*HEADER    ANTIFUNGAL PROTEIN                      28-MAR-17   5XDI              
*TITLE     VACCATIDE: ANTIFUNGAL GLUTAMINE-RICH 8C-HEVEIN-LIKE PEPTIDE, VH1      
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: VACCATIDE, VH1;                                            
*COMPND   3 CHAIN: A                                                             
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: VACCARIA HISPANICA;                             
*SOURCE   3 ORGANISM_TAXID: 39387                                                
*KEYWDS    HEVEIN-LIKE PEPTIDE, CYSTEIN, ANTIFUNGAL, VACCARIA HISPANICA,         
*KEYWDS   2 ANTIFUNGAL PROTEIN                                                   
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    T.XIAO,J.P.TAM                                                        
*REVDAT   1   19-JUL-17 5XDI    0                                                
# Restraints file 1: angel.txt
assign (resid   29 and name C    ) (resid   30 and name N    )
       (resid   30 and name CA   ) (resid   30 and name C    )    1.0  -160.4   20.0 2
assign (resid   17 and name C    ) (resid   18 and name N    )
       (resid   18 and name CA   ) (resid   18 and name C    )    1.0  -160.0   20.0 2
assign (resid   16 and name C    ) (resid   17 and name N    )
       (resid   17 and name CA   ) (resid   17 and name C    )    1.0  -160.0   20.0 2
assign (resid   8 and name C    ) (resid   9 and name N    )
       (resid   9 and name CA   ) (resid   9 and name C    )    1.0  -160.0   20.0 2
assign (resid   10 and name C    ) (resid   11 and name N    )
       (resid   11 and name CA   ) (resid   11 and name C    )    1.0  -160.0   20.0 2
assign (resid   13 and name C    ) (resid   14 and name N    )
       (resid   14 and name CA   ) (resid   14 and name C    )    1.0  -100.0   40.0 2
assign (resid   25 and name C    ) (resid   26 and name N    )
       (resid   26 and name CA   ) (resid   26 and name C    )    1.0  -140.0   20.0 2
assign (resid   34 and name C    ) (resid   35 and name N    )
       (resid   35 and name CA   ) (resid   35 and name C    )    1.0  -140.0   20.0 2
assign (resid   22 and name C    ) (resid   23 and name N    )
       (resid   23 and name CA   ) (resid   23 and name C    )    1.0  -140.0   20.0 2

# Restraints file 2: hbond.txt
assign (resid 19 and name O) (resid 23 and name HN) 2.2 0.6 0.5
assign (resid 19 and name O) (resid 23 and name N) 3.3 0.8 0.2
assign (resid 17 and name O) (resid 25 and name HN) 2.2 0.6 0.5
assign (resid 17 and name O) (resid 25 and name N) 3.3 0.8 0.2
assign (resid 4 and name O) (resid 8 and name HN) 2.2 0.6 0.5
assign (resid 4 and name O) (resid 8 and name N) 3.3 0.8 0.2
assign (resid 28 and name O) (resid 31 and name HN) 2.2 0.6 0.5
assign (resid 28 and name O) (resid 31 and name N) 3.3 0.8 0.2
# Restraints file 3: vh_noe.txt
assign (resid 23 and name HD#) (resid 2 and name HN) 5 3.4 1
assign (resid 7 and name HB#) (resid 2 and name HN) 5 3.4 1
assign (resid 1 and name HD#) (resid 2 and name HN) 3.4 1.8 1
