY  19          HA2       GLY  19   1.743   6.140  -1.185
  125   2HA   GLY  19          HA1       GLY  19   2.340   7.267   0.033
  126    H    TYR  20           HN       TYR  20   0.387   4.771   1.355
  127    HA   TYR  20           HA       TYR  20   2.814   3.248   2.238
  128   1HB   TYR  20          HB1       TYR  20   0.511   4.160   3.783
  129   2HB   TYR  20          HB2       TYR  20   1.372   2.860   4.267
  130    HD1  TYR  20           HD1      TYR  20   3.335   3.065   5.571
  131    HD2  TYR  20           HD2      TYR  20   1.722   6.431   3.427
  132    HE1  TYR  20           HE1      TYR  20   5.057   4.534   6.597
  133    HE2  TYR  20           HE2      TYR  20   3.442   7.902   4.448
  134    HH   TYR  20           HH       TYR  20   5.907   6.673   6.716
  135    H    CYS  21           HN       CYS  21   2.765   1.067   2.389
  136    HA   CYS  21           HA       CYS  21   0.768  -0.270   0.656
  137   1HB   CYS  21          HB1       CYS  21   3.237  -0.499   0.421
  138   2HB   CYS  21          HB2       CYS  21   3.265  -1.324   1.831
  139    H    GLY  22           HN       GLY  22  -0.384  -2.153   1.365
  140   1HA   GLY  22          HA2       GLY  22   0.042  -3.501   3.840
  141   2HA   GLY  22          HA1       GLY  22  -1.202  -2.293   4.090
  142    H    LYS  23           HN       LYS  23  -2.654  -4.117   4.533
  143    HA   LYS  23           HA       LYS  23  -4.049  -4.876   2.084
  144   1HB   LYS  23          HB1       LYS  23  -2.537  -6.769   2.773
  145   2HB   LYS  23          HB2       LYS  23  -3.509  -6.991   4.067
  146   1HG   LYS  23          HG1       LYS  23  -5.313  -7.547   2.712
  147   2HG   LYS  23          HG2       LYS  23  -4.520  -7.070   1.367
  148   1HD   LYS  23          HD1       LYS  23  -2.992  -8.875   1.618
  149   2HD   LYS  23          HD2       LYS  23  -3.764  -9.346   2.978
  150   1HE   LYS  23          HE1       LYS  23  -4.434 -10.740   1.208
  151   2HE   LYS  23          HE2       LYS  23  -5.712  -9.837   1.675
  152   1HZ   LYS  23          HZ1       LYS  23  -4.042  -9.147  -0.561
  153   2HZ   LYS  23          HZ2       LYS  23  -5.464  -9.975  -0.723
  154   3HZ   LYS  23          HZ3       LYS  23  -5.451  -8.426  -0.156
  155    H    GLY  24           HN       GLY  24  -6.279  -5.401   2.477
  156   1HA   GLY  24          HA2       GLY  24  -8.317  -5.261   3.680
  157   2HA   GLY  24          HA1       GLY  24  -7.446  -4.674   5.103
  158    HA   PRO  25           HA       PRO  25  -9.776  -1.468   2.545
  159   1HB   PRO  25          HB1       PRO  25 -11.270  -0.387   4.513
  160   2HB   PRO  25          HB2       PRO  25 -11.738  -1.689   3.645
  161   1HG   PRO  25          HG1       PRO  25 -10.553  -1.682   6.283
  162   2HG   PRO  25          HG2       PRO  25 -11.804  -2.596   5.764
  163   1HD   PRO  25          HD1       PRO  25  -9.422  -3.632   5.858
  164   2HD   PRO  25          HD2       PRO  25 -10.432  -4.050   4.645
  165    H    LYS  26           HN       LYS  26  -7.887  -1.021   5.468
  166    HA   LYS  26           HA       LYS  26  -7.465   1.791   5.342
  167   1HB   LYS  26          HB1       LYS  26  -6.727   0.307   7.142
  168   2HB   LYS  26          HB2       LYS  26  -5.580  -0.342   6.177
  169   1HG   LYS  26          HG1       LYS  26  -4.457   1.049   7.566
  170   2HG   LYS  26          HG2       LYS  26  -4.527   1.845   6.142
  171   1HD   LYS  26          HD1       LYS  26  -6.269   2.434   8.340
  172   2HD   LYS  26          HD2       LYS  26  -4.864   3.227   8.087
  173   1HE   LYS  26          HE1       LYS  26  -7.201   3.380   6.423
  174   2HE   LYS  26          HE2       LYS  26  -6.615   4.576   7.368
  175   1HZ   LYS  26          HZ1       LYS  26  -4.689   4.705   5.975
  176   2HZ   LYS  26          HZ2       LYS  26  -5.340   3.524   5.014
  177   3HZ   LYS  26          HZ3       LYS  26  -6.070   4.980   5.114
  178    H    TYR  27           HN       TYR  27  -6.376  -0.694   3.210
  179    HA   TYR  27           HA       TYR  27  -4.504   1.197   1.854
  180   1HB   TYR  27          HB1       TYR  27  -4.084  -1.686   2.301
  181   2HB   TYR  27          HB2       TYR  27  -3.033  -0.654   1.596
  182    HD1  TYR  27           HD1      TYR  27  -1.848   1.117   2.902
  183    HD2  TYR  27           HD2      TYR  27  -4.214  -1.997   4.696
  184    HE1  TYR  27           HE1      TYR  27  -0.731   1.533   5.085
  185    HE2  TYR  27           HE2      TYR  27  -3.076  -1.627   6.870
  186    HH   TYR  27           HH       TYR  27  -1.636  -0.216   8.037
  187    H    CYS  28           HN       CYS  28  -6.640  -1.610   1.434
  188    HA   CYS  28           HA       CYS  28  -6.576  -1.410  -1.498
  189   1HB   CYS  28          HB1       CYS  28  -7.943  -3.094   0.478
  190   2HB   CYS  28          HB2       CYS  28  -8.343  -3.152  -1.104
  191    H    GLY  29           HN       GLY  29  -8.325   0.219   1.028
  192   1HA   GLY  29          HA2       GLY  29 -10.686   0.909  -0.564
  193   2HA   GLY  29          HA1       GLY  29 -10.166   1.614   0.975
  194    H    ARG  30           HN       ARG  30  -8.999   1.328  -2.369
  195    HA   ARG  30           HA       ARG  30  -8.066   4.166  -2.469
  196   1HB   ARG  30          HB1       ARG  30  -6.247   2.760  -1.805
  197   2HB   ARG  30          HB2       ARG  30  -6.535   1.683  -2.998
  198   1HG   ARG  30          HG1       ARG  30  -5.971   4.213  -4.015
  199   2HG   ARG  30          HG2       ARG  30  -4.742   3.639  -3.105
  200   1HD   ARG  30          HD1       ARG  30  -4.396   3.084  -5.389
  201   2HD   ARG  30          HD2       ARG  30  -4.591   1.722  -4.508
  202    HE   ARG  30           HE       ARG  30  -7.014   1.841  -5.224
  203   1HH1  ARG  30          2HH2      ARG  30  -4.587   2.997  -7.510
  204   2HH1  ARG  30          1HH2      ARG  30  -5.806   3.175  -8.727
  205   1HH2  ARG  30          2HH1      ARG  30  -8.397   2.107  -6.678
  206   2HH2  ARG  30          1HH1      ARG  30  -7.960   2.673  -8.256
  Start of MODEL   15
    1   1H    VAL   1           H1       VAL   1   5.735  -0.907   1.213
    2   2H    VAL   1           H2       VAL   1   5.232  -2.470   0.967
    3   3H    VAL   1           H3       VAL   1   6.762  -2.139   1.527
    4    HA   VAL   1           HA       VAL   1   4.300  -1.525   2.986
    5    HB   VAL   1           HB       VAL   1   4.666  -3.940   2.842
    6   1HG1  VAL   1          1HG1      VAL   1   6.560  -5.026   3.965
    7   2HG1  VAL   1          2HG1      VAL   1   7.130  -4.047   2.611
    8   3HG1  VAL   1          3HG1      VAL   1   7.316  -3.457   4.278
    9   1HG2  VAL   1          1HG2      VAL   1   3.636  -2.895   4.851
   10   2HG2  VAL   1          2HG2      VAL   1   4.468  -4.416   5.206
   11   3HG2  VAL   1          3HG2      VAL   1   5.231  -2.879   5.642
   12    H    GLY   2           HN       GLY   2   4.612  -0.484   4.957
   13   1HA   GLY   2          HA2       GLY   2   5.407   1.568   5.773
   14   2HA   GLY   2          HA1       GLY   2   6.978   1.303   4.973
   15    H    GLU   3           HN       GLU   3   7.210   2.557   3.126
   16    HA   GLU   3           HA       GLU   3   5.078   3.812   1.711
   17   1HB   GLU   3          HB1       GLU   3   6.708   4.271   0.076
   18   2HB   GLU   3          HB2       GLU   3   7.365   4.511   1.552
   19   1HG   GLU   3          HG1       GLU   3   8.704   2.624   1.341
   20   2HG   GLU   3          HG2       GLU   3   7.922   2.158  -0.015
   21    H    CYS   4           HN       CYS   4   4.315   3.424  -0.453
   22    HA   CYS   4           HA       CYS   4   4.277   0.696  -1.539
   23   1HB   CYS   4          HB1       CYS   4   3.795   3.247  -2.930
   24   2HB   CYS   4          HB2       CYS   4   3.374   1.752  -3.436
   25    H    VAL   5           HN       VAL   5   6.066  -0.192  -2.082
   26    HA   VAL   5           HA       VAL   5   8.639   0.911  -1.775
   27    HB   VAL   5           HB       VAL   5   7.928  -1.633  -3.284
   28   1HG1  VAL   5          1HG1      VAL   5  10.167  -2.369  -2.518
   29   2HG1  VAL   5          2HG1      VAL   5  10.301  -0.926  -3.527
   30   3HG1  VAL   5          3HG1      VAL   5  10.440  -0.787  -1.762
   31   1HG2  VAL   5          1HG2      VAL   5   8.327  -1.161  -0.301
   32   2HG2  VAL   5          2HG2      VAL   5   6.852  -1.751  -1.116
   33   3HG2  VAL   5          3HG2      VAL   5   8.298  -2.761  -1.079
   34    H    ARG   6           HN       ARG   6   9.134   2.611  -2.936
   35    HA   ARG   6           HA       ARG   6   9.283   4.114  -4.660
   36   1HB   ARG   6          HB1       ARG   6  10.546   1.818  -6.017
   37   2HB   ARG   6          HB2       ARG   6  10.801   3.396  -6.354
   38   1HG   ARG   6          HG1       ARG   6  11.503   2.229  -3.819
   39   2HG   ARG   6          HG2       ARG   6  12.566   2.341  -5.054
   40   1HD   ARG   6          HD1       ARG   6  13.102   4.106  -3.753
   41   2HD   ARG   6          HD2       ARG   6  12.189   4.777  -4.930
   42    HE   ARG   6           HE       ARG   6  10.781   4.132  -2.468
   43   1HH1  ARG   6          2HH2      ARG   6  12.231   6.707  -4.424
   44   2HH1  ARG   6          1HH2      ARG   6  11.549   7.942  -3.420
   45   1HH2  ARG   6          2HH1      ARG   6  10.013   5.820  -1.227
   46   2HH2  ARG   6          1HH1      ARG   6  10.343   7.458  -1.682
   47    H    GLY   7           HN       GLY   7   6.791   3.101  -4.485
   48   1HA   GLY   7          HA2       GLY   7   4.907   3.831  -5.783
   49   2HA   GLY   7          HA1       GLY   7   5.731   3.373  -7.267
   50    H    ARG   8           HN       ARG   8   6.315   0.696  -5.362
   51    HA   ARG   8           HA       ARG   8   3.913  -0.674  -6.457
   52   1HB   ARG   8          HB1       ARG   8   6.744  -1.514  -6.258
   53   2HB   ARG   8          HB2       ARG   8   5.538  -2.456  -6.826
   54   1HG   ARG   8          HG1       ARG   8   6.154  -1.692  -8.795
   55   2HG   ARG   8          HG2       ARG   8   5.277  -0.378  -8.383
   56   1HD   ARG   8          HD1       ARG   8   7.154   0.661  -8.967
   57   2HD   ARG   8          HD2       ARG   8   7.527   0.373  -7.403
   58    HE   ARG   8           HE       ARG   8   8.536  -1.063  -9.691
   59   1HH1  ARG   8          2HH2      ARG   8   8.964  -0.511  -6.217
   60   2HH1  ARG   8          1HH2      ARG   8  10.462  -1.380  -6.211
   61   1HH2  ARG   8          2HH1      ARG   8  10.431  -2.163  -9.547
   62   2HH2  ARG   8          1HH1      ARG   8  11.265  -2.285  -8.034
   63    H    CYS   9           HN       CYS   9   3.814  -3.034  -5.584
   64    HA   CYS   9           HA       CYS   9   4.166  -3.162  -2.652
   65   1HB   CYS   9          HB1       CYS   9   1.637  -3.358  -4.126
   66   2HB   CYS   9          HB2       CYS   9   1.838  -4.237  -2.765
   67    HA   PRO  10           HA       PRO  10   5.195  -7.375  -3.827
   68   1HB   PRO  10          HB1       PRO  10   5.145  -8.579  -1.466
   69   2HB   PRO  10          HB2       PRO  10   6.303  -7.474  -1.787
   70   1HG   PRO  10          HG1       PRO  10   3.872  -7.062  -0.269
   71   2HG   PRO  10          HG2       PRO  10   5.373  -6.553   0.123
   72   1HD   PRO  10          HD1       PRO  10   3.661  -4.940  -1.061
   73   2HD   PRO  10          HD2       PRO  10   5.270  -4.778  -1.291
   74    H    SER  11           HN       SER  11   4.358  -9.599  -3.626
   75    HA   SER  11           HA       SER  11   2.022  -9.856  -4.948
   76   1HB   SER  11          HB1       SER  11   3.709 -11.599  -4.616
   77   2HB   SER  11          HB2       SER  11   3.044 -11.974  -3.172
   78    HG   SER  11           HG       SER  11   2.184 -13.300  -4.755
   79    H    GLY  12           HN       GLY  12   0.071  -9.218  -4.487
   80   1HA   GLY  12          HA2       GLY  12  -2.066  -9.539  -3.625
   81   2HA   GLY  12          HA1       GLY  12  -1.398 -10.389  -2.237
   82    H    MET  13           HN       MET  13   0.425  -7.630  -2.099
   83    HA   MET  13           HA       MET  13  -1.406  -6.356  -0.147
   84   1HB   MET  13          HB1       MET  13   1.304  -5.633  -1.087
   85   2HB   MET  13          HB2       MET  13   0.481  -4.807   0.056
   86   1HG   MET  13          HG1       MET  13   1.253  -7.560   0.330
   87   2HG   MET  13          HG2       MET  13   2.096  -6.318   0.974
   88   1HE   MET  13          HE1       MET  13   0.727  -8.136   4.127
   89   2HE   MET  13          HE2       MET  13   1.260  -8.881   2.601
   90   3HE   MET  13          HE3       MET  13   2.194  -7.545   3.315
   91    H    CYS  14           HN       CYS  14  -1.581  -3.883  -0.286
   92    HA   CYS  14           HA       CYS  14  -2.187  -2.943  -3.051
   93   1HB   CYS  14          HB1       CYS  14  -3.888  -2.410  -0.714
   94   2HB   CYS  14          HB2       CYS  14  -4.185  -2.021  -2.272
   95    H    CYS  15           HN       CYS  15  -1.985  -0.722  -3.379
   96    HA   CYS  15           HA       CYS  15  -0.243   0.718  -1.475
   97   1HB   CYS  15          HB1       CYS  15   0.431   0.562  -3.790
   98   2HB   CYS  15          HB2       CYS  15  -0.934   1.307  -4.288
   99    H    SER  16           HN       SER  16  -1.173   2.031  -0.075
  100    HA   SER  16           HA       SER  16  -3.949   2.689  -0.137
  101   1HB   SER  16          HB1       SER  16  -3.467   3.930   1.852
  102   2HB   SER  16          HB2       SER  16  -2.678   2.502   1.922
  103    HG   SER  16           HG       SER  16  -0.841   3.341   1.771
  104    H    GLN  17           HN       GLN  17  -4.902   4.649   0.070
  105    HA   GLN  17           HA       GLN  17  -4.509   6.877  -1.581
  106   1HB   GLN  17          HB1       GLN  17  -6.174   7.775  -0.109
  107   2HB   GLN  17          HB2       GLN  17  -6.528   6.213  -0.428
  108   1HG   GLN  17          HG1       GLN  17  -5.406   5.763   1.785
  109   2HG   GLN  17          HG2       GLN  17  -5.687   7.347   2.067
  110   1HE2  GLN  17          1HE2      GLN  17  -6.926   4.362   2.764
  111   2HE2  GLN  17          2HE2      GLN  17  -8.621   4.836   2.878
  112    H1   NAL  18           HD1      NAL  18  -2.782   5.427   3.977
  113    H3   NAL  18           HD2      NAL  18  -2.953   9.560   3.484
  114    H4   NAL  18           HE2      NAL  18  -5.116   9.611   4.537
  115    H5   NAL  18           HH2      NAL  18  -6.977   8.426   5.601
  116    H6   NAL  18           HP       NAL  18  -7.938   6.380   6.425
  117    H7   NAL  18           HH1      NAL  18  -6.745   4.309   6.183
  118    H8   NAL  18           HZ1      NAL  18  -4.619   4.257   5.058
  119   1H9   NAL  18          HB2       NAL  18  -0.889   6.474   3.098
  120   2H9   NAL  18          HB1       NAL  18  -0.672   8.177   3.473
  121    H10  NAL  18           HA       NAL  18  -1.541   8.864   1.358
  122   1HN   NAL  18          HN        NAL  18  -2.383   6.033   0.898
  123    H    GLY  19           HN       GLY  19  -0.727   6.257  -0.578
  124   1HA   GLY  19          HA2       GLY  19   1.238   5.758  -1.710
  125   2HA   GLY  19          HA1       GLY  19   2.061   7.080  -0.878
  126    H    TYR  20           HN       TYR  20   0.462   4.858   1.191
  127    HA   TYR  20           HA       TYR  20   3.005   3.410   1.849
  128   1HB   TYR  20          HB1       TYR  20   0.833   4.391   3.535
  129   2HB   TYR  20          HB2       TYR  20   1.622   3.035   3.989
  130    HD1  TYR  20           HD1      TYR  20   3.341   3.239   5.558
  131    HD2  TYR  20           HD2      TYR  20   2.471   6.448   2.803
  132    HE1  TYR  20           HE1      TYR  20   5.175   4.612   6.554
  133    HE2  TYR  20           HE2      TYR  20   4.289   7.792   3.785
  134    HH   TYR  20           HH       TYR  20   5.958   7.873   5.368
  135    H    CYS  21           HN       CYS  21   2.836   1.151   2.285
  136    HA   CYS  21           HA       CYS  21   0.617  -0.092   0.673
  137   1HB   CYS  21          HB1       CYS  21   2.648  -0.043  -0.478
  138   2HB   CYS  21          HB2       CYS  21   3.486  -0.682   0.770
  139    H    GLY  22           HN       GLY  22  -0.422  -1.818   1.373
  140   1HA   GLY  22          HA2       GLY  22   0.331  -3.578   3.528
  141   2HA   GLY  22          HA1       GLY  22  -0.734  -2.280   4.105
  142    H    LYS  23           HN       LYS  23  -2.458  -3.833   4.531
  143    HA   LYS  23           HA       LYS  23  -4.014  -4.435   2.127
  144   1HB   LYS  23          HB1       LYS  23  -2.604  -6.428   2.793
  145   2HB   LYS  23          HB2       LYS  23  -3.573  -6.591   4.097
  146   1HG   LYS  23          HG1       LYS  23  -4.173  -8.106   2.374
  147   2HG   LYS  23          HG2       LYS  23  -5.402  -7.089   2.724
  148   1HD   LYS  23          HD1       LYS  23  -4.984  -5.842   0.779
  149   2HD   LYS  23          HD2       LYS  23  -3.649  -6.726   0.460
  150   1HE   LYS  23          HE1       LYS  23  -5.107  -8.676   0.251
  151   2HE   LYS  23          HE2       LYS  23  -6.378  -7.654   0.328
  152   1HZ   LYS  23          HZ1       LYS  23  -4.328  -7.638  -1.671
  153   2HZ   LYS  23          HZ2       LYS  23  -5.875  -8.144  -1.931
  154   3HZ   LYS  23          HZ3       LYS  23  -5.560  -6.546  -1.631
  155    H    GLY  24           HN       GLY  24  -6.211  -5.304   2.757
  156   1HA   GLY  24          HA2       GLY  24  -8.213  -5.036   4.012
  157   2HA   GLY  24          HA1       GLY  24  -7.368  -3.967   5.144
  158    HA   PRO  25           HA       PRO  25  -9.796  -1.783   1.661
  159   1HB   PRO  25          HB1       PRO  25 -11.535  -0.416   3.214
  160   2HB   PRO  25          HB2       PRO  25 -11.863  -1.892   2.596
  161   1HG   PRO  25          HG1       PRO  25 -10.973  -1.276   5.274
  162   2HG   PRO  25          HG2       PRO  25 -12.109  -2.365   4.835
  163   1HD   PRO  25          HD1       PRO  25  -9.693  -3.176   5.384
  164   2HD   PRO  25          HD2       PRO  25 -10.548  -3.920   4.208
  165    H    LYS  26           HN       LYS  26  -8.639  -0.551   4.763
  166    HA   LYS  26           HA       LYS  26  -8.226   2.146   4.230
  167   1HB   LYS  26          HB1       LYS  26  -6.386   0.385   5.748
  168   2HB   LYS  26          HB2       LYS  26  -6.609   1.987   5.977
  169   1HG   LYS  26          HG1       LYS  26  -8.231  -0.165   6.885
  170   2HG   LYS  26          HG2       LYS  26  -7.645   1.094   7.745
  171   1HD   LYS  26          HD1       LYS  26  -9.940   1.138   6.021
  172   2HD   LYS  26          HD2       LYS  26  -9.940   1.330   7.642
  173   1HE   LYS  26          HE1       LYS  26  -9.188   3.462   7.509
  174   2HE   LYS  26          HE2       LYS  26  -8.572   3.244   6.012
  175   1HZ   LYS  26          HZ1       LYS  26 -11.332   3.680   6.695
  176   2HZ   LYS  26          HZ2       LYS  26 -10.400   4.399   5.482
  177   3HZ   LYS  26          HZ3       LYS  26 -10.878   2.922   5.275
  178    H    TYR  27           HN       TYR  27  -6.303  -0.554   3.144
  179    HA   TYR  27           HA       TYR  27  -4.315   1.227   1.837
  180   1HB   TYR  27          HB1       TYR  27  -4.208  -1.616   2.599
  181   2HB   TYR  27          HB2       TYR  27  -3.066  -0.899   1.678
  182    HD1  TYR  27           HD1      TYR  27  -4.468  -1.149   5.015
  183    HD2  TYR  27           HD2      TYR  27  -1.396   0.623   2.566
  184    HE1  TYR  27           HE1      TYR  27  -3.300  -0.333   7.063
  185    HE2  TYR  27           HE2      TYR  27  -0.232   1.436   4.603
  186    HH   TYR  27           HH       TYR  27  -0.285   1.558   6.906
  187    H    CYS  28           HN       CYS  28  -7.030  -0.745   1.064
  188    HA   CYS  28           HA       CYS  28  -6.094  -0.971  -1.758
  189   1HB   CYS  28          HB1       CYS  28  -6.889  -2.914  -0.135
  190   2HB   CYS  28          HB2       CYS  28  -8.281  -2.619  -0.937
  191    H    GLY  29           HN       GLY  29  -8.262   0.917   0.019
  192   1HA   GLY  29          HA2       GLY  29  -8.617   2.572  -2.143
  193   2HA   GLY  29          HA1       GLY  29 -10.018   1.520  -2.271
  194    H    ARG  30           HN       ARG  30  -9.987   1.572   0.964
  195    HA   ARG  30           HA       ARG  30 -11.025   4.266   1.322
  196   1HB   ARG  30          HB1       ARG  30 -12.766   2.566   0.425
  197   2HB   ARG  30          HB2       ARG  30 -12.886   2.146   1.999
  198   1HG   ARG  30          HG1       ARG  30 -14.527   3.746   1.497
  199   2HG   ARG  30          HG2       ARG  30 -13.453   4.384   2.549
  200   1HD   ARG  30          HD1       ARG  30 -12.799   4.965  -0.110
  201   2HD   ARG  30          HD2       ARG  30 -14.253   5.573   0.318
  202    HE   ARG  30           HE       ARG  30 -13.234   6.858   2.041
  203   1HH1  ARG  30          2HH2      ARG  30 -10.868   5.670  -0.338
  204   2HH1  ARG  30          1HH2      ARG  30  -9.654   6.727   0.299
  205   1HH2  ARG  30          2HH1      ARG  30 -11.537   8.022   2.806
  206   2HH2  ARG  30          1HH1      ARG  30 -10.012   7.985   1.986
  Start of MODEL   16
    1   1H    VAL   1           H1       VAL   1   4.823   3.249   7.122
    2   2H    VAL   1           H2       VAL   1   6.387   3.238   7.593
    3   3H    VAL   1           H3       VAL   1   5.187   3.162   8.732
    4    HA   VAL   1           HA       VAL   1   6.211   1.035   8.459
    5    HB   VAL   1           HB       VAL   1   3.818   1.276   8.975
    6   1HG1  VAL   1          1HG1      VAL   1   2.083   0.668   7.393
    7   2HG1  VAL   1          2HG1      VAL   1   2.919   2.125   6.862
    8   3HG1  VAL   1          3HG1      VAL   1   3.247   0.564   6.072
    9   1HG2  VAL   1          1HG2      VAL   1   4.317  -1.332   7.512
   10   2HG2  VAL   1          2HG2      VAL   1   5.021  -0.904   9.090
   11   3HG2  VAL   1          3HG2      VAL   1   3.268  -1.007   8.885
   12    H    GLY   2           HN       GLY   2   5.076  -0.695   6.103
   13   1HA   GLY   2          HA2       GLY   2   7.390  -0.517   4.412
   14   2HA   GLY   2          HA1       GLY   2   5.942  -1.493   4.149
   15    H    GLU   3           HN       GLU   3   7.427   1.649   3.610
   16    HA   GLU   3           HA       GLU   3   5.465   2.956   2.106
   17   1HB   GLU   3          HB1       GLU   3   7.277   4.207   1.228
   18   2HB   GLU   3          HB2       GLU   3   7.483   3.965   2.830
   19   1HG   GLU   3          HG1       GLU   3   9.570   3.691   2.113
   20   2HG   GLU   3          HG2       GLU   3   9.047   2.144   2.082
   21    H    CYS   4           HN       CYS   4   4.958   3.206  -0.072
   22    HA   CYS   4           HA       CYS   4   4.991   0.782  -1.618
   23   1HB   CYS   4          HB1       CYS   4   4.307   3.488  -2.547
   24   2HB   CYS   4          HB2       CYS   4   3.859   2.075  -3.231
   25    H    VAL   5           HN       VAL   5   6.767   0.014  -2.490
   26    HA   VAL   5           HA       VAL   5   9.222   1.377  -2.813
   27    HB   VAL   5           HB       VAL   5   8.410  -1.309  -3.993
   28   1HG1  VAL   5          1HG1      VAL   5  11.152  -0.118  -3.348
   29   2HG1  VAL   5          2HG1      VAL   5  10.848  -1.784  -3.881
   30   3HG1  VAL   5          3HG1      VAL   5  10.517  -0.444  -4.978
   31   1HG2  VAL   5          1HG2      VAL   5   9.659  -0.582  -1.302
   32   2HG2  VAL   5          2HG2      VAL   5   8.062  -1.307  -1.557
   33   3HG2  VAL   5          3HG2      VAL   5   9.512  -2.233  -1.946
   34    H    ARG   6           HN       ARG   6   8.995   3.091  -4.035
   35    HA   ARG   6           HA       ARG   6   8.546   4.571  -5.692
   36   1HB   ARG   6          HB1       ARG   6   9.544   2.645  -7.663
   37   2HB   ARG   6          HB2       ARG   6   9.655   4.274  -7.684
   38   1HG   ARG   6          HG1       ARG   6  11.222   2.479  -6.083
   39   2HG   ARG   6          HG2       ARG   6  11.771   3.433  -7.291
   40   1HD   ARG   6          HD1       ARG   6  12.239   5.023  -5.879
   41   2HD   ARG   6          HD2       ARG   6  10.712   5.017  -5.301
   42    HE   ARG   6           HE       ARG   6  12.881   3.371  -4.284
   43   1HH1  ARG   6          2HH2      ARG   6   9.805   4.914  -3.538
   44   2HH1  ARG   6          1HH2      ARG   6   9.693   4.105  -2.010
   45   1HH2  ARG   6          2HH1      ARG   6  12.584   2.278  -2.398
   46   2HH2  ARG   6          1HH1      ARG   6  11.231   2.645  -1.381
   47    H    GLY   7           HN       GLY   7   6.433   3.077  -4.825
   48   1HA   GLY   7          HA2       GLY   7   4.140   3.280  -5.394
   49   2HA   GLY   7          HA1       GLY   7   4.517   3.169  -7.100
   50    H    ARG   8           HN       ARG   8   6.268   0.538  -5.959
   51    HA   ARG   8           HA       ARG   8   4.013  -1.303  -6.452
   52   1HB   ARG   8          HB1       ARG   8   6.880  -1.418  -6.653
   53   2HB   ARG   8          HB2       ARG   8   6.292  -2.724  -5.868
   54   1HG   ARG   8          HG1       ARG   8   6.092  -3.562  -7.879
   55   2HG   ARG   8          HG2       ARG   8   4.710  -2.693  -7.917
   56   1HD   ARG   8          HD1       ARG   8   7.186  -1.741  -9.022
   57   2HD   ARG   8          HD2       ARG   8   6.036  -2.480  -9.914
   58    HE   ARG   8           HE       ARG   8   4.588  -0.634  -9.665
   59   1HH1  ARG   8          2HH2      ARG   8   7.833   0.000  -8.427
   60   2HH1  ARG   8          1HH2      ARG   8   7.609   1.715  -8.534
   61   1HH2  ARG   8          2HH1      ARG   8   4.422   1.611  -9.713
   62   2HH2  ARG   8          1HH1      ARG   8   5.771   2.583  -9.227
   63    H    CYS   9           HN       CYS   9   3.663  -3.167  -5.085
   64    HA   CYS   9           HA       CYS   9   4.562  -2.963  -2.294
   65   1HB   CYS   9          HB1       CYS   9   1.756  -3.049  -3.171
   66   2HB   CYS   9          HB2       CYS   9   2.205  -3.564  -1.687
   67    HA   PRO  10           HA       PRO  10   4.989  -7.325  -3.317
   68   1HB   PRO  10          HB1       PRO  10   6.067  -8.175  -1.051
   69   2HB   PRO  10          HB2       PRO  10   6.912  -7.187  -2.040
   70   1HG   PRO  10          HG1       PRO  10   5.484  -6.442   0.365
   71   2HG   PRO  10          HG2       PRO  10   6.979  -5.959  -0.082
   72   1HD   PRO  10          HD1       PRO  10   4.868  -4.452  -0.543
   73   2HD   PRO  10          HD2       PRO  10   6.175  -4.401  -1.522
   74    H    SER  11           HN       SER  11   4.528  -9.485  -2.124
   75    HA   SER  11           HA       SER  11   2.890 -11.000  -1.671
   76   1HB   SER  11          HB1       SER  11   2.989  -9.403   0.818
   77   2HB   SER  11          HB2       SER  11   2.519 -10.964   0.716
   78    HG   SER  11           HG       SER  11   4.667 -10.855   1.339
   79    H    GLY  12           HN       GLY  12   1.659  -9.284  -3.227
   80   1HA   GLY  12          HA2       GLY  12  -0.426  -8.557  -3.987
   81   2HA   GLY  12          HA1       GLY  12  -1.107  -9.791  -2.924
   82    H    MET  13           HN       MET  13   0.765  -6.962  -1.751
   83    HA   MET  13           HA       MET  13  -1.650  -5.874  -0.400
   84   1HB   MET  13          HB1       MET  13   1.198  -5.075  -0.355
   85   2HB   MET  13          HB2       MET  13   0.016  -4.290   0.453
   86   1HG   MET  13          HG1       MET  13  -0.440  -6.348   1.637
   87   2HG   MET  13          HG2       MET  13   0.884  -6.990   0.928
   88   1HE   MET  13          HE1       MET  13   3.149  -4.946   0.976
   89   2HE   MET  13          HE2       MET  13   3.888  -5.286   2.556
   90   3HE   MET  13          HE3       MET  13   3.326  -6.628   1.528
   91    H    CYS  14           HN       CYS  14  -2.007  -3.584  -0.551
   92    HA   CYS  14           HA       CYS  14  -1.793  -2.485  -3.330
   93   1HB   CYS  14          HB1       CYS  14  -3.858  -1.901  -1.306
   94   2HB   CYS  14          HB2       CYS  14  -3.852  -1.434  -2.871
   95    H    CYS  15           HN       CYS  15  -1.266  -0.277  -3.518
   96    HA   CYS  15           HA       CYS  15   0.215   0.916  -1.287
   97   1HB   CYS  15          HB1       CYS  15   1.008   1.080  -3.582
   98   2HB   CYS  15          HB2       CYS  15  -0.306   1.951  -4.012
   99    H    SER  16           HN       SER  16  -0.889   1.943   0.275
  100    HA   SER  16           HA       SER  16  -3.559   2.926  -0.040
  101   1HB   SER  16          HB1       SER  16  -3.213   3.881   2.145
  102   2HB   SER  16          HB2       SER  16  -2.665   2.342   2.118
  103    HG   SER  16           HG       SER  16  -0.721   2.883   2.397
  104    H    GLN  17           HN       GLN  17  -4.338   4.949   0.295
  105    HA   GLN  17           HA       GLN  17  -3.466   7.290  -0.971
  106   1HB   GLN  17          HB1       GLN  17  -5.237   8.218   0.339
  107   2HB   GLN  17          HB2       GLN  17  -5.699   6.754  -0.220
  108   1HG   GLN  17          HG1       GLN  17  -4.992   5.953   2.075
  109   2HG   GLN  17          HG2       GLN  17  -5.191   7.520   2.491
  110   1HE2  GLN  17          1HE2      GLN  17  -6.778   4.651   2.744
  111   2HE2  GLN  17          2HE2      GLN  17  -8.418   5.265   2.540
  112    H1   NAL  18           HD1      NAL  18  -2.814   5.016   4.541
  113    H3   NAL  18           HD2      NAL  18  -2.332   9.153   4.593
  114    H4   NAL  18           HE2      NAL  18  -4.603   9.423   5.336
  115    H5   NAL  18           HH2      NAL  18  -6.757   8.439   5.944
  116    H6   NAL  18           HP       NAL  18  -8.126   6.493   6.307
  117    H7   NAL  18           HH1      NAL  18  -7.213   4.300   5.952
  118    H8   NAL  18           HZ1      NAL  18  -4.950   4.035   5.181
  119   1H9   NAL  18          HB1       NAL  18  -0.688   5.853   4.011
  120   2H9   NAL  18          HB2       NAL  18  -0.288   7.431   4.676
  121    H10  NAL  18           HA       NAL  18  -0.816   8.536   2.610
  122   1HN   NAL  18          HN        NAL  18  -1.848   5.913   1.627
  123    H    GLY  19           HN       GLY  19   0.004   6.189   0.388
  124   1HA   GLY  19          HA2       GLY  19   2.042   5.859  -0.681
  125   2HA   GLY  19          HA1       GLY  19   2.857   6.852   0.529
  126    H    TYR  20           HN       TYR  20   0.917   4.325   1.810
  127    HA   TYR  20           HA       TYR  20   3.302   2.568   2.282
  128   1HB   TYR  20          HB1       TYR  20   1.191   3.422   4.158
  129   2HB   TYR  20          HB2       TYR  20   2.189   2.165   4.464
  130    HD1  TYR  20           HD1      TYR  20   1.771   5.662   4.818
  131    HD2  TYR  20           HD2      TYR  20   4.716   2.569   4.374
  132    HE1  TYR  20           HE1      TYR  20   3.537   7.229   5.605
  133    HE2  TYR  20           HE2      TYR  20   6.510   4.151   5.091
  134    HH   TYR  20           HH       TYR  20   6.977   6.408   5.527