assign (resid 2 and name HB#) (resid 2 and name HN) 3.4 1.8 0.6
assign (resid 1 and name HB#) (resid 2 and name HN) 3.4 1.8 1
assign (resid 23 and name HA) (resid 2 and name HN) 5 3.4 0
assign (resid 2 and name HG#) (resid 2 and name HN) 3.4 1.8 1
assign (resid 2 and name HA) (resid 2 and name HN) 3.4 1.8 0
assign (resid 1 and name HA) (resid 2 and name HN) 3.4 1.8 0
assign (resid 3 and name HN) (resid 2 and name HN) 5 3.4 0
assign (resid 4 and name HN) (resid 3 and name HN) 5 3.4 0
assign (resid 3 and name HB#) (resid 3 and name HN) 5 3.4 0.6
assign (resid 1 and name HA) (resid 3 and name HN) 5 3.4 0
assign (resid 23 and name HA) (resid 3 and name HN) 5 3.4 0
assign (resid 2 and name HB#) (resid 3 and name HN) 3.4 1.8 1
assign (resid 1 and name HB#) (resid 3 and name HN) 5 3.4 1
assign (resid 2 and name HA) (resid 3 and name HN) 3.4 1.8 0
assign (resid 3 and name HA) (resid 3 and name HN) 3.4 1.8 0
assign (resid 7 and name HB#) (resid 3 and name HN) 5 1.8 1
assign (resid 10 and name HB#) (resid 3 and name HN) 5 1.8 1
assign (resid 11 and name HA) (resid 4 and name HN) 5 3.4 0
assign (resid 7 and name HB#) (resid 4 and name HN) 5 3.4 1
assign (resid 10 and name HB#) (resid 4 and name HN) 5 3.4 1
assign (resid 10 and name HN) (resid 4 and name HN) 5 3.4 0
assign (resid 3 and name HA) (resid 4 and name HN) 3.4 1.8 0
assign (resid 3 and name HB#) (resid 4 and name HN) 3.4 1.8 1
assign (resid 4 and name HA#) (resid 4 and name HN) 3.4 1.8 0.6
assign (resid 4 and name HN) (resid 5 and name HN) 5 3.4 0
assign (resid 5 and name HD#) (resid 5 and name HN) 5 3.4 1
assign (resid 37 and name HD#) (resid 5 and name HN) 5 3.4 1
assign (resid 5 and name HB#) (resid 5 and name HN) 3.4 1.8 0.6
assign (resid 5 and name HG#) (resid 5 and name HN) 3.4 1.8 1
assign (resid 4 and name HA#) (resid 5 and name HN) 3.4 1.8 1
assign (resid 5 and name HA) (resid 5 and name HN) 3.4 1.8 0
assign (resid 4 and name HA#) (resid 5 and name HN) 3.4 1.8 1
assign (resid 37 and name HD#) (resid 6 and name HN) 5 3.4 1
assign (resid 5 and name HB#) (resid 6 and name HN) 5 1.8 1
assign (resid 5 and name HG#) (resid 6 and name HN) 5 1.8 1
assign (resid 5 and name HA) (resid 6 and name HN) 3.4 1.8 0
assign (resid 6 and name HG#) (resid 6 and name HN) 3.4 1.8 1
assign (resid 6 and name HA) (resid 6 and name HN) 3.4 1.8 0
assign (resid 6 and name HG#) (resid 6 and name HN) 3.4 1.8 1
assign (resid 6 and name HB#) (resid 6 and name HN) 3.4 1.8 0.6
assign (resid 7 and name HN) (resid 6 and name HN) 5 3.4 0
assign (resid 22 and name HA#) (resid 7 and name HN) 5 3.4 1
assign (resid 5 and name HG#) (resid 7 and name HN) 5 3.4 1
assign (resid 9 and name HN) (resid 7 and name HN) 5 3.4 0
assign (resid 7 and name HA) (resid 7 and name HN) 3.4 1.8 0
assign (resid 8 and name HN) (resid 7 and name HN) 3.4 1.8 0
assign (resid 7 and name HB#) (resid 7 and name HN) 3.4 1.8 0.6
assign (resid 5 and name HA) (resid 8 and name HN) 5 3.4 0
assign (resid 7 and name HB#) (resid 8 and name HN) 3.4 1.8 1
assign (resid 7 and name HA) (resid 8 and name HN) 3.4 1.8 0