  135    H    CYS  21           HN       CYS  21   3.047   0.382   2.208
  136    HA   CYS  21           HA       CYS  21   0.826  -0.627   0.670
  137   1HB   CYS  21          HB1       CYS  21   3.124  -1.959   1.956
  138   2HB   CYS  21          HB2       CYS  21   2.108  -2.679   0.898
  139    H    GLY  22           HN       GLY  22  -0.786  -2.054   1.247
  140   1HA   GLY  22          HA2       GLY  22  -0.817  -3.671   3.593
  141   2HA   GLY  22          HA1       GLY  22  -1.830  -2.260   3.892
  142    H    LYS  23           HN       LYS  23  -3.666  -3.796   4.017
  143    HA   LYS  23           HA       LYS  23  -4.723  -4.574   1.339
  144   1HB   LYS  23          HB1       LYS  23  -4.626  -6.350   3.711
  145   2HB   LYS  23          HB2       LYS  23  -5.491  -6.666   2.362
  146   1HG   LYS  23          HG1       LYS  23  -3.488  -6.805   1.095
  147   2HG   LYS  23          HG2       LYS  23  -2.611  -6.447   2.425
  148   1HD   LYS  23          HD1       LYS  23  -3.422  -8.489   3.440
  149   2HD   LYS  23          HD2       LYS  23  -4.145  -8.860   2.023
  150   1HE   LYS  23          HE1       LYS  23  -1.316  -8.397   2.103
  151   2HE   LYS  23          HE2       LYS  23  -1.907  -9.873   2.477
  152   1HZ   LYS  23          HZ1       LYS  23  -1.185  -9.713   0.207
  153   2HZ   LYS  23          HZ2       LYS  23  -2.782 -10.116   0.329
  154   3HZ   LYS  23          HZ3       LYS  23  -2.335  -8.588  -0.082
  155    H    GLY  24           HN       GLY  24  -7.030  -5.108   1.417
  156   1HA   GLY  24          HA2       GLY  24  -9.231  -4.659   1.951
  157   2HA   GLY  24          HA1       GLY  24  -8.725  -4.028   3.524
  158    HA   PRO  25           HA       PRO  25 -10.456  -0.815   0.446
  159   1HB   PRO  25          HB1       PRO  25 -11.810  -0.040   2.947
  160   2HB   PRO  25          HB2       PRO  25 -12.370   0.041   1.415
  161   1HG   PRO  25          HG1       PRO  25 -13.110  -1.956   2.881
  162   2HG   PRO  25          HG2       PRO  25 -12.748  -2.241   1.314
  163   1HD   PRO  25          HD1       PRO  25 -11.105  -2.760   3.617
  164   2HD   PRO  25          HD2       PRO  25 -11.232  -3.665   2.264
  165    H    LYS  26           HN       LYS  26  -9.364  -0.256   3.783
  166    HA   LYS  26           HA       LYS  26  -8.687   2.450   3.599
  167   1HB   LYS  26          HB1       LYS  26  -7.309   0.415   5.256
  168   2HB   LYS  26          HB2       LYS  26  -7.432   2.011   5.580
  169   1HG   LYS  26          HG1       LYS  26  -9.397  -0.016   5.961
  170   2HG   LYS  26          HG2       LYS  26  -8.861   1.086   7.041
  171   1HD   LYS  26          HD1       LYS  26 -10.757   1.557   4.935
  172   2HD   LYS  26          HD2       LYS  26 -11.058   1.609   6.540
  173   1HE   LYS  26          HE1       LYS  26 -10.070   3.636   6.779
  174   2HE   LYS  26          HE2       LYS  26  -9.203   3.473   5.404
  175   1HZ   LYS  26          HZ1       LYS  26 -11.997   4.133   5.604
  176   2HZ   LYS  26          HZ2       LYS  26 -10.782   4.916   4.740
  177   3HZ   LYS  26          HZ3       LYS  26 -11.314   3.527   4.207
  178    H    TYR  27           HN       TYR  27  -6.897  -0.246   2.372
  179    HA   TYR  27           HA       TYR  27  -4.610   1.525   1.618
  180   1HB   TYR  27          HB1       TYR  27  -4.674  -1.386   2.086
  181   2HB   TYR  27          HB2       TYR  27  -3.383  -0.580   1.491
  182    HD1  TYR  27           HD1      TYR  27  -5.464  -1.037   4.460
  183    HD2  TYR  27           HD2      TYR  27  -1.750   0.478   2.881
  184    HE1  TYR  27           HE1      TYR  27  -4.656  -0.618   6.767
  185    HE2  TYR  27           HE2      TYR  27  -0.939   0.897   5.192
  186    HH   TYR  27           HH       TYR  27  -2.920   0.160   8.064
  187    H    CYS  28           HN       CYS  28  -7.220  -0.350   0.330
  188    HA   CYS  28           HA       CYS  28  -5.960  -0.299  -2.375
  189   1HB   CYS  28          HB1       CYS  28  -6.649  -2.421  -0.993
  190   2HB   CYS  28          HB2       CYS  28  -8.069  -2.179  -1.765
  191    H    GLY  29           HN       GLY  29  -8.435   1.314  -0.736
  192   1HA   GLY  29          HA2       GLY  29  -9.480   2.330  -3.295
  193   2HA   GLY  29          HA1       GLY  29 -10.647   1.447  -2.311
  194    H    ARG  30           HN       ARG  30 -10.706   2.240   0.075
  195    HA   ARG  30           HA       ARG  30 -10.397   5.124   0.445
  196   1HB   ARG  30          HB1       ARG  30 -13.040   3.800   0.539
  197   2HB   ARG  30          HB2       ARG  30 -12.746   5.264   1.200
  198   1HG   ARG  30          HG1       ARG  30 -12.555   4.777  -1.623
  199   2HG   ARG  30          HG2       ARG  30 -13.918   5.329  -0.913
  200   1HD   ARG  30          HD1       ARG  30 -12.940   7.208  -1.770
  201   2HD   ARG  30          HD2       ARG  30 -12.566   7.266  -0.181
  202    HE   ARG  30           HE       ARG  30 -10.681   6.096  -2.030
  203   1HH1  ARG  30          2HH2      ARG  30 -11.052   8.407   0.630
  204   2HH1  ARG  30          1HH2      ARG  30  -9.336   8.413   0.870
  205   1HH2  ARG  30          2HH1      ARG  30  -8.652   6.109  -1.553
  206   2HH2  ARG  30          1HH1      ARG  30  -8.027   7.149  -0.318
  Start of MODEL   17
    1   1H    VAL   1           H1       VAL   1   4.209   0.240   3.548
    2   2H    VAL   1           H2       VAL   1   3.291   0.668   4.827
    3   3H    VAL   1           H3       VAL   1   3.078  -0.828   4.167
    4    HA   VAL   1           HA       VAL   1   4.322  -0.962   6.224
    5    HB   VAL   1           HB       VAL   1   6.408  -2.039   5.432
    6   1HG1  VAL   1          1HG1      VAL   1   5.285  -3.875   4.299
    7   2HG1  VAL   1          2HG1      VAL   1   4.252  -3.239   5.586
    8   3HG1  VAL   1          3HG1      VAL   1   3.905  -2.846   3.884
    9   1HG2  VAL   1          1HG2      VAL   1   5.489  -1.351   2.596
   10   2HG2  VAL   1          2HG2      VAL   1   6.904  -0.647   3.390
   11   3HG2  VAL   1          3HG2      VAL   1   6.848  -2.378   3.061
   12    H    GLY   2           HN       GLY   2   7.455  -0.301   5.599
   13   1HA   GLY   2          HA2       GLY   2   7.405   2.567   6.309
   14   2HA   GLY   2          HA1       GLY   2   8.811   1.578   5.868
   15    H    GLU   3           HN       GLU   3   6.116   3.446   4.645
   16    HA   GLU   3           HA       GLU   3   5.546   4.314   2.587
   17   1HB   GLU   3          HB1       GLU   3   8.006   4.701   2.347
   18   2HB   GLU   3          HB2       GLU   3   8.057   3.361   1.414
   19   1HG   GLU   3          HG1       GLU   3   6.148   5.032   0.399
   20   2HG   GLU   3          HG2       GLU   3   7.521   5.891   0.611
   21    H    CYS   4           HN       CYS   4   5.499   3.386   0.129
   22    HA   CYS   4           HA       CYS   4   4.767   0.520   0.097
   23   1HB   CYS   4          HB1       CYS   4   5.043   2.409  -2.149
   24   2HB   CYS   4          HB2       CYS   4   4.410   0.905  -2.217
   25    H    VAL   5           HN       VAL   5   6.016  -0.596  -1.886
   26    HA   VAL   5           HA       VAL   5   8.940  -0.398  -1.372
   27    HB   VAL   5           HB       VAL   5   7.478  -2.109  -3.407
   28   1HG1  VAL   5          1HG1      VAL   5  10.299  -2.278  -2.243
   29   2HG1  VAL   5          2HG1      VAL   5   9.578  -3.430  -3.388
   30   3HG1  VAL   5          3HG1      VAL   5   9.887  -1.768  -3.894
   31   1HG2  VAL   5          1HG2      VAL   5   8.404  -2.811  -0.583
   32   2HG2  VAL   5          2HG2      VAL   5   6.730  -2.810  -1.180
   33   3HG2  VAL   5          3HG2      VAL   5   7.887  -3.994  -1.802
   34    H    ARG   6           HN       ARG   6   8.895   1.884  -1.955
   35    HA   ARG   6           HA       ARG   6   9.078   3.700  -3.336
   36   1HB   ARG   6          HB1       ARG   6  10.367   1.805  -5.200
   37   2HB   ARG   6          HB2       ARG   6  10.551   3.428  -5.194
   38   1HG   ARG   6          HG1       ARG   6  11.511   1.636  -3.154
   39   2HG   ARG   6          HG2       ARG   6  12.446   2.417  -4.241
   40   1HD   ARG   6          HD1       ARG   6  10.968   3.732  -2.144
   41   2HD   ARG   6          HD2       ARG   6  12.573   3.436  -2.089
   42    HE   ARG   6           HE       ARG   6  12.845   4.923  -4.006
   43   1HH1  ARG   6          2HH2      ARG   6  10.007   5.487  -1.942
   44   2HH1  ARG   6          1HH2      ARG   6   9.921   7.145  -2.438
   45   1HH2  ARG   6          2HH1      ARG   6  12.617   7.038  -4.540
   46   2HH2  ARG   6          1HH1      ARG   6  11.343   7.990  -3.854
   47    H    GLY   7           HN       GLY   7   6.680   2.961  -3.270
   48   1HA   GLY   7          HA2       GLY   7   4.656   3.529  -4.334
   49   2HA   GLY   7          HA1       GLY   7   5.531   3.803  -5.832
   50    H    ARG   8           HN       ARG   8   6.176   0.587  -4.716
   51    HA   ARG   8           HA       ARG   8   3.818  -0.623  -6.078
   52   1HB   ARG   8          HB1       ARG   8   6.714  -1.167  -6.374
   53   2HB   ARG   8          HB2       ARG   8   5.588  -2.282  -6.767
   54   1HG   ARG   8          HG1       ARG   8   5.906  -1.359  -8.769
   55   2HG   ARG   8          HG2       ARG   8   4.684  -0.420  -8.228
   56   1HD   ARG   8          HD1       ARG   8   6.309   1.239  -7.582
   57   2HD   ARG   8          HD2       ARG   8   7.472   0.316  -8.263
   58    HE   ARG   8           HE       ARG   8   6.918   1.023 -10.333
   59   1HH1  ARG   8          2HH2      ARG   8   4.281   2.002  -8.166
   60   2HH1  ARG   8          1HH2      ARG   8   3.539   2.956  -9.407
   61   1HH2  ARG   8          2HH1      ARG   8   5.865   2.261 -11.827
   62   2HH2  ARG   8          1HH1      ARG   8   4.407   3.097 -11.410
   63    H    CYS   9           HN       CYS   9   3.787  -3.092  -5.442
   64    HA   CYS   9           HA       CYS   9   4.690  -3.488  -2.647
   65   1HB   CYS   9          HB1       CYS   9   1.886  -3.805  -3.517
   66   2HB   CYS   9          HB2       CYS   9   2.472  -4.276  -2.066
   67    HA   PRO  10           HA       PRO  10   4.940  -7.785  -4.089
   68   1HB   PRO  10          HB1       PRO  10   5.370  -8.998  -1.789
   69   2HB   PRO  10          HB2       PRO  10   6.506  -7.967  -2.349
   70   1HG   PRO  10          HG1       PRO  10   4.497  -7.413  -0.328
   71   2HG   PRO  10          HG2       PRO  10   6.088  -7.052  -0.251
   72   1HD   PRO  10          HD1       PRO  10   4.318  -5.265  -1.046
   73   2HD   PRO  10          HD2       PRO  10   5.860  -5.229  -1.582
   74    H    SER  11           HN       SER  11   3.915  -9.914  -3.496
   75    HA   SER  11           HA       SER  11   1.984 -11.169  -3.571
   76   1HB   SER  11          HB1       SER  11   2.458 -10.457  -0.741
   77   2HB   SER  11          HB2       SER  11   1.759 -11.836  -1.267
   78    HG   SER  11           HG       SER  11   3.920 -12.217  -0.858
   79    H    GLY  12           HN       GLY  12   0.916  -8.931  -4.421
   80   1HA   GLY  12          HA2       GLY  12  -1.109  -7.808  -4.723
   81   2HA   GLY  12          HA1       GLY  12  -1.874  -9.181  -3.919
   82    H    MET  13           HN       MET  13   0.504  -7.063  -2.261
   83    HA   MET  13           HA       MET  13  -1.626  -5.881  -0.549
   84   1HB   MET  13          HB1       MET  13   1.296  -5.552  -0.664
   85   2HB   MET  13          HB2       MET  13   0.358  -4.486   0.143
   86   1HG   MET  13          HG1       MET  13   1.172  -5.953   1.699
   87   2HG   MET  13          HG2       MET  13  -0.414  -6.296   1.513
   88   1HE   MET  13          HE1       MET  13   1.322  -9.685   2.538
   89   2HE   MET  13          HE2       MET  13   1.911  -8.070   2.984
   90   3HE   MET  13          HE3       MET  13   0.172  -8.437   3.074
   91    H    CYS  14           HN       CYS  14  -1.684  -3.560  -0.433
   92    HA   CYS  14           HA       CYS  14  -2.020  -2.426  -3.184
   93   1HB   CYS  14          HB1       CYS  14  -3.678  -1.845  -0.826
   94   2HB   CYS  14          HB2       CYS  14  -4.010  -1.521  -2.392
   95    H    CYS  15           HN       CYS  15  -0.668  -0.771  -3.590
   96    HA   CYS  15           HA       CYS  15   0.595   0.790  -1.483
   97   1HB   CYS  15          HB1       CYS  15   1.724   0.351  -3.571
   98   2HB   CYS  15          HB2       CYS  15   0.615   1.211  -4.407
   99    H    SER  16           HN       SER  16  -1.053   1.657  -0.345
  100    HA   SER  16           HA       SER  16  -3.411   2.828  -1.249
  101   1HB   SER  16          HB1       SER  16  -3.531   3.688   0.990
  102   2HB   SER  16          HB2       SER  16  -2.963   2.158   1.014
  103    HG   SER  16           HG       SER  16  -1.084   2.727   1.682
  104    H    GLN  17           HN       GLN  17  -4.211   5.045  -0.874
  105    HA   GLN  17           HA       GLN  17  -2.905   6.993  -2.490
  106   1HB   GLN  17          HB1       GLN  17  -4.680   8.400  -1.752
  107   2HB   GLN  17          HB2       GLN  17  -5.275   6.925  -2.123
  108   1HG   GLN  17          HG1       GLN  17  -4.782   7.475   0.625
  109   2HG   GLN  17          HG2       GLN  17  -6.095   8.168  -0.056
  110   1HE2  GLN  17          1HE2      GLN  17  -8.057   7.051   0.130
  111   2HE2  GLN  17          2HE2      GLN  17  -8.033   5.283   0.232
  112    H1   NAL  18           HD1      NAL  18  -3.300   5.152   2.844
  113    H3   NAL  18           HD2      NAL  18  -3.029   9.155   3.957
  114    H4   NAL  18           HE2      NAL  18  -5.392   9.202   4.407
  115    H5   NAL  18           HH2      NAL  18  -7.577   8.061   4.400
  116    H6   NAL  18           HP       NAL  18  -8.898   6.103   3.949
  117    H7   NAL  18           HH1      NAL  18  -7.845   4.109   3.113
  118    H8   NAL  18           HZ1      NAL  18  -5.465   4.061   2.779
  119   1H9   NAL  18          HB1       NAL  18  -1.125   6.108   3.041
  120   2H9   NAL  18          HB2       NAL  18  -0.932   7.703   3.754
  121    H10  NAL  18           HA       NAL  18  -1.308   8.800   1.641
  122   1HN   NAL  18          HN        NAL  18  -2.506   6.254   0.860
  123    H    GLY  19           HN       GLY  19  -0.145   6.200  -0.268
  124   1HA   GLY  19          HA2       GLY  19   2.005   5.869  -1.108
  125   2HA   GLY  19          HA1       GLY  19   2.669   7.007   0.068
  126    H    TYR  20           HN       TYR  20   0.612   4.266   0.966
  127    HA   TYR  20           HA       TYR  20   2.953   2.858   2.205
  128   1HB   TYR  20          HB1       TYR  20   0.408   3.639   3.453
  129   2HB   TYR  20          HB2       TYR  20   1.308   2.414   4.051
  130    HD1  TYR  20           HD1      TYR  20   1.521   5.990   3.219
  131    HD2  TYR  20           HD2      TYR  20   2.906   2.801   5.745
  132    HE1  TYR  20           HE1      TYR  20   2.925   7.601   4.447
  133    HE2  TYR  20           HE2      TYR  20   4.337   4.407   6.987
  134    HH   TYR  20           HH       TYR  20   4.469   7.870   6.141
  135    H    CYS  21           HN       CYS  21   3.093   0.770   1.546
  136    HA   CYS  21           HA       CYS  21   0.922  -0.722   0.343
  137   1HB   CYS  21          HB1       CYS  21   3.424  -1.633   1.599
  138   2HB   CYS  21          HB2       CYS  21   2.337  -2.664   0.947
  139    H    GLY  22           HN       GLY  22  -0.701  -1.852   1.243
  140   1HA   GLY  22          HA2       GLY  22  -0.298  -3.415   3.642
  141   2HA   GLY  22          HA1       GLY  22  -1.478  -2.131   3.902
  142    H    LYS  23           HN       LYS  23  -3.000  -3.943   4.253
  143    HA   LYS  23           HA       LYS  23  -4.308  -4.808   1.741
  144   1HB   LYS  23          HB1       LYS  23  -3.154  -6.568   3.710
  145   2HB   LYS  23          HB2       LYS  23  -4.738  -6.880   3.459
  146   1HG   LYS  23          HG1       LYS  23  -4.344  -7.233   1.161
  147   2HG   LYS  23          HG2       LYS  23  -2.779  -6.798   1.334
  148   1HD   LYS  23          HD1       LYS  23  -2.329  -8.699   2.617
  149   2HD   LYS  23          HD2       LYS  23  -3.915  -9.088   2.673
  150   1HE   LYS  23          HE1       LYS  23  -2.728 -10.515   1.183
  151   2HE   LYS  23          HE2       LYS  23  -3.885  -9.672   0.396
  152   1HZ   LYS  23          HZ1       LYS  23  -1.631  -9.804  -0.696
  153   2HZ   LYS  23          HZ2       LYS  23  -2.383  -8.353  -0.658
  154   3HZ   LYS  23          HZ3       LYS  23  -1.184  -8.722   0.420
  155    H    GLY  24           HN       GLY  24  -6.567  -5.538   2.188
  156   1HA   GLY  24          HA2       GLY  24  -8.685  -5.162   3.060
  157   2HA   GLY  24          HA1       GLY  24  -7.945  -4.573   4.556
  158    HA   PRO  25           HA       PRO  25 -10.013  -1.279   1.882
  159   1HB   PRO  25          HB1       PRO  25 -11.660  -0.255   3.757
  160   2HB   PRO  25          HB2       PRO  25 -12.078  -1.500   2.787
  161   1HG   PRO  25          HG1       PRO  25 -11.147  -1.651   5.520
  162   2HG   PRO  25          HG2       PRO  25 -12.359  -2.510   4.840
  163   1HD   PRO  25          HD1       PRO  25 -10.010  -3.600   5.107
  164   2HD   PRO  25          HD2       PRO  25 -10.915  -3.947   3.793
  165    H    LYS  26           HN       LYS  26  -8.576  -1.001   5.094
  166    HA   LYS  26           HA       LYS  26  -8.017   1.809   5.012
  167   1HB   LYS  26          HB1       LYS  26  -7.077  -0.448   6.595
  168   2HB   LYS  26          HB2       LYS  26  -6.078   0.843   6.552
  169   1HG   LYS  26          HG1       LYS  26  -8.810   1.320   7.173
  170   2HG   LYS  26          HG2       LYS  26  -7.881   0.656   8.341
  171   1HD   LYS  26          HD1       LYS  26  -7.914   2.917   8.746
  172   2HD   LYS  26          HD2       LYS  26  -6.424   2.573   8.172
  173   1HE   LYS  26          HE1       LYS  26  -8.275   3.481   6.247
  174   2HE   LYS  26          HE2       LYS  26  -7.799   4.596   7.342
  175   1HZ   LYS  26          HZ1       LYS  26  -6.466   4.706   5.397
  176   2HZ   LYS  26          HZ2       LYS  26  -5.546   4.269   6.692
  177   3HZ   LYS  26          HZ3       LYS  26  -6.019   3.157   5.573
  178    H    TYR  27           HN       TYR  27  -6.635  -0.632   3.072
  179    HA   TYR  27           HA       TYR  27  -4.614   1.383   2.177
  180   1HB   TYR  27          HB1       TYR  27  -4.088  -1.487   2.594
  181   2HB   TYR  27          HB2       TYR  27  -3.055  -0.451   1.869
  182    HD1  TYR  27           HD1      TYR  27  -1.842   1.311   3.110
  183    HD2  TYR  27           HD2      TYR  27  -4.427  -1.562   5.018
  184    HE1  TYR  27           HE1      TYR  27  -0.942   1.979   5.323
  185    HE2  TYR  27           HE2      TYR  27  -3.505  -0.906   7.241
  186    HH   TYR  27           HH       TYR  27  -1.033   1.633   7.599
  187    H    CYS  28           HN       CYS  28  -6.803  -1.246   1.207
  188    HA   CYS  28           HA       CYS  28  -6.177  -0.711  -1.634
  189   1HB   CYS  28          HB1       CYS  28  -6.871  -2.961  -0.247
  190   2HB   CYS  28          HB2       CYS  28  -8.196  -2.620  -1.140
  191    H    GLY  29           HN       GLY  29  -8.443   0.486   0.699
  192   1HA   GLY  29          HA2       GLY  29 -10.462   1.309  -1.282
  193   2HA   GLY  29          HA1       GLY  29 -10.326   1.801   0.419
  194    H    ARG  30           HN       ARG  30  -8.720   2.109  -2.748
  195    HA   ARG  30           HA       ARG  30  -7.618   4.788  -2.107
  196   1HB   ARG  30          HB1       ARG  30  -5.454   4.013  -2.506
  197   2HB   ARG  30          HB2       ARG  30  -6.089   2.955  -1.436
  198   1HG   ARG  30          HG1       ARG  30  -5.032   1.544  -2.788
  199   2HG   ARG  30          HG2       ARG  30  -6.506   1.554  -3.491
  200   1HD   ARG  30          HD1       ARG  30  -4.865   1.692  -5.162
  201   2HD   ARG  30          HD2       ARG  30  -5.694   3.099  -5.124
  202    HE   ARG  30           HE       ARG  30  -2.990   2.721  -4.111
  203   1HH1  ARG  30          2HH2      ARG  30  -5.375   5.163  -5.101
  204   2HH1  ARG  30          1HH2      ARG  30  -4.142   6.379  -5.130
  205   1HH2  ARG  30          2HH1      ARG  30  -1.587   4.268  -4.199
  206   2HH2  ARG  30          1HH1      ARG  30  -2.042   5.883  -4.628
  Start of MODEL   18
    1   1H    VAL   1           H1       VAL   1   1.499  -0.942   6.971
    2   2H    VAL   1           H2       VAL   1   1.517  -0.289   5.486
    3   3H    VAL   1           H3       VAL   1   0.567   0.389   6.655
    4    HA   VAL   1           HA       VAL   1   2.593   1.737   6.361
    5    HB   VAL   1           HB       VAL   1   2.642   0.137   8.956
    6   1HG1  VAL   1          1HG1      VAL   1   4.708   1.448   8.696
    7   2HG1  VAL   1          2HG1      VAL   1   3.767   2.896   8.266
    8   3HG1  VAL   1          3HG1      VAL   1   3.674   2.211   9.898
    9   1HG2  VAL   1          1HG2      VAL   1   1.172   2.718   8.232
   10   2HG2  VAL   1          2HG2      VAL   1   0.419   1.154   8.631
   11   3HG2  VAL   1          3HG2      VAL   1   1.307   2.041   9.863
   12    H    GLY   2           HN       GLY   2   4.680   1.891   5.939
   13   1HA   GLY   2          HA2       GLY   2   6.876   0.774   5.497
   14   2HA   GLY   2          HA1       GLY   2   5.959  -0.691   5.111
   15    H    GLU   3           HN       GLU   3   7.139   2.225   3.948
   16    HA   GLU   3           HA       GLU   3   5.788   3.305   1.974
   17   1HB   GLU   3          HB1       GLU   3   8.229   3.567   2.451
   18   2HB   GLU   3          HB2       GLU   3   8.517   2.420   1.326
   19   1HG   GLU   3          HG1       GLU   3   7.061   3.920  -0.129
   20   2HG   GLU   3          HG2       GLU   3   7.532   5.071   0.930
   21    H    CYS   4           HN       CYS   4   4.751   2.941   0.118
   22    HA   CYS   4           HA       CYS   4   4.878   0.484  -1.420
   23   1HB   CYS   4          HB1       CYS   4   4.046   3.145  -2.352
   24   2HB   CYS   4          HB2       CYS   4   3.684   1.703  -3.030
   25    H    VAL   5           HN       VAL   5   6.757  -0.136  -2.145
   26    HA   VAL   5           HA       VAL   5   9.128   1.398  -2.276
   27    HB   VAL   5           HB       VAL   5   8.571  -1.313  -3.545
   28   1HG1  VAL   5          1HG1      VAL   5  11.195   0.044  -2.752
   29   2HG1  VAL   5          2HG1      VAL   5  11.026  -1.635  -3.306
   30   3HG1  VAL   5          3HG1      VAL   5  10.662  -0.311  -4.413
   31   1HG2  VAL   5          1HG2      VAL   5   9.641  -0.567  -0.786
   32   2HG2  VAL   5          2HG2      VAL   5   8.097  -1.365  -1.130
   33   3HG2  VAL   5          3HG2      VAL   5   9.609  -2.210  -1.464
   34    H    ARG   6           HN       ARG   6   9.008   3.131  -3.531
   35    HA   ARG   6           HA       ARG   6   8.687   4.545  -5.337
   36   1HB   ARG   6          HB1       ARG   6   9.713   2.359  -7.026
   37   2HB   ARG   6          HB2       ARG   6   9.776   3.962  -7.334
   38   1HG   ARG   6          HG1       ARG   6  11.261   2.816  -5.173
   39   2HG   ARG   6          HG2       ARG   6  11.876   2.863  -6.685
   40   1HD   ARG   6          HD1       ARG   6  12.767   4.601  -5.372
   41   2HD   ARG   6          HD2       ARG   6  11.915   5.208  -6.627
   42    HE   ARG   6           HE       ARG   6  10.753   6.442  -5.184
   43   1HH1  ARG   6          2HH2      ARG   6  11.662   3.543  -3.392
   44   2HH1  ARG   6          1HH2      ARG   6  10.893   4.124  -1.953
   45   1HH2  ARG   6          2HH1      ARG   6   9.753   7.047  -3.334
   46   2HH2  ARG   6          1HH1      ARG   6   9.844   6.048  -1.922
   47    H    GLY   7           HN       GLY   7   6.467   3.093  -4.456
   48   1HA   GLY   7          HA2       GLY   7   4.211   3.213  -5.102
   49   2HA   GLY   7          HA1       GLY   7   4.651   3.198  -6.797
   50    H    ARG   8           HN       ARG   8   6.395   0.562  -5.567
   51    HA   ARG   8           HA       ARG   8   4.247  -1.331  -6.334
   52   1HB   ARG   8          HB1       ARG   8   7.165  -1.555  -5.920
   53   2HB   ARG   8          HB2       ARG   8   6.222  -2.881  -6.060
   54   1HG   ARG   8          HG1       ARG   8   6.820  -2.746  -8.163
   55   2HG   ARG   8          HG2       ARG   8   5.559  -1.710  -8.241
   56   1HD   ARG   8          HD1       ARG   8   8.186  -0.687  -7.785
   57   2HD   ARG   8          HD2       ARG   8   7.719  -1.050  -9.307
   58    HE   ARG   8           HE       ARG   8   7.166   1.306  -7.954
   59   1HH1  ARG   8          2HH2      ARG   8   5.529  -0.815 -10.258
   60   2HH1  ARG   8          1HH2      ARG   8   4.595   0.503 -10.883
   61   1HH2  ARG   8          2HH1      ARG   8   5.957   2.879  -8.791
   62   2HH2  ARG   8          1HH1      ARG   8   4.834   2.553 -10.069
   63    H    CYS   9           HN       CYS   9   4.036  -3.350  -5.042
   64    HA   CYS   9           HA       CYS   9   4.743  -3.162  -2.202
   65   1HB   CYS   9          HB1       CYS   9   1.977  -3.421  -3.208
   66   2HB   CYS   9          HB2       CYS   9   2.397  -3.980  -1.732
   67    HA   PRO  10           HA       PRO  10   5.674  -7.380  -2.891
   68   1HB   PRO  10          HB1       PRO  10   5.436  -8.478  -0.475
   69   2HB   PRO  10          HB2       PRO  10   6.602  -7.376  -0.780
   70   1HG   PRO  10          HG1       PRO  10   4.054  -6.901   0.517
   71   2HG   PRO  10          HG2       PRO  10   5.518  -6.368   1.006
   72   1HD   PRO  10          HD1       PRO  10   3.958  -4.795  -0.374
   73   2HD   PRO  10          HD2       PRO  10   5.577  -4.714  -0.570
   74    H    SER  11           HN       SER  11   4.948  -9.644  -2.737
   75    HA   SER  11           HA       SER  11   2.828 -10.175  -4.190
   76   1HB   SER  11          HB1       SER  11   3.916 -12.004  -2.148
   77   2HB   SER  11          HB2       SER  11   3.146 -12.438  -3.521
   78    HG   SER  11           HG       SER  11   5.354 -12.569  -3.827
   79    H    GLY  12           HN       GLY  12   0.903  -9.192  -3.747
   80   1HA   GLY  12          HA2       GLY  12  -1.359  -9.790  -3.270
   81   2HA   GLY  12          HA1       GLY  12  -0.845 -10.630  -1.811
   82    H    MET  13           HN       MET  13   0.840  -7.766  -1.596
   83    HA   MET  13           HA       MET  13  -1.238  -6.459   0.075
   84   1HB   MET  13          HB1       MET  13   1.597  -5.839  -0.469
   85   2HB   MET  13          HB2       MET  13   0.622  -4.818   0.352
   86   1HG   MET  13          HG1       MET  13   0.206  -6.678   1.898
   87   2HG   MET  13          HG2       MET  13   1.457  -7.439   1.174
   88   1HE   MET  13          HE1       MET  13   3.000  -6.535   4.625
   89   2HE   MET  13          HE2       MET  13   1.334  -7.054   4.282
   90   3HE   MET  13          HE3       MET  13   2.701  -7.849   3.464
   91    H    CYS  14           HN       CYS  14  -1.427  -4.091  -0.169
   92    HA   CYS  14           HA       CYS  14  -1.463  -3.047  -2.938
   93   1HB   CYS  14          HB1       CYS  14  -3.800  -2.264  -2.262
   94   2HB   CYS  14          HB2       CYS  14  -3.593  -3.761  -2.881
   95    H    CYS  15           HN       CYS  15  -1.972  -0.651  -2.928
   96    HA   CYS  15           HA       CYS  15  -0.195   0.527  -0.858
   97   1HB   CYS  15          HB1       CYS  15   0.617   0.448  -3.117
   98   2HB   CYS  15          HB2       CYS  15  -0.658   1.312  -3.663
   99    H    SER  16           HN       SER  16  -1.080   1.847   0.560
  100    HA   SER  16           HA       SER  16  -3.739   3.004   0.354
  101   1HB   SER  16          HB1       SER  16  -2.469   2.376   2.433
  102   2HB   SER  16          HB2       SER  16  -1.640   3.774   2.273
  103    HG   SER  16           HG       SER  16  -4.401   3.538   2.378
  104    H    GLN  17           HN       GLN  17  -4.263   5.273   0.434
  105    HA   GLN  17           HA       GLN  17  -2.938   7.078  -1.319
  106   1HB   GLN  17          HB1       GLN  17  -4.328   8.718  -0.186
  107   2HB   GLN  17          HB2       GLN  17  -5.184   7.406  -0.646
  108   1HG   GLN  17          HG1       GLN  17  -4.314   7.376   2.040
  109   2HG   GLN  17          HG2       GLN  17  -5.451   8.497   1.693
  110   1HE2  GLN  17          1HE2      GLN  17  -7.293   7.713   2.739
  111   2HE2  GLN  17          2HE2      GLN  17  -8.000   6.191   2.180
  112    H1   NAL  18           HD1      NAL  18  -3.082   5.688   4.725
  113    H3   NAL  18           HD2      NAL  18  -1.921   9.657   4.234
  114    H4   NAL  18           HE2      NAL  18  -4.165  10.386   4.697
  115    H5   NAL  18           HH2      NAL  18  -6.501   9.850   5.198
  116    H6   NAL  18           HP       NAL  18  -8.187   8.224   5.746
  117    H7   NAL  18           HH1      NAL  18  -7.624   5.889   5.825
  118    H8   NAL  18           HZ1      NAL  18  -5.392   5.164   5.306
  119   1H9   NAL  18          HB2       NAL  18  -0.844   6.075   4.102
  120   2H9   NAL  18          HB1       NAL  18  -0.188   7.614   4.663
  121    H10  NAL  18           HA       NAL  18  -0.549   8.633   2.489
  122   1HN   NAL  18          HN        NAL  18  -2.234   6.294   1.998
  123    H    GLY  19           HN       GLY  19   0.046   6.164   0.419
  124   1HA   GLY  19          HA2       GLY  19   2.028   5.695  -0.673
  125   2HA   GLY  19          HA1       GLY  19   2.910   6.682   0.497
  126    H    TYR  20           HN       TYR  20   0.908   4.178   1.792
  127    HA   TYR  20           HA       TYR  20   3.302   2.475   2.385
  128   1HB   TYR  20          HB1       TYR  20   0.890   3.078   3.978
  129   2HB   TYR  20          HB2       TYR  20   1.916   1.864   4.354
  130    HD1  TYR  20           HD1      TYR  20   0.957   4.253   6.064
  131    HD2  TYR  20           HD2      TYR  20   4.527   3.445   3.781
  132    HE1  TYR  20           HE1      TYR  20   2.274   5.688   7.594
  133    HE2  TYR  20           HE2      TYR  20   5.843   4.861   5.331
  134    HH   TYR  20           HH       TYR  20   4.351   6.603   8.044
  135    H    CYS  21           HN       CYS  21   3.230   0.326   2.193
  136    HA   CYS  21           HA       CYS  21   1.036  -0.974   0.791
  137   1HB   CYS  21          HB1       CYS  21   3.512  -2.017   2.012
  138   2HB   CYS  21          HB2       CYS  21   2.469  -2.914   1.132
  139    H    GLY  22           HN       GLY  22  -0.143  -2.722   1.592
  140   1HA   GLY  22          HA2       GLY  22  -0.130  -3.976   4.087
  141   2HA   GLY  22          HA1       GLY  22  -1.204  -2.565   4.236
  142    H    LYS  23           HN       LYS  23  -2.971  -4.181   4.506
  143    HA   LYS  23           HA       LYS  23  -4.201  -4.563   1.911
  144   1HB   LYS  23          HB1       LYS  23  -3.055  -6.749   2.675
  145   2HB   LYS  23          HB2       LYS  23  -4.349  -6.918   3.658
  146   1HG   LYS  23          HG1       LYS  23  -5.811  -6.954   1.839
  147   2HG   LYS  23          HG2       LYS  23  -4.614  -6.538   0.809
  148   1HD   LYS  23          HD1       LYS  23  -3.565  -8.652   1.195
  149   2HD   LYS  23          HD2       LYS  23  -4.793  -9.068   2.189
  150   1HE   LYS  23          HE1       LYS  23  -5.151 -10.069   0.090
  151   2HE   LYS  23          HE2       LYS  23  -6.306  -8.940   0.335
  152   1HZ   LYS  23          HZ1       LYS  23  -5.193  -7.442  -1.074
  153   2HZ   LYS  23          HZ2       LYS  23  -3.929  -8.471  -1.210
  154   3HZ   LYS  23          HZ3       LYS  23  -5.383  -8.865  -1.887
  155    H    GLY  24           HN       GLY  24  -6.529  -5.016   2.114
  156   1HA   GLY  24          HA2       GLY  24  -8.588  -4.881   3.395
  157   2HA   GLY  24          HA1       GLY  24  -7.749  -3.914   4.612
  158    HA   PRO  25           HA       PRO  25 -10.218  -1.508   1.405
  159   1HB   PRO  25          HB1       PRO  25 -11.876  -0.193   3.048
  160   2HB   PRO  25          HB2       PRO  25 -12.177  -1.717   2.543
  161   1HG   PRO  25          HG1       PRO  25 -11.037  -0.914   5.083
  162   2HG   PRO  25          HG2       PRO  25 -12.205  -2.029   4.838
  163   1HD   PRO  25          HD1       PRO  25  -9.743  -2.807   5.143
  164   2HD   PRO  25          HD2       PRO  25 -10.714  -3.604   4.100
  165    H    LYS  26           HN       LYS  26  -8.146  -0.429   3.946
  166    HA   LYS  26           HA       LYS  26  -8.015   2.361   2.926
  167   1HB   LYS  26          HB1       LYS  26  -6.708   0.972   5.195
  168   2HB   LYS  26          HB2       LYS  26  -6.523   2.556   4.844
  169   1HG   LYS  26          HG1       LYS  26  -8.976   1.332   5.729
  170   2HG   LYS  26          HG2       LYS  26  -8.024   2.295   6.642
  171   1HD   LYS  26          HD1       LYS  26  -9.537   3.807   6.088
  172   2HD   LYS  26          HD2       LYS  26  -8.572   3.974   4.781
  173   1HE   LYS  26          HE1       LYS  26 -10.016   2.461   3.583
  174   2HE   LYS  26          HE2       LYS  26 -11.016   2.447   4.874
  175   1HZ   LYS  26          HZ1       LYS  26 -11.552   4.019   2.986
  176   2HZ   LYS  26          HZ2       LYS  26 -11.586   4.691   4.534
  177   3HZ   LYS  26          HZ3       LYS  26 -10.326   4.837   3.438
  178    H    TYR  27           HN       TYR  27  -6.716  -0.539   2.031
  179    HA   TYR  27           HA       TYR  27  -4.245   0.727   0.886
  180   1HB   TYR  27          HB1       TYR  27  -4.622  -2.028   1.874
  181   2HB   TYR  27          HB2       TYR  27  -3.312  -1.521   1.040
  182    HD1  TYR  27           HD1      TYR  27  -4.961  -1.507   4.272
  183    HD2  TYR  27           HD2      TYR  27  -1.644  -0.024   1.965
  184    HE1  TYR  27           HE1      TYR  27  -3.857  -0.754   6.360
  185    HE2  TYR  27           HE2      TYR  27  -0.555   0.789   4.044
  186    HH   TYR  27           HH       TYR  27  -2.094   0.450   7.230
  187    H    CYS  28           HN       CYS  28  -6.692  -1.848   0.436
  188    HA   CYS  28           HA       CYS  28  -6.280  -1.897  -2.502
  189   1HB   CYS  28          HB1       CYS  28  -7.760  -3.504  -0.538
  190   2HB   CYS  28          HB2       CYS  28  -8.037  -3.667  -2.140
  191    H    GLY  29           HN       GLY  29  -8.061  -0.118  -0.306
  192   1HA   GLY  29          HA2       GLY  29  -9.722   1.052  -2.432
  193   2HA   GLY  29          HA1       GLY  29 -10.481   0.709  -0.857
  194    H    ARG  30           HN       ARG  30 -10.659   3.224  -1.023
  195    HA   ARG  30           HA       ARG  30  -8.239   4.561   0.137
  196   1HB   ARG  30          HB1       ARG  30 -10.444   5.851  -1.348
  197   2HB   ARG  30          HB2       ARG  30  -9.131   6.591  -0.719
  198   1HG   ARG  30          HG1       ARG  30  -9.038   4.790  -2.959
  199   2HG   ARG  30          HG2       ARG  30  -9.033   6.418  -3.095
  200   1HD   ARG  30          HD1       ARG  30  -6.849   5.774  -3.399
  201   2HD   ARG  30          HD2       ARG  30  -6.903   6.397  -1.890
  202    HE   ARG  30           HE       ARG  30  -7.303   3.887  -1.296
  203   1HH1  ARG  30          2HH2      ARG  30  -4.619   5.130  -3.273
  204   2HH1  ARG  30          1HH2      ARG  30  -3.697   3.709  -2.909
  205   1HH2  ARG  30          2HH1      ARG  30  -6.111   2.207  -1.021
  206   2HH2  ARG  30          1HH1      ARG  30  -4.513   2.117  -1.683
  Start of MODEL   19
    1   1H    VAL   1           H1       VAL   1   1.157  -0.173   5.182
    2   2H    VAL   1           H2       VAL   1   0.327   0.501   6.441
    3   3H    VAL   1           H3       VAL   1   1.150  -0.926   6.619
    4    HA   VAL   1           HA       VAL   1   2.422   1.691   6.138
    5    HB   VAL   1           HB       VAL   1   2.487  -0.096   8.605
    6   1HG1  VAL   1          1HG1      VAL   1   4.633   1.077   8.328
    7   2HG1  VAL   1          2HG1      VAL   1   3.782   2.618   8.052
    8   3HG1  VAL   1          3HG1      VAL   1   3.720   1.819   9.633
    9   1HG2  VAL   1          1HG2      VAL   1   1.361   1.850   9.710
   10   2HG2  VAL   1          2HG2      VAL   1   1.180   2.626   8.127
   11   3HG2  VAL   1          3HG2      VAL   1   0.341   1.097   8.495
   12    H    GLY   2           HN       GLY   2   4.585   1.675   5.748
   13   1HA   GLY   2          HA2       GLY   2   6.619   0.337   5.083
   14   2HA   GLY   2          HA1       GLY   2   5.486  -0.885   4.473
   15    H    GLU   3           HN       GLU   3   6.968   2.165   3.889
   16    HA   GLU   3           HA       GLU   3   5.354   3.428   2.071
   17   1HB   GLU   3          HB1       GLU   3   7.268   4.594   1.425
   18   2HB   GLU   3          HB2       GLU   3   7.363   4.298   3.029
   19   1HG   GLU   3          HG1       GLU   3   9.477   3.939   2.412
   20   2HG   GLU   3          HG2       GLU   3   8.878   2.422   2.339
   21    H    CYS   4           HN       CYS   4   4.883   3.486  -0.056
   22    HA   CYS   4           HA       CYS   4   5.071   1.035  -1.529
   23   1HB   CYS   4          HB1       CYS   4   4.302   3.686  -2.541
   24   2HB   CYS   4          HB2       CYS   4   3.946   2.243  -3.219
   25    H    VAL   5           HN       VAL   5   6.919   0.314  -2.236
   26    HA   VAL   5           HA       VAL   5   9.338   1.643  -2.628
   27    HB   VAL   5           HB       VAL   5   8.518  -1.044  -3.794
   28   1HG1  VAL   5          1HG1      VAL   5  10.947  -1.547  -3.630
   29   2HG1  VAL   5          2HG1      VAL   5  10.651  -0.223  -4.755
   30   3HG1  VAL   5          3HG1      VAL   5  11.263   0.124  -3.120
   31   1HG2  VAL   5          1HG2      VAL   5   9.729  -0.303  -1.090
   32   2HG2  VAL   5          2HG2      VAL   5   8.130  -1.020  -1.367
   33   3HG2  VAL   5          3HG2      VAL   5   9.580  -1.958  -1.722
   34    H    ARG   6           HN       ARG   6   9.106   3.345  -3.838
   35    HA   ARG   6           HA       ARG   6   8.574   4.837  -5.437
   36   1HB   ARG   6          HB1       ARG   6   9.946   3.134  -7.390
   37   2HB   ARG   6          HB2       ARG   6   9.854   4.764  -7.350
   38   1HG   ARG   6          HG1       ARG   6  11.458   3.130  -5.614
   39   2HG   ARG   6          HG2       ARG   6  12.021   4.109  -6.794
   40   1HD   ARG   6          HD1       ARG   6  12.143   5.805  -5.424
   41   2HD   ARG   6          HD2       ARG   6  10.609   5.576  -4.911
   42    HE   ARG   6           HE       ARG   6  12.969   4.336  -3.763
   43   1HH1  ARG   6          2HH2      ARG   6   9.600   5.198  -3.258
   44   2HH1  ARG   6          1HH2      ARG   6   9.529   4.343  -1.753
   45   1HH2  ARG   6          2HH1      ARG   6  12.762   3.161  -1.910
   46   2HH2  ARG   6          1HH1      ARG   6  11.286   3.212  -1.006
   47    H    GLY   7           HN       GLY   7   6.502   3.307  -4.822
   48   1HA   GLY   7          HA2       GLY   7   4.287   3.625  -5.717
   49   2HA   GLY   7          HA1       GLY   7   4.869   3.263  -7.331
   50    H    ARG   8           HN       ARG   8   6.279   0.775  -5.578
   51    HA   ARG   8           HA       ARG   8   3.903  -0.985  -6.032
   52   1HB   ARG   8          HB1       ARG   8   6.795  -1.330  -6.444
   53   2HB   ARG   8          HB2       ARG   8   5.839  -2.640  -6.252
   54   1HG   ARG   8          HG1       ARG   8   4.727  -2.265  -8.200
   55   2HG   ARG   8          HG2       ARG   8   5.135  -0.684  -8.229
   56   1HD   ARG   8          HD1       ARG   8   6.980  -2.843  -8.766
   57   2HD   ARG   8          HD2       ARG   8   6.317  -1.893  -9.918
   58    HE   ARG   8           HE       ARG   8   8.481  -1.222  -8.187
   59   1HH1  ARG   8          2HH2      ARG   8   6.198   0.261 -10.436
   60   2HH1  ARG   8          1HH2      ARG   8   6.816   1.844 -10.100
   61   1HH2  ARG   8          2HH1      ARG   8   9.015   0.828  -7.673
   62   2HH2  ARG   8          1HH1      ARG   8   8.363   2.153  -8.578
   63    H    CYS   9           HN       CYS   9   3.973  -3.086  -4.870
   64    HA   CYS   9           HA       CYS   9   4.751  -2.889  -2.047
   65   1HB   CYS   9          HB1       CYS   9   1.997  -3.125  -3.125
   66   2HB   CYS   9          HB2       CYS   9   2.372  -3.489  -1.577
   67    HA   PRO  10           HA       PRO  10   5.343  -7.289  -2.259
   68   1HB   PRO  10          HB1       PRO  10   3.401  -7.619  -0.071
   69   2HB   PRO  10          HB2       PRO  10   4.908  -8.235  -0.205
   70   1HG   PRO  10          HG1       PRO  10   4.537  -6.172   1.316
   71   2HG   PRO  10          HG2       PRO  10   5.898  -6.250   0.417
   72   1HD   PRO  10          HD1       PRO  10   3.519  -4.729  -0.130
   73   2HD   PRO  10          HD2       PRO  10   5.066  -4.286  -0.407
   74    H    SER  11           HN       SER  11   4.448  -9.261  -2.884
   75    HA   SER  11           HA       SER  11   2.453  -9.182  -4.863
   76   1HB   SER  11          HB1       SER  11   4.253 -10.696  -4.952
   77   2HB   SER  11          HB2       SER  11   3.825 -11.452  -3.569
   78    HG   SER  11           HG       SER  11   1.951 -12.136  -4.522
   79    H    GLY  12           HN       GLY  12   0.720  -8.270  -3.571
   80   1HA   GLY  12          HA2       GLY  12  -1.637  -9.524  -3.515
   81   2HA   GLY  12          HA1       GLY  12  -0.967 -10.174  -2.019
   82    H    MET  13           HN       MET  13   0.390  -7.216  -1.942
   83    HA   MET  13           HA       MET  13  -1.780  -5.944  -0.380
   84   1HB   MET  13          HB1       MET  13   1.101  -5.437  -0.785
   85   2HB   MET  13          HB2       MET  13   0.139  -4.318  -0.084
   86   1HG   MET  13          HG1       MET  13   1.314  -5.549   1.533
   87   2HG   MET  13          HG2       MET  13  -0.298  -5.752   1.696
   88   1HE   MET  13          HE1       MET  13   2.032  -7.429   3.161
   89   2HE   MET  13          HE2       MET  13   0.298  -7.603   3.530
   90   3HE   MET  13          HE3       MET  13   1.273  -9.036   3.129
   91    H    CYS  14           HN       CYS  14  -1.922  -3.575  -0.661
   92    HA   CYS  14           HA       CYS  14  -1.714  -2.576  -3.490
   93   1HB   CYS  14          HB1       CYS  14  -3.860  -2.169  -1.513
   94   2HB   CYS  14          HB2       CYS  14  -3.626  -1.138  -2.758
   95    H    CYS  15           HN       CYS  15  -1.058  -0.427  -3.686
   96    HA   CYS  15           HA       CYS  15   0.209   0.907  -1.385
   97   1HB   CYS  15          HB1       CYS  15   1.213   1.012  -3.602
   98   2HB   CYS  15          HB2       CYS  15  -0.099   1.783  -4.197
   99    H    SER  16           HN       SER  16  -0.992   2.122  -0.063
  100    HA   SER  16           HA       SER  16  -3.628   3.180  -0.846
  101   1HB   SER  16          HB1       SER  16  -3.690   3.990   1.392
  102   2HB   SER  16          HB2       SER  16  -3.263   2.413   1.405
  103    HG   SER  16           HG       SER  16  -1.135   2.952   1.752
  104    H    GLN  17           HN       GLN  17  -4.213   5.377  -0.644
  105    HA   GLN  17           HA       GLN  17  -2.595   7.298  -1.984
  106   1HB   GLN  17          HB1       GLN  17  -4.349   8.800  -1.337
  107   2HB   GLN  17          HB2       GLN  17  -4.979   7.403  -1.901
  108   1HG   GLN  17          HG1       GLN  17  -4.794   7.672   0.919
  109   2HG   GLN  17          HG2       GLN  17  -5.950   8.548   0.168
  110   1HE2  GLN  17          1HE2      GLN  17  -8.008   7.616   0.083
  111   2HE2  GLN  17          2HE2      GLN  17  -8.132   5.853   0.083
  112    H1   NAL  18           HD1      NAL  18  -3.605   5.247   3.285
  113    H3   NAL  18           HD2      NAL  18  -3.072   9.218   4.418
  114    H4   NAL  18           HE2      NAL  18  -5.454   9.506   4.574
  115    H5   NAL  18           HH2      NAL  18  -7.724   8.602   4.266
  116    H6   NAL  18           HP       NAL  18  -9.171   6.798   3.603
  117    H7   NAL  18           HH1      NAL  18  -8.228   4.694   2.915
  118    H8   NAL  18           HZ1      NAL  18  -5.845   4.388   2.911
  119   1H9   NAL  18          HB1       NAL  18  -1.375   6.006   3.615
  120   2H9   NAL  18          HB2       NAL  18  -1.105   7.550   4.418
  121    H10  NAL  18           HA       NAL  18  -1.224   8.759   2.340
  122   1HN   NAL  18          HN        NAL  18  -2.464   6.312   1.294
  123    H    GLY  19           HN       GLY  19  -0.090   6.466   0.209
  124   1HA   GLY  19          HA2       GLY  19   2.068   6.269  -0.624
  125   2HA   GLY  19          HA1       GLY  19   2.716   7.126   0.776
  126    H    TYR  20           HN       TYR  20   0.609   4.554   1.618
  127    HA   TYR  20           HA       TYR  20   2.949   2.818   2.331
  128   1HB   TYR  20          HB1       TYR  20   0.562   3.589   3.878
  129   2HB   TYR  20          HB2       TYR  20   1.365   2.210   4.225
  130    HD1  TYR  20           HD1      TYR  20   0.725   4.741   5.957
  131    HD2  TYR  20           HD2      TYR  20   4.206   3.238   3.918
  132    HE1  TYR  20           HE1      TYR  20   2.191   5.870   7.607
  133    HE2  TYR  20           HE2      TYR  20   5.675   4.368   5.571
  134    HH   TYR  20           HH       TYR  20   4.370   6.348   8.217
  135    H    CYS  21           HN       CYS  21   2.879   0.728   1.983
  136    HA   CYS  21           HA       CYS  21   0.806  -0.529   0.446
  137   1HB   CYS  21          HB1       CYS  21   3.156  -1.571   1.900
  138   2HB   CYS  21          HB2       CYS  21   2.247  -2.454   0.869
  139    H    GLY  22           HN       GLY  22  -0.628  -2.176   1.084
  140   1HA   GLY  22          HA2       GLY  22  -0.491  -3.651   3.494
  141   2HA   GLY  22          HA1       GLY  22  -1.609  -2.315   3.770
  142    H    LYS  23           HN       LYS  23  -3.020  -4.194   4.164
  143    HA   LYS  23           HA       LYS  23  -4.532  -5.077   1.758
  144   1HB   LYS  23          HB1       LYS  23  -3.530  -6.731   3.990
  145   2HB   LYS  23          HB2       LYS  23  -4.913  -7.148   3.228
  146   1HG   LYS  23          HG1       LYS  23  -3.799  -7.410   1.205
  147   2HG   LYS  23          HG2       LYS  23  -2.428  -6.773   1.824
  148   1HD   LYS  23          HD1       LYS  23  -2.289  -9.139   1.574
  149   2HD   LYS  23          HD2       LYS  23  -2.063  -8.663   3.120
  150   1HE   LYS  23          HE1       LYS  23  -3.360 -10.619   3.069
  151   2HE   LYS  23          HE2       LYS  23  -4.248  -9.385   3.666
  152   1HZ   LYS  23          HZ1       LYS  23  -5.313 -10.889   2.003
  153   2HZ   LYS  23          HZ2       LYS  23  -5.611  -9.316   1.888
  154   3HZ   LYS  23          HZ3       LYS  23  -4.471 -10.004   0.892
  155    H    GLY  24           HN       GLY  24  -6.741  -5.739   2.347
  156   1HA   GLY  24          HA2       GLY  24  -8.756  -5.500   3.502
  157   2HA   GLY  24          HA1       GLY  24  -7.903  -4.768   4.862
  158    HA   PRO  25           HA       PRO  25 -10.710  -1.845   2.394
  159   1HB   PRO  25          HB1       PRO  25 -11.382  -1.029   5.142
  160   2HB   PRO  25          HB2       PRO  25 -12.357  -1.135   3.836
  161   1HG   PRO  25          HG1       PRO  25 -12.408  -3.066   5.548
  162   2HG   PRO  25          HG2       PRO  25 -12.455  -3.447   3.961
  163   1HD   PRO  25          HD1       PRO  25 -10.179  -3.551   5.723
  164   2HD   PRO  25          HD2       PRO  25 -10.571  -4.614   4.546
  165    H    LYS  26           HN       LYS  26  -8.382  -1.113   4.929
  166    HA   LYS  26           HA       LYS  26  -8.140   1.722   4.347
  167   1HB   LYS  26          HB1       LYS  26  -6.640  -0.240   5.952
  168   2HB   LYS  26          HB2       LYS  26  -5.950   1.209   5.649
  169   1HG   LYS  26          HG1       LYS  26  -8.582   1.288   6.696
  170   2HG   LYS  26          HG2       LYS  26  -7.416   0.810   7.736
  171   1HD   LYS  26          HD1       LYS  26  -7.795   3.136   7.957
  172   2HD   LYS  26          HD2       LYS  26  -6.276   2.866   7.419
  173   1HE   LYS  26          HE1       LYS  26  -6.955   3.412   5.211
  174   2HE   LYS  26          HE2       LYS  26  -8.479   3.667   5.739
  175   1HZ   LYS  26          HZ1       LYS  26  -7.756   5.503   7.012
  176   2HZ   LYS  26          HZ2       LYS  26  -6.203   5.225   6.533
  177   3HZ   LYS  26          HZ3       LYS  26  -7.323   5.698   5.432
  178    H    TYR  27           HN       TYR  27  -7.097  -0.938   2.543
  179    HA   TYR  27           HA       TYR  27  -5.107   0.741   1.052
  180   1HB   TYR  27          HB1       TYR  27  -4.615  -1.999   2.057
  181   2HB   TYR  27          HB2       TYR  27  -3.600  -1.139   1.109
  182    HD1  TYR  27           HD1      TYR  27  -4.875  -1.561   4.476
  183    HD2  TYR  27           HD2      TYR  27  -2.110   0.552   1.950
  184    HE1  TYR  27           HE1      TYR  27  -3.699  -0.726   6.490
  185    HE2  TYR  27           HE2      TYR  27  -0.957   1.450   3.965
  186    HH   TYR  27           HH       TYR  27  -2.142   0.821   7.242
  187    H    CYS  28           HN       CYS  28  -6.756  -2.417   1.092
  188    HA   CYS  28           HA       CYS  28  -6.721  -2.555  -1.883
  189   1HB   CYS  28          HB1       CYS  28  -4.887  -3.640  -0.325
  190   2HB   CYS  28          HB2       CYS  28  -5.968  -4.864  -0.278
  191    H    GLY  29           HN       GLY  29  -8.828  -2.611   0.581
  192   1HA   GLY  29          HA2       GLY  29 -11.041  -3.352   0.718
  193   2HA   GLY  29          HA1       GLY  29 -10.829  -4.272  -0.772
  194    H    ARG  30           HN       ARG  30  -8.935  -5.990  -0.300
  195    HA   ARG  30           HA       ARG  30  -9.497  -7.516   2.215
  196   1HB   ARG  30          HB1       ARG  30  -9.897  -9.433   1.136
  197   2HB   ARG  30          HB2       ARG  30 -10.658  -8.359   0.169
  198   1HG   ARG  30          HG1       ARG  30  -8.272  -9.813  -0.455
  199   2HG   ARG  30          HG2       ARG  30  -9.736 -10.001  -1.154
  200   1HD   ARG  30          HD1       ARG  30  -8.545  -8.917  -2.746
  201   2HD   ARG  30          HD2       ARG  30  -9.389  -7.705  -2.047
  202    HE   ARG  30           HE       ARG  30  -7.431  -7.144  -0.719
  203   1HH1  ARG  30          2HH1      ARG  30  -6.563  -8.928  -3.643
  204   2HH1  ARG  30          1HH1      ARG  30  -4.893  -8.834  -3.195
  205   1HH2  ARG  30          2HH2      ARG  30  -5.492  -7.205  -0.206
  206   2HH2  ARG  30          1HH2      ARG  30  -4.293  -7.869  -1.265
  Start of MODEL   20
    1   1H    VAL   1           H1       VAL   1   2.536  -0.260   4.058
    2   2H    VAL   1           H2       VAL   1   4.117  -0.659   4.381
    3   3H    VAL   1           H3       VAL   1   3.798   0.657   3.468
    4    HA   VAL   1           HA       VAL   1   2.715   1.725   5.347
    5    HB   VAL   1           HB       VAL   1   3.190   0.823   7.600
    6   1HG1  VAL   1          1HG1      VAL   1   1.316  -0.683   7.671
    7   2HG1  VAL   1          2HG1      VAL   1   0.973   0.570   6.470
    8   3HG1  VAL   1          3HG1      VAL   1   1.457  -1.061   5.950
    9   1HG2  VAL   1          1HG2      VAL   1   3.685  -1.542   7.944
   10   2HG2  VAL   1          2HG2      VAL   1   3.832  -1.823   6.204
   11   3HG2  VAL   1          3HG2      VAL   1   5.012  -0.792   7.051
   12    H    GLY   2           HN       GLY   2   3.992   3.235   6.542
   13   1HA   GLY   2          HA2       GLY   2   5.896   4.537   6.782
   14   2HA   GLY   2          HA1       GLY   2   6.916   3.189   6.258
   15    H    GLU   3           HN       GLU   3   5.982   2.501   3.849
   16    HA   GLU   3           HA       GLU   3   5.260   4.768   2.139
   17   1HB   GLU   3          HB1       GLU   3   7.159   4.461   0.706
   18   2HB   GLU   3          HB2       GLU   3   7.674   4.864   2.203
   19   1HG   GLU   3          HG1       GLU   3   8.488   2.749   2.600
   20   2HG   GLU   3          HG2       GLU   3   7.679   2.123   1.327
   21    H    CYS   4           HN       CYS   4   5.169   3.975  -0.212
   22    HA   CYS   4           HA       CYS   4   5.049   1.033  -0.574
   23   1HB   CYS   4          HB1       CYS   4   4.470   3.075  -2.622
   24   2HB   CYS   4          HB2       CYS   4   4.187   1.470  -2.722
   25    H    VAL   5           HN       VAL   5   6.547   0.099  -2.063
   26    HA   VAL   5           HA       VAL   5   9.195   1.270  -1.932
   27    HB   VAL   5           HB       VAL   5   8.278  -1.241  -3.390
   28   1HG1  VAL   5          1HG1      VAL   5  10.662  -1.894  -3.152
   29   2HG1  VAL   5          2HG1      VAL   5  10.501  -0.438  -4.135
   30   3HG1  VAL   5          3HG1      VAL   5  11.030  -0.309  -2.439
   31   1HG2  VAL   5          1HG2      VAL   5   9.353  -0.854  -0.561
   32   2HG2  VAL   5          2HG2      VAL   5   7.736  -1.443  -1.006
   33   3HG2  VAL   5          3HG2      VAL   5   9.155  -2.424  -1.371
   34    H    ARG   6           HN       ARG   6   9.165   3.119  -3.049
   35    HA   ARG   6           HA       ARG   6   9.024   4.682  -4.717
   36   1HB   ARG   6          HB1       ARG   6   9.769   2.642  -6.689
   37   2HB   ARG   6          HB2       ARG   6  10.131   4.234  -6.683
   38   1HG   ARG   6          HG1       ARG   6  11.369   2.245  -5.026
   39   2HG   ARG   6          HG2       ARG   6  12.063   2.969  -6.315
   40   1HD   ARG   6          HD1       ARG   6  12.824   4.586  -5.067
   41   2HD   ARG   6          HD2       ARG   6  11.341   4.874  -4.447
   42    HE   ARG   6           HE       ARG   6  13.262   2.978  -3.363
   43   1HH1  ARG   6          2HH2      ARG   6  10.467   5.005  -2.703
   44   2HH1  ARG   6          1HH2      ARG   6  10.222   4.286  -1.146
   45   1HH2  ARG   6          2HH1      ARG   6  12.785   2.018  -1.424
   46   2HH2  ARG   6          1HH1      ARG   6  11.500   2.639  -0.442
   47    H    GLY   7           HN       GLY   7   6.626   3.193  -4.063
   48   1HA   GLY   7          HA2       GLY   7   4.388   3.664  -4.881
   49   2HA   GLY   7          HA1       GLY   7   4.976   3.626  -6.528
   50    H    ARG   8           HN       ARG   8   6.364   0.848  -5.186
   51    HA   ARG   8           HA       ARG   8   4.037  -0.849  -5.993
   52   1HB   ARG   8          HB1       ARG   8   6.965  -1.127  -6.299
   53   2HB   ARG   8          HB2       ARG   8   5.980  -2.424  -6.419
   54   1HG   ARG   8          HG1       ARG   8   5.029  -1.679  -8.337
   55   2HG   ARG   8          HG2       ARG   8   5.429  -0.125  -8.036
   56   1HD   ARG   8          HD1       ARG   8   7.800  -1.289  -8.318
   57   2HD   ARG   8          HD2       ARG   8   6.894  -2.047  -9.445
   58    HE   ARG   8           HE       ARG   8   6.958  -0.213 -10.774
   59   1HH1  ARG   8          2HH2      ARG   8   7.700   0.780  -7.480
   60   2HH1  ARG   8          1HH2      ARG   8   7.863   2.446  -7.927
   61   1HH2  ARG   8          2HH1      ARG   8   7.127   1.994 -11.240
   62   2HH2  ARG   8          1HH1      ARG   8   7.549   3.110  -9.985
   63    H    CYS   9           HN       CYS   9   4.109  -3.104  -5.027
   64    HA   CYS   9           HA       CYS   9   4.907  -3.135  -2.200
   65   1HB   CYS   9          HB1       CYS   9   2.122  -3.379  -3.182
   66   2HB   CYS   9          HB2       CYS   9   2.590  -3.682  -1.647
   67    HA   PRO  10           HA       PRO  10   5.349  -7.554  -2.712
   68   1HB   PRO  10          HB1       PRO  10   3.603  -7.843  -0.356
   69   2HB   PRO  10          HB2       PRO  10   5.039  -8.560  -0.660
   70   1HG   PRO  10          HG1       PRO  10   4.970  -6.525   0.947
   71   2HG   PRO  10          HG2       PRO  10   6.232  -6.677  -0.079
   72   1HD   PRO  10          HD1       PRO  10   3.960  -4.943  -0.337
   73   2HD   PRO  10          HD2       PRO  10   5.501  -4.640  -0.787
   74    H    SER  11           HN       SER  11   4.345  -9.479  -3.328
   75    HA   SER  11           HA       SER  11   2.231  -9.439  -5.055
   76   1HB   SER  11          HB1       SER  11   3.205 -11.753  -3.487
   77   2HB   SER  11          HB2       SER  11   2.421 -11.823  -4.919
   78    HG   SER  11           HG       SER  11   4.120 -10.933  -5.960
   79    H    GLY  12           HN       GLY  12   0.273  -8.670  -4.519
   80   1HA   GLY  12          HA2       GLY  12  -1.976  -9.348  -3.968
   81   2HA   GLY  12          HA1       GLY  12  -1.376 -10.223  -2.566
   82    H    MET  13           HN       MET  13   0.309  -7.328  -2.410
   83    HA   MET  13           HA       MET  13  -1.561  -6.133  -0.487
   84   1HB   MET  13          HB1       MET  13   1.046  -5.265  -1.573
   85   2HB   MET  13          HB2       MET  13   0.224  -4.438  -0.429
   86   1HG   MET  13          HG1       MET  13   1.118  -7.149  -0.073
   87   2HG   MET  13          HG2       MET  13   1.955  -5.856   0.471
   88   1HE   MET  13          HE1       MET  13   1.185  -8.399   2.215
   89   2HE   MET  13          HE2       MET  13   2.164  -7.052   2.841
   90   3HE   MET  13          HE3       MET  13   0.734  -7.607   3.741
   91    H    CYS  14           HN       CYS  14  -1.752  -3.604  -0.714
   92    HA   CYS  14           HA       CYS  14  -2.120  -2.642  -3.511
   93   1HB   CYS  14          HB1       CYS  14  -3.765  -2.098  -1.140
   94   2HB   CYS  14          HB2       CYS  14  -3.734  -1.091  -2.425
   95    H    CYS  15           HN       CYS  15  -1.002  -0.770  -3.942
   96    HA   CYS  15           HA       CYS  15   0.329   0.717  -1.756
   97   1HB   CYS  15          HB1       CYS  15   1.501   0.541  -3.873
   98   2HB   CYS  15          HB2       CYS  15   0.276   1.283  -4.659
   99    H    SER  16           HN       SER  16  -1.038   1.874  -0.587
  100    HA   SER  16           HA       SER  16  -3.669   2.622  -1.542
  101   1HB   SER  16          HB1       SER  16  -3.921   3.397   0.688
  102   2HB   SER  16          HB2       SER  16  -3.157   1.955   0.731
  103    HG   SER  16           HG       SER  16  -1.189   3.024   0.961
  104    H    GLN  17           HN       GLN  17  -4.622   4.761  -1.194
  105    HA   GLN  17           HA       GLN  17  -3.347   6.929  -2.545
  106   1HB   GLN  17          HB1       GLN  17  -5.274   8.120  -1.886
  107   2HB   GLN  17          HB2       GLN  17  -5.746   6.616  -2.316
  108   1HG   GLN  17          HG1       GLN  17  -5.423   7.141   0.460
  109   2HG   GLN  17          HG2       GLN  17  -6.749   7.749  -0.274
  110   1HE2  GLN  17          1HE2      GLN  17  -8.589   6.532   0.143
  111   2HE2  GLN  17          2HE2      GLN  17  -8.433   4.777   0.221
  112    H1   NAL  18           HD1      NAL  18  -4.060   4.662   2.615
  113    H3   NAL  18           HD2      NAL  18  -3.746   8.512   4.165
  114    H4   NAL  18           HE2      NAL  18  -6.110   8.539   4.599
  115    H5   NAL  18           HH2      NAL  18  -8.307   7.447   4.448
  116    H6   NAL  18           HP       NAL  18  -9.638   5.523   3.891
  117    H7   NAL  18           HH1      NAL  18  -8.604   3.600   2.876
  118    H8   NAL  18           HZ1      NAL  18  -6.247   3.615   2.403
  119   1H9   NAL  18          HB1       NAL  18  -1.857   5.576   2.952
  120   2H9   NAL  18          HB2       NAL  18  -1.682   7.088   3.824
  121    H10  NAL  18           HA       NAL  18  -2.062   8.386   1.813
  122   1HN   NAL  18          HN        NAL  18  -2.998   5.839   0.690
  123    H    GLY  19           HN       GLY  19  -0.690   6.362  -0.455
  124   1HA   GLY  19          HA2       GLY  19   1.463   6.219  -1.258
  125   2HA   GLY  19          HA1       GLY  19   2.010   7.327   0.008
  126    H    TYR  20           HN       TYR  20   0.260   4.518   0.943
  127    HA   TYR  20           HA       TYR  20   2.690   3.201   2.107
  128   1HB   TYR  20          HB1       TYR  20   0.096   3.868   3.269
  129   2HB   TYR  20          HB2       TYR  20   0.849   2.512   3.779
  130    HD1  TYR  20           HD1      TYR  20   2.650   5.656   3.067
  131    HD2  TYR  20           HD2      TYR  20   0.940   3.091   6.106
  132    HE1  TYR  20           HE1      TYR  20   3.860   6.896   4.784
  133    HE2  TYR  20           HE2      TYR  20   2.177   4.376   7.845
  134    HH   TYR  20           HH       TYR  20   4.362   7.059   7.009
  135    H    CYS  21           HN       CYS  21   2.947   1.087   1.489
  136    HA   CYS  21           HA       CYS  21   0.946  -0.495   0.194
  137   1HB   CYS  21          HB1       CYS  21   3.286  -1.330   1.781
  138   2HB   CYS  21          HB2       CYS  21   2.366  -2.361   0.910
  139    H    GLY  22           HN       GLY  22  -0.600  -1.946   0.944
  140   1HA   GLY  22          HA2       GLY  22  -0.338  -3.437   3.316
  141   2HA   GLY  22          HA1       GLY  22  -1.434  -2.109   3.695
  142    H    LYS  23           HN       LYS  23  -2.883  -3.966   4.113
  143    HA   LYS  23           HA       LYS  23  -4.555  -4.612   1.758
  144   1HB   LYS  23          HB1       LYS  23  -3.326  -6.526   3.563
  145   2HB   LYS  23          HB2       LYS  23  -4.907  -6.783   3.245
  146   1HG   LYS  23          HG1       LYS  23  -4.435  -6.756   0.908
  147   2HG   LYS  23          HG2       LYS  23  -2.852  -6.517   1.234
  148   1HD   LYS  23          HD1       LYS  23  -3.326  -8.784   0.644
  149   2HD   LYS  23          HD2       LYS  23  -2.652  -8.654   2.126
  150   1HE   LYS  23          HE1       LYS  23  -4.435 -10.263   2.035
  151   2HE   LYS  23          HE2       LYS  23  -4.675  -9.105   3.161
  152   1HZ   LYS  23          HZ1       LYS  23  -5.933  -8.965   0.553
  153   2HZ   LYS  23          HZ2       LYS  23  -6.671  -9.592   1.894
  154   3HZ   LYS  23          HZ3       LYS  23  -6.239  -8.007   1.755