assign (resid 8 and name HA#) (resid 8 and name HN) 3.4 1.8 0.6
assign (resid 10 and name HB#) (resid 9 and name HN) 5 3.4 1
assign (resid 7 and name HB#) (resid 9 and name HN) 5 3.4 1
assign (resid 5 and name HA) (resid 9 and name HN) 5 3.4 0
assign (resid 8 and name HA#) (resid 9 and name HN) 3.4 1.8 1
assign (resid 8 and name HN) (resid 9 and name HN) 5 3.4 0
assign (resid 9 and name HA#) (resid 9 and name HN) 3.4 1.8 0.6
assign (resid 10 and name HN) (resid 9 and name HN) 5 3.4 0
assign (resid 3 and name HA) (resid 10 and name HN) 5 3.4 0
assign (resid 11 and name HN) (resid 10 and name HN) 5 3.4 0
assign (resid 9 and name HA#) (resid 10 and name HN) 3.4 1.8 1
assign (resid 8 and name HA#) (resid 10 and name HN) 5 3.4 1
assign (resid 10 and name HA) (resid 10 and name HN) 3.4 1.8 0
assign (resid 10 and name HB#) (resid 10 and name HN) 3.4 1.8 0.6
assign (resid 12 and name HN) (resid 11 and name HN) 5 3.4 0
assign (resid 11 and name HB#) (resid 11 and name HN) 3.4 1.8 0.6
assign (resid 11 and name HG#) (resid 11 and name HN) 3.4 1.8 1
assign (resid 11 and name HA) (resid 11 and name HN) 3.4 1.8 0
assign (resid 10 and name HA) (resid 11 and name HN) 3.4 1.8 0
assign (resid 13 and name HN) (resid 12 and name HN) 5 3.4 0
assign (resid 18 and name HB#) (resid 12 and name HN) 5 3.4 1
assign (resid 11 and name HG#) (resid 12 and name HN) 3.4 1.8 1
assign (resid 12 and name HB#) (resid 12 and name HN) 3.4 1.8 0.6
assign (resid 12 and name HA) (resid 12 and name HN) 3.4 1.8 0
assign (resid 11 and name HB#) (resid 12 and name HN) 3.4 1.8 1
assign (resid 39 and name HD#) (resid 12 and name HN) 5 3.4 1
assign (resid 11 and name HA) (resid 12 and name HN) 3.4 1.8 0
assign (resid 14 and name HB#) (resid 13 and name HN) 5 3.4 1
assign (resid 14 and name HN) (resid 13 and name HN) 5 3.4 0
assign (resid 16 and name HB#) (resid 13 and name HN) 5 3.4 1
assign (resid 13 and name HB#) (resid 13 and name HN) 3.4 1.8 0.6
assign (resid 12 and name HB#) (resid 13 and name HN) 3.4 1.8 1
assign (resid 13 and name HA) (resid 13 and name HN) 3.4 1.8 0
assign (resid 12 and name HA) (resid 13 and name HN) 3.4 1.8 0
assign (resid 14 and name HB#) (resid 14 and name HN) 3.4 1.8 0.6
assign (resid 15 and name HN) (resid 14 and name HN) 5 3.4 0
assign (resid 13 and name HB#) (resid 14 and name HN) 3.4 1.8 1
assign (resid 14 and name HA) (resid 14 and name HN) 3.4 1.8 0
assign (resid 13 and name HA) (resid 14 and name HN) 3.4 1.8 0
assign (resid 14 and name HB#) (resid 15 and name HN) 3.4 1.8 1
assign (resid 15 and name HA#) (resid 15 and name HN) 3.4 1.8 0.6
assign (resid 16 and name HN) (resid 15 and name HN) 5 3.4 0
assign (resid 14 and name HA) (resid 15 and name HN) 3.4 1.8 0
assign (resid 14 and name HB#) (resid 16 and name HN) 5 3.4 1
assign (resid 12 and name HB#) (resid 16 and name HN) 5 3.4 1
assign (resid 14 and name HA) (resid 16 and name HN) 5 3.4 0
assign (resid 15 and name HA#) (resid 16 and name HN) 3.4 1.8 1
assign (resid 16 and name HD##) (resid 16 and name HN) 3.4 1.8 1.7
assign (resid 16 and name HA) (resid 16 and name HN) 3.4 1.8 0