  155    H    GLY  24           HN       GLY  24  -6.792  -5.413   2.516
  156   1HA   GLY  24          HA2       GLY  24  -8.717  -5.039   3.676
  157   2HA   GLY  24          HA1       GLY  24  -7.775  -4.520   5.080
  158    HA   PRO  25           HA       PRO  25 -10.476  -1.155   3.070
  159   1HB   PRO  25          HB1       PRO  25 -10.896  -0.638   5.940
  160   2HB   PRO  25          HB2       PRO  25 -11.949  -0.458   4.704
  161   1HG   PRO  25          HG1       PRO  25 -12.110  -2.603   6.133
  162   2HG   PRO  25          HG2       PRO  25 -12.288  -2.743   4.515
  163   1HD   PRO  25          HD1       PRO  25  -9.959  -3.362   6.085
  164   2HD   PRO  25          HD2       PRO  25 -10.509  -4.155   4.767
  165    H    LYS  26           HN       LYS  26  -8.102  -0.785   5.677
  166    HA   LYS  26           HA       LYS  26  -7.715   2.049   5.227
  167   1HB   LYS  26          HB1       LYS  26  -6.857   0.191   7.131
  168   2HB   LYS  26          HB2       LYS  26  -5.511   0.912   6.552
  169   1HG   LYS  26          HG1       LYS  26  -7.761   2.348   7.637
  170   2HG   LYS  26          HG2       LYS  26  -6.391   2.041   8.473
  171   1HD   LYS  26          HD1       LYS  26  -6.467   3.713   6.125
  172   2HD   LYS  26          HD2       LYS  26  -6.497   4.301   7.649
  173   1HE   LYS  26          HE1       LYS  26  -4.319   4.183   7.809
  174   2HE   LYS  26          HE2       LYS  26  -4.313   2.629   7.307
  175   1HZ   LYS  26          HZ1       LYS  26  -4.392   3.340   5.071
  176   2HZ   LYS  26          HZ2       LYS  26  -4.350   4.911   5.551
  177   3HZ   LYS  26          HZ3       LYS  26  -3.045   3.926   5.820
  178    H    TYR  27           HN       TYR  27  -6.702  -0.469   3.306
  179    HA   TYR  27           HA       TYR  27  -4.758   1.368   1.971
  180   1HB   TYR  27          HB1       TYR  27  -4.091  -1.446   2.588
  181   2HB   TYR  27          HB2       TYR  27  -3.150  -0.407   1.749
  182    HD1  TYR  27           HD1      TYR  27  -4.107  -1.548   5.014
  183    HD2  TYR  27           HD2      TYR  27  -2.068   1.564   2.856
  184    HE1  TYR  27           HE1      TYR  27  -3.123  -0.737   7.135
  185    HE2  TYR  27           HE2      TYR  27  -1.135   2.432   4.998
  186    HH   TYR  27           HH       TYR  27  -1.715   0.834   8.112
  187    H    CYS  28           HN       CYS  28  -6.803  -1.451   1.649
  188    HA   CYS  28           HA       CYS  28  -6.454  -1.528  -1.296
  189   1HB   CYS  28          HB1       CYS  28  -5.098  -2.950   0.368
  190   2HB   CYS  28          HB2       CYS  28  -6.467  -3.818   0.567
  191    H    GLY  29           HN       GLY  29  -8.687  -1.933   1.365
  192   1HA   GLY  29          HA2       GLY  29 -10.882  -2.704   1.496
  193   2HA   GLY  29          HA1       GLY  29 -10.924  -2.933  -0.256
  194    H    ARG  30           HN       ARG  30  -9.056  -4.586  -0.868
  195    HA   ARG  30           HA       ARG  30  -9.668  -7.169   0.485
  196   1HB   ARG  30          HB1       ARG  30  -9.288  -8.075  -1.712
  197   2HB   ARG  30          HB2       ARG  30 -10.398  -6.880  -1.796
  198   1HG   ARG  30          HG1       ARG  30  -9.223  -5.856  -3.326
  199   2HG   ARG  30          HG2       ARG  30  -7.933  -5.795  -2.327
  200   1HD   ARG  30          HD1       ARG  30  -7.584  -8.185  -3.100
  201   2HD   ARG  30          HD2       ARG  30  -8.481  -7.707  -4.378
  202    HE   ARG  30           HE       ARG  30  -6.782  -6.365  -5.168
  203   1HH1  ARG  30          2HH2      ARG  30  -5.929  -7.722  -2.039
  204   2HH1  ARG  30          1HH2      ARG  30  -4.259  -7.295  -2.210
  205   1HH2  ARG  30          2HH1      ARG  30  -4.598  -5.843  -5.304
  206   2HH2  ARG  30          1HH1      ARG  30  -3.524  -6.259  -4.010
  Start of MODEL   21
    1   1H    VAL   1           H1       VAL   1   4.247   0.096   3.199
    2   2H    VAL   1           H2       VAL   1   2.948  -0.644   3.943
    3   3H    VAL   1           H3       VAL   1   4.486  -1.236   4.112
    4    HA   VAL   1           HA       VAL   1   3.529   1.338   5.132
    5    HB   VAL   1           HB       VAL   1   4.049   0.445   7.359
    6   1HG1  VAL   1          1HG1      VAL   1   2.042  -0.832   7.647
    7   2HG1  VAL   1          2HG1      VAL   1   1.726   0.379   6.400
    8   3HG1  VAL   1          3HG1      VAL   1   2.009  -1.318   5.949
    9   1HG2  VAL   1          1HG2      VAL   1   4.307  -2.297   6.027
   10   2HG2  VAL   1          2HG2      VAL   1   5.644  -1.373   6.753
   11   3HG2  VAL   1          3HG2      VAL   1   4.315  -1.950   7.761
   12    H    GLY   2           HN       GLY   2   5.156   2.571   6.345
   13   1HA   GLY   2          HA2       GLY   2   7.267   3.546   6.443
   14   2HA   GLY   2          HA1       GLY   2   7.987   2.132   5.658
   15    H    GLU   3           HN       GLU   3   6.750   1.817   3.370
   16    HA   GLU   3           HA       GLU   3   5.772   4.209   2.098
   17   1HB   GLU   3          HB1       GLU   3   7.277   4.213   0.252
   18   2HB   GLU   3          HB2       GLU   3   8.105   4.490   1.632
   19   1HG   GLU   3          HG1       GLU   3   9.117   2.418   1.541
   20   2HG   GLU   3          HG2       GLU   3   8.103   1.905   0.369
   21    H    CYS   4           HN       CYS   4   5.378   3.610  -0.329
   22    HA   CYS   4           HA       CYS   4   4.880   0.735  -0.830
   23   1HB   CYS   4          HB1       CYS   4   4.230   3.040  -2.580
   24   2HB   CYS   4          HB2       CYS   4   3.808   1.484  -2.845
   25    H    VAL   5           HN       VAL   5   6.286  -0.335  -2.090
   26    HA   VAL   5           HA       VAL   5   9.024   0.359  -2.049
   27    HB   VAL   5           HB       VAL   5   7.526  -1.823  -3.537
   28   1HG1  VAL   5          1HG1      VAL   5  10.523  -1.527  -3.056
   29   2HG1  VAL   5          2HG1      VAL   5   9.717  -3.020  -3.587
   30   3HG1  VAL   5          3HG1      VAL   5   9.694  -1.610  -4.631
   31   1HG2  VAL   5          1HG2      VAL   5   9.061  -1.823  -0.905
   32   2HG2  VAL   5          2HG2      VAL   5   7.297  -1.945  -1.088
   33   3HG2  VAL   5          3HG2      VAL   5   8.335  -3.245  -1.684
   34    H    ARG   6           HN       ARG   6   9.401   2.295  -3.087
   35    HA   ARG   6           HA       ARG   6   9.445   3.927  -4.774
   36   1HB   ARG   6          HB1       ARG   6  10.081   1.669  -6.571
   37   2HB   ARG   6          HB2       ARG   6  10.361   3.248  -6.882
   38   1HG   ARG   6          HG1       ARG   6  11.703   1.959  -4.719
   39   2HG   ARG   6          HG2       ARG   6  12.281   1.821  -6.240
   40   1HD   ARG   6          HD1       ARG   6  13.464   3.492  -5.083
   41   2HD   ARG   6          HD2       ARG   6  12.641   4.158  -6.326
   42    HE   ARG   6           HE       ARG   6  11.660   5.575  -4.890
   43   1HH1  ARG   6          2HH2      ARG   6  12.482   2.690  -3.064
   44   2HH1  ARG   6          1HH2      ARG   6  11.706   3.282  -1.634
   45   1HH2  ARG   6          2HH1      ARG   6  10.568   6.186  -3.037
   46   2HH2  ARG   6          1HH1      ARG   6  10.657   5.195  -1.618
   47    H    GLY   7           HN       GLY   7   6.860   2.847  -4.179
   48   1HA   GLY   7          HA2       GLY   7   4.701   3.427  -4.991
   49   2HA   GLY   7          HA1       GLY   7   5.344   3.635  -6.612
   50    H    ARG   8           HN       ARG   8   6.392   0.585  -5.410
   51    HA   ARG   8           HA       ARG   8   4.109  -0.946  -6.563
   52   1HB   ARG   8          HB1       ARG   8   6.864  -1.826  -5.922
   53   2HB   ARG   8          HB2       ARG   8   5.762  -2.613  -6.836
   54   1HG   ARG   8          HG1       ARG   8   7.104  -0.218  -7.685
   55   2HG   ARG   8          HG2       ARG   8   7.579  -1.721  -8.112
   56   1HD   ARG   8          HD1       ARG   8   6.403  -0.861  -9.908
   57   2HD   ARG   8          HD2       ARG   8   5.446  -1.996  -9.226
   58    HE   ARG   8           HE       ARG   8   4.722   0.342  -8.024
   59   1HH1  ARG   8          2HH2      ARG   8   4.494  -0.821 -11.342
   60   2HH1  ARG   8          1HH2      ARG   8   3.116   0.182 -11.652
   61   1HH2  ARG   8          2HH1      ARG   8   3.014   1.531  -8.463
   62   2HH2  ARG   8          1HH1      ARG   8   2.285   1.502 -10.034
   63    H    CYS   9           HN       CYS   9   3.940  -3.188  -5.423
   64    HA   CYS   9           HA       CYS   9   4.358  -2.966  -2.509
   65   1HB   CYS   9          HB1       CYS   9   1.765  -3.389  -3.819
   66   2HB   CYS   9          HB2       CYS   9   2.036  -3.863  -2.279
   67    HA   PRO  10           HA       PRO  10   5.389  -7.286  -3.243
   68   1HB   PRO  10          HB1       PRO  10   6.272  -7.881  -0.829
   69   2HB   PRO  10          HB2       PRO  10   7.110  -6.807  -1.731
   70   1HG   PRO  10          HG1       PRO  10   5.251  -6.205   0.413
   71   2HG   PRO  10          HG2       PRO  10   6.725  -5.543   0.179
   72   1HD   PRO  10          HD1       PRO  10   4.532  -4.344  -0.671
   73   2HD   PRO  10          HD2       PRO  10   5.967  -4.129  -1.421
   74    H    SER  11           HN       SER  11   4.745  -9.445  -2.370
   75    HA   SER  11           HA       SER  11   3.157 -10.971  -1.847
   76   1HB   SER  11          HB1       SER  11   2.517 -10.895   0.483
   77   2HB   SER  11          HB2       SER  11   4.063 -10.386   0.352
   78    HG   SER  11           HG       SER  11   2.837  -8.221   0.152
   79    H    GLY  12           HN       GLY  12   2.170  -9.006  -3.443
   80   1HA   GLY  12          HA2       GLY  12   0.222  -8.035  -4.346
   81   2HA   GLY  12          HA1       GLY  12  -0.646  -9.389  -3.615
   82    H    MET  13           HN       MET  13   1.159  -6.906  -1.737
   83    HA   MET  13           HA       MET  13  -1.265  -5.912  -0.405
   84   1HB   MET  13          HB1       MET  13   1.548  -5.012  -0.463
   85   2HB   MET  13          HB2       MET  13   0.379  -4.164   0.300
   86   1HG   MET  13          HG1       MET  13  -0.022  -6.005   1.732
   87   2HG   MET  13          HG2       MET  13   1.150  -6.851   0.970
   88   1HE   MET  13          HE1       MET  13   2.823  -6.357   4.409
   89   2HE   MET  13          HE2       MET  13   1.121  -6.725   4.053
   90   3HE   MET  13          HE3       MET  13   2.417  -7.531   3.137
   91    H    CYS  14           HN       CYS  14  -1.647  -3.537  -0.467
   92    HA   CYS  14           HA       CYS  14  -1.596  -2.427  -3.252
   93   1HB   CYS  14          HB1       CYS  14  -3.889  -2.308  -1.410
   94   2HB   CYS  14          HB2       CYS  14  -3.851  -1.867  -2.982
   95    H    CYS  15           HN       CYS  15  -1.610  -0.131  -3.381
   96    HA   CYS  15           HA       CYS  15  -0.135   1.067  -1.149
   97   1HB   CYS  15          HB1       CYS  15   0.645   1.068  -3.465
   98   2HB   CYS  15          HB2       CYS  15  -0.564   2.086  -3.880
   99    H    SER  16           HN       SER  16  -1.230   2.107   0.377
  100    HA   SER  16           HA       SER  16  -3.855   3.288   0.100
  101   1HB   SER  16          HB1       SER  16  -3.426   4.104   2.312
  102   2HB   SER  16          HB2       SER  16  -3.031   2.523   2.211
  103    HG   SER  16           HG       SER  16  -0.894   2.977   2.181
  104    H    GLN  17           HN       GLN  17  -4.392   5.481   0.634
  105    HA   GLN  17           HA       GLN  17  -3.353   7.595  -0.879
  106   1HB   GLN  17          HB1       GLN  17  -4.658   8.928   0.724
  107   2HB   GLN  17          HB2       GLN  17  -5.499   7.683   0.082
  108   1HG   GLN  17          HG1       GLN  17  -4.336   7.177   2.612
  109   2HG   GLN  17          HG2       GLN  17  -5.574   8.241   2.611
  110   1HE2  GLN  17          1HE2      GLN  17  -7.333   7.132   3.554
  111   2HE2  GLN  17          2HE2      GLN  17  -7.927   5.677   2.723
  112    H1   NAL  18           HD1      NAL  18  -2.406   5.163   4.578
  113    H3   NAL  18           HD2      NAL  18  -1.826   9.270   4.979
  114    H4   NAL  18           HE2      NAL  18  -4.059   9.517   5.840
  115    H5   NAL  18           HH2      NAL  18  -6.219   8.523   6.427
  116    H6   NAL  18           HP       NAL  18  -7.606   6.574   6.690
  117    H7   NAL  18           HH1      NAL  18  -6.759   4.408   6.088
  118    H8   NAL  18           HZ1      NAL  18  -4.540   4.178   5.192
  119   1H9   NAL  18          HB1       NAL  18  -0.303   6.013   3.976
  120   2H9   NAL  18          HB2       NAL  18   0.181   7.549   4.686
  121    H10  NAL  18           HA       NAL  18  -0.539   8.779   2.753
  122   1HN   NAL  18          HN        NAL  18  -2.058   6.346   2.107
  123    H    GLY  19           HN       GLY  19  -0.127   6.525   0.344
  124   1HA   GLY  19          HA2       GLY  19   1.702   5.884  -0.916
  125   2HA   GLY  19          HA1       GLY  19   2.720   6.993   0.020
  126    H    TYR  20           HN       TYR  20   0.763   4.494   1.497
  127    HA   TYR  20           HA       TYR  20   3.159   2.876   2.291
  128   1HB   TYR  20          HB1       TYR  20   0.869   3.850   3.822
  129   2HB   TYR  20          HB2       TYR  20   1.467   2.379   4.203
  130    HD1  TYR  20           HD1      TYR  20   2.040   2.803   6.476
  131    HD2  TYR  20           HD2      TYR  20   3.534   5.308   3.283
  132    HE1  TYR  20           HE1      TYR  20   3.724   3.809   8.019
  133    HE2  TYR  20           HE2      TYR  20   5.179   6.281   4.804
  134    HH   TYR  20           HH       TYR  20   6.099   6.213   6.892
  135    H    CYS  21           HN       CYS  21   3.089   0.833   1.431
  136    HA   CYS  21           HA       CYS  21   0.722  -0.393   0.381
  137   1HB   CYS  21          HB1       CYS  21   3.244  -1.608   1.288
  138   2HB   CYS  21          HB2       CYS  21   2.057  -2.448   0.545
  139    H    GLY  22           HN       GLY  22  -0.670  -1.941   1.176
  140   1HA   GLY  22          HA2       GLY  22  -0.302  -3.467   3.581
  141   2HA   GLY  22          HA1       GLY  22  -1.443  -2.148   3.865
  142    H    LYS  23           HN       LYS  23  -3.119  -3.772   4.194
  143    HA   LYS  23           HA       LYS  23  -4.201  -5.002   1.690
  144   1HB   LYS  23          HB1       LYS  23  -4.026  -6.231   4.384
  145   2HB   LYS  23          HB2       LYS  23  -4.897  -6.853   3.151
  146   1HG   LYS  23          HG1       LYS  23  -2.048  -6.550   2.966
  147   2HG   LYS  23          HG2       LYS  23  -2.726  -7.910   3.564
  148   1HD   LYS  23          HD1       LYS  23  -3.824  -8.246   1.442
  149   2HD   LYS  23          HD2       LYS  23  -3.027  -6.946   0.857
  150   1HE   LYS  23          HE1       LYS  23  -0.959  -8.015   1.145
  151   2HE   LYS  23          HE2       LYS  23  -1.671  -9.267   1.916
  152   1HZ   LYS  23          HZ1       LYS  23  -2.123  -8.631  -0.857
  153   2HZ   LYS  23          HZ2       LYS  23  -1.056  -9.763  -0.356
  154   3HZ   LYS  23          HZ3       LYS  23  -2.676  -9.975  -0.070
  155    H    GLY  24           HN       GLY  24  -6.481  -5.301   1.685
  156   1HA   GLY  24          HA2       GLY  24  -8.667  -5.096   2.400
  157   2HA   GLY  24          HA1       GLY  24  -8.112  -4.355   3.902
  158    HA   PRO  25           HA       PRO  25 -10.635  -1.584   1.081
  159   1HB   PRO  25          HB1       PRO  25 -11.689  -0.761   3.705
  160   2HB   PRO  25          HB2       PRO  25 -12.490  -0.961   2.296
  161   1HG   PRO  25          HG1       PRO  25 -12.624  -2.849   4.051
  162   2HG   PRO  25          HG2       PRO  25 -12.463  -3.267   2.480
  163   1HD   PRO  25          HD1       PRO  25 -10.405  -3.185   4.493
  164   2HD   PRO  25          HD2       PRO  25 -10.588  -4.293   3.307
  165    H    LYS  26           HN       LYS  26  -8.566  -0.628   3.759
  166    HA   LYS  26           HA       LYS  26  -8.504   2.235   2.880
  167   1HB   LYS  26          HB1       LYS  26  -7.728   0.775   5.274
  168   2HB   LYS  26          HB2       LYS  26  -6.834   2.089   4.898
  169   1HG   LYS  26          HG1       LYS  26  -8.497   2.703   6.408
  170   2HG   LYS  26          HG2       LYS  26  -8.773   3.433   4.973
  171   1HD   LYS  26          HD1       LYS  26 -10.231   1.074   5.607
  172   2HD   LYS  26          HD2       LYS  26 -10.696   2.490   6.275
  173   1HE   LYS  26          HE1       LYS  26 -10.637   1.950   3.448
  174   2HE   LYS  26          HE2       LYS  26 -11.991   2.017   4.358
  175   1HZ   LYS  26          HZ1       LYS  26 -11.626   4.007   3.050
  176   2HZ   LYS  26          HZ2       LYS  26 -11.637   4.361   4.694
  177   3HZ   LYS  26          HZ3       LYS  26 -10.262   4.235   3.732
  178    H    TYR  27           HN       TYR  27  -7.049  -0.491   1.819
  179    HA   TYR  27           HA       TYR  27  -4.574   0.978   0.967
  180   1HB   TYR  27          HB1       TYR  27  -4.862  -1.788   1.937
  181   2HB   TYR  27          HB2       TYR  27  -3.540  -1.263   1.133
  182    HD1  TYR  27           HD1      TYR  27  -5.372  -1.098   4.265
  183    HD2  TYR  27           HD2      TYR  27  -1.921   0.277   2.089
  184    HE1  TYR  27           HE1      TYR  27  -4.418  -0.197   6.367
  185    HE2  TYR  27           HE2      TYR  27  -0.950   1.178   4.209
  186    HH   TYR  27           HH       TYR  27  -2.656   0.949   7.323
  187    H    CYS  28           HN       CYS  28  -6.805  -1.722   0.126
  188    HA   CYS  28           HA       CYS  28  -6.112  -1.286  -2.748
  189   1HB   CYS  28          HB1       CYS  28  -6.676  -3.575  -1.325
  190   2HB   CYS  28          HB2       CYS  28  -7.956  -3.360  -2.317
  191    H    GLY  29           HN       GLY  29  -8.471  -0.432  -0.467
  192   1HA   GLY  29          HA2       GLY  29  -9.982   1.001  -2.605
  193   2HA   GLY  29          HA1       GLY  29 -10.641   0.687  -0.989
  194    H    ARG  30           HN       ARG  30 -10.790   3.002  -0.550
  195    HA   ARG  30           HA       ARG  30  -8.232   4.266   0.250
  196   1HB   ARG  30          HB1       ARG  30  -9.651   5.171  -1.892
  197   2HB   ARG  30          HB2       ARG  30 -10.294   6.067  -0.687
  198   1HG   ARG  30          HG1       ARG  30  -8.630   7.413  -1.304
  199   2HG   ARG  30          HG2       ARG  30  -7.869   6.549  -0.146
  200   1HD   ARG  30          HD1       ARG  30  -7.581   6.194  -2.991
  201   2HD   ARG  30          HD2       ARG  30  -6.424   6.718  -1.964
  202    HE   ARG  30           HE       ARG  30  -7.386   4.050  -1.500
  203   1HH1  ARG  30          2HH2      ARG  30  -4.616   5.834  -2.844
  204   2HH1  ARG  30          1HH2      ARG  30  -3.678   4.378  -2.860
  205   1HH2  ARG  30          2HH1      ARG  30  -6.117   2.362  -1.604
  206   2HH2  ARG  30          1HH1      ARG  30  -4.492   2.499  -2.188
  Start of MODEL   22
    1   1H    VAL   1           H1       VAL   1   1.201  -2.313   6.162
    2   2H    VAL   1           H2       VAL   1   1.082  -1.100   5.095
    3   3H    VAL   1           H3       VAL   1   0.522  -0.876   6.637
    4    HA   VAL   1           HA       VAL   1   2.621   0.248   6.459
    5    HB   VAL   1           HB       VAL   1   4.003  -0.967   8.098
    6   1HG1  VAL   1          1HG1      VAL   1   2.094   0.454   8.812
    7   2HG1  VAL   1          2HG1      VAL   1   1.045  -0.985   8.842
    8   3HG1  VAL   1          3HG1      VAL   1   2.428  -0.867   9.939
    9   1HG2  VAL   1          1HG2      VAL   1   3.577  -3.315   7.354
   10   2HG2  VAL   1          2HG2      VAL   1   3.290  -3.079   9.079
   11   3HG2  VAL   1          3HG2      VAL   1   1.914  -3.198   7.977
   12    H    GLY   2           HN       GLY   2   4.972   0.076   6.155
   13   1HA   GLY   2          HA2       GLY   2   6.698  -0.431   4.595
   14   2HA   GLY   2          HA1       GLY   2   5.613  -1.531   3.733
   15    H    GLU   3           HN       GLU   3   6.818   1.653   3.905
   16    HA   GLU   3           HA       GLU   3   4.955   3.145   2.329
   17   1HB   GLU   3          HB1       GLU   3   6.836   4.079   3.475
   18   2HB   GLU   3          HB2       GLU   3   7.897   3.281   2.524
   19   1HG   GLU   3          HG1       GLU   3   6.118   5.121   1.287
   20   2HG   GLU   3          HG2       GLU   3   7.398   5.721   2.105
   21    H    CYS   4           HN       CYS   4   4.692   3.355   0.070
   22    HA   CYS   4           HA       CYS   4   5.018   0.922  -1.390
   23   1HB   CYS   4          HB1       CYS   4   4.447   3.582  -2.494
   24   2HB   CYS   4          HB2       CYS   4   4.156   2.146  -3.214
   25    H    VAL   5           HN       VAL   5   6.868   0.131  -2.101
   26    HA   VAL   5           HA       VAL   5   9.345   1.515  -2.269
   27    HB   VAL   5           HB       VAL   5   8.610  -1.207  -3.421
   28   1HG1  VAL   5          1HG1      VAL   5  10.748  -0.378  -4.361
   29   2HG1  VAL   5          2HG1      VAL   5  11.325   0.021  -2.726
   30   3HG1  VAL   5          3HG1      VAL   5  11.045  -1.668  -3.197
   31   1HG2  VAL   5          1HG2      VAL   5   8.180  -1.106  -0.995
   32   2HG2  VAL   5          2HG2      VAL   5   9.625  -2.067  -1.317
   33   3HG2  VAL   5          3HG2      VAL   5   9.784  -0.399  -0.721
   34    H    ARG   6           HN       ARG   6   9.009   3.239  -3.519
   35    HA   ARG   6           HA       ARG   6   8.612   4.641  -5.235
   36   1HB   ARG   6          HB1       ARG   6  10.020   2.755  -6.997
   37   2HB   ARG   6          HB2       ARG   6   9.866   4.370  -7.185
   38   1HG   ARG   6          HG1       ARG   6  11.551   3.021  -5.291
   39   2HG   ARG   6          HG2       ARG   6  12.042   3.961  -6.533
   40   1HD   ARG   6          HD1       ARG   6  12.248   5.594  -5.108
   41   2HD   ARG   6          HD2       ARG   6  10.621   5.615  -4.978
   42    HE   ARG   6           HE       ARG   6  12.394   4.144  -3.208
   43   1HH1  ARG   6          2HH2      ARG   6   9.298   5.808  -3.490
   44   2HH1  ARG   6          1HH2      ARG   6   8.835   5.337  -1.889
   45   1HH2  ARG   6          2HH1      ARG   6  11.655   3.479  -1.262
   46   2HH2  ARG   6          1HH1      ARG   6  10.134   4.050  -0.661
   47    H    GLY   7           HN       GLY   7   6.550   3.199  -4.492
   48   1HA   GLY   7          HA2       GLY   7   4.309   3.162  -5.268
   49   2HA   GLY   7          HA1       GLY   7   4.855   3.042  -6.926
   50    H    ARG   8           HN       ARG   8   6.667   0.571  -5.585
   51    HA   ARG   8           HA       ARG   8   4.633  -1.448  -6.290
   52   1HB   ARG   8          HB1       ARG   8   7.525  -1.537  -5.692
   53   2HB   ARG   8          HB2       ARG   8   6.634  -2.903  -5.787
   54   1HG   ARG   8          HG1       ARG   8   7.348  -2.900  -7.859
   55   2HG   ARG   8          HG2       ARG   8   6.068  -1.911  -8.085
   56   1HD   ARG   8          HD1       ARG   8   8.636  -0.782  -7.544
   57   2HD   ARG   8          HD2       ARG   8   8.269  -1.255  -9.064
   58    HE   ARG   8           HE       ARG   8   7.543   1.157  -7.872
   59   1HH1  ARG   8          2HH2      ARG   8   6.213  -1.140 -10.207
   60   2HH1  ARG   8          1HH2      ARG   8   5.276   0.100 -10.972
   61   1HH2  ARG   8          2HH1      ARG   8   6.334   2.632  -8.888
   62   2HH2  ARG   8          1HH1      ARG   8   5.344   2.194 -10.239
   63    H    CYS   9           HN       CYS   9   4.301  -3.313  -4.927
   64    HA   CYS   9           HA       CYS   9   4.803  -3.023  -2.050
   65   1HB   CYS   9          HB1       CYS   9   2.114  -3.252  -3.254
   66   2HB   CYS   9          HB2       CYS   9   2.409  -3.638  -1.695
   67    HA   PRO  10           HA       PRO  10   5.246  -7.462  -2.507
   68   1HB   PRO  10          HB1       PRO  10   5.102  -8.245   0.021
   69   2HB   PRO  10          HB2       PRO  10   6.355  -7.317  -0.465
   70   1HG   PRO  10          HG1       PRO  10   3.974  -6.435   0.935
   71   2HG   PRO  10          HG2       PRO  10   5.518  -6.029   1.275
   72   1HD   PRO  10          HD1       PRO  10   4.004  -4.449  -0.180
   73   2HD   PRO  10          HD2       PRO  10   5.619  -4.511  -0.415
   74    H    SER  11           HN       SER  11   4.126  -9.548  -1.760
   75    HA   SER  11           HA       SER  11   2.290 -10.886  -2.147
   76   1HB   SER  11          HB1       SER  11   1.794  -9.571   0.453
   77   2HB   SER  11          HB2       SER  11   1.256 -11.052   0.023
   78    HG   SER  11           HG       SER  11   3.128 -11.275   1.215
   79    H    GLY  12           HN       GLY  12   1.665  -8.985  -3.799
   80   1HA   GLY  12          HA2       GLY  12  -0.022  -7.913  -4.986
   81   2HA   GLY  12          HA1       GLY  12  -1.091  -9.154  -4.331
   82    H    MET  13           HN       MET  13   0.575  -6.731  -2.295
   83    HA   MET  13           HA       MET  13  -1.962  -5.807  -1.180
   84   1HB   MET  13          HB1       MET  13   0.842  -4.956  -0.792
   85   2HB   MET  13          HB2       MET  13  -0.418  -4.312   0.023
   86   1HG   MET  13          HG1       MET  13  -0.868  -6.423   1.001
   87   2HG   MET  13          HG2       MET  13   0.388  -7.072   0.182
   88   1HE   MET  13          HE1       MET  13   1.656  -7.223   3.864
   89   2HE   MET  13          HE2       MET  13  -0.001  -7.487   3.272
   90   3HE   MET  13          HE3       MET  13   1.384  -8.171   2.386
   91    H    CYS  14           HN       CYS  14  -2.462  -3.592  -0.992
   92    HA   CYS  14           HA       CYS  14  -2.471  -2.174  -3.604
   93   1HB   CYS  14          HB1       CYS  14  -3.971  -1.705  -1.094
   94   2HB   CYS  14          HB2       CYS  14  -4.183  -0.874  -2.484
   95    H    CYS  15           HN       CYS  15  -0.938  -0.624  -3.934
   96    HA   CYS  15           HA       CYS  15   0.329   0.863  -1.755
   97   1HB   CYS  15          HB1       CYS  15   1.442   0.736  -3.888
   98   2HB   CYS  15          HB2       CYS  15   0.200   1.477  -4.647
   99    H    SER  16           HN       SER  16  -1.092   1.848  -0.469
  100    HA   SER  16           HA       SER  16  -3.622   2.879  -1.397
  101   1HB   SER  16          HB1       SER  16  -3.917   3.419   0.884
  102   2HB   SER  16          HB2       SER  16  -3.214   1.947   0.804
  103    HG   SER  16           HG       SER  16  -1.465   2.587   1.683
  104    H    GLN  17           HN       GLN  17  -4.454   5.030  -0.922
  105    HA   GLN  17           HA       GLN  17  -3.018   7.181  -2.110
  106   1HB   GLN  17          HB1       GLN  17  -4.880   8.459  -1.394
  107   2HB   GLN  17          HB2       GLN  17  -5.427   7.023  -1.947
  108   1HG   GLN  17          HG1       GLN  17  -5.145   7.303   0.866
  109   2HG   GLN  17          HG2       GLN  17  -6.406   8.064   0.160
  110   1HE2  GLN  17          1HE2      GLN  17  -8.342   6.948   0.436
  111   2HE2  GLN  17          2HE2      GLN  17  -8.308   5.185   0.352
  112    H1   NAL  18           HD1      NAL  18  -3.909   4.665   2.839
  113    H3   NAL  18           HD2      NAL  18  -3.494   8.374   4.677
  114    H4   NAL  18           HE2      NAL  18  -5.864   8.450   5.072
  115    H5   NAL  18           HH2      NAL  18  -8.095   7.448   4.803
  116    H6   NAL  18           HP       NAL  18  -9.477   5.620   4.066
  117    H7   NAL  18           HH1      NAL  18  -8.487   3.746   2.926
  118    H8   NAL  18           HZ1      NAL  18  -6.117   3.709   2.512
  119   1H9   NAL  18          HB1       NAL  18  -1.681   5.455   3.308
  120   2H9   NAL  18          HB2       NAL  18  -1.469   6.908   4.273
  121    H10  NAL  18           HA       NAL  18  -1.732   8.335   2.336
  122   1HN   NAL  18          HN        NAL  18  -2.766   5.905   1.048
  123    H    GLY  19           HN       GLY  19  -0.405   6.204   0.060
  124   1HA   GLY  19          HA2       GLY  19   1.776   6.199  -0.748
  125   2HA   GLY  19          HA1       GLY  19   2.353   7.015   0.705
  126    H    TYR  20           HN       TYR  20   0.392   4.271   1.351
  127    HA   TYR  20           HA       TYR  20   2.809   2.597   1.953
  128   1HB   TYR  20          HB1       TYR  20   0.676   3.481   3.757
  129   2HB   TYR  20          HB2       TYR  20   1.416   2.049   4.026
  130    HD1  TYR  20           HD1      TYR  20   3.494   1.862   5.131
  131    HD2  TYR  20           HD2      TYR  20   2.047   5.654   3.715
  132    HE1  TYR  20           HE1      TYR  20   5.381   3.028   6.304
  133    HE2  TYR  20           HE2      TYR  20   3.922   6.807   4.840
  134    HH   TYR  20           HH       TYR  20   5.836   6.542   6.102
  135    H    CYS  21           HN       CYS  21   2.627   0.459   1.923
  136    HA   CYS  21           HA       CYS  21   0.634  -0.782   0.257
  137   1HB   CYS  21          HB1       CYS  21   2.883  -1.849   1.855
  138   2HB   CYS  21          HB2       CYS  21   2.060  -2.691   0.723
  139    H    GLY  22           HN       GLY  22  -0.960  -2.261   0.828
  140   1HA   GLY  22          HA2       GLY  22  -0.776  -4.007   2.997
  141   2HA   GLY  22          HA1       GLY  22  -1.808  -2.702   3.559
  142    H    LYS  23           HN       LYS  23  -3.270  -4.575   3.770
  143    HA   LYS  23           HA       LYS  23  -5.107  -4.716   1.468
  144   1HB   LYS  23          HB1       LYS  23  -4.043  -7.002   2.979
  145   2HB   LYS  23          HB2       LYS  23  -5.585  -7.059   2.444
  146   1HG   LYS  23          HG1       LYS  23  -4.871  -6.920   0.213
  147   2HG   LYS  23          HG2       LYS  23  -3.328  -6.667   0.683
  148   1HD   LYS  23          HD1       LYS  23  -3.003  -8.823   1.234
  149   2HD   LYS  23          HD2       LYS  23  -4.584  -9.077   1.551
  150   1HE   LYS  23          HE1       LYS  23  -4.119 -10.332  -0.309
  151   2HE   LYS  23          HE2       LYS  23  -4.970  -9.047  -0.849
  152   1HZ   LYS  23          HZ1       LYS  23  -3.144  -9.573  -2.266
  153   2HZ   LYS  23          HZ2       LYS  23  -3.028  -8.061  -1.723
  154   3HZ   LYS  23          HZ3       LYS  23  -2.086  -9.255  -1.071
  155    H    GLY  24           HN       GLY  24  -7.359  -5.037   2.192
  156   1HA   GLY  24          HA2       GLY  24  -9.093  -4.842   3.732
  157   2HA   GLY  24          HA1       GLY  24  -7.955  -4.432   5.024
  158    HA   PRO  25           HA       PRO  25 -10.541  -0.983   3.067
  159   1HB   PRO  25          HB1       PRO  25 -10.897  -0.245   5.897
  160   2HB   PRO  25          HB2       PRO  25 -11.965  -0.118   4.668
  161   1HG   PRO  25          HG1       PRO  25 -12.169  -2.159   6.239
  162   2HG   PRO  25          HG2       PRO  25 -12.368  -2.405   4.637
  163   1HD   PRO  25          HD1       PRO  25 -10.025  -2.953   6.218
  164   2HD   PRO  25          HD2       PRO  25 -10.629  -3.850   4.993
  165    H    LYS  26           HN       LYS  26  -8.335  -0.397   5.773
  166    HA   LYS  26           HA       LYS  26  -7.616   2.276   5.044
  167   1HB   LYS  26          HB1       LYS  26  -6.844   0.391   7.049
  168   2HB   LYS  26          HB2       LYS  26  -5.547   1.236   6.528
  169   1HG   LYS  26          HG1       LYS  26  -7.968   2.491   7.454
  170   2HG   LYS  26          HG2       LYS  26  -6.672   2.247   8.418
  171   1HD   LYS  26          HD1       LYS  26  -6.634   3.959   6.099
  172   2HD   LYS  26          HD2       LYS  26  -6.810   4.507   7.628
  173   1HE   LYS  26          HE1       LYS  26  -4.638   4.716   7.695
  174   2HE   LYS  26          HE2       LYS  26  -4.557   3.085   7.730
  175   1HZ   LYS  26          HZ1       LYS  26  -4.400   4.710   5.363
  176   2HZ   LYS  26          HZ2       LYS  26  -3.169   3.838   6.018
  177   3HZ   LYS  26          HZ3       LYS  26  -4.462   3.084   5.324
  178    H    TYR  27           HN       TYR  27  -6.907  -0.372   3.208
  179    HA   TYR  27           HA       TYR  27  -4.689   1.151   1.956
  180   1HB   TYR  27          HB1       TYR  27  -4.607  -1.756   2.415
  181   2HB   TYR  27          HB2       TYR  27  -3.478  -0.882   1.622
  182    HD1  TYR  27           HD1      TYR  27  -2.031   0.788   2.821
  183    HD2  TYR  27           HD2      TYR  27  -4.646  -2.000   4.809
  184    HE1  TYR  27           HE1      TYR  27  -0.765   1.112   4.939
  185    HE2  TYR  27           HE2      TYR  27  -3.378  -1.706   6.916
  186    HH   TYR  27           HH       TYR  27  -1.720  -0.454   7.973
  187    H    CYS  28           HN       CYS  28  -7.163  -1.407   1.483
  188    HA   CYS  28           HA       CYS  28  -7.050  -0.963  -1.461
  189   1HB   CYS  28          HB1       CYS  28  -7.893  -3.220   0.235
  190   2HB   CYS  28          HB2       CYS  28  -8.109  -3.176  -1.383
  191    H    GLY  29           HN       GLY  29  -8.986   0.089   1.121
  192   1HA   GLY  29          HA2       GLY  29 -11.131   0.927   1.195
  193   2HA   GLY  29          HA1       GLY  29 -11.354   0.544  -0.516
  194    H    ARG  30           HN       ARG  30 -11.021  -2.120  -0.632
  195    HA   ARG  30           HA       ARG  30 -13.068  -3.443   1.038
  196   1HB   ARG  30          HB1       ARG  30 -12.888  -4.075  -1.260
  197   2HB   ARG  30          HB2       ARG  30 -11.298  -4.422  -1.124
  198   1HG   ARG  30          HG1       ARG  30 -12.575  -6.391  -1.304
  199   2HG   ARG  30          HG2       ARG  30 -11.789  -6.338   0.127
  200   1HD   ARG  30          HD1       ARG  30 -14.575  -5.644  -0.078
  201   2HD   ARG  30          HD2       ARG  30 -14.091  -7.173   0.233
  202    HE   ARG  30           HE       ARG  30 -12.768  -5.633   2.053
  203   1HH1  ARG  30          2HH2      ARG  30 -16.242  -6.087   1.651
  204   2HH1  ARG  30          1HH2      ARG  30 -16.530  -5.253   3.141
  205   1HH2  ARG  30          2HH1      ARG  30 -13.156  -4.631   3.739
  206   2HH2  ARG  30          1HH1      ARG  30 -14.770  -4.420   4.330
  Start of MODEL   23
    1   1H    VAL   1           H1       VAL   1   4.913  -1.188   3.110
    2   2H    VAL   1           H2       VAL   1   4.565   0.331   2.585
    3   3H    VAL   1           H3       VAL   1   3.348  -0.630   3.184
    4    HA   VAL   1           HA       VAL   1   4.040   1.066   4.758
    5    HB   VAL   1           HB       VAL   1   3.050  -0.987   5.580
    6   1HG1  VAL   1          1HG1      VAL   1   5.855  -2.140   5.876
    7   2HG1  VAL   1          2HG1      VAL   1   4.345  -2.858   6.453
    8   3HG1  VAL   1          3HG1      VAL   1   4.624  -2.697   4.718
    9   1HG2  VAL   1          1HG2      VAL   1   5.359  -0.075   7.342
   10   2HG2  VAL   1          2HG2      VAL   1   3.776   0.729   7.178
   11   3HG2  VAL   1          3HG2      VAL   1   3.879  -0.892   7.871
   12    H    GLY   2           HN       GLY   2   5.699   2.306   5.479
   13   1HA   GLY   2          HA2       GLY   2   7.782   3.298   5.056
   14   2HA   GLY   2          HA1       GLY   2   8.452   1.722   4.578
   15    H    GLU   3           HN       GLU   3   5.965   4.092   3.633
   16    HA   GLU   3           HA       GLU   3   4.961   4.684   1.714
   17   1HB   GLU   3          HB1       GLU   3   7.504   3.960   0.431
   18   2HB   GLU   3          HB2       GLU   3   6.328   4.879  -0.231
   19   1HG   GLU   3          HG1       GLU   3   6.764   6.625   1.236
   20   2HG   GLU   3          HG2       GLU   3   7.754   5.690   2.138
   21    H    CYS   4           HN       CYS   4   4.631   3.949  -0.689
   22    HA   CYS   4           HA       CYS   4   4.401   1.006  -1.059
   23   1HB   CYS   4          HB1       CYS   4   3.927   3.130  -3.056
   24   2HB   CYS   4          HB2       CYS   4   3.449   1.570  -3.132
   25    H    VAL   5           HN       VAL   5   6.016  -0.054  -2.201
   26    HA   VAL   5           HA       VAL   5   8.583   1.096  -1.641
   27    HB   VAL   5           HB       VAL   5   8.007  -1.508  -3.094
   28   1HG1  VAL   5          1HG1      VAL   5  10.404  -0.785  -3.179
   29   2HG1  VAL   5          2HG1      VAL   5  10.397  -0.580  -1.417
   30   3HG1  VAL   5          3HG1      VAL   5  10.195  -2.190  -2.133
   31   1HG2  VAL   5          1HG2      VAL   5   6.792  -1.534  -0.969
   32   2HG2  VAL   5          2HG2      VAL   5   8.229  -2.544  -0.824
   33   3HG2  VAL   5          3HG2      VAL   5   8.222  -0.917  -0.107
   34    H    ARG   6           HN       ARG   6   8.747   2.896  -2.939
   35    HA   ARG   6           HA       ARG   6   8.994   4.263  -4.741
   36   1HB   ARG   6          HB1       ARG   6  10.207   1.998  -6.191
   37   2HB   ARG   6          HB2       ARG   6  10.306   3.577  -6.598
   38   1HG   ARG   6          HG1       ARG   6  11.484   2.493  -4.206
   39   2HG   ARG   6          HG2       ARG   6  12.320   2.720  -5.591
   40   1HD   ARG   6          HD1       ARG   6  12.730   4.792  -5.045
   41   2HD   ARG   6          HD2       ARG   6  11.133   5.096  -4.883
   42    HE   ARG   6           HE       ARG   6  12.869   4.170  -2.744
   43   1HH1  ARG   6          2HH1      ARG   6   9.944   5.942  -3.585
   44   2HH1  ARG   6          1HH1      ARG   6   9.586   6.269  -1.923
   45   1HH2  ARG   6          2HH2      ARG   6  12.311   4.575  -0.671
   46   2HH2  ARG   6          1HH2      ARG   6  10.899   5.511  -0.307
   47    H    GLY   7           HN       GLY   7   6.616   3.212  -4.190
   48   1HA   GLY   7          HA2       GLY   7   4.528   3.696  -5.226
   49   2HA   GLY   7          HA1       GLY   7   5.217   3.373  -6.809
   50    H    ARG   8           HN       ARG   8   6.289   0.739  -5.224
   51    HA   ARG   8           HA       ARG   8   4.079  -0.869  -6.331
   52   1HB   ARG   8          HB1       ARG   8   6.906  -1.483  -5.684
   53   2HB   ARG   8          HB2       ARG   8   5.871  -2.531  -6.391
   54   1HG   ARG   8          HG1       ARG   8   5.832  -1.322  -8.351
   55   2HG   ARG   8          HG2       ARG   8   6.504  -0.014  -7.641
   56   1HD   ARG   8          HD1       ARG   8   7.918  -2.491  -8.109
   57   2HD   ARG   8          HD2       ARG   8   8.086  -1.157  -9.037
   58    HE   ARG   8           HE       ARG   8   8.586  -0.375  -6.435
   59   1HH1  ARG   8          2HH2      ARG   8  10.301  -2.394  -8.769
   60   2HH1  ARG   8          1HH2      ARG   8  11.786  -2.216  -7.896
   61   1HH2  ARG   8          2HH1      ARG   8  10.409  -0.227  -5.409
   62   2HH2  ARG   8          1HH1      ARG   8  11.846  -0.993  -5.998
   63    H    CYS   9           HN       CYS   9   3.936  -3.123  -5.445
   64    HA   CYS   9           HA       CYS   9   4.018  -3.392  -2.515
   65   1HB   CYS   9          HB1       CYS   9   1.639  -3.524  -4.258
   66   2HB   CYS   9          HB2       CYS   9   1.696  -4.406  -2.884
   67    HA   PRO  10           HA       PRO  10   4.758  -7.687  -3.867
   68   1HB   PRO  10          HB1       PRO  10   4.214  -8.994  -1.620
   69   2HB   PRO  10          HB2       PRO  10   5.571  -8.092  -1.733
   70   1HG   PRO  10          HG1       PRO  10   3.077  -7.340  -0.468
   71   2HG   PRO  10          HG2       PRO  10   4.583  -7.128   0.126
   72   1HD   PRO  10          HD1       PRO  10   3.342  -5.168  -1.103
   73   2HD   PRO  10          HD2       PRO  10   4.969  -5.300  -1.172
   74    H    SER  11           HN       SER  11   3.578  -9.637  -4.253
   75    HA   SER  11           HA       SER  11   1.176  -9.308  -5.491
   76   1HB   SER  11          HB1       SER  11   2.318 -11.838  -4.472
   77   2HB   SER  11          HB2       SER  11   1.263 -11.690  -5.711
   78    HG   SER  11           HG       SER  11   2.761 -10.695  -6.947
   79    H    GLY  12           HN       GLY  12  -0.406  -8.358  -4.251
   80   1HA   GLY  12          HA2       GLY  12  -2.652  -9.214  -3.521
   81   2HA   GLY  12          HA1       GLY  12  -1.814 -10.108  -2.255
   82    H    MET  13           HN       MET  13  -0.032  -7.365  -2.248
   83    HA   MET  13           HA       MET  13  -1.819  -5.884  -0.363
   84   1HB   MET  13          HB1       MET  13   1.049  -5.593  -1.010
   85   2HB   MET  13          HB2       MET  13   0.227  -4.556  -0.054
   86   1HG   MET  13          HG1       MET  13  -0.253  -6.446   1.402
   87   2HG   MET  13          HG2       MET  13   0.815  -7.308   0.517
   88   1HE   MET  13          HE1       MET  13   2.726  -6.852   3.878
   89   2HE   MET  13          HE2       MET  13   0.978  -7.100   3.653
   90   3HE   MET  13          HE3       MET  13   2.144  -8.037   2.685
   91    H    CYS  14           HN       CYS  14  -1.763  -3.523  -0.606
   92    HA   CYS  14           HA       CYS  14  -2.015  -2.596  -3.440
   93   1HB   CYS  14          HB1       CYS  14  -4.009  -2.196  -1.295
   94   2HB   CYS  14          HB2       CYS  14  -4.146  -1.725  -2.853
   95    H    CYS  15           HN       CYS  15  -1.602  -0.447  -3.786
   96    HA   CYS  15           HA       CYS  15  -0.194   1.044  -1.690
   97   1HB   CYS  15          HB1       CYS  15   0.651   0.899  -3.961
   98   2HB   CYS  15          HB2       CYS  15  -0.660   1.685  -4.535
   99    H    SER  16           HN       SER  16  -1.418   2.153  -0.270
  100    HA   SER  16           HA       SER  16  -4.126   3.025  -0.873
  101   1HB   SER  16          HB1       SER  16  -4.066   3.903   1.337
  102   2HB   SER  16          HB2       SER  16  -3.418   2.403   1.360
  103    HG   SER  16           HG       SER  16  -1.336   3.384   1.271
  104    H    GLN  17           HN       GLN  17  -4.915   5.195  -0.582
  105    HA   GLN  17           HA       GLN  17  -3.721   7.190  -2.216
  106   1HB   GLN  17          HB1       GLN  17  -5.499   8.543  -1.372
  107   2HB   GLN  17          HB2       GLN  17  -6.070   7.057  -1.735
  108   1HG   GLN  17          HG1       GLN  17  -5.445   7.554   0.990
  109   2HG   GLN  17          HG2       GLN  17  -6.794   8.262   0.400
  110   1HE2  GLN  17          1HE2      GLN  17  -8.713   7.151   0.827
  111   2HE2  GLN  17          2HE2      GLN  17  -8.660   5.388   0.910
  112    H1   NAL  18           HD1      NAL  18  -3.789   5.345   3.200
  113    H3   NAL  18           HD2      NAL  18  -3.380   9.387   4.111
  114    H4   NAL  18           HE2      NAL  18  -5.720   9.512   4.663
  115    H5   NAL  18           HH2      NAL  18  -7.917   8.423   4.831
  116    H6   NAL  18           HP       NAL  18  -9.297   6.469   4.573
  117    H7   NAL  18           HH1      NAL  18  -8.322   4.405   3.811
  118    H8   NAL  18           HZ1      NAL  18  -5.974   4.298   3.304
  119   1H9   NAL  18          HB1       NAL  18  -1.593   6.271   3.161
  120   2H9   NAL  18          HB2       NAL  18  -1.324   7.858   3.871
  121    H10  NAL  18           HA       NAL  18  -1.861   8.971   1.793
  122   1HN   NAL  18          HN        NAL  18  -2.981   6.366   1.020
  123    H    GLY  19           HN       GLY  19  -0.821   6.731  -0.424
  124   1HA   GLY  19          HA2       GLY  19   1.229   6.518  -1.477
  125   2HA   GLY  19          HA1       GLY  19   1.958   7.621  -0.303
  126    H    TYR  20           HN       TYR  20   0.183   4.910   0.920
  127    HA   TYR  20           HA       TYR  20   2.708   3.526   1.730
  128   1HB   TYR  20          HB1       TYR  20   0.709   4.731   3.325
  129   2HB   TYR  20          HB2       TYR  20   0.820   3.140   3.679
  130    HD1  TYR  20           HD1      TYR  20   2.099   2.618   5.567
  131    HD2  TYR  20           HD2      TYR  20   3.169   5.905   2.982
  132    HE1  TYR  20           HE1      TYR  20   4.085   3.093   6.991
  133    HE2  TYR  20           HE2      TYR  20   5.184   6.344   4.383
  134    HH   TYR  20           HH       TYR  20   5.832   4.633   7.400
  135    H    CYS  21           HN       CYS  21   2.838   1.456   1.211
  136    HA   CYS  21           HA       CYS  21   0.550   0.031   0.079
  137   1HB   CYS  21          HB1       CYS  21   2.722  -0.186  -0.854
  138   2HB   CYS  21          HB2       CYS  21   3.352  -0.746   0.545
  139    H    GLY  22           HN       GLY  22  -0.537  -1.757   0.917
  140   1HA   GLY  22          HA2       GLY  22   0.328  -3.365   3.115
  141   2HA   GLY  22          HA1       GLY  22  -0.803  -2.141   3.707
  142    H    LYS  23           HN       LYS  23  -2.146  -4.094   4.260
  143    HA   LYS  23           HA       LYS  23  -3.947  -4.761   2.021
  144   1HB   LYS  23          HB1       LYS  23  -2.324  -6.613   2.338
  145   2HB   LYS  23          HB2       LYS  23  -2.929  -6.871   3.832
  146   1HG   LYS  23          HG1       LYS  23  -4.930  -7.591   3.020
  147   2HG   LYS  23          HG2       LYS  23  -4.671  -6.913   1.557
  148   1HD   LYS  23          HD1       LYS  23  -2.968  -8.592   1.162
  149   2HD   LYS  23          HD2       LYS  23  -3.433  -9.318   2.549
  150   1HE   LYS  23          HE1       LYS  23  -4.456 -10.370   0.664
  151   2HE   LYS  23          HE2       LYS  23  -5.587  -9.715   1.644
  152   1HZ   LYS  23          HZ1       LYS  23  -5.999  -7.998   0.245
  153   2HZ   LYS  23          HZ2       LYS  23  -4.594  -8.274  -0.632
  154   3HZ   LYS  23          HZ3       LYS  23  -5.903  -9.293  -0.752
  155    H    GLY  24           HN       GLY  24  -6.037  -5.711   2.804
  156   1HA   GLY  24          HA2       GLY  24  -7.838  -5.736   4.300
  157   2HA   GLY  24          HA1       GLY  24  -6.854  -4.931   5.528
  158    HA   PRO  25           HA       PRO  25 -10.345  -2.298   3.775
  159   1HB   PRO  25          HB1       PRO  25 -10.022  -1.249   6.507
  160   2HB   PRO  25          HB2       PRO  25 -11.387  -1.388   5.623
  161   1HG   PRO  25          HG1       PRO  25 -10.864  -3.248   7.332
  162   2HG   PRO  25          HG2       PRO  25 -11.445  -3.694   5.872
  163   1HD   PRO  25          HD1       PRO  25  -8.728  -3.822   6.793
  164   2HD   PRO  25          HD2       PRO  25  -9.490  -4.865   5.794
  165    H    LYS  26           HN       LYS  26  -7.693  -0.920   5.701
  166    HA   LYS  26           HA       LYS  26  -7.723   1.665   4.554
  167   1HB   LYS  26          HB1       LYS  26  -6.502   0.484   6.622
  168   2HB   LYS  26          HB2       LYS  26  -5.219   0.629   5.621
  169   1HG   LYS  26          HG1       LYS  26  -5.235   2.493   7.012
  170   2HG   LYS  26          HG2       LYS  26  -5.641   3.000   5.513
  171   1HD   LYS  26          HD1       LYS  26  -7.852   3.260   6.090
  172   2HD   LYS  26          HD2       LYS  26  -7.673   2.382   7.455
  173   1HE   LYS  26          HE1       LYS  26  -7.865   4.656   8.022
  174   2HE   LYS  26          HE2       LYS  26  -6.362   4.137   8.395
  175   1HZ   LYS  26          HZ1       LYS  26  -6.298   6.265   7.346
  176   2HZ   LYS  26          HZ2       LYS  26  -5.512   5.131   6.447
  177   3HZ   LYS  26          HZ3       LYS  26  -7.014   5.615   6.015
  178    H    TYR  27           HN       TYR  27  -6.782  -1.082   2.904
  179    HA   TYR  27           HA       TYR  27  -5.011   0.472   1.047
  180   1HB   TYR  27          HB1       TYR  27  -4.429  -2.222   2.103
  181   2HB   TYR  27          HB2       TYR  27  -3.511  -1.380   1.046
  182    HD1  TYR  27           HD1      TYR  27  -4.321  -1.900   4.505
  183    HD2  TYR  27           HD2      TYR  27  -2.124   0.537   1.723
  184    HE1  TYR  27           HE1      TYR  27  -2.930  -1.053   6.373
  185    HE2  TYR  27           HE2      TYR  27  -0.768   1.448   3.616
  186    HH   TYR  27           HH       TYR  27  -1.214   0.367   6.974
  187    H    CYS  28           HN       CYS  28  -6.578  -2.730   1.449
  188    HA   CYS  28           HA       CYS  28  -7.019  -2.936  -1.499
  189   1HB   CYS  28          HB1       CYS  28  -6.521  -4.895   0.653
  190   2HB   CYS  28          HB2       CYS  28  -6.985  -5.327  -0.852
  191    H    GLY  29           HN       GLY  29  -8.779  -2.429   1.364
  192   1HA   GLY  29          HA2       GLY  29 -11.065  -2.808   1.882
  193   2HA   GLY  29          HA1       GLY  29 -11.258  -3.739   0.403
  194    H    ARG  30           HN       ARG  30  -9.368  -5.668   0.527
  195    HA   ARG  30           HA       ARG  30  -9.712  -7.138   3.093
  196   1HB   ARG  30          HB1       ARG  30 -10.851  -7.774   0.574
  197   2HB   ARG  30          HB2       ARG  30  -9.837  -8.977   1.014
  198   1HG   ARG  30          HG1       ARG  30 -11.755  -8.057   2.921
  199   2HG   ARG  30          HG2       ARG  30 -12.262  -9.064   1.739
  200   1HD   ARG  30          HD1       ARG  30 -11.695 -10.161   3.851
  201   2HD   ARG  30          HD2       ARG  30 -10.967 -10.797   2.535
  202    HE   ARG  30           HE       ARG  30  -9.028  -9.241   3.202
  203   1HH1  ARG  30          2HH2      ARG  30 -10.820 -11.095   5.614
  204   2HH1  ARG  30          1HH2      ARG  30  -9.481 -10.981   6.708
  205   1HH2  ARG  30          2HH1      ARG  30  -7.518  -9.118   4.523
  206   2HH2  ARG  30          1HH1      ARG  30  -7.605  -9.856   6.087
  Start of MODEL   24
    1   1H    VAL   1           H1       VAL   1   4.413   0.044   3.079
    2   2H    VAL   1           H2       VAL   1   3.256  -0.939   3.758
    3   3H    VAL   1           H3       VAL   1   4.855  -1.383   3.740
    4    HA   VAL   1           HA       VAL   1   3.705   0.854   5.257
    5    HB   VAL   1           HB       VAL   1   5.013  -1.702   6.276
    6   1HG1  VAL   1          1HG1      VAL   1   5.377   0.193   7.812
    7   2HG1  VAL   1          2HG1      VAL   1   3.644   0.607   7.744
    8   3HG1  VAL   1          3HG1      VAL   1   4.186  -0.906   8.492
    9   1HG2  VAL   1          1HG2      VAL   1   2.076  -0.852   6.243
   10   2HG2  VAL   1          2HG2      VAL   1   2.790  -2.267   5.428
   11   3HG2  VAL   1          3HG2      VAL   1   2.727  -2.210   7.182
   12    H    GLY   2           HN       GLY   2   5.233   2.276   6.214
   13   1HA   GLY   2          HA2       GLY   2   7.247   3.457   6.219
   14   2HA   GLY   2          HA1       GLY   2   8.067   2.114   5.413
   15    H    GLU   3           HN       GLU   3   6.608   1.664   3.189
   16    HA   GLU   3           HA       GLU   3   5.692   4.115   1.873
   17   1HB   GLU   3          HB1       GLU   3   8.243   3.602   1.532
   18   2HB   GLU   3          HB2       GLU   3   7.696   2.575   0.386
   19   1HG   GLU   3          HG1       GLU   3   6.698   4.330  -0.788
   20   2HG   GLU   3          HG2       GLU   3   7.048   5.382   0.412
   21    H    CYS   4           HN       CYS   4   4.820   3.524  -0.367
   22    HA   CYS   4           HA       CYS   4   4.336   0.640  -0.944
   23   1HB   CYS   4          HB1       CYS   4   3.744   2.976  -2.656
   24   2HB   CYS   4          HB2       CYS   4   3.276   1.431  -2.904
   25    H    VAL   5           HN       VAL   5   6.184  -0.301  -1.713
   26    HA   VAL   5           HA       VAL   5   8.592   1.139  -1.478
   27    HB   VAL   5           HB       VAL   5   8.194  -1.591  -2.765
   28   1HG1  VAL   5          1HG1      VAL   5  10.534  -1.988  -2.015
   29   2HG1  VAL   5          2HG1      VAL   5  10.457  -0.688  -3.203
   30   3HG1  VAL   5          3HG1      VAL   5  10.649  -0.300  -1.479
   31   1HG2  VAL   5          1HG2      VAL   5   7.232  -1.570  -0.502
   32   2HG2  VAL   5          2HG2      VAL   5   8.754  -2.460  -0.499
   33   3HG2  VAL   5          3HG2      VAL   5   8.702  -0.804   0.140
   34    H    ARG   6           HN       ARG   6   8.873   2.880  -2.785
   35    HA   ARG   6           HA       ARG   6   8.976   4.197  -4.611
   36   1HB   ARG   6          HB1       ARG   6  10.420   1.892  -5.765
   37   2HB   ARG   6          HB2       ARG   6  10.530   3.440  -6.276
   38   1HG   ARG   6          HG1       ARG   6  11.311   2.713  -3.610
   39   2HG   ARG   6          HG2       ARG   6  12.370   2.607  -4.849
   40   1HD   ARG   6          HD1       ARG   6  12.868   4.600  -3.927
   41   2HD   ARG   6          HD2       ARG   6  11.932   5.008  -5.202
   42    HE   ARG   6           HE       ARG   6  10.442   4.836  -2.735
   43   1HH1  ARG   6          2HH2      ARG   6  12.268   7.000  -4.872
   44   2HH1  ARG   6          1HH2      ARG   6  11.696   8.414  -4.052
   45   1HH2  ARG   6          2HH1      ARG   6   9.837   6.761  -1.718
   46   2HH2  ARG   6          1HH1      ARG   6  10.378   8.283  -2.343
   47    H    GLY   7           HN       GLY   7   6.576   2.876  -4.338
   48   1HA   GLY   7          HA2       GLY   7   4.577   3.119  -5.584
   49   2HA   GLY   7          HA1       GLY   7   5.443   2.885  -7.091
   50    H    ARG   8           HN       ARG   8   6.577   0.343  -5.156
   51    HA   ARG   8           HA       ARG   8   4.598  -1.507  -6.342
   52   1HB   ARG   8          HB1       ARG   8   7.340  -1.808  -5.301
   53   2HB   ARG   8          HB2       ARG   8   6.398  -3.110  -5.594
   54   1HG   ARG   8          HG1       ARG   8   7.381  -3.092  -7.541
   55   2HG   ARG   8          HG2       ARG   8   6.266  -1.954  -7.900
   56   1HD   ARG   8          HD1       ARG   8   8.793  -1.108  -6.895
   57   2HD   ARG   8          HD2       ARG   8   8.685  -1.549  -8.464
   58    HE   ARG   8           HE       ARG   8   7.990   0.928  -7.414
   59   1HH1  ARG   8          2HH2      ARG   8   6.857  -1.250  -9.957
   60   2HH1  ARG   8          1HH2      ARG   8   6.246   0.076 -10.889
   61   1HH2  ARG   8          2HH1      ARG   8   7.198   2.509  -8.642
   62   2HH2  ARG   8          1HH1      ARG   8   6.437   2.162 -10.159
   63    H    CYS   9           HN       CYS   9   4.293  -3.570  -5.105
   64    HA   CYS   9           HA       CYS   9   4.048  -3.327  -2.208
   65   1HB   CYS   9          HB1       CYS   9   1.873  -3.748  -4.107
   66   2HB   CYS   9          HB2       CYS   9   1.866  -4.691  -2.774
   67    HA   PRO  10           HA       PRO  10   5.484  -7.664  -2.551
   68   1HB   PRO  10          HB1       PRO  10   3.801  -8.027  -0.171
   69   2HB   PRO  10          HB2       PRO  10   5.349  -8.490  -0.412
   70   1HG   PRO  10          HG1       PRO  10   4.881  -6.408   1.062
   71   2HG   PRO  10          HG2       PRO  10   6.170  -6.388   0.059
   72   1HD   PRO  10          HD1       PRO  10   3.586  -5.184  -0.384
   73   2HD   PRO  10          HD2       PRO  10   5.048  -4.546  -0.735
   74    H    SER  11           HN       SER  11   4.496  -9.823  -2.735
   75    HA   SER  11           HA       SER  11   2.710 -10.149  -4.665
   76   1HB   SER  11          HB1       SER  11   3.132 -12.053  -2.448
   77   2HB   SER  11          HB2       SER  11   2.644 -12.426  -3.962
   78    HG   SER  11           HG       SER  11   4.840 -12.786  -3.772
   79    H    GLY  12           HN       GLY  12   0.802  -9.048  -4.689
   80   1HA   GLY  12          HA2       GLY  12  -1.530  -9.154  -4.615
   81   2HA   GLY  12          HA1       GLY  12  -1.448 -10.340  -3.319
   82    H    MET  13           HN       MET  13   0.473  -7.641  -2.441
   83    HA   MET  13           HA       MET  13  -1.627  -6.606  -0.634
   84   1HB   MET  13          HB1       MET  13   1.214  -5.904  -0.973
   85   2HB   MET  13          HB2       MET  13   0.219  -5.163   0.089
   86   1HG   MET  13          HG1       MET  13  -0.177  -7.351   1.087
   87   2HG   MET  13          HG2       MET  13   1.034  -7.920   0.151
   88   1HE   MET  13          HE1       MET  13   2.375  -8.968   2.126
   89   2HE   MET  13          HE2       MET  13   2.734  -8.066   3.617
   90   3HE   MET  13          HE3       MET  13   1.049  -8.460   3.201
   91    H    CYS  14           HN       CYS  14  -1.627  -4.094  -0.437
   92    HA   CYS  14           HA       CYS  14  -2.367  -2.955  -3.103
   93   1HB   CYS  14          HB1       CYS  14  -3.836  -2.719  -0.555
   94   2HB   CYS  14          HB2       CYS  14  -4.308  -2.150  -2.011
   95    H    CYS  15           HN       CYS  15  -1.705  -0.855  -3.425
   96    HA   CYS  15           HA       CYS  15  -0.222   0.554  -1.315
   97   1HB   CYS  15          HB1       CYS  15   0.538   0.594  -3.595
   98   2HB   CYS  15          HB2       CYS  15  -0.830   1.338  -4.089
   99    H    SER  16           HN       SER  16  -1.089   2.018   0.052
  100    HA   SER  16           HA       SER  16  -3.867   2.886  -0.230
  101   1HB   SER  16          HB1       SER  16  -3.513   3.930   1.859
  102   2HB   SER  16          HB2       SER  16  -2.983   2.387   1.926
  103    HG   SER  16           HG       SER  16  -0.996   2.936   2.141
  104    H    GLN  17           HN       GLN  17  -4.608   5.182  -0.385
  105    HA   GLN  17           HA       GLN  17  -3.120   6.947  -2.011
  106   1HB   GLN  17          HB1       GLN  17  -4.852   8.479  -1.249
  107   2HB   GLN  17          HB2       GLN  17  -5.498   7.052  -1.710
  108   1HG   GLN  17          HG1       GLN  17  -5.869   6.426   0.501
  109   2HG   GLN  17          HG2       GLN  17  -5.015   7.703   1.055
  110   1HE2  GLN  17          1HE2      GLN  17  -8.253   6.722  -0.328
  111   2HE2  GLN  17          2HE2      GLN  17  -8.818   8.246   0.287
  112    H1   NAL  18           HD1      NAL  18  -4.115   5.405   3.407
  113    H3   NAL  18           HD2      NAL  18  -3.269   9.392   4.258
  114    H4   NAL  18           HE2      NAL  18  -5.620   9.873   4.397
  115    H5   NAL  18           HH2      NAL  18  -7.948   9.143   4.122
  116    H6   NAL  18           HP       NAL  18  -9.540   7.432   3.560
  117    H7   NAL  18           HH1      NAL  18  -8.777   5.220   3.004
  118    H8   NAL  18           HZ1      NAL  18  -6.425   4.717   3.020
  119   1H9   NAL  18          HB2       NAL  18  -1.838   6.121   3.604
  120   2H9   NAL  18          HB1       NAL  18  -1.481   7.566   4.277
  121    H10  NAL  18           HA       NAL  18  -1.564   8.709   2.193
  122   1HN   NAL  18          HN        NAL  18  -2.887   6.255   1.361
  123    H    GLY  19           HN       GLY  19  -0.477   6.330   0.172
  124   1HA   GLY  19          HA2       GLY  19   1.630   6.191  -0.747
  125   2HA   GLY  19          HA1       GLY  19   2.276   7.199   0.550
  126    H    TYR  20           HN       TYR  20   0.519   4.518   1.726
  127    HA   TYR  20           HA       TYR  20   3.031   2.950   2.258
  128   1HB   TYR  20          HB1       TYR  20   0.793   3.674   3.973
  129   2HB   TYR  20          HB2       TYR  20   1.461   2.199   4.186
  130    HD1  TYR  20           HD1      TYR  20   2.172   2.453   6.448
  131    HD2  TYR  20           HD2      TYR  20   3.393   5.244   3.378
  132    HE1  TYR  20           HE1      TYR  20   3.914   3.406   7.967
  133    HE2  TYR  20           HE2      TYR  20   5.104   6.153   4.869
  134    HH   TYR  20           HH       TYR  20   6.112   6.001   6.913
  135    H    CYS  21           HN       CYS  21   3.058   0.917   1.438
  136    HA   CYS  21           HA       CYS  21   0.656  -0.333   0.348
  137   1HB   CYS  21          HB1       CYS  21   2.861  -0.743  -0.536
  138   2HB   CYS  21          HB2       CYS  21   3.347  -1.434   0.862
  139    H    GLY  22           HN       GLY  22  -0.482  -2.134   1.143
  140   1HA   GLY  22          HA2       GLY  22   0.239  -3.711   3.402
  141   2HA   GLY  22          HA1       GLY  22  -0.891  -2.454   3.929
  142    H    LYS  23           HN       LYS  23  -2.410  -4.203   4.423
  143    HA   LYS  23           HA       LYS  23  -4.068  -4.861   2.091
  144   1HB   LYS  23          HB1       LYS  23  -2.525  -6.801   2.771
  145   2HB   LYS  23          HB2       LYS  23  -3.500  -6.984   4.069
  146   1HG   LYS  23          HG1       LYS  23  -4.307  -8.486   2.553
  147   2HG   LYS  23          HG2       LYS  23  -5.349  -7.232   2.457
  148   1HD   LYS  23          HD1       LYS  23  -4.066  -6.449   0.523
  149   2HD   LYS  23          HD2       LYS  23  -3.271  -7.875   0.561
  150   1HE   LYS  23          HE1       LYS  23  -5.226  -9.059   0.099
  151   2HE   LYS  23          HE2       LYS  23  -6.142  -7.722   0.304
  152   1HZ   LYS  23          HZ1       LYS  23  -5.841  -8.263  -2.013
  153   2HZ   LYS  23          HZ2       LYS  23  -5.238  -6.773  -1.641
  154   3HZ   LYS  23          HZ3       LYS  23  -4.219  -8.039  -1.816
  155    H    GLY  24           HN       GLY  24  -6.264  -5.257   2.651
  156   1HA   GLY  24          HA2       GLY  24  -8.123  -5.264   4.196
  157   2HA   GLY  24          HA1       GLY  24  -7.151  -4.365   5.365
  158    HA   PRO  25           HA       PRO  25 -10.284  -1.798   2.847
  159   1HB   PRO  25          HB1       PRO  25 -10.587  -0.637   5.540
  160   2HB   PRO  25          HB2       PRO  25 -11.721  -0.849   4.384
  161   1HG   PRO  25          HG1       PRO  25 -11.589  -2.588   6.290
  162   2HG   PRO  25          HG2       PRO  25 -11.851  -3.129   4.771
  163   1HD   PRO  25          HD1       PRO  25  -9.380  -3.163   6.244
  164   2HD   PRO  25          HD2       PRO  25  -9.935  -4.297   5.208
  165    H    LYS  26           HN       LYS  26  -8.218  -0.391   5.383
  166    HA   LYS  26           HA       LYS  26  -7.793   2.166   4.279
  167   1HB   LYS  26          HB1       LYS  26  -6.173   0.486   6.101
  168   2HB   LYS  26          HB2       LYS  26  -5.757   2.027   5.754
  169   1HG   LYS  26          HG1       LYS  26  -8.386   1.685   6.730
  170   2HG   LYS  26          HG2       LYS  26  -7.201   1.401   7.817
  171   1HD   LYS  26          HD1       LYS  26  -7.920   3.628   8.033
  172   2HD   LYS  26          HD2       LYS  26  -6.382   3.619   7.481
  173   1HE   LYS  26          HE1       LYS  26  -7.166   4.033   5.279
  174   2HE   LYS  26          HE2       LYS  26  -8.706   4.032   5.824
  175   1HZ   LYS  26          HZ1       LYS  26  -8.305   5.975   7.066