assign (resid 16 and name HG) (resid 16 and name HN) 3.4 1.8 0
assign (resid 16 and name HB#) (resid 16 and name HN) 3.4 1.8 0.6
assign (resid 24 and name HA) (resid 17 and name HN) 5 3.4 0
assign (resid 16 and name HG) (resid 17 and name HN) 3.4 1.8 0
assign (resid 16 and name HB#) (resid 17 and name HN) 3.4 1.8 1
assign (resid 26 and name HA) (resid 17 and name HN) 5 3.4 0
assign (resid 17 and name HB#) (resid 17 and name HN) 3.4 1.8 0.6
assign (resid 17 and name HA) (resid 17 and name HN) 3.4 1.8 0
assign (resid 16 and name HD##) (resid 17 and name HN) 3.4 1.8 2.4
assign (resid 25 and name HN) (resid 17 and name HN) 5 3.4 0
assign (resid 16 and name HA) (resid 17 and name HN) 3.4 1.8 0
assign (resid 37 and name HN) (resid 18 and name HN) 5 3.4 0
assign (resid 37 and name HB#) (resid 18 and name HN) 5 3.4 1
assign (resid 18 and name HA) (resid 18 and name HN) 3.4 1.8 0
assign (resid 39 and name HB#) (resid 18 and name HN) 5 3.4 1
assign (resid 38 and name HN) (resid 18 and name HN) 5 3.4 0
assign (resid 17 and name HB#) (resid 18 and name HN) 3.4 1.8 1
assign (resid 18 and name HB#) (resid 18 and name HN) 3.4 1.8 0.6
assign (resid 17 and name HA) (resid 18 and name HN) 3.4 1.8 0
assign (resid 18 and name HB#) (resid 19 and name HN) 3.4 1.8 1
assign (resid 20 and name HN) (resid 19 and name HN) 5 3.4 0
assign (resid 30 and name HB#) (resid 19 and name HN) 5 3.4 1
assign (resid 25 and name HN) (resid 19 and name HN) 5 3.4 0
assign (resid 18 and name HN) (resid 19 and name HN) 5 3.4 0
assign (resid 22 and name HN) (resid 19 and name HN) 5 3.4 0
assign (resid 30 and name HA) (resid 19 and name HN) 5 3.4 0
assign (resid 24 and name HA) (resid 19 and name HN) 5 3.4 0
assign (resid 19 and name HB#) (resid 19 and name HN) 3.4 1.8 0.6
assign (resid 23 and name HN) (resid 19 and name HN) 5 3.4 0
assign (resid 30 and name HD#) (resid 19 and name HN) 5 3.4 1
assign (resid 19 and name HA) (resid 19 and name HN) 3.4 1.8 0
assign (resid 18 and name HA) (resid 19 and name HN) 3.4 1.8 0
assign (resid 37 and name HA) (resid 20 and name HN) 5 3.4 0
assign (resid 37 and name HN) (resid 20 and name HN) 5 3.4 0
assign (resid 21 and name HN) (resid 20 and name HN) 5 3.4 0
assign (resid 20 and name HG#) (resid 20 and name HN) 3.4 1.8 1
assign (resid 20 and name HA) (resid 20 and name HN) 3.4 1.8 0
assign (resid 19 and name HB#) (resid 20 and name HN) 3.4 1.8 1
assign (resid 20 and name HB#) (resid 20 and name HN) 3.4 1.8 0.6
assign (resid 19 and name HA) (resid 20 and name HN) 3.4 1.8 0
assign (resid 20 and name HG#) (resid 21 and name HN) 5 1.8 1
assign (resid 19 and name HA) (resid 21 and name HN) 5 3.4 0
assign (resid 20 and name HB#) (resid 21 and name HN) 3.4 1.8 1
assign (resid 20 and name HA) (resid 21 and name HN) 3.4 1.8 0
assign (resid 21 and name HA) (resid 21 and name HN) 3.4 1.8 0
assign (resid 19 and name HB#) (resid 21 and name HN) 5 3.4 1
assign (resid 21 and name HB#) (resid 21 and name HN) 3.4 1.8 0.6
assign (resid 21 and name HD#) (resid 21 and name HN) 3.4 1.8 1
assign (resid 22 and name HN) (resid 21 and name HN) 5 3.4 0