  176   2HZ   LYS  26          HZ2       LYS  26  -6.720   5.948   6.616
  177   3HZ   LYS  26          HZ3       LYS  26  -7.880   6.231   5.492
  178    H    TYR  27           HN       TYR  27  -6.606  -0.716   2.976
  179    HA   TYR  27           HA       TYR  27  -4.474   0.701   1.425
  180   1HB   TYR  27          HB1       TYR  27  -4.585  -2.094   2.353
  181   2HB   TYR  27          HB2       TYR  27  -3.428  -1.483   1.375
  182    HD1  TYR  27           HD1      TYR  27  -1.850   0.274   2.157
  183    HD2  TYR  27           HD2      TYR  27  -4.528  -1.857   4.768
  184    HE1  TYR  27           HE1      TYR  27  -0.515   1.008   4.138
  185    HE2  TYR  27           HE2      TYR  27  -3.184  -1.161   6.733
  186    HH   TYR  27           HH       TYR  27  -1.347   0.035   7.458
  187    H    CYS  28           HN       CYS  28  -7.049  -1.806   1.241
  188    HA   CYS  28           HA       CYS  28  -6.819  -1.852  -1.710
  189   1HB   CYS  28          HB1       CYS  28  -8.203  -3.650   0.164
  190   2HB   CYS  28          HB2       CYS  28  -7.919  -3.925  -1.420
  191    H    GLY  29           HN       GLY  29  -8.999  -0.516   0.677
  192   1HA   GLY  29          HA2       GLY  29 -11.188  -0.225  -1.341
  193   2HA   GLY  29          HA1       GLY  29 -11.515  -0.804   0.302
  194    H    ARG  30           HN       ARG  30  -9.896   1.841  -1.461
  195    HA   ARG  30           HA       ARG  30 -10.434   3.938   0.506
  196   1HB   ARG  30          HB1       ARG  30  -8.037   4.101   0.941
  197   2HB   ARG  30          HB2       ARG  30  -8.616   2.678   1.495
  198   1HG   ARG  30          HG1       ARG  30  -6.695   2.008   0.559
  199   2HG   ARG  30          HG2       ARG  30  -7.733   1.767  -0.679
  200   1HD   ARG  30          HD1       ARG  30  -7.042   4.034  -1.439
  201   2HD   ARG  30          HD2       ARG  30  -5.777   3.846  -0.422
  202    HE   ARG  30           HE       ARG  30  -4.835   2.183  -1.792
  203   1HH1  ARG  30          2HH2      ARG  30  -7.935   3.190  -3.205
  204   2HH1  ARG  30          1HH2      ARG  30  -7.475   2.509  -4.730
  205   1HH2  ARG  30          2HH1      ARG  30  -4.345   1.506  -3.701
  206   2HH2  ARG  30          1HH1      ARG  30  -5.483   1.575  -5.004
  Start of MODEL   25
    1   1H    VAL   1           H1       VAL   1   4.442  -1.202   3.655
    2   2H    VAL   1           H2       VAL   1   4.023   0.224   2.979
    3   3H    VAL   1           H3       VAL   1   2.842  -0.753   3.620
    4    HA   VAL   1           HA       VAL   1   3.189   0.992   5.158
    5    HB   VAL   1           HB       VAL   1   4.664  -1.475   6.167
    6   1HG1  VAL   1          1HG1      VAL   1   4.874   0.429   7.717
    7   2HG1  VAL   1          2HG1      VAL   1   3.118   0.720   7.633
    8   3HG1  VAL   1          3HG1      VAL   1   3.758  -0.756   8.379
    9   1HG2  VAL   1          1HG2      VAL   1   1.674  -0.847   6.129
   10   2HG2  VAL   1          2HG2      VAL   1   2.488  -2.180   5.275
   11   3HG2  VAL   1          3HG2      VAL   1   2.425  -2.177   7.032
   12    H    GLY   2           HN       GLY   2   4.591   2.542   6.072
   13   1HA   GLY   2          HA2       GLY   2   6.526   3.836   6.157
   14   2HA   GLY   2          HA1       GLY   2   7.463   2.528   5.424
   15    H    GLU   3           HN       GLU   3   6.122   1.969   3.155
   16    HA   GLU   3           HA       GLU   3   5.141   4.304   1.706
   17   1HB   GLU   3          HB1       GLU   3   7.735   3.978   1.498
   18   2HB   GLU   3          HB2       GLU   3   7.320   2.864   0.378
   19   1HG   GLU   3          HG1       GLU   3   6.097   4.576  -0.797
   20   2HG   GLU   3          HG2       GLU   3   6.662   5.669   0.277
   21    H    CYS   4           HN       CYS   4   4.487   3.488  -0.581
   22    HA   CYS   4           HA       CYS   4   4.515   0.528  -0.997
   23   1HB   CYS   4          HB1       CYS   4   3.049   2.599  -2.292
   24   2HB   CYS   4          HB2       CYS   4   4.030   1.852  -3.363
   25    H    VAL   5           HN       VAL   5   6.534  -0.123  -1.356
   26    HA   VAL   5           HA       VAL   5   8.778   1.628  -1.312
   27    HB   VAL   5           HB       VAL   5   8.657  -1.312  -2.070
   28   1HG1  VAL   5          1HG1      VAL   5  11.028  -1.324  -1.304
   29   2HG1  VAL   5          2HG1      VAL   5  10.811  -0.281  -2.709
   30   3HG1  VAL   5          3HG1      VAL   5  10.964   0.438  -1.088
   31   1HG2  VAL   5          1HG2      VAL   5   7.700  -0.976   0.172
   32   2HG2  VAL   5          2HG2      VAL   5   9.306  -1.689   0.312
   33   3HG2  VAL   5          3HG2      VAL   5   9.082   0.042   0.635
   34    H    ARG   6           HN       ARG   6   8.975   3.037  -2.917
   35    HA   ARG   6           HA       ARG   6   9.081   3.984  -5.046
   36   1HB   ARG   6          HB1       ARG   6  10.331   1.444  -5.889
   37   2HB   ARG   6          HB2       ARG   6  10.444   2.880  -6.660
   38   1HG   ARG   6          HG1       ARG   6  11.532   2.611  -4.039
   39   2HG   ARG   6          HG2       ARG   6  12.386   2.068  -5.320
   40   1HD   ARG   6          HD1       ARG   6  13.120   4.216  -4.632
   41   2HD   ARG   6          HD2       ARG   6  12.574   4.236  -6.172
   42    HE   ARG   6           HE       ARG   6  11.181   5.900  -5.622
   43   1HH1  ARG   6          2HH2      ARG   6  11.682   4.033  -2.689
   44   2HH1  ARG   6          1HH2      ARG   6  10.524   4.973  -1.808
   45   1HH2  ARG   6          2HH1      ARG   6   9.605   6.939  -4.462
   46   2HH2  ARG   6          1HH1      ARG   6   9.380   6.571  -2.784
   47    H    GLY   7           HN       GLY   7   6.684   2.733  -4.298
   48   1HA   GLY   7          HA2       GLY   7   4.581   2.761  -5.338
   49   2HA   GLY   7          HA1       GLY   7   5.305   2.510  -6.906
   50    H    ARG   8           HN       ARG   8   6.629   0.151  -4.753
   51    HA   ARG   8           HA       ARG   8   4.638  -1.872  -5.657
   52   1HB   ARG   8          HB1       ARG   8   7.587  -1.905  -5.443
   53   2HB   ARG   8          HB2       ARG   8   6.710  -3.272  -5.618
   54   1HG   ARG   8          HG1       ARG   8   7.391  -2.876  -7.715
   55   2HG   ARG   8          HG2       ARG   8   5.888  -2.235  -7.717
   56   1HD   ARG   8          HD1       ARG   8   6.723  -0.078  -7.675
   57   2HD   ARG   8          HD2       ARG   8   8.236  -0.607  -7.361
   58    HE   ARG   8           HE       ARG   8   7.542  -1.757  -9.737
   59   1HH1  ARG   8          2HH2      ARG   8   8.117   1.571  -8.689
   60   2HH1  ARG   8          1HH2      ARG   8   8.571   2.063 -10.286
   61   1HH2  ARG   8          2HH1      ARG   8   8.147  -1.018 -11.732
   62   2HH2  ARG   8          1HH1      ARG   8   8.588   0.642 -11.957
   63    H    CYS   9           HN       CYS   9   4.617  -3.865  -4.420
   64    HA   CYS   9           HA       CYS   9   5.950  -4.213  -1.963
   65   1HB   CYS   9          HB1       CYS   9   3.216  -3.261  -1.821
   66   2HB   CYS   9          HB2       CYS   9   3.504  -4.604  -0.938
   67    HA   PRO  10           HA       PRO  10   5.260  -8.533  -2.896
   68   1HB   PRO  10          HB1       PRO  10   3.635  -8.781  -0.440
   69   2HB   PRO  10          HB2       PRO  10   4.774  -9.801  -1.014
   70   1HG   PRO  10          HG1       PRO  10   5.462  -8.146   0.843
   71   2HG   PRO  10          HG2       PRO  10   6.508  -8.391  -0.387
   72   1HD   PRO  10          HD1       PRO  10   4.731  -6.159  -0.013
   73   2HD   PRO  10          HD2       PRO  10   6.244  -6.132  -0.629
   74    H    SER  11           HN       SER  11   3.920  -9.659  -4.201
   75    HA   SER  11           HA       SER  11   1.693  -8.448  -5.369
   76   1HB   SER  11          HB1       SER  11   1.549 -10.542  -6.562
   77   2HB   SER  11          HB2       SER  11   3.109 -10.072  -6.452
   78    HG   SER  11           HG       SER  11   1.936 -11.799  -4.671
   79    H    GLY  12           HN       GLY  12   0.021  -7.955  -4.051
   80   1HA   GLY  12          HA2       GLY  12  -2.273  -9.089  -3.585
   81   2HA   GLY  12          HA1       GLY  12  -1.342 -10.071  -2.448
   82    H    MET  13           HN       MET  13   0.423  -7.517  -1.959
   83    HA   MET  13           HA       MET  13  -1.398  -5.988  -0.181
   84   1HB   MET  13          HB1       MET  13   1.475  -5.588  -0.746
   85   2HB   MET  13          HB2       MET  13   0.596  -4.836   0.407
   86   1HG   MET  13          HG1       MET  13   0.315  -6.948   1.508
   87   2HG   MET  13          HG2       MET  13   1.301  -7.625   0.396
   88   1HE   MET  13          HE1       MET  13   2.555  -4.908   3.825
   89   2HE   MET  13          HE2       MET  13   1.445  -4.351   2.557
   90   3HE   MET  13          HE3       MET  13   0.970  -5.690   3.630
   91    H    CYS  14           HN       CYS  14  -1.483  -3.707  -0.483
   92    HA   CYS  14           HA       CYS  14  -1.491  -2.804  -3.343
   93   1HB   CYS  14          HB1       CYS  14  -3.787  -2.828  -1.470
   94   2HB   CYS  14          HB2       CYS  14  -3.815  -2.290  -3.012
   95    H    CYS  15           HN       CYS  15  -1.231  -0.568  -3.627
   96    HA   CYS  15           HA       CYS  15  -0.240   0.993  -1.422
   97   1HB   CYS  15          HB1       CYS  15  -1.003   1.864  -4.133
   98   2HB   CYS  15          HB2       CYS  15   0.002   2.635  -3.102
   99    H    SER  16           HN       SER  16  -1.104   2.919  -0.585
  100    HA   SER  16           HA       SER  16  -4.037   3.375  -0.926
  101   1HB   SER  16          HB1       SER  16  -4.072   3.912   1.401
  102   2HB   SER  16          HB2       SER  16  -3.496   2.396   1.211
  103    HG   SER  16           HG       SER  16  -1.438   3.054   1.564
  104    H    GLN  17           HN       GLN  17  -4.802   5.493  -0.266
  105    HA   GLN  17           HA       GLN  17  -3.553   7.679  -1.536
  106   1HB   GLN  17          HB1       GLN  17  -5.281   8.927  -0.497
  107   2HB   GLN  17          HB2       GLN  17  -5.906   7.491  -0.961
  108   1HG   GLN  17          HG1       GLN  17  -5.687   6.761   1.364
  109   2HG   GLN  17          HG2       GLN  17  -5.332   8.310   1.744
  110   1HE2  GLN  17          1HE2      GLN  17  -7.822   6.183   1.906
  111   2HE2  GLN  17          2HE2      GLN  17  -9.104   7.360   1.591
  112    H1   NAL  18           HD1      NAL  18  -3.680   5.115   3.525
  113    H3   NAL  18           HD2      NAL  18  -2.927   8.898   5.098
  114    H4   NAL  18           HE2      NAL  18  -5.241   9.115   5.716
  115    H5   NAL  18           HH2      NAL  18  -7.520   8.205   5.737
  116    H6   NAL  18           HP       NAL  18  -9.070   6.466   5.140
  117    H7   NAL  18           HH1      NAL  18  -8.285   4.489   4.015
  118    H8   NAL  18           HZ1      NAL  18  -5.950   4.246   3.499
  119   1H9   NAL  18          HB1       NAL  18  -1.407   5.866   3.601
  120   2H9   NAL  18          HB2       NAL  18  -1.010   7.308   4.529
  121    H10  NAL  18           HA       NAL  18  -1.523   8.756   2.655
  122   1HN   NAL  18          HN        NAL  18  -2.827   6.367   1.559
  123    H    GLY  19           HN       GLY  19  -0.669   6.795   0.119
  124   1HA   GLY  19          HA2       GLY  19   1.330   6.540  -1.004
  125   2HA   GLY  19          HA1       GLY  19   2.180   7.401   0.285
  126    H    TYR  20           HN       TYR  20   0.235   4.824   1.436
  127    HA   TYR  20           HA       TYR  20   2.690   3.205   2.041
  128   1HB   TYR  20          HB1       TYR  20   0.329   3.942   3.585
  129   2HB   TYR  20          HB2       TYR  20   1.001   2.482   3.874
  130    HD1  TYR  20           HD1      TYR  20   2.838   5.619   3.161
  131    HD2  TYR  20           HD2      TYR  20   1.650   2.711   6.136
  132    HE1  TYR  20           HE1      TYR  20   4.443   6.586   4.735
  133    HE2  TYR  20           HE2      TYR  20   3.279   3.727   7.740
  134    HH   TYR  20           HH       TYR  20   5.383   6.444   6.813
  135    H    CYS  21           HN       CYS  21   2.729   1.076   1.403
  136    HA   CYS  21           HA       CYS  21   0.337  -0.130   0.263
  137   1HB   CYS  21          HB1       CYS  21   1.691  -1.686  -0.472
  138   2HB   CYS  21          HB2       CYS  21   2.842  -0.562  -0.188
  139    H    GLY  22           HN       GLY  22  -0.853  -1.851   1.048
  140   1HA   GLY  22          HA2       GLY  22  -0.327  -3.287   3.511
  141   2HA   GLY  22          HA1       GLY  22  -1.540  -2.026   3.741
  142    H    LYS  23           HN       LYS  23  -2.983  -3.830   4.240
  143    HA   LYS  23           HA       LYS  23  -4.483  -4.712   1.866
  144   1HB   LYS  23          HB1       LYS  23  -3.539  -6.572   3.974
  145   2HB   LYS  23          HB2       LYS  23  -4.805  -6.914   3.000
  146   1HG   LYS  23          HG1       LYS  23  -3.233  -6.505   1.121
  147   2HG   LYS  23          HG2       LYS  23  -2.051  -6.629   2.241
  148   1HD   LYS  23          HD1       LYS  23  -2.271  -8.687   1.168
  149   2HD   LYS  23          HD2       LYS  23  -2.763  -8.853   2.717
  150   1HE   LYS  23          HE1       LYS  23  -4.157  -9.994   1.076
  151   2HE   LYS  23          HE2       LYS  23  -4.972  -9.010   2.094
  152   1HZ   LYS  23          HZ1       LYS  23  -5.528  -8.899  -0.324
  153   2HZ   LYS  23          HZ2       LYS  23  -5.431  -7.509   0.519
  154   3HZ   LYS  23          HZ3       LYS  23  -4.139  -8.004  -0.446
  155    H    GLY  24           HN       GLY  24  -6.665  -5.435   2.468
  156   1HA   GLY  24          HA2       GLY  24  -8.626  -5.267   3.775
  157   2HA   GLY  24          HA1       GLY  24  -7.735  -4.428   5.045
  158    HA   PRO  25           HA       PRO  25 -10.852  -1.786   2.682
  159   1HB   PRO  25          HB1       PRO  25 -10.993  -0.614   5.380
  160   2HB   PRO  25          HB2       PRO  25 -12.191  -0.814   4.288
  161   1HG   PRO  25          HG1       PRO  25 -11.971  -2.566   6.169
  162   2HG   PRO  25          HG2       PRO  25 -12.299  -3.102   4.661
  163   1HD   PRO  25          HD1       PRO  25  -9.768  -3.133   6.022
  164   2HD   PRO  25          HD2       PRO  25 -10.363  -4.263   5.004
  165    H    LYS  26           HN       LYS  26  -8.262  -0.550   4.772
  166    HA   LYS  26           HA       LYS  26  -8.196   2.097   3.589
  167   1HB   LYS  26          HB1       LYS  26  -6.353   0.603   5.358
  168   2HB   LYS  26          HB2       LYS  26  -6.039   2.128   4.863
  169   1HG   LYS  26          HG1       LYS  26  -8.052   2.870   5.917
  170   2HG   LYS  26          HG2       LYS  26  -8.327   1.347   6.441
  171   1HD   LYS  26          HD1       LYS  26  -7.428   2.546   8.223
  172   2HD   LYS  26          HD2       LYS  26  -6.300   1.472   7.731
  173   1HE   LYS  26          HE1       LYS  26  -5.202   3.468   8.165
  174   2HE   LYS  26          HE2       LYS  26  -5.201   3.266   6.545
  175   1HZ   LYS  26          HZ1       LYS  26  -6.913   4.823   6.295
  176   2HZ   LYS  26          HZ2       LYS  26  -7.074   4.947   7.930
  177   3HZ   LYS  26          HZ3       LYS  26  -5.722   5.506   7.181
  178    H    TYR  27           HN       TYR  27  -7.144  -0.834   2.275
  179    HA   TYR  27           HA       TYR  27  -5.091   0.529   0.548
  180   1HB   TYR  27          HB1       TYR  27  -4.816  -2.075   1.920
  181   2HB   TYR  27          HB2       TYR  27  -3.714  -1.403   0.920
  182    HD1  TYR  27           HD1      TYR  27  -2.292   0.491   1.585
  183    HD2  TYR  27           HD2      TYR  27  -5.032  -1.468   4.262
  184    HE1  TYR  27           HE1      TYR  27  -1.160   1.555   3.549
  185    HE2  TYR  27           HE2      TYR  27  -3.870  -0.469   6.209
  186    HH   TYR  27           HH       TYR  27  -2.078   0.824   6.900
  187    H    CYS  28           HN       CYS  28  -7.035  -2.479   0.920
  188    HA   CYS  28           HA       CYS  28  -7.312  -2.597  -2.040
  189   1HB   CYS  28          HB1       CYS  28  -5.480  -4.094  -0.754
  190   2HB   CYS  28          HB2       CYS  28  -6.722  -5.145  -0.899
  191    H    GLY  29           HN       GLY  29  -9.052  -2.550   0.738
  192   1HA   GLY  29          HA2       GLY  29 -11.267  -3.233   1.215
  193   2HA   GLY  29          HA1       GLY  29 -11.290  -4.210  -0.247
  194    H    ARG  30           HN       ARG  30  -9.116  -5.827   0.050
  195    HA   ARG  30           HA       ARG  30  -9.482  -7.334   2.599
  196   1HB   ARG  30          HB1       ARG  30 -10.067  -8.159  -0.075
  197   2HB   ARG  30          HB2       ARG  30  -9.003  -9.184   0.621
  198   1HG   ARG  30          HG1       ARG  30 -11.347  -8.484   2.095
  199   2HG   ARG  30          HG2       ARG  30 -11.501  -9.578   0.892
  200   1HD   ARG  30          HD1       ARG  30 -11.168 -10.486   3.173
  201   2HD   ARG  30          HD2       ARG  30 -10.240 -11.131   1.994
  202    HE   ARG  30           HE       ARG  30  -8.505  -9.419   2.750
  203   1HH1  ARG  30          2HH2      ARG  30 -10.505 -11.078   5.148
  204   2HH1  ARG  30          1HH2      ARG  30  -9.356 -10.691   6.385
  205   1HH2  ARG  30          2HH1      ARG  30  -7.224  -8.978   4.236
  206   2HH2  ARG  30          1HH1      ARG  30  -7.493  -9.497   5.866
  Start of MODEL   26
    1   1H    VAL   1           H1       VAL   1   3.491  -0.584   3.123
    2   2H    VAL   1           H2       VAL   1   4.626  -1.765   3.009
    3   3H    VAL   1           H3       VAL   1   5.020  -0.176   2.691
    4    HA   VAL   1           HA       VAL   1   3.946  -1.064   5.274
    5    HB   VAL   1           HB       VAL   1   6.930  -0.743   4.855
    6   1HG1  VAL   1          1HG1      VAL   1   7.000  -1.959   7.010
    7   2HG1  VAL   1          2HG1      VAL   1   6.003  -0.518   7.202
    8   3HG1  VAL   1          3HG1      VAL   1   5.233  -2.101   7.016
    9   1HG2  VAL   1          1HG2      VAL   1   7.040  -3.241   5.003
   10   2HG2  VAL   1          2HG2      VAL   1   5.284  -3.314   4.784
   11   3HG2  VAL   1          3HG2      VAL   1   6.344  -2.683   3.490
   12    H    GLY   2           HN       GLY   2   6.528   0.998   5.888
   13   1HA   GLY   2          HA2       GLY   2   4.963   3.397   6.129
   14   2HA   GLY   2          HA1       GLY   2   6.702   3.233   6.339
   15    H    GLU   3           HN       GLU   3   5.204   2.257   3.385
   16    HA   GLU   3           HA       GLU   3   5.425   4.474   1.722
   17   1HB   GLU   3          HB1       GLU   3   7.919   3.814   2.222
   18   2HB   GLU   3          HB2       GLU   3   7.659   2.661   1.095
   19   1HG   GLU   3          HG1       GLU   3   6.876   4.503  -0.365
   20   2HG   GLU   3          HG2       GLU   3   7.568   5.510   0.718
   21    H    CYS   4           HN       CYS   4   4.995   3.808  -0.514
   22    HA   CYS   4           HA       CYS   4   4.577   0.924  -1.155
   23   1HB   CYS   4          HB1       CYS   4   4.033   3.269  -2.871
   24   2HB   CYS   4          HB2       CYS   4   3.532   1.731  -3.103
   25    H    VAL   5           HN       VAL   5   6.394  -0.054  -1.933
   26    HA   VAL   5           HA       VAL   5   8.855   1.445  -1.837
   27    HB   VAL   5           HB       VAL   5   8.397  -1.443  -2.680
   28   1HG1  VAL   5          1HG1      VAL   5  10.920   0.027  -1.773
   29   2HG1  VAL   5          2HG1      VAL   5  10.787  -1.727  -2.022
   30   3HG1  VAL   5          3HG1      VAL   5  10.619  -0.636  -3.399
   31   1HG2  VAL   5          1HG2      VAL   5   7.585  -1.055  -0.385
   32   2HG2  VAL   5          2HG2      VAL   5   9.102  -1.955  -0.341
   33   3HG2  VAL   5          3HG2      VAL   5   9.096  -0.216   0.028
   34    H    ARG   6           HN       ARG   6   9.283   2.862  -3.423
   35    HA   ARG   6           HA       ARG   6   9.334   3.910  -5.465
   36   1HB   ARG   6          HB1       ARG   6   9.900   1.325  -6.744
   37   2HB   ARG   6          HB2       ARG   6  10.338   2.816  -7.247
   38   1HG   ARG   6          HG1       ARG   6  11.518   1.406  -5.044
   39   2HG   ARG   6          HG2       ARG   6  12.208   1.609  -6.510
   40   1HD   ARG   6          HD1       ARG   6  13.176   3.423  -5.795
   41   2HD   ARG   6          HD2       ARG   6  11.715   4.095  -5.511
   42    HE   ARG   6           HE       ARG   6  13.281   2.610  -3.567
   43   1HH1  ARG   6          2HH2      ARG   6  10.729   4.974  -4.057
   44   2HH1  ARG   6          1HH2      ARG   6  10.270   4.931  -2.387
   45   1HH2  ARG   6          2HH1      ARG   6  12.516   2.493  -1.493
   46   2HH2  ARG   6          1HH1      ARG   6  11.256   3.561  -0.973
   47    H    GLY   7           HN       GLY   7   6.820   2.970  -4.463
   48   1HA   GLY   7          HA2       GLY   7   4.621   3.260  -5.220
   49   2HA   GLY   7          HA1       GLY   7   5.136   3.064  -6.889
   50    H    ARG   8           HN       ARG   8   6.560   0.408  -5.413
   51    HA   ARG   8           HA       ARG   8   4.365  -1.326  -6.339
   52   1HB   ARG   8          HB1       ARG   8   7.231  -1.760  -5.765
   53   2HB   ARG   8          HB2       ARG   8   6.211  -2.997  -6.076
   54   1HG   ARG   8          HG1       ARG   8   7.293  -2.584  -8.043
   55   2HG   ARG   8          HG2       ARG   8   5.787  -1.983  -8.236
   56   1HD   ARG   8          HD1       ARG   8   6.564   0.199  -8.075
   57   2HD   ARG   8          HD2       ARG   8   8.049  -0.309  -7.622
   58    HE   ARG   8           HE       ARG   8   7.681  -1.475 -10.030
   59   1HH1  ARG   8          2HH2      ARG   8   7.814   1.915  -9.029
   60   2HH1  ARG   8          1HH2      ARG   8   8.308   2.425 -10.609
   61   1HH2  ARG   8          2HH1      ARG   8   8.308  -0.708 -12.002
   62   2HH2  ARG   8          1HH1      ARG   8   8.579   0.985 -12.241
   63    H    CYS   9           HN       CYS   9   4.282  -3.502  -5.138
   64    HA   CYS   9           HA       CYS   9   3.984  -3.144  -2.241
   65   1HB   CYS   9          HB1       CYS   9   1.912  -3.443  -4.277
   66   2HB   CYS   9          HB2       CYS   9   1.684  -4.216  -2.856
   67    HA   PRO  10           HA       PRO  10   4.966  -7.620  -2.207
   68   1HB   PRO  10          HB1       PRO  10   3.287  -7.586   0.191
   69   2HB   PRO  10          HB2       PRO  10   4.792  -8.190  -0.002
   70   1HG   PRO  10          HG1       PRO  10   4.477  -5.937   1.252
   71   2HG   PRO  10          HG2       PRO  10   5.778  -6.138   0.285
   72   1HD   PRO  10          HD1       PRO  10   3.338  -4.740  -0.324
   73   2HD   PRO  10          HD2       PRO  10   4.859  -4.309  -0.736
   74    H    SER  11           HN       SER  11   3.633  -9.684  -1.630
   75    HA   SER  11           HA       SER  11   2.050 -10.520  -3.535
   76   1HB   SER  11          HB1       SER  11   1.793 -11.399  -0.731
   77   2HB   SER  11          HB2       SER  11   1.470 -12.289  -2.062
   78    HG   SER  11           HG       SER  11   3.512 -12.799  -1.323
   79    H    GLY  12           HN       GLY  12   0.497  -9.140  -4.315
   80   1HA   GLY  12          HA2       GLY  12  -1.623  -8.331  -4.673
   81   2HA   GLY  12          HA1       GLY  12  -2.217  -9.547  -3.540
   82    H    MET  13           HN       MET  13   0.123  -7.027  -2.631
   83    HA   MET  13           HA       MET  13  -1.859  -5.747  -0.818
   84   1HB   MET  13          HB1       MET  13   1.072  -5.495  -1.091
   85   2HB   MET  13          HB2       MET  13   0.181  -4.537  -0.114
   86   1HG   MET  13          HG1       MET  13  -0.623  -6.648   0.911
   87   2HG   MET  13          HG2       MET  13   0.646  -7.351   0.160
   88   1HE   MET  13          HE1       MET  13   1.825  -7.428   3.854
   89   2HE   MET  13          HE2       MET  13   0.173  -7.669   3.245
   90   3HE   MET  13          HE3       MET  13   1.553  -8.399   2.390
   91    H    CYS  14           HN       CYS  14  -1.622  -3.325  -0.728
   92    HA   CYS  14           HA       CYS  14  -1.964  -2.148  -3.432
   93   1HB   CYS  14          HB1       CYS  14  -4.094  -1.344  -1.996
   94   2HB   CYS  14          HB2       CYS  14  -4.108  -2.496  -3.154
   95    H    CYS  15           HN       CYS  15  -1.737   0.040  -3.576
   96    HA   CYS  15           HA       CYS  15  -0.194   1.300  -1.422
   97   1HB   CYS  15          HB1       CYS  15   0.518   1.291  -3.761
   98   2HB   CYS  15          HB2       CYS  15  -0.750   2.240  -4.161
   99    H    SER  16           HN       SER  16  -1.232   2.458   0.108
  100    HA   SER  16           HA       SER  16  -3.958   3.393  -0.248
  101   1HB   SER  16          HB1       SER  16  -3.683   4.265   1.964
  102   2HB   SER  16          HB2       SER  16  -3.096   2.741   1.922
  103    HG   SER  16           HG       SER  16  -0.999   3.660   1.601
  104    H    GLN  17           HN       GLN  17  -4.656   5.554   0.239
  105    HA   GLN  17           HA       GLN  17  -3.754   7.672  -1.351
  106   1HB   GLN  17          HB1       GLN  17  -5.251   8.933   0.110
  107   2HB   GLN  17          HB2       GLN  17  -5.934   7.549  -0.423
  108   1HG   GLN  17          HG1       GLN  17  -4.746   7.358   2.127
  109   2HG   GLN  17          HG2       GLN  17  -6.061   8.325   2.061
  110   1HE2  GLN  17          1HE2      GLN  17  -7.668   7.191   3.113
  111   2HE2  GLN  17          2HE2      GLN  17  -8.162   5.590   2.611
  112    H1   NAL  18           HD1      NAL  18  -2.628   5.507   4.084
  113    H3   NAL  18           HD2      NAL  18  -2.395   9.636   4.576
  114    H4   NAL  18           HE2      NAL  18  -4.630   9.667   5.463
  115    H5   NAL  18           HH2      NAL  18  -6.705   8.477   6.022
  116    H6   NAL  18           HP       NAL  18  -7.960   6.425   6.122
  117    H7   NAL  18           HH1      NAL  18  -6.956   4.366   5.391
  118    H8   NAL  18           HZ1      NAL  18  -4.685   4.338   4.602
  119   1H9   NAL  18          HB2       NAL  18  -0.580   6.535   3.572
  120   2H9   NAL  18          HB1       NAL  18  -0.263   8.142   4.209
  121    H10  NAL  18           HA       NAL  18  -1.047   9.202   2.214
  122   1HN   NAL  18          HN        NAL  18  -2.330   6.605   1.625
  123    H    GLY  19           HN       GLY  19  -0.438   6.834  -0.069
  124   1HA   GLY  19          HA2       GLY  19   1.460   6.300  -1.288
  125   2HA   GLY  19          HA1       GLY  19   2.409   7.443  -0.329
  126    H    TYR  20           HN       TYR  20   0.531   5.066   1.356
  127    HA   TYR  20           HA       TYR  20   2.981   3.533   2.175
  128   1HB   TYR  20          HB1       TYR  20   0.589   4.398   3.628
  129   2HB   TYR  20          HB2       TYR  20   1.383   3.054   4.109
  130    HD1  TYR  20           HD1      TYR  20   1.813   3.781   6.337
  131    HD2  TYR  20           HD2      TYR  20   3.186   6.054   2.924
  132    HE1  TYR  20           HE1      TYR  20   3.325   5.118   7.804
  133    HE2  TYR  20           HE2      TYR  20   4.689   7.327   4.367
  134    HH   TYR  20           HH       TYR  20   5.566   7.533   6.472
  135    H    CYS  21           HN       CYS  21   3.013   1.447   1.433
  136    HA   CYS  21           HA       CYS  21   0.568   0.284   0.314
  137   1HB   CYS  21          HB1       CYS  21   2.652  -0.034  -0.791
  138   2HB   CYS  21          HB2       CYS  21   3.309  -0.776   0.507
  139    H    GLY  22           HN       GLY  22  -0.574  -1.446   1.040
  140   1HA   GLY  22          HA2       GLY  22   0.179  -3.189   3.206
  141   2HA   GLY  22          HA1       GLY  22  -1.009  -1.986   3.740
  142    H    LYS  23           HN       LYS  23  -2.541  -3.856   4.013
  143    HA   LYS  23           HA       LYS  23  -3.722  -4.734   1.416
  144   1HB   LYS  23          HB1       LYS  23  -2.152  -6.360   2.730
  145   2HB   LYS  23          HB2       LYS  23  -3.498  -6.655   3.607
  146   1HG   LYS  23          HG1       LYS  23  -4.631  -7.423   1.698
  147   2HG   LYS  23          HG2       LYS  23  -3.377  -6.998   0.742
  148   1HD   LYS  23          HD1       LYS  23  -2.003  -8.628   1.768
  149   2HD   LYS  23          HD2       LYS  23  -3.202  -9.015   2.807
  150   1HE   LYS  23          HE1       LYS  23  -3.237 -10.693   1.263
  151   2HE   LYS  23          HE2       LYS  23  -4.486  -9.731   0.837
  152   1HZ   LYS  23          HZ1       LYS  23  -3.299 -10.366  -1.076
  153   2HZ   LYS  23          HZ2       LYS  23  -3.134  -8.750  -0.875
  154   3HZ   LYS  23          HZ3       LYS  23  -1.903  -9.766  -0.476
  155    H    GLY  24           HN       GLY  24  -5.956  -5.164   1.461
  156   1HA   GLY  24          HA2       GLY  24  -8.070  -5.440   2.422
  157   2HA   GLY  24          HA1       GLY  24  -7.394  -5.060   3.998
  158    HA   PRO  25           HA       PRO  25 -10.455  -2.036   2.449
  159   1HB   PRO  25          HB1       PRO  25 -11.755  -1.550   4.723
  160   2HB   PRO  25          HB2       PRO  25 -11.951  -2.947   3.902
  161   1HG   PRO  25          HG1       PRO  25 -10.250  -2.512   6.210
  162   2HG   PRO  25          HG2       PRO  25 -11.287  -3.752   5.976
  163   1HD   PRO  25          HD1       PRO  25  -8.770  -4.080   5.419
  164   2HD   PRO  25          HD2       PRO  25  -9.899  -4.789   4.476
  165    H    LYS  26           HN       LYS  26  -7.746  -1.185   4.229
  166    HA   LYS  26           HA       LYS  26  -8.350   1.725   3.983
  167   1HB   LYS  26          HB1       LYS  26  -6.726   0.226   5.962
  168   2HB   LYS  26          HB2       LYS  26  -6.702   1.854   5.833
  169   1HG   LYS  26          HG1       LYS  26  -9.196   0.577   6.349
  170   2HG   LYS  26          HG2       LYS  26  -8.146   0.752   7.588
  171   1HD   LYS  26          HD1       LYS  26  -9.679   2.485   7.686
  172   2HD   LYS  26          HD2       LYS  26  -8.222   3.109   7.292
  173   1HE   LYS  26          HE1       LYS  26  -9.874   4.194   6.058
  174   2HE   LYS  26          HE2       LYS  26  -8.938   3.325   5.040
  175   1HZ   LYS  26          HZ1       LYS  26 -11.205   3.165   4.471
  176   2HZ   LYS  26          HZ2       LYS  26 -10.596   1.702   4.798
  177   3HZ   LYS  26          HZ3       LYS  26 -11.539   2.476   5.939
  178    H    TYR  27           HN       TYR  27  -6.927  -0.575   2.344
  179    HA   TYR  27           HA       TYR  27  -4.736   1.182   1.337
  180   1HB   TYR  27          HB1       TYR  27  -4.529  -1.723   1.829
  181   2HB   TYR  27          HB2       TYR  27  -3.433  -0.850   0.990
  182    HD1  TYR  27           HD1      TYR  27  -4.676  -1.672   4.289
  183    HD2  TYR  27           HD2      TYR  27  -1.937   0.771   2.039
  184    HE1  TYR  27           HE1      TYR  27  -3.483  -1.061   6.394
  185    HE2  TYR  27           HE2      TYR  27  -0.765   1.409   4.133
  186    HH   TYR  27           HH       TYR  27  -0.709   1.173   6.421
  187    H    CYS  28           HN       CYS  28  -6.539  -1.841   0.613
  188    HA   CYS  28           HA       CYS  28  -6.725  -1.236  -2.262
  189   1HB   CYS  28          HB1       CYS  28  -7.765  -3.326  -0.467
  190   2HB   CYS  28          HB2       CYS  28  -8.301  -3.190  -2.003
  191    H    GLY  29           HN       GLY  29  -9.039  -1.634   0.447
  192   1HA   GLY  29          HA2       GLY  29 -11.064   0.169  -0.671
  193   2HA   GLY  29          HA1       GLY  29 -11.011  -0.473   0.978
  194    H    ARG  30           HN       ARG  30 -11.686   2.166   0.572
  195    HA   ARG  30           HA       ARG  30  -9.246   3.808   0.793
  196   1HB   ARG  30          HB1       ARG  30 -11.304   4.162  -0.781
  197   2HB   ARG  30          HB2       ARG  30 -11.939   4.931   0.513
  198   1HG   ARG  30          HG1       ARG  30 -10.994   6.638  -0.609
  199   2HG   ARG  30          HG2       ARG  30  -9.827   6.269   0.471
  200   1HD   ARG  30          HD1       ARG  30  -9.782   5.254  -2.224
  201   2HD   ARG  30          HD2       ARG  30  -9.031   6.644  -1.811
  202    HE   ARG  30           HE       ARG  30  -7.537   5.402  -0.370
  203   1HH1  ARG  30          2HH2      ARG  30  -9.285   3.324  -2.633
  204   2HH1  ARG  30          1HH2      ARG  30  -8.190   2.019  -2.321
  205   1HH2  ARG  30          2HH1      ARG  30  -6.293   3.800  -0.027
  206   2HH2  ARG  30          1HH1      ARG  30  -6.503   2.289  -0.847
  Start of MODEL   27
    1   1H    VAL   1           H1       VAL   1   7.776   3.121   9.025
    2   2H    VAL   1           H2       VAL   1   6.154   3.115   8.683
    3   3H    VAL   1           H3       VAL   1   7.250   3.313   7.478
    4    HA   VAL   1           HA       VAL   1   8.069   1.126   7.705
    5    HB   VAL   1           HB       VAL   1   7.794   0.904  10.112
    6   1HG1  VAL   1          1HG1      VAL   1   5.501   1.859  10.423
    7   2HG1  VAL   1          2HG1      VAL   1   4.813   0.405   9.666
    8   3HG1  VAL   1          3HG1      VAL   1   5.707   0.280  11.185
    9   1HG2  VAL   1          1HG2      VAL   1   7.205  -1.450  10.172
   10   2HG2  VAL   1          2HG2      VAL   1   6.332  -1.326   8.636
   11   3HG2  VAL   1          3HG2      VAL   1   8.099  -1.106   8.683
   12    H    GLY   2           HN       GLY   2   7.393   0.015   5.969
   13   1HA   GLY   2          HA2       GLY   2   5.845  -1.129   4.612
   14   2HA   GLY   2          HA1       GLY   2   4.502  -0.347   5.437
   15    H    GLU   3           HN       GLU   3   6.839   2.009   4.568
   16    HA   GLU   3           HA       GLU   3   5.362   3.398   2.635
   17   1HB   GLU   3          HB1       GLU   3   8.277   3.220   3.107
   18   2HB   GLU   3          HB2       GLU   3   7.598   4.310   2.099
   19   1HG   GLU   3          HG1       GLU   3   8.029   5.453   4.020
   20   2HG   GLU   3          HG2       GLU   3   6.415   5.201   4.021
   21    H    CYS   4           HN       CYS   4   4.886   2.997   0.507
   22    HA   CYS   4           HA       CYS   4   5.421   0.501  -0.636
   23   1HB   CYS   4          HB1       CYS   4   4.694   2.965  -2.088
   24   2HB   CYS   4          HB2       CYS   4   4.513   1.443  -2.651
   25    H    VAL   5           HN       VAL   5   6.428  -0.127  -2.620
   26    HA   VAL   5           HA       VAL   5   9.164   0.847  -3.031
   27    HB   VAL   5           HB       VAL   5   7.704  -1.231  -4.696
   28   1HG1  VAL   5          1HG1      VAL   5  10.658  -0.744  -4.060
   29   2HG1  VAL   5          2HG1      VAL   5  10.014  -2.030  -5.101
   30   3HG1  VAL   5          3HG1      VAL   5   9.872  -0.341  -5.595
   31   1HG2  VAL   5          1HG2      VAL   5   7.559  -2.021  -2.385
   32   2HG2  VAL   5          2HG2      VAL   5   8.801  -2.932  -3.240
   33   3HG2  VAL   5          3HG2      VAL   5   9.275  -1.639  -2.116
   34    H    ARG   6           HN       ARG   6   7.781   2.857  -3.268
   35    HA   ARG   6           HA       ARG   6   7.191   4.759  -4.378
   36   1HB   ARG   6          HB1       ARG   6   8.886   3.827  -6.581
   37   2HB   ARG   6          HB2       ARG   6   8.563   5.366  -6.139
   38   1HG   ARG   6          HG1       ARG   6  10.232   3.542  -4.670
   39   2HG   ARG   6          HG2       ARG   6  10.776   4.783  -5.583
   40   1HD   ARG   6          HD1       ARG   6  10.987   5.704  -3.583
   41   2HD   ARG   6          HD2       ARG   6   9.456   6.169  -3.912
   42    HE   ARG   6           HE       ARG   6   9.091   3.842  -2.584
   43   1HH1  ARG   6          2HH2      ARG   6  10.845   6.741  -1.648
   44   2HH1  ARG   6          1HH2      ARG   6  10.598   6.406   0.034
   45   1HH2  ARG   6          2HH1      ARG   6   8.784   3.520  -0.482
   46   2HH2  ARG   6          1HH1      ARG   6   9.452   4.616   0.681
   47    H    GLY   7           HN       GLY   7   5.350   2.789  -4.477
   48   1HA   GLY   7          HA2       GLY   7   3.146   3.238  -5.534
   49   2HA   GLY   7          HA1       GLY   7   3.936   3.120  -7.099
   50    H    ARG   8           HN       ARG   8   5.503   0.671  -5.650
   51    HA   ARG   8           HA       ARG   8   3.373  -1.374  -6.101
   52   1HB   ARG   8          HB1       ARG   8   6.279  -1.336  -6.674
   53   2HB   ARG   8          HB2       ARG   8   5.412  -2.721  -6.665
   54   1HG   ARG   8          HG1       ARG   8   4.407  -2.258  -8.601
   55   2HG   ARG   8          HG2       ARG   8   4.403  -0.648  -8.323
   56   1HD   ARG   8          HD1       ARG   8   6.729  -2.138  -9.172
   57   2HD   ARG   8          HD2       ARG   8   5.831  -1.197 -10.161
   58    HE   ARG   8           HE       ARG   8   7.759  -0.319  -8.244
   59   1HH1  ARG   8          2HH2      ARG   8   5.182   0.876 -10.347
   60   2HH1  ARG   8          1HH2      ARG   8   5.551   2.521  -9.950
   61   1HH2  ARG   8          2HH1      ARG   8   8.038   1.752  -7.700
   62   2HH2  ARG   8          1HH1      ARG   8   7.132   3.005  -8.481
   63    H    CYS   9           HN       CYS   9   3.936  -3.508  -4.914
   64    HA   CYS   9           HA       CYS   9   4.957  -3.021  -2.197
   65   1HB   CYS   9          HB1       CYS   9   2.177  -3.635  -2.975
   66   2HB   CYS   9          HB2       CYS   9   2.738  -4.014  -1.489
   67    HA   PRO  10           HA       PRO  10   6.008  -7.391  -2.070
   68   1HB   PRO  10          HB1       PRO  10   4.421  -7.519   0.408
   69   2HB   PRO  10          HB2       PRO  10   5.935  -8.066   0.134
   70   1HG   PRO  10          HG1       PRO  10   5.635  -5.844   1.425
   71   2HG   PRO  10          HG2       PRO  10   6.854  -5.961   0.345
   72   1HD   PRO  10          HD1       PRO  10   4.298  -4.687  -0.025
   73   2HD   PRO  10          HD2       PRO  10   5.751  -4.170  -0.563
   74    H    SER  11           HN       SER  11   5.094  -9.578  -1.981
   75    HA   SER  11           HA       SER  11   3.393 -10.225  -3.842
   76   1HB   SER  11          HB1       SER  11   3.701 -11.762  -1.343
   77   2HB   SER  11          HB2       SER  11   3.300 -12.367  -2.807
   78    HG   SER  11           HG       SER  11   5.487 -12.658  -2.444
   79    H    GLY  12           HN       GLY  12   1.491  -9.173  -4.155
   80   1HA   GLY  12          HA2       GLY  12  -0.825  -9.200  -4.215
   81   2HA   GLY  12          HA1       GLY  12  -0.845 -10.328  -2.863
   82    H    MET  13           HN       MET  13   0.997  -7.606  -1.943
   83    HA   MET  13           HA       MET  13  -1.233  -6.502  -0.334
   84   1HB   MET  13          HB1       MET  13   1.580  -5.628  -0.506
   85   2HB   MET  13          HB2       MET  13   0.480  -5.149   0.603
   86   1HG   MET  13          HG1       MET  13   1.518  -7.817   0.421
   87   2HG   MET  13          HG2       MET  13   2.055  -6.700   1.483
   88   1HE   MET  13          HE1       MET  13  -1.208  -8.719   0.460
   89   2HE   MET  13          HE2       MET  13   0.156  -9.710   1.029
   90   3HE   MET  13          HE3       MET  13  -1.323  -9.579   2.006
   91    H    CYS  14           HN       CYS  14  -1.618  -4.163  -0.337
   92    HA   CYS  14           HA       CYS  14  -1.598  -3.045  -3.112
   93   1HB   CYS  14          HB1       CYS  14  -3.642  -2.746  -1.005
   94   2HB   CYS  14          HB2       CYS  14  -3.741  -2.203  -2.542
   95    H    CYS  15           HN       CYS  15  -0.754  -1.069  -3.418
   96    HA   CYS  15           HA       CYS  15   0.339   0.462  -1.184
   97   1HB   CYS  15          HB1       CYS  15   1.422   0.316  -3.390
   98   2HB   CYS  15          HB2       CYS  15   0.223   1.217  -4.037
   99    H    SER  16           HN       SER  16  -1.025   1.517   0.053
  100    HA   SER  16           HA       SER  16  -3.576   2.665  -0.614
  101   1HB   SER  16          HB1       SER  16  -2.981   2.299   1.627
  102   2HB   SER  16          HB2       SER  16  -1.591   3.151   1.519
  103    HG   SER  16           HG       SER  16  -4.096   4.379   1.263
  104    H    GLN  17           HN       GLN  17  -4.134   4.725  -1.013
  105    HA   GLN  17           HA       GLN  17  -2.716   6.479  -2.701
  106   1HB   GLN  17          HB1       GLN  17  -4.539   7.921  -2.221
  107   2HB   GLN  17          HB2       GLN  17  -5.115   6.400  -2.372
  108   1HG   GLN  17          HG1       GLN  17  -4.683   7.480   0.238
  109   2HG   GLN  17          HG2       GLN  17  -6.050   7.859  -0.571
  110   1HE2  GLN  17          1HE2      GLN  17  -7.866   6.577  -0.321
  111   2HE2  GLN  17          2HE2      GLN  17  -7.688   4.985   0.402
  112    H1   NAL  18           HD1      NAL  18  -3.808   6.003   3.472
  113    H3   NAL  18           HD2      NAL  18  -3.018   9.922   2.314
  114    H4   NAL  18           HE2      NAL  18  -5.379  10.388   2.256
  115    H5   NAL  18           HH2      NAL  18  -7.700   9.586   2.398
  116    H6   NAL  18           HP       NAL  18  -9.264   7.824   2.882
  117    H7   NAL  18           HH1      NAL  18  -8.462   5.637   3.486
  118    H8   NAL  18           HZ1      NAL  18  -6.099   5.213   3.612
  119   1H9   NAL  18          HB2       NAL  18  -1.559   6.568   3.154
  120   2H9   NAL  18          HB1       NAL  18  -1.179   8.260   3.449
  121    H10  NAL  18           HA       NAL  18  -1.125   8.747   1.098
  122   1HN   NAL  18          HN        NAL  18  -2.427   6.113   0.753
  123    H    GLY  19           HN       GLY  19  -0.027   5.887  -0.172
  124   1HA   GLY  19          HA2       GLY  19   2.182   5.678  -0.908
  125   2HA   GLY  19          HA1       GLY  19   2.762   6.666   0.425
  126    H    TYR  20           HN       TYR  20   0.650   4.016   1.230
  127    HA   TYR  20           HA       TYR  20   2.972   2.491   2.368
  128   1HB   TYR  20          HB1       TYR  20   0.487   3.420   3.625
  129   2HB   TYR  20          HB2       TYR  20   1.295   2.136   4.230
  130    HD1  TYR  20           HD1      TYR  20   1.583   5.740   3.544
  131    HD2  TYR  20           HD2      TYR  20   3.207   2.308   5.601
  132    HE1  TYR  20           HE1      TYR  20   3.220   7.209   4.714
  133    HE2  TYR  20           HE2      TYR  20   4.780   3.786   6.793
  134    HH   TYR  20           HH       TYR  20   5.516   5.806   7.138
  135    H    CYS  21           HN       CYS  21   2.921   0.297   2.321
  136    HA   CYS  21           HA       CYS  21   0.936  -1.065   0.662
  137   1HB   CYS  21          HB1       CYS  21   3.352  -1.978   2.098
  138   2HB   CYS  21          HB2       CYS  21   2.453  -2.937   1.128
  139    H    GLY  22           HN       GLY  22  -0.622  -2.504   1.290
  140   1HA   GLY  22          HA2       GLY  22  -0.494  -4.235   3.517
  141   2HA   GLY  22          HA1       GLY  22  -1.436  -2.827   4.019
  142    H    LYS  23           HN       LYS  23  -3.166  -4.421   4.293
  143    HA   LYS  23           HA       LYS  23  -4.868  -4.606   1.904
  144   1HB   LYS  23          HB1       LYS  23  -4.249  -6.928   3.655
  145   2HB   LYS  23          HB2       LYS  23  -5.530  -6.891   2.642
  146   1HG   LYS  23          HG1       LYS  23  -2.806  -6.700   1.722
  147   2HG   LYS  23          HG2       LYS  23  -3.630  -8.110   1.763
  148   1HD   LYS  23          HD1       LYS  23  -4.671  -5.910   0.250
  149   2HD   LYS  23          HD2       LYS  23  -3.533  -6.877  -0.412
  150   1HE   LYS  23          HE1       LYS  23  -4.951  -8.553  -0.701
  151   2HE   LYS  23          HE2       LYS  23  -5.745  -8.242   0.691
  152   1HZ   LYS  23          HZ1       LYS  23  -6.989  -6.610  -0.240
  153   2HZ   LYS  23          HZ2       LYS  23  -6.074  -6.594  -1.632
  154   3HZ   LYS  23          HZ3       LYS  23  -7.074  -7.869  -1.292
  155    H    GLY  24           HN       GLY  24  -7.158  -5.173   2.545
  156   1HA   GLY  24          HA2       GLY  24  -9.011  -4.778   3.915
  157   2HA   GLY  24          HA1       GLY  24  -7.955  -4.290   5.243
  158    HA   PRO  25           HA       PRO  25 -10.578  -0.872   3.316
  159   1HB   PRO  25          HB1       PRO  25 -10.513  -0.038   6.141
  160   2HB   PRO  25          HB2       PRO  25 -11.730   0.107   5.060
  161   1HG   PRO  25          HG1       PRO  25 -11.809  -1.879   6.707
  162   2HG   PRO  25          HG2       PRO  25 -12.228  -2.158   5.153
  163   1HD   PRO  25          HD1       PRO  25  -9.736  -2.791   6.440
  164   2HD   PRO  25          HD2       PRO  25 -10.518  -3.665   5.303
  165    H    LYS  26           HN       LYS  26  -7.902  -0.332   5.572
  166    HA   LYS  26           HA       LYS  26  -7.328   2.374   4.772
  167   1HB   LYS  26          HB1       LYS  26  -6.490   0.697   6.737
  168   2HB   LYS  26          HB2       LYS  26  -5.129   0.870   5.851
  169   1HG   LYS  26          HG1       LYS  26  -6.570   3.113   6.915
  170   2HG   LYS  26          HG2       LYS  26  -5.339   2.402   7.719
  171   1HD   LYS  26          HD1       LYS  26  -5.067   3.805   5.222
  172   2HD   LYS  26          HD2       LYS  26  -4.619   4.395   6.678
  173   1HE   LYS  26          HE1       LYS  26  -2.656   3.461   6.497
  174   2HE   LYS  26          HE2       LYS  26  -3.341   1.996   6.270
  175   1HZ   LYS  26          HZ1       LYS  26  -3.645   2.620   3.946
  176   2HZ   LYS  26          HZ2       LYS  26  -2.662   3.892   4.211
  177   3HZ   LYS  26          HZ3       LYS  26  -2.087   2.348   4.391
  178    H    TYR  27           HN       TYR  27  -6.786  -0.480   2.997
  179    HA   TYR  27           HA       TYR  27  -4.561   0.783   1.412
  180   1HB   TYR  27          HB1       TYR  27  -4.670  -1.990   2.409
  181   2HB   TYR  27          HB2       TYR  27  -3.507  -1.375   1.441
  182    HD1  TYR  27           HD1      TYR  27  -1.810   0.170   2.232
  183    HD2  TYR  27           HD2      TYR  27  -4.671  -1.703   4.831
  184    HE1  TYR  27           HE1      TYR  27  -0.349   0.658   4.193
  185    HE2  TYR  27           HE2      TYR  27  -3.225  -1.198   6.801
  186    HH   TYR  27           HH       TYR  27   0.025   0.071   6.457
  187    H    CYS  28           HN       CYS  28  -6.962  -1.856   1.417
  188    HA   CYS  28           HA       CYS  28  -7.106  -1.712  -1.553
  189   1HB   CYS  28          HB1       CYS  28  -5.594  -3.477  -0.310
  190   2HB   CYS  28          HB2       CYS  28  -6.984  -4.333  -0.367
  191    H    GLY  29           HN       GLY  29  -8.982  -1.455   1.116
  192   1HA   GLY  29          HA2       GLY  29 -11.290  -1.711   1.466
  193   2HA   GLY  29          HA1       GLY  29 -11.433  -2.574  -0.063
  194    H    ARG  30           HN       ARG  30  -9.810  -4.666   0.140
  195    HA   ARG  30           HA       ARG  30 -10.558  -6.227   2.579
  196   1HB   ARG  30          HB1       ARG  30 -11.966  -6.854   0.766
  197   2HB   ARG  30          HB2       ARG  30 -10.708  -7.061  -0.254
  198   1HG   ARG  30          HG1       ARG  30 -11.598  -9.145   0.456
  199   2HG   ARG  30          HG2       ARG  30 -10.036  -8.985   0.906
  200   1HD   ARG  30          HD1       ARG  30 -10.834  -8.329   3.112
  201   2HD   ARG  30          HD2       ARG  30 -12.335  -8.753   2.628
  202    HE   ARG  30           HE       ARG  30 -11.871 -10.957   2.881
  203   1HH1  ARG  30          2HH2      ARG  30  -8.816  -9.169   3.090
  204   2HH1  ARG  30          1HH2      ARG  30  -7.975 -10.555   3.699
  205   1HH2  ARG  30          2HH1      ARG  30 -10.684 -12.654   3.671
  206   2HH2  ARG  30          1HH1      ARG  30  -8.998 -12.464   4.018
  Start of MODEL   28
    1   1H    VAL   1           H1       VAL   1   4.093   0.117   3.201
    2   2H    VAL   1           H2       VAL   1   2.884  -0.731   3.972
    3   3H    VAL   1           H3       VAL   1   4.351  -1.430   3.643
    4    HA   VAL   1           HA       VAL   1   3.908   0.771   5.530
    5    HB   VAL   1           HB       VAL   1   4.845  -2.078   6.061
    6   1HG1  VAL   1          1HG1      VAL   1   4.553  -1.419   8.452
    7   2HG1  VAL   1          2HG1      VAL   1   5.813  -0.477   7.666
    8   3HG1  VAL   1          3HG1      VAL   1   4.208   0.246   7.946
    9   1HG2  VAL   1          1HG2      VAL   1   2.163  -0.728   6.633
   10   2HG2  VAL   1          2HG2      VAL   1   2.447  -2.137   5.580
   11   3HG2  VAL   1          3HG2      VAL   1   2.678  -2.280   7.315
   12    H    GLY   2           HN       GLY   2   5.798   1.816   6.277
   13   1HA   GLY   2          HA2       GLY   2   7.987   2.570   6.113
   14   2HA   GLY   2          HA1       GLY   2   8.430   1.155   5.149
   15    H    GLU   3           HN       GLU   3   6.863   1.160   3.018
   16    HA   GLU   3           HA       GLU   3   6.308   3.807   1.911
   17   1HB   GLU   3          HB1       GLU   3   8.763   2.940   1.407
   18   2HB   GLU   3          HB2       GLU   3   8.007   2.159   0.188
   19   1HG   GLU   3          HG1       GLU   3   7.128   4.275  -0.556
   20   2HG   GLU   3          HG2       GLU   3   8.016   5.013   0.599
   21    H    CYS   4           HN       CYS   4   5.425   3.478  -0.409
   22    HA   CYS   4           HA       CYS   4   4.808   0.685  -1.182
   23   1HB   CYS   4          HB1       CYS   4   4.213   3.126  -2.722
   24   2HB   CYS   4          HB2       CYS   4   3.723   1.604  -3.056
   25    H    VAL   5           HN       VAL   5   6.476  -0.252  -2.233
   26    HA   VAL   5           HA       VAL   5   9.055   0.985  -2.142
   27    HB   VAL   5           HB       VAL   5   8.232  -1.623  -3.480
   28   1HG1  VAL   5          1HG1      VAL   5  10.608  -2.254  -3.098
   29   2HG1  VAL   5          2HG1      VAL   5  10.480  -0.883  -4.198
   30   3HG1  VAL   5          3HG1      VAL   5  10.949  -0.615  -2.503
   31   1HG2  VAL   5          1HG2      VAL   5   7.600  -1.655  -1.104
   32   2HG2  VAL   5          2HG2      VAL   5   9.020  -2.669  -1.361
   33   3HG2  VAL   5          3HG2      VAL   5   9.209  -1.056  -0.645
   34    H    ARG   6           HN       ARG   6   9.224   2.747  -3.409
   35    HA   ARG   6           HA       ARG   6   9.171   4.150  -5.278
   36   1HB   ARG   6          HB1       ARG   6   9.924   1.772  -6.862
   37   2HB   ARG   6          HB2       ARG   6  10.128   3.333  -7.297
   38   1HG   ARG   6          HG1       ARG   6  11.541   2.330  -5.038
   39   2HG   ARG   6          HG2       ARG   6  12.102   2.003  -6.536
   40   1HD   ARG   6          HD1       ARG   6  13.243   3.842  -5.568
   41   2HD   ARG   6          HD2       ARG   6  12.471   4.279  -6.939
   42    HE   ARG   6           HE       ARG   6  11.462   5.918  -5.799
   43   1HH1  ARG   6          2HH2      ARG   6  12.059   3.341  -3.483
   44   2HH1  ARG   6          1HH2      ARG   6  11.249   4.201  -2.216
   45   1HH2  ARG   6          2HH1      ARG   6  10.337   6.873  -4.145
   46   2HH2  ARG   6          1HH1      ARG   6  10.305   6.133  -2.579
   47    H    GLY   7           HN       GLY   7   6.734   2.951  -4.443
   48   1HA   GLY   7          HA2       GLY   7   4.516   3.277  -5.141
   49   2HA   GLY   7          HA1       GLY   7   5.011   3.316  -6.822
   50    H    ARG   8           HN       ARG   8   6.476   0.484  -5.685
   51    HA   ARG   8           HA       ARG   8   4.205  -1.197  -6.596
   52   1HB   ARG   8          HB1       ARG   8   7.097  -1.665  -6.180
   53   2HB   ARG   8          HB2       ARG   8   6.054  -2.903  -6.394
   54   1HG   ARG   8          HG1       ARG   8   6.668  -2.714  -8.485
   55   2HG   ARG   8          HG2       ARG   8   5.513  -1.560  -8.515
   56   1HD   ARG   8          HD1       ARG   8   8.218  -0.813  -7.990
   57   2HD   ARG   8          HD2       ARG   8   7.740  -1.057  -9.533
   58    HE   ARG   8           HE       ARG   8   7.365   1.271  -8.058
   59   1HH1  ARG   8          2HH2      ARG   8   5.618  -0.567 -10.519
   60   2HH1  ARG   8          1HH2      ARG   8   4.819   0.862 -11.085
   61   1HH2  ARG   8          2HH1      ARG   8   6.325   2.978  -8.814
   62   2HH2  ARG   8          1HH1      ARG   8   5.214   2.836 -10.135
   63    H    CYS   9           HN       CYS   9   3.927  -3.307  -5.361
   64    HA   CYS   9           HA       CYS   9   4.477  -3.074  -2.484
   65   1HB   CYS   9          HB1       CYS   9   1.799  -3.305  -3.681
   66   2HB   CYS   9          HB2       CYS   9   2.089  -3.828  -2.162
   67    HA   PRO  10           HA       PRO  10   5.167  -7.459  -3.096
   68   1HB   PRO  10          HB1       PRO  10   5.834  -8.112  -0.634
   69   2HB   PRO  10          HB2       PRO  10   6.788  -7.065  -1.447
   70   1HG   PRO  10          HG1       PRO  10   4.774  -6.402   0.538
   71   2HG   PRO  10          HG2       PRO  10   6.298  -5.820   0.458
   72   1HD   PRO  10          HD1       PRO  10   4.272  -4.485  -0.573
   73   2HD   PRO  10          HD2       PRO  10   5.778  -4.353  -1.192
   74    H    SER  11           HN       SER  11   4.443  -9.560  -2.139
   75    HA   SER  11           HA       SER  11   2.767 -11.060  -1.693
   76   1HB   SER  11          HB1       SER  11   3.992 -10.632   0.346
   77   2HB   SER  11          HB2       SER  11   2.941  -9.468   0.803
   78    HG   SER  11           HG       SER  11   1.303 -11.052   0.678
   79    H    GLY  12           HN       GLY  12   1.531  -9.258  -3.194
   80   1HA   GLY  12          HA2       GLY  12  -0.566  -8.486  -3.890
   81   2HA   GLY  12          HA1       GLY  12  -1.251  -9.721  -2.833
   82    H    MET  13           HN       MET  13   0.729  -6.997  -1.619
   83    HA   MET  13           HA       MET  13  -1.579  -5.804  -0.197
   84   1HB   MET  13          HB1       MET  13   1.244  -4.952  -0.453
   85   2HB   MET  13          HB2       MET  13   0.121  -4.192   0.458
   86   1HG   MET  13          HG1       MET  13  -0.048  -6.119   1.837
   87   2HG   MET  13          HG2       MET  13   1.100  -6.854   0.937
   88   1HE   MET  13          HE1       MET  13   3.064  -6.368   4.227
   89   2HE   MET  13          HE2       MET  13   1.362  -6.837   4.022
   90   3HE   MET  13          HE3       MET  13   2.611  -7.522   2.954
   91    H    CYS  14           HN       CYS  14  -1.974  -3.523  -0.483
   92    HA   CYS  14           HA       CYS  14  -1.863  -2.555  -3.316
   93   1HB   CYS  14          HB1       CYS  14  -3.902  -1.987  -1.259
   94   2HB   CYS  14          HB2       CYS  14  -3.928  -1.496  -2.817
   95    H    CYS  15           HN       CYS  15  -1.353  -0.354  -3.602
   96    HA   CYS  15           HA       CYS  15   0.144   0.914  -1.436
   97   1HB   CYS  15          HB1       CYS  15   0.918   0.981  -3.734
   98   2HB   CYS  15          HB2       CYS  15  -0.386   1.853  -4.189
   99    H    SER  16           HN       SER  16  -0.919   1.986   0.107
  100    HA   SER  16           HA       SER  16  -3.611   2.915  -0.216
  101   1HB   SER  16          HB1       SER  16  -3.321   3.733   2.018
  102   2HB   SER  16          HB2       SER  16  -2.686   2.232   1.911
  103    HG   SER  16           HG       SER  16  -0.783   2.869   2.270
  104    H    GLN  17           HN       GLN  17  -4.410   4.921   0.349
  105    HA   GLN  17           HA       GLN  17  -3.636   7.312  -0.894
  106   1HB   GLN  17          HB1       GLN  17  -5.351   8.179   0.524
  107   2HB   GLN  17          HB2       GLN  17  -5.822   6.729  -0.062
  108   1HG   GLN  17          HG1       GLN  17  -5.045   5.853   2.172
  109   2HG   GLN  17          HG2       GLN  17  -5.200   7.406   2.652
  110   1HE2  GLN  17          1HE2      GLN  17  -6.856   4.544   2.868
  111   2HE2  GLN  17          2HE2      GLN  17  -8.475   5.251   2.691
  112    H1   NAL  18           HD1      NAL  18  -2.592   4.749   4.447
  113    H3   NAL  18           HD2      NAL  18  -2.322   8.894   4.785
  114    H4   NAL  18           HE2      NAL  18  -4.543   8.978   5.707
  115    H5   NAL  18           HH2      NAL  18  -6.566   7.821   6.442
  116    H6   NAL  18           HP       NAL  18  -7.773   5.771   6.814
  117    H7   NAL  18           HH1      NAL  18  -6.788   3.669   6.191
  118    H8   NAL  18           HZ1      NAL  18  -4.608   3.602   5.179
  119   1H9   NAL  18          HB1       NAL  18  -0.543   5.739   3.884
  120   2H9   NAL  18          HB2       NAL  18  -0.189   7.297   4.617
  121    H10  NAL  18           HA       NAL  18  -0.888   8.486   2.657
  122   1HN   NAL  18          HN        NAL  18  -1.943   5.878   1.659
  123    H    GLY  19           HN       GLY  19  -0.144   6.305   0.247
  124   1HA   GLY  19          HA2       GLY  19   1.834   5.921  -0.905
  125   2HA   GLY  19          HA1       GLY  19   2.682   7.017   0.192
  126    H    TYR  20           HN       TYR  20   0.865   4.388   1.501
  127    HA   TYR  20           HA       TYR  20   3.300   2.758   2.140
  128   1HB   TYR  20          HB1       TYR  20   1.212   3.836   3.830
  129   2HB   TYR  20          HB2       TYR  20   1.573   2.267   4.109
  130    HD1  TYR  20           HD1      TYR  20   3.994   4.911   3.222
  131    HD2  TYR  20           HD2      TYR  20   2.376   2.402   6.347
  132    HE1  TYR  20           HE1      TYR  20   5.878   5.518   4.672
  133    HE2  TYR  20           HE2      TYR  20   4.290   3.042   7.820
  134    HH   TYR  20           HH       TYR  20   6.918   5.149   6.665
  135    H    CYS  21           HN       CYS  21   3.166   0.667   1.351
  136    HA   CYS  21           HA       CYS  21   0.800  -0.514   0.346
  137   1HB   CYS  21          HB1       CYS  21   3.125  -1.879   1.531
  138   2HB   CYS  21          HB2       CYS  21   1.979  -2.602   0.618
  139    H    GLY  22           HN       GLY  22  -0.829  -1.754   1.182
  140   1HA   GLY  22          HA2       GLY  22  -0.643  -3.256   3.630
  141   2HA   GLY  22          HA1       GLY  22  -1.722  -1.877   3.847
  142    H    LYS  23           HN       LYS  23  -3.539  -3.453   4.093
  143    HA   LYS  23           HA       LYS  23  -4.563  -4.436   1.476
  144   1HB   LYS  23          HB1       LYS  23  -4.282  -6.087   3.921
  145   2HB   LYS  23          HB2       LYS  23  -5.271  -6.495   2.687
  146   1HG   LYS  23          HG1       LYS  23  -3.413  -6.679   1.230
  147   2HG   LYS  23          HG2       LYS  23  -2.408  -6.209   2.429
  148   1HD   LYS  23          HD1       LYS  23  -3.004  -8.185   3.663
  149   2HD   LYS  23          HD2       LYS  23  -3.931  -8.665   2.406
  150   1HE   LYS  23          HE1       LYS  23  -1.125  -8.204   2.030
  151   2HE   LYS  23          HE2       LYS  23  -1.649  -9.648   2.583
  152   1HZ   LYS  23          HZ1       LYS  23  -2.863  -9.991   0.601
  153   2HZ   LYS  23          HZ2       LYS  23  -2.398  -8.519   0.026
  154   3HZ   LYS  23          HZ3       LYS  23  -1.278  -9.687   0.248
  155    H    GLY  24           HN       GLY  24  -6.820  -5.096   1.581
  156   1HA   GLY  24          HA2       GLY  24  -9.048  -4.711   2.033
  157   2HA   GLY  24          HA1       GLY  24  -8.615  -3.922   3.557
  158    HA   PRO  25           HA       PRO  25 -10.222  -0.976   0.099
  159   1HB   PRO  25          HB1       PRO  25 -11.919  -0.205   2.382
  160   2HB   PRO  25          HB2       PRO  25 -12.286  -0.210   0.791
  161   1HG   PRO  25          HG1       PRO  25 -13.104  -2.189   2.241
  162   2HG   PRO  25          HG2       PRO  25 -12.539  -2.510   0.742
  163   1HD   PRO  25          HD1       PRO  25 -11.165  -2.857   3.246
  164   2HD   PRO  25          HD2       PRO  25 -11.089  -3.821   1.930
  165    H    LYS  26           HN       LYS  26  -9.580  -0.349   3.514
  166    HA   LYS  26           HA       LYS  26  -8.861   2.348   3.530
  167   1HB   LYS  26          HB1       LYS  26  -7.883   0.036   5.116
  168   2HB   LYS  26          HB2       LYS  26  -7.554   1.584   5.518
  169   1HG   LYS  26          HG1       LYS  26 -10.296   0.940   5.237
  170   2HG   LYS  26          HG2       LYS  26  -9.547   0.297   6.537
  171   1HD   LYS  26          HD1       LYS  26 -10.624   2.306   7.130
  172   2HD   LYS  26          HD2       LYS  26  -9.009   2.456   7.316
  173   1HE   LYS  26          HE1       LYS  26  -9.782   4.424   6.380
  174   2HE   LYS  26          HE2       LYS  26  -8.934   3.639   5.225
  175   1HZ   LYS  26          HZ1       LYS  26 -10.964   2.935   4.185
  176   2HZ   LYS  26          HZ2       LYS  26 -11.817   3.776   5.355
  177   3HZ   LYS  26          HZ3       LYS  26 -10.797   4.470   4.218
  178    H    TYR  27           HN       TYR  27  -6.949  -0.292   2.285
  179    HA   TYR  27           HA       TYR  27  -4.751   1.624   1.643
  180   1HB   TYR  27          HB1       TYR  27  -4.553  -1.263   2.206
  181   2HB   TYR  27          HB2       TYR  27  -3.319  -0.341   1.664
  182    HD1  TYR  27           HD1      TYR  27  -1.788   0.725   3.154
  183    HD2  TYR  27           HD2      TYR  27  -5.595  -0.786   4.515
  184    HE1  TYR  27           HE1      TYR  27  -1.195   1.316   5.489
  185    HE2  TYR  27           HE2      TYR  27  -4.989  -0.212   6.845
  186    HH   TYR  27           HH       TYR  27  -3.391   0.721   8.229
  187    H    CYS  28           HN       CYS  28  -7.193  -0.326   0.282
  188    HA   CYS  28           HA       CYS  28  -5.802  -0.383  -2.353
  189   1HB   CYS  28          HB1       CYS  28  -6.700  -2.430  -0.997
  190   2HB   CYS  28          HB2       CYS  28  -8.078  -2.090  -1.805
  191    H    GLY  29           HN       GLY  29  -8.285   1.377  -0.871
  192   1HA   GLY  29          HA2       GLY  29  -9.061   2.502  -3.477
  193   2HA   GLY  29          HA1       GLY  29 -10.349   1.639  -2.637
  194    H    ARG  30           HN       ARG  30 -10.342   2.372  -0.077
  195    HA   ARG  30           HA       ARG  30  -9.994   5.206   0.311
  196   1HB   ARG  30          HB1       ARG  30 -12.145   5.068  -0.897