assign (resid 20 and name HA) (resid 22 and name HN) 5 3.4 0
assign (resid 23 and name HD#) (resid 22 and name HN) 5 3.4 1
assign (resid 21 and name HD#) (resid 22 and name HN) 5 3.4 1
assign (resid 21 and name HB#) (resid 22 and name HN) 5 3.4 1
assign (resid 21 and name HA) (resid 22 and name HN) 3.4 1.8 0
assign (resid 37 and name HD#) (resid 22 and name HN) 5 3.4 1
assign (resid 22 and name HA#) (resid 22 and name HN) 3.4 1.8 0.6
assign (resid 22 and name HA#) (resid 23 and name HN) 3.4 1.8 1
assign (resid 6 and name HG#) (resid 23 and name HN) 5 3.4 1
assign (resid 1 and name HD#) (resid 23 and name HN) 5 3.4 1
assign (resid 23 and name HA) (resid 23 and name HN) 3.4 1.8 0
assign (resid 23 and name HD#) (resid 23 and name HN) 3.4 1.8 1
assign (resid 23 and name HB#) (resid 23 and name HN) 3.4 1.8 0.6
assign (resid 2 and name HG#) (resid 24 and name HN) 5 3.4 1
assign (resid 25 and name HN) (resid 24 and name HN) 5 3.4 0
assign (resid 2 and name HB#) (resid 24 and name HN) 5 3.4 1
assign (resid 23 and name HD#) (resid 24 and name HN) 3.4 1.8 1
assign (resid 23 and name HB#) (resid 24 and name HN) 3.4 1.8 1
assign (resid 24 and name HA) (resid 24 and name HN) 3.4 1.8 0
assign (resid 23 and name HA) (resid 24 and name HN) 3.4 1.8 0
assign (resid 24 and name HB#) (resid 24 and name HN) 3.4 1.8 0.6
assign (resid 26 and name HA) (resid 25 and name HN) 5 3.4 0
assign (resid 18 and name HA) (resid 25 and name HN) 5 3.4 0
assign (resid 16 and name HB#) (resid 25 and name HN) 5 3.4 1
assign (resid 30 and name HB#) (resid 25 and name HN) 5 3.4 1
assign (resid 31 and name HB#) (resid 25 and name HN) 5 3.4 1
assign (resid 25 and name HA#) (resid 25 and name HN) 3.4 1.8 0.6
assign (resid 16 and name HD##) (resid 25 and name HN) 5 3.4 2.4
assign (resid 24 and name HB#) (resid 25 and name HN) 3.4 1.8 1
assign (resid 24 and name HA) (resid 25 and name HN) 3.4 1.8 0
assign (resid 25 and name HN) (resid 26 and name HN) 5 3.4 0
assign (resid 16 and name HD##) (resid 26 and name HN) 5 3.4 2.4
assign (resid 26 and name HB#) (resid 26 and name HN) 3.4 1.8 0.6
assign (resid 26 and name HA) (resid 26 and name HN) 3.4 1.8 0
assign (resid 28 and name HD#) (resid 26 and name HN) 5 3.4 1
assign (resid 25 and name HA#) (resid 26 and name HN) 3.4 1.8 1
assign (resid 27 and name HN) (resid 26 and name HN) 5 3.4 0
assign (resid 26 and name HB#) (resid 27 and name HN) 3.4 1.8 1
assign (resid 27 and name HA) (resid 27 and name HN) 3.4 1.8 0
assign (resid 25 and name HA#) (resid 27 and name HN) 5 3.4 1
assign (resid 30 and name HB#) (resid 27 and name HN) 5 3.4 1
assign (resid 26 and name HA) (resid 27 and name HN) 3.4 1.8 0
assign (resid 27 and name HG#) (resid 27 and name HN) 3.4 1.8 1
assign (resid 27 and name HN) (resid 30 and name HN) 5 3.4 0
assign (resid 31 and name HB#) (resid 30 and name HN) 5 3.4 1
assign (resid 28 and name HA) (resid 30 and name HN) 5 3.4 0
assign (resid 29 and name HA) (resid 30 and name HN) 3.4 1.8 0
assign (resid 32 and name HN) (resid 30 and name HN) 5 3.4 0
assign (resid 28 and name HD#) (resid 30 and name HN) 5 3.4 1