  197   2HB   ARG  30          HB2       ARG  30 -12.746   4.083   0.260
  198   1HG   ARG  30          HG1       ARG  30 -13.633   6.031   0.884
  199   2HG   ARG  30          HG2       ARG  30 -12.276   6.015   1.793
  200   1HD   ARG  30          HD1       ARG  30 -12.613   7.536  -0.629
  201   2HD   ARG  30          HD2       ARG  30 -12.636   8.162   0.880
  202    HE   ARG  30           HE       ARG  30 -10.297   7.865   1.092
  203   1HH1  ARG  30          2HH2      ARG  30 -11.451   6.992  -2.122
  204   2HH1  ARG  30          1HH2      ARG  30  -9.836   6.920  -2.745
  205   1HH2  ARG  30          2HH1      ARG  30  -8.296   7.641   0.217
  206   2HH2  ARG  30          1HH1      ARG  30  -8.112   7.272  -1.465
  Start of MODEL   29
    1   1H    VAL   1           H1       VAL   1   0.552   0.053   6.700
    2   2H    VAL   1           H2       VAL   1   1.299  -1.422   6.615
    3   3H    VAL   1           H3       VAL   1   1.204  -0.504   5.282
    4    HA   VAL   1           HA       VAL   1   2.653   1.172   6.295
    5    HB   VAL   1           HB       VAL   1   3.920   0.521   8.311
    6   1HG1  VAL   1          1HG1      VAL   1   0.917   0.682   8.811
    7   2HG1  VAL   1          2HG1      VAL   1   2.219   1.140   9.920
    8   3HG1  VAL   1          3HG1      VAL   1   1.979   2.060   8.430
    9   1HG2  VAL   1          1HG2      VAL   1   1.833  -1.678   8.715
   10   2HG2  VAL   1          2HG2      VAL   1   3.534  -1.949   8.266
   11   3HG2  VAL   1          3HG2      VAL   1   3.132  -1.215   9.821
   12    H    GLY   2           HN       GLY   2   5.079   0.888   6.355
   13   1HA   GLY   2          HA2       GLY   2   6.867   0.088   4.991
   14   2HA   GLY   2          HA1       GLY   2   5.805  -1.162   4.317
   15    H    GLU   3           HN       GLU   3   7.056   1.975   3.855
   16    HA   GLU   3           HA       GLU   3   5.051   3.274   2.356
   17   1HB   GLU   3          HB1       GLU   3   6.783   4.643   1.620
   18   2HB   GLU   3          HB2       GLU   3   7.105   4.261   3.175
   19   1HG   GLU   3          HG1       GLU   3   9.151   4.022   2.405
   20   2HG   GLU   3          HG2       GLU   3   8.617   2.525   2.027
   21    H    CYS   4           HN       CYS   4   4.740   3.555   0.072
   22    HA   CYS   4           HA       CYS   4   4.800   1.102  -1.425
   23   1HB   CYS   4          HB1       CYS   4   4.350   3.830  -2.422
   24   2HB   CYS   4          HB2       CYS   4   3.992   2.447  -3.214
   25    H    VAL   5           HN       VAL   5   6.632   0.208  -1.950
   26    HA   VAL   5           HA       VAL   5   9.189   1.380  -2.079
   27    HB   VAL   5           HB       VAL   5   8.312  -1.318  -3.183
   28   1HG1  VAL   5          1HG1      VAL   5  10.586  -0.673  -3.932
   29   2HG1  VAL   5          2HG1      VAL   5  11.037  -0.288  -2.253
   30   3HG1  VAL   5          3HG1      VAL   5  10.669  -1.960  -2.728
   31   1HG2  VAL   5          1HG2      VAL   5   9.254  -0.508  -0.396
   32   2HG2  VAL   5          2HG2      VAL   5   7.656  -1.146  -0.827
   33   3HG2  VAL   5          3HG2      VAL   5   9.077  -2.185  -0.965
   34    H    ARG   6           HN       ARG   6   9.151   3.031  -3.433
   35    HA   ARG   6           HA       ARG   6   8.888   4.373  -5.268
   36   1HB   ARG   6          HB1       ARG   6  10.292   2.263  -6.759
   37   2HB   ARG   6          HB2       ARG   6  10.274   3.863  -7.084
   38   1HG   ARG   6          HG1       ARG   6  11.532   2.763  -4.747
   39   2HG   ARG   6          HG2       ARG   6  12.346   3.055  -6.132
   40   1HD   ARG   6          HD1       ARG   6  12.793   4.720  -4.527
   41   2HD   ARG   6          HD2       ARG   6  12.074   5.363  -5.845
   42    HE   ARG   6           HE       ARG   6  10.518   6.265  -4.536
   43   1HH1  ARG   6          2HH2      ARG   6  11.658   3.441  -2.755
   44   2HH1  ARG   6          1HH2      ARG   6  10.528   3.726  -1.474
   45   1HH2  ARG   6          2HH1      ARG   6   9.032   6.441  -2.953
   46   2HH2  ARG   6          1HH1      ARG   6   9.077   5.380  -1.585
   47    H    GLY   7           HN       GLY   7   6.697   3.212  -4.588
   48   1HA   GLY   7          HA2       GLY   7   4.517   3.404  -5.477
   49   2HA   GLY   7          HA1       GLY   7   5.119   3.078  -7.095
   50    H    ARG   8           HN       ARG   8   6.565   0.576  -5.454
   51    HA   ARG   8           HA       ARG   8   4.344  -1.250  -6.167
   52   1HB   ARG   8          HB1       ARG   8   7.253  -1.612  -5.760
   53   2HB   ARG   8          HB2       ARG   8   6.229  -2.863  -6.000
   54   1HG   ARG   8          HG1       ARG   8   7.176  -2.498  -8.033
   55   2HG   ARG   8          HG2       ARG   8   5.683  -1.846  -8.150
   56   1HD   ARG   8          HD1       ARG   8   6.549   0.314  -8.037
   57   2HD   ARG   8          HD2       ARG   8   8.040  -0.253  -7.685
   58    HE   ARG   8           HE       ARG   8   7.447  -1.394 -10.069
   59   1HH1  ARG   8          2HH2      ARG   8   7.855   1.970  -9.050
   60   2HH1  ARG   8          1HH2      ARG   8   8.299   2.465 -10.649
   61   1HH2  ARG   8          2HH1      ARG   8   8.021  -0.644 -12.068
   62   2HH2  ARG   8          1HH1      ARG   8   8.390   1.032 -12.304
   63    H    CYS   9           HN       CYS   9   4.099  -3.249  -4.813
   64    HA   CYS   9           HA       CYS   9   4.739  -2.978  -1.984
   65   1HB   CYS   9          HB1       CYS   9   1.989  -3.063  -3.066
   66   2HB   CYS   9          HB2       CYS   9   2.330  -3.498  -1.529
   67    HA   PRO  10           HA       PRO  10   5.179  -7.393  -2.155
   68   1HB   PRO  10          HB1       PRO  10   3.381  -7.573   0.169
   69   2HB   PRO  10          HB2       PRO  10   4.848  -8.258  -0.046
   70   1HG   PRO  10          HG1       PRO  10   4.670  -6.130   1.422
   71   2HG   PRO  10          HG2       PRO  10   5.961  -6.296   0.435
   72   1HD   PRO  10          HD1       PRO  10   3.616  -4.690   0.000
   73   2HD   PRO  10          HD2       PRO  10   5.157  -4.328  -0.401
   74    H    SER  11           HN       SER  11   4.182  -9.381  -2.681
   75    HA   SER  11           HA       SER  11   2.213  -9.430  -4.511
   76   1HB   SER  11          HB1       SER  11   2.943 -11.664  -2.721
   77   2HB   SER  11          HB2       SER  11   2.288 -11.797  -4.211
   78    HG   SER  11           HG       SER  11   4.498 -12.088  -4.339
   79    H    GLY  12           HN       GLY  12   0.236  -8.556  -4.222
   80   1HA   GLY  12          HA2       GLY  12  -2.075  -9.000  -3.869
   81   2HA   GLY  12          HA1       GLY  12  -1.688 -10.010  -2.480
   82    H    MET  13           HN       MET  13   0.159  -7.222  -2.080
   83    HA   MET  13           HA       MET  13  -1.879  -5.847  -0.412
   84   1HB   MET  13          HB1       MET  13   0.978  -5.249  -0.878
   85   2HB   MET  13          HB2       MET  13  -0.004  -4.418   0.129
   86   1HG   MET  13          HG1       MET  13  -0.299  -6.538   1.341
   87   2HG   MET  13          HG2       MET  13   0.975  -7.089   0.480
   88   1HE   MET  13          HE1       MET  13   2.558  -6.703   4.002
   89   2HE   MET  13          HE2       MET  13   0.916  -7.259   3.605
   90   3HE   MET  13          HE3       MET  13   2.303  -7.810   2.634
   91    H    CYS  14           HN       CYS  14  -2.055  -3.528  -0.639
   92    HA   CYS  14           HA       CYS  14  -1.895  -2.501  -3.460
   93   1HB   CYS  14          HB1       CYS  14  -3.870  -2.067  -1.317
   94   2HB   CYS  14          HB2       CYS  14  -3.741  -1.056  -2.594
   95    H    CYS  15           HN       CYS  15  -0.915  -0.554  -3.752
   96    HA   CYS  15           HA       CYS  15   0.334   0.913  -1.540
   97   1HB   CYS  15          HB1       CYS  15   1.369   0.926  -3.714
   98   2HB   CYS  15          HB2       CYS  15   0.041   1.572  -4.412
   99    H    SER  16           HN       SER  16  -0.999   1.960  -0.199
  100    HA   SER  16           HA       SER  16  -3.615   2.967  -1.031
  101   1HB   SER  16          HB1       SER  16  -3.774   3.672   1.228
  102   2HB   SER  16          HB2       SER  16  -3.189   2.147   1.206
  103    HG   SER  16           HG       SER  16  -1.272   2.740   1.868
  104    H    GLN  17           HN       GLN  17  -4.329   5.149  -0.719
  105    HA   GLN  17           HA       GLN  17  -2.865   7.145  -2.094
  106   1HB   GLN  17          HB1       GLN  17  -4.674   8.538  -1.419
  107   2HB   GLN  17          HB2       GLN  17  -5.262   7.084  -1.875
  108   1HG   GLN  17          HG1       GLN  17  -4.918   7.510   0.911
  109   2HG   GLN  17          HG2       GLN  17  -6.166   8.280   0.192
  110   1HE2  GLN  17          1HE2      GLN  17  -8.138   7.250   0.547
  111   2HE2  GLN  17          2HE2      GLN  17  -8.176   5.485   0.540
  112    H1   NAL  18           HD1      NAL  18  -3.591   5.069   3.026
  113    H3   NAL  18           HD2      NAL  18  -3.202   8.916   4.568
  114    H4   NAL  18           HE2      NAL  18  -5.569   8.992   4.996
  115    H5   NAL  18           HH2      NAL  18  -7.781   7.913   4.890
  116    H6   NAL  18           HP       NAL  18  -9.144   6.020   4.307
  117    H7   NAL  18           HH1      NAL  18  -8.148   4.099   3.253
  118    H8   NAL  18           HZ1      NAL  18  -5.788   4.074   2.790
  119   1H9   NAL  18          HB1       NAL  18  -1.377   5.906   3.426
  120   2H9   NAL  18          HB2       NAL  18  -1.162   7.440   4.257
  121    H10  NAL  18           HA       NAL  18  -1.473   8.688   2.211
  122   1HN   NAL  18          HN        NAL  18  -2.580   6.178   1.180
  123    H    GLY  19           HN       GLY  19  -0.218   6.315   0.125
  124   1HA   GLY  19          HA2       GLY  19   1.954   6.241  -0.728
  125   2HA   GLY  19          HA1       GLY  19   2.565   7.152   0.654
  126    H    TYR  20           HN       TYR  20   0.552   4.436   1.436
  127    HA   TYR  20           HA       TYR  20   2.958   2.793   2.144
  128   1HB   TYR  20          HB1       TYR  20   0.698   3.546   3.876
  129   2HB   TYR  20          HB2       TYR  20   1.693   2.299   4.223
  130    HD1  TYR  20           HD1      TYR  20   4.041   2.614   4.865
  131    HD2  TYR  20           HD2      TYR  20   1.361   5.895   4.124
  132    HE1  TYR  20           HE1      TYR  20   5.701   4.198   5.873
  133    HE2  TYR  20           HE2      TYR  20   3.000   7.468   5.096
  134    HH   TYR  20           HH       TYR  20   5.101   7.699   6.017
  135    H    CYS  21           HN       CYS  21   2.802   0.636   2.136
  136    HA   CYS  21           HA       CYS  21   0.779  -0.622   0.511
  137   1HB   CYS  21          HB1       CYS  21   3.060  -1.679   2.063
  138   2HB   CYS  21          HB2       CYS  21   2.187  -2.549   0.992
  139    H    GLY  22           HN       GLY  22  -0.714  -2.222   1.123
  140   1HA   GLY  22          HA2       GLY  22  -0.646  -3.751   3.460
  141   2HA   GLY  22          HA1       GLY  22  -1.687  -2.380   3.842
  142    H    LYS  23           HN       LYS  23  -3.266  -4.139   4.158
  143    HA   LYS  23           HA       LYS  23  -4.760  -4.823   1.687
  144   1HB   LYS  23          HB1       LYS  23  -4.056  -6.724   3.843
  145   2HB   LYS  23          HB2       LYS  23  -5.192  -7.023   2.708
  146   1HG   LYS  23          HG1       LYS  23  -3.383  -6.541   1.064
  147   2HG   LYS  23          HG2       LYS  23  -2.363  -6.754   2.321
  148   1HD   LYS  23          HD1       LYS  23  -2.495  -8.717   1.025
  149   2HD   LYS  23          HD2       LYS  23  -3.058  -8.990   2.534
  150   1HE   LYS  23          HE1       LYS  23  -4.370  -9.997   0.731
  151   2HE   LYS  23          HE2       LYS  23  -5.227  -9.119   1.810
  152   1HZ   LYS  23          HZ1       LYS  23  -5.946  -8.652  -0.383
  153   2HZ   LYS  23          HZ2       LYS  23  -5.463  -7.368   0.341
  154   3HZ   LYS  23          HZ3       LYS  23  -4.390  -8.069  -0.754
  155    H    GLY  24           HN       GLY  24  -7.009  -5.620   2.210
  156   1HA   GLY  24          HA2       GLY  24  -9.059  -5.313   3.207
  157   2HA   GLY  24          HA1       GLY  24  -8.255  -4.813   4.699
  158    HA   PRO  25           HA       PRO  25 -10.800  -1.427   2.556
  159   1HB   PRO  25          HB1       PRO  25 -11.472  -0.951   5.383
  160   2HB   PRO  25          HB2       PRO  25 -12.422  -0.792   4.064
  161   1HG   PRO  25          HG1       PRO  25 -12.657  -2.943   5.471
  162   2HG   PRO  25          HG2       PRO  25 -12.689  -3.085   3.844
  163   1HD   PRO  25          HD1       PRO  25 -10.479  -3.629   5.608
  164   2HD   PRO  25          HD2       PRO  25 -10.909  -4.461   4.271
  165    H    LYS  26           HN       LYS  26  -8.536  -1.164   5.253
  166    HA   LYS  26           HA       LYS  26  -8.119   1.692   4.960
  167   1HB   LYS  26          HB1       LYS  26  -6.928  -0.455   6.551
  168   2HB   LYS  26          HB2       LYS  26  -6.019   0.886   6.342
  169   1HG   LYS  26          HG1       LYS  26  -8.669   0.898   7.462
  170   2HG   LYS  26          HG2       LYS  26  -7.304   0.964   8.356
  171   1HD   LYS  26          HD1       LYS  26  -8.248   3.037   6.596
  172   2HD   LYS  26          HD2       LYS  26  -8.250   3.103   8.228
  173   1HE   LYS  26          HE1       LYS  26  -6.414   4.282   7.916
  174   2HE   LYS  26          HE2       LYS  26  -5.716   2.807   7.836
  175   1HZ   LYS  26          HZ1       LYS  26  -6.528   4.347   5.541
  176   2HZ   LYS  26          HZ2       LYS  26  -4.982   4.172   6.048
  177   3HZ   LYS  26          HZ3       LYS  26  -5.804   2.889   5.447
  178    H    TYR  27           HN       TYR  27  -7.073  -0.774   2.935
  179    HA   TYR  27           HA       TYR  27  -5.070   1.083   1.721
  180   1HB   TYR  27          HB1       TYR  27  -4.458  -1.730   2.378
  181   2HB   TYR  27          HB2       TYR  27  -3.481  -0.713   1.554
  182    HD1  TYR  27           HD1      TYR  27  -4.738  -1.607   4.842
  183    HD2  TYR  27           HD2      TYR  27  -2.014   0.865   2.610
  184    HE1  TYR  27           HE1      TYR  27  -3.507  -1.090   6.929
  185    HE2  TYR  27           HE2      TYR  27  -0.806   1.436   4.694
  186    HH   TYR  27           HH       TYR  27  -1.848   0.234   7.871
  187    H    CYS  28           HN       CYS  28  -6.885  -1.947   1.350
  188    HA   CYS  28           HA       CYS  28  -6.512  -1.909  -1.599
  189   1HB   CYS  28          HB1       CYS  28  -5.061  -3.313   0.033
  190   2HB   CYS  28          HB2       CYS  28  -6.352  -4.312   0.087
  191    H    GLY  29           HN       GLY  29  -8.844  -2.070   0.812
  192   1HA   GLY  29          HA2       GLY  29 -11.115  -2.661   0.770
  193   2HA   GLY  29          HA1       GLY  29 -10.931  -3.276  -0.874
  194    H    ARG  30           HN       ARG  30  -9.063  -5.156  -0.734
  195    HA   ARG  30           HA       ARG  30  -9.873  -7.189   1.302
  196   1HB   ARG  30          HB1       ARG  30 -11.237  -7.239  -0.756
  197   2HB   ARG  30          HB2       ARG  30  -9.905  -7.600  -1.630
  198   1HG   ARG  30          HG1       ARG  30 -10.193  -9.435   0.407
  199   2HG   ARG  30          HG2       ARG  30 -11.568  -9.368  -0.471
  200   1HD   ARG  30          HD1       ARG  30 -10.484 -10.007  -2.401
  201   2HD   ARG  30          HD2       ARG  30  -9.013  -9.713  -1.754
  202    HE   ARG  30           HE       ARG  30 -10.493 -12.107  -1.570
  203   1HH1  ARG  30          2HH2      ARG  30  -7.983 -10.268   0.108
  204   2HH1  ARG  30          1HH2      ARG  30  -7.377 -11.681   0.905
  205   1HH2  ARG  30          2HH1      ARG  30  -9.638 -13.856  -0.487
  206   2HH2  ARG  30          1HH1      ARG  30  -8.288 -13.655   0.578
  Start of MODEL   30
    1   1H    VAL   1           H1       VAL   1   4.444   0.756   3.013
    2   2H    VAL   1           H2       VAL   1   3.257   0.006   3.902
    3   3H    VAL   1           H3       VAL   1   4.771  -0.650   3.779
    4    HA   VAL   1           HA       VAL   1   4.175   1.913   5.078
    5    HB   VAL   1           HB       VAL   1   4.933   0.791   7.165
    6   1HG1  VAL   1          1HG1      VAL   1   2.541   1.219   6.645
    7   2HG1  VAL   1          2HG1      VAL   1   2.411  -0.419   5.959
    8   3HG1  VAL   1          3HG1      VAL   1   2.785  -0.199   7.674
    9   1HG2  VAL   1          1HG2      VAL   1   4.852  -1.631   7.384
   10   2HG2  VAL   1          2HG2      VAL   1   4.480  -1.836   5.668
   11   3HG2  VAL   1          3HG2      VAL   1   6.067  -1.206   6.175
   12    H    GLY   2           HN       GLY   2   6.060   2.933   6.073
   13   1HA   GLY   2          HA2       GLY   2   8.238   3.734   5.824
   14   2HA   GLY   2          HA1       GLY   2   8.689   2.298   4.894
   15    H    GLU   3           HN       GLU   3   7.027   2.137   2.899
   16    HA   GLU   3           HA       GLU   3   6.421   4.705   1.543
   17   1HB   GLU   3          HB1       GLU   3   7.827   2.435   0.260
   18   2HB   GLU   3          HB2       GLU   3   7.369   3.820  -0.473
   19   1HG   GLU   3          HG1       GLU   3   9.064   5.006   0.564
   20   2HG   GLU   3          HG2       GLU   3   9.440   3.731   1.513
   21    H    CYS   4           HN       CYS   4   4.936   4.204  -0.416
   22    HA   CYS   4           HA       CYS   4   4.148   1.358  -0.740
   23   1HB   CYS   4          HB1       CYS   4   3.715   3.682  -2.517
   24   2HB   CYS   4          HB2       CYS   4   3.294   2.141  -2.860
   25    H    VAL   5           HN       VAL   5   5.837   0.187  -1.396
   26    HA   VAL   5           HA       VAL   5   8.486   1.118  -1.598
   27    HB   VAL   5           HB       VAL   5   7.308  -1.483  -2.634
   28   1HG1  VAL   5          1HG1      VAL   5   9.608  -2.379  -2.254
   29   2HG1  VAL   5          2HG1      VAL   5   9.585  -1.143  -3.510
   30   3HG1  VAL   5          3HG1      VAL   5  10.175  -0.736  -1.881
   31   1HG2  VAL   5          1HG2      VAL   5   6.791  -1.200  -0.246
   32   2HG2  VAL   5          2HG2      VAL   5   8.056  -2.411  -0.444
   33   3HG2  VAL   5          3HG2      VAL   5   8.484  -0.772   0.092
   34    H    ARG   6           HN       ARG   6   8.992   2.627  -3.046
   35    HA   ARG   6           HA       ARG   6   8.974   3.867  -4.988
   36   1HB   ARG   6          HB1       ARG   6   9.786   1.350  -6.296
   37   2HB   ARG   6          HB2       ARG   6  10.240   2.869  -6.689
   38   1HG   ARG   6          HG1       ARG   6  11.097   1.432  -4.342
   39   2HG   ARG   6          HG2       ARG   6  12.029   1.751  -5.645
   40   1HD   ARG   6          HD1       ARG   6  12.541   3.765  -4.924
   41   2HD   ARG   6          HD2       ARG   6  11.018   4.064  -4.417
   42    HE   ARG   6           HE       ARG   6  11.438   3.257  -2.307
   43   1HH1  ARG   6          2HH2      ARG   6  14.313   2.794  -4.337
   44   2HH1  ARG   6          1HH2      ARG   6  15.319   2.475  -2.963
   45   1HH2  ARG   6          2HH1      ARG   6  12.822   2.868  -0.630
   46   2HH2  ARG   6          1HH1      ARG   6  14.494   2.516  -0.916
   47    H    GLY   7           HN       GLY   7   6.468   3.195  -4.351
   48   1HA   GLY   7          HA2       GLY   7   4.475   3.953  -5.419
   49   2HA   GLY   7          HA1       GLY   7   5.047   3.347  -6.969
   50    H    ARG   8           HN       ARG   8   5.683   0.824  -4.855
   51    HA   ARG   8           HA       ARG   8   3.126  -0.558  -5.553
   52   1HB   ARG   8          HB1       ARG   8   5.983  -1.218  -5.944
   53   2HB   ARG   8          HB2       ARG   8   4.826  -2.368  -6.015
   54   1HG   ARG   8          HG1       ARG   8   3.989  -1.587  -7.956
   55   2HG   ARG   8          HG2       ARG   8   4.532  -0.070  -7.688
   56   1HD   ARG   8          HD1       ARG   8   6.417  -2.167  -8.198
   57   2HD   ARG   8          HD2       ARG   8   5.676  -1.434  -9.455
   58    HE   ARG   8           HE       ARG   8   6.807   0.528  -7.792
   59   1HH1  ARG   8          2HH2      ARG   8   7.858  -1.812 -10.212
   60   2HH1  ARG   8          1HH2      ARG   8   9.192  -0.814 -10.685
   61   1HH2  ARG   8          2HH1      ARG   8   8.471   1.739  -8.483
   62   2HH2  ARG   8          1HH1      ARG   8   9.532   1.161  -9.724
   63    H    CYS   9           HN       CYS   9   3.411  -2.924  -4.601
   64    HA   CYS   9           HA       CYS   9   4.756  -3.142  -2.096
   65   1HB   CYS   9          HB1       CYS   9   2.095  -2.527  -1.937
   66   2HB   CYS   9          HB2       CYS   9   2.099  -4.154  -1.792
   67    HA   PRO  10           HA       PRO  10   5.043  -7.283  -3.806
   68   1HB   PRO  10          HB1       PRO  10   4.284  -8.548  -1.293
   69   2HB   PRO  10          HB2       PRO  10   5.659  -8.725  -2.158
   70   1HG   PRO  10          HG1       PRO  10   5.673  -7.331   0.053
   71   2HG   PRO  10          HG2       PRO  10   6.642  -6.902  -1.190
   72   1HD   PRO  10          HD1       PRO  10   4.113  -5.738  -0.455
   73   2HD   PRO  10          HD2       PRO  10   5.446  -4.960  -0.991
   74    H    SER  11           HN       SER  11   3.930  -9.313  -4.280
   75    HA   SER  11           HA       SER  11   1.320  -9.021  -5.258
   76   1HB   SER  11          HB1       SER  11   1.532 -11.411  -5.617
   77   2HB   SER  11          HB2       SER  11   2.909 -10.649  -6.054
   78    HG   SER  11           HG       SER  11   2.552 -11.737  -3.557
   79    H    GLY  12           HN       GLY  12  -0.352  -8.560  -3.951
   80   1HA   GLY  12          HA2       GLY  12  -2.174  -9.652  -2.690
   81   2HA   GLY  12          HA1       GLY  12  -0.963 -10.357  -1.627
   82    H    MET  13           HN       MET  13   0.227  -7.252  -2.144
   83    HA   MET  13           HA       MET  13  -1.496  -6.017  -0.024
   84   1HB   MET  13          HB1       MET  13   1.381  -5.881  -0.569
   85   2HB   MET  13          HB2       MET  13   0.625  -4.647   0.189
   86   1HG   MET  13          HG1       MET  13   1.735  -6.106   1.685
   87   2HG   MET  13          HG2       MET  13   0.140  -5.957   2.002
   88   1HE   MET  13          HE1       MET  13   1.917  -8.277  -0.589
   89   2HE   MET  13          HE2       MET  13   2.983  -8.265   0.837
   90   3HE   MET  13          HE3       MET  13   2.104  -9.746   0.387
   91    H    CYS  14           HN       CYS  14  -1.390  -3.621  -0.208
   92    HA   CYS  14           HA       CYS  14  -1.635  -2.609  -3.000
   93   1HB   CYS  14          HB1       CYS  14  -3.861  -1.726  -2.225
   94   2HB   CYS  14          HB2       CYS  14  -3.761  -3.280  -2.717
   95    H    CYS  15           HN       CYS  15  -1.952  -0.272  -3.161
   96    HA   CYS  15           HA       CYS  15  -0.234   1.098  -1.173
   97   1HB   CYS  15          HB1       CYS  15   0.566   1.009  -3.412
   98   2HB   CYS  15          HB2       CYS  15  -0.802   1.673  -4.007
   99    H    SER  16           HN       SER  16  -1.259   2.376   0.289
  100    HA   SER  16           HA       SER  16  -4.023   3.014  -0.016
  101   1HB   SER  16          HB1       SER  16  -3.775   4.163   2.061
  102   2HB   SER  16          HB2       SER  16  -2.945   2.759   2.155
  103    HG   SER  16           HG       SER  16  -1.148   3.682   2.349
  104    H    GLN  17           HN       GLN  17  -5.014   4.939   0.259
  105    HA   GLN  17           HA       GLN  17  -4.605   7.216  -1.309
  106   1HB   GLN  17          HB1       GLN  17  -6.358   8.038   0.106
  107   2HB   GLN  17          HB2       GLN  17  -6.660   6.485  -0.299
  108   1HG   GLN  17          HG1       GLN  17  -5.639   6.000   1.980
  109   2HG   GLN  17          HG2       GLN  17  -6.069   7.546   2.289
  110   1HE2  GLN  17          1HE2      GLN  17  -7.137   4.393   2.640
  111   2HE2  GLN  17          2HE2      GLN  17  -8.868   4.749   2.639
  112    H1   NAL  18           HD1      NAL  18  -2.877   5.610   4.251
  113    H3   NAL  18           HD2      NAL  18  -3.363   9.732   3.908
  114    H4   NAL  18           HE2      NAL  18  -5.558   9.569   4.882
  115    H5   NAL  18           HH2      NAL  18  -7.359   8.190   5.815
  116    H6   NAL  18           HP       NAL  18  -8.168   6.040   6.541
  117    H7   NAL  18           HH1      NAL  18  -6.795   4.088   6.265
  118    H8   NAL  18           HZ1      NAL  18  -4.647   4.253   5.198
  119   1H9   NAL  18          HB1       NAL  18  -1.117   6.895   3.433
  120   2H9   NAL  18          HB2       NAL  18  -1.034   8.476   3.836
  121    H10  NAL  18           HA       NAL  18  -1.838   9.227   1.793
  122   1HN   NAL  18          HN        NAL  18  -2.586   6.382   1.262
  123    H    GLY  19           HN       GLY  19  -0.920   6.729  -0.231
  124   1HA   GLY  19          HA2       GLY  19   1.046   6.410  -1.424
  125   2HA   GLY  19          HA1       GLY  19   1.806   7.732  -0.537
  126    H    TYR  20           HN       TYR  20   0.353   5.199   1.311
  127    HA   TYR  20           HA       TYR  20   2.976   3.858   1.884
  128   1HB   TYR  20          HB1       TYR  20   1.100   5.106   3.670
  129   2HB   TYR  20          HB2       TYR  20   1.455   3.571   4.101
  130    HD1  TYR  20           HD1      TYR  20   2.673   3.825   6.134
  131    HD2  TYR  20           HD2      TYR  20   3.696   6.088   2.596
  132    HE1  TYR  20           HE1      TYR  20   4.821   4.550   7.192
  133    HE2  TYR  20           HE2      TYR  20   5.833   6.743   3.627
  134    HH   TYR  20           HH       TYR  20   7.325   6.019   5.253
  135    H    CYS  21           HN       CYS  21   2.947   1.655   1.513
  136    HA   CYS  21           HA       CYS  21   0.310   0.540   0.827
  137   1HB   CYS  21          HB1       CYS  21   1.408  -1.031  -0.356
  138   2HB   CYS  21          HB2       CYS  21   2.229   0.357  -0.620
  139    H    GLY  22           HN       GLY  22  -0.337  -1.637   1.312
  140   1HA   GLY  22          HA2       GLY  22   0.272  -3.055   3.725
  141   2HA   GLY  22          HA1       GLY  22  -0.930  -1.798   4.051
  142    H    LYS  23           HN       LYS  23  -2.720  -3.261   4.394
  143    HA   LYS  23           HA       LYS  23  -3.689  -4.726   1.984
  144   1HB   LYS  23          HB1       LYS  23  -3.539  -5.905   4.707
  145   2HB   LYS  23          HB2       LYS  23  -4.235  -6.611   3.409
  146   1HG   LYS  23          HG1       LYS  23  -2.102  -6.773   2.364
  147   2HG   LYS  23          HG2       LYS  23  -1.414  -6.092   3.679
  148   1HD   LYS  23          HD1       LYS  23  -1.043  -8.320   3.971
  149   2HD   LYS  23          HD2       LYS  23  -2.312  -8.006   4.950
  150   1HE   LYS  23          HE1       LYS  23  -2.850  -9.969   3.904
  151   2HE   LYS  23          HE2       LYS  23  -3.747  -8.835   3.144
  152   1HZ   LYS  23          HZ1       LYS  23  -2.319  -8.838   1.295
  153   2HZ   LYS  23          HZ2       LYS  23  -1.231  -9.742   2.104
  154   3HZ   LYS  23          HZ3       LYS  23  -2.672 -10.396   1.640
  155    H    GLY  24           HN       GLY  24  -5.903  -5.258   2.008
  156   1HA   GLY  24          HA2       GLY  24  -8.136  -5.142   2.601
  157   2HA   GLY  24          HA1       GLY  24  -7.705  -4.319   4.106
  158    HA   PRO  25           HA       PRO  25 -10.027  -1.739   0.820
  159   1HB   PRO  25          HB1       PRO  25 -11.347  -0.887   3.316
  160   2HB   PRO  25          HB2       PRO  25 -11.989  -1.037   1.821
  161   1HG   PRO  25          HG1       PRO  25 -12.356  -2.965   3.499
  162   2HG   PRO  25          HG2       PRO  25 -12.023  -3.350   1.947
  163   1HD   PRO  25          HD1       PRO  25 -10.229  -3.408   4.193
  164   2HD   PRO  25          HD2       PRO  25 -10.269  -4.437   2.925
  165    H    LYS  26           HN       LYS  26  -8.955  -0.548   3.984
  166    HA   LYS  26           HA       LYS  26  -8.571   2.166   3.437
  167   1HB   LYS  26          HB1       LYS  26  -7.223   0.324   5.322
  168   2HB   LYS  26          HB2       LYS  26  -6.996   1.940   5.366
  169   1HG   LYS  26          HG1       LYS  26  -9.657   0.870   5.540
  170   2HG   LYS  26          HG2       LYS  26  -8.739   0.974   6.886
  171   1HD   LYS  26          HD1       LYS  26  -8.861   3.212   6.955
  172   2HD   LYS  26          HD2       LYS  26  -9.063   3.345   5.340
  173   1HE   LYS  26          HE1       LYS  26 -11.182   2.218   6.890
  174   2HE   LYS  26          HE2       LYS  26 -11.017   3.842   6.859
  175   1HZ   LYS  26          HZ1       LYS  26 -11.427   2.206   4.482
  176   2HZ   LYS  26          HZ2       LYS  26 -12.542   3.231   5.160
  177   3HZ   LYS  26          HZ3       LYS  26 -11.128   3.726   4.427
  178    H    TYR  27           HN       TYR  27  -6.567  -0.446   2.417
  179    HA   TYR  27           HA       TYR  27  -4.505   1.416   1.329
  180   1HB   TYR  27          HB1       TYR  27  -4.359  -1.451   1.983
  181   2HB   TYR  27          HB2       TYR  27  -3.182  -0.638   1.195
  182    HD1  TYR  27           HD1      TYR  27  -4.925  -0.935   4.405
  183    HD2  TYR  27           HD2      TYR  27  -1.584   0.746   2.286
  184    HE1  TYR  27           HE1      TYR  27  -3.913  -0.222   6.568
  185    HE2  TYR  27           HE2      TYR  27  -0.574   1.482   4.435
  186    HH   TYR  27           HH       TYR  27  -0.837   1.567   6.727
  187    H    CYS  28           HN       CYS  28  -6.836  -1.094   0.494
  188    HA   CYS  28           HA       CYS  28  -5.966  -1.217  -2.297
  189   1HB   CYS  28          HB1       CYS  28  -7.959  -2.584  -0.653
  190   2HB   CYS  28          HB2       CYS  28  -7.895  -2.809  -2.269
  191    H    GLY  29           HN       GLY  29  -8.190   0.845  -0.670
  192   1HA   GLY  29          HA2       GLY  29  -8.373   2.476  -2.913
  193   2HA   GLY  29          HA1       GLY  29  -9.805   1.467  -3.034
  194    H    ARG  30           HN       ARG  30 -10.076   1.519   0.095
  195    HA   ARG  30           HA       ARG  30 -10.721   4.293   0.582
  196   1HB   ARG  30          HB1       ARG  30 -12.656   3.142  -0.659
  197   2HB   ARG  30          HB2       ARG  30 -12.966   2.393   0.759
  198   1HG   ARG  30          HG1       ARG  30 -14.291   4.156   1.027
  199   2HG   ARG  30          HG2       ARG  30 -12.918   4.790   1.644
  200   1HD   ARG  30          HD1       ARG  30 -14.017   5.307  -0.970
  201   2HD   ARG  30          HD2       ARG  30 -13.815   6.396   0.230
  202    HE   ARG  30           HE       ARG  30 -11.802   5.437  -1.579
  203   1HH1  ARG  30          2HH2      ARG  30 -12.168   7.272   1.425
  204   2HH1  ARG  30          1HH2      ARG  30 -10.490   7.700   1.396
  205   1HH2  ARG  30          2HH1      ARG  30  -9.731   5.913  -1.409
  206   2HH2  ARG  30          1HH1      ARG  30  -9.159   6.952  -0.147