assign (resid 30 and name HA) (resid 30 and name HN) 3.4 1.8 0
assign (resid 30 and name HB#) (resid 30 and name HN) 3.4 1.8 0.6
assign (resid 31 and name HN) (resid 30 and name HN) 3.4 1.8 0
assign (resid 32 and name HA#) (resid 31 and name HN) 5 3.4 1
assign (resid 31 and name HB#) (resid 31 and name HN) 3.4 1.8 0.6
assign (resid 29 and name HA) (resid 31 and name HN) 5 3.4 0
assign (resid 31 and name HA) (resid 31 and name HN) 3.4 1.8 0
assign (resid 30 and name HB#) (resid 31 and name HN) 3.4 1.8 1
assign (resid 34 and name HA#) (resid 31 and name HN) 5 3.4 1
assign (resid 36 and name HB#) (resid 32 and name HN) 5 3.4 1
assign (resid 31 and name HA) (resid 32 and name HN) 3.4 1.8 0
assign (resid 33 and name HN) (resid 32 and name HN) 5 3.4 0
assign (resid 31 and name HB#) (resid 32 and name HN) 3.4 1.8 1
assign (resid 29 and name HA) (resid 32 and name HN) 5 3.4 0
assign (resid 31 and name HN) (resid 32 and name HN) 3.4 1.8 0
assign (resid 32 and name HA#) (resid 32 and name HN) 3.4 1.8 0.6
assign (resid 34 and name HN) (resid 33 and name HN) 5 3.4 0
assign (resid 33 and name HA) (resid 33 and name HN) 3.4 1.8 0
assign (resid 32 and name HA#) (resid 33 and name HN) 3.4 1.8 1
assign (resid 33 and name HB#) (resid 33 and name HN) 3.4 1.8 0.6
assign (resid 36 and name HN) (resid 34 and name HN) 5 3.4 0
assign (resid 33 and name HB#) (resid 34 and name HN) 3.4 1.8 1
assign (resid 35 and name HN) (resid 34 and name HN) 5 3.4 0
assign (resid 34 and name HA#) (resid 34 and name HN) 3.4 1.8 0.6
assign (resid 30 and name HN) (resid 35 and name HN) 5 3.4 0
assign (resid 36 and name HB#) (resid 35 and name HN) 5 3.4 1
assign (resid 35 and name HG#) (resid 35 and name HN) 3.4 1.8 1
assign (resid 35 and name HB#) (resid 35 and name HN) 3.4 1.8 0.6
assign (resid 34 and name HA#) (resid 35 and name HN) 3.4 1.8 1
assign (resid 35 and name HA) (resid 35 and name HN) 3.4 1.8 0
assign (resid 36 and name HN) (resid 35 and name HN) 5 3.4 0
assign (resid 33 and name HA) (resid 36 and name HN) 5 3.4 0
assign (resid 35 and name HA) (resid 36 and name HN) 3.4 1.8 0
assign (resid 35 and name HB#) (resid 36 and name HN) 3.4 1.8 1
assign (resid 36 and name HB#) (resid 36 and name HN) 3.4 1.8 0.6
assign (resid 38 and name HB#) (resid 37 and name HN) 5 3.4 1
assign (resid 18 and name HB#) (resid 37 and name HN) 5 3.4 1
assign (resid 20 and name HA) (resid 37 and name HN) 5 3.4 0
assign (resid 36 and name HB#) (resid 37 and name HN) 3.4 1.8 1
assign (resid 37 and name HB#) (resid 37 and name HN) 3.4 1.8 0.6
assign (resid 19 and name HA) (resid 37 and name HN) 5 3.4 0
assign (resid 37 and name HA) (resid 37 and name HN) 3.4 1.8 0
assign (resid 37 and name HG#) (resid 37 and name HN) 3.4 1.8 1
assign (resid 38 and name HN) (resid 37 and name HN) 5 3.4 0
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assign (resid 37 and name HB#) (resid 38 and name HN) 3.4 1.8 1
assign (resid 38 and name HB#) (resid 38 and name HN) 3.4 1.8 0.6
assign (resid 37 and name HG#) (resid 38 and name HN) 3.4 1.8 1
assign (resid 18 and name HB#) (resid 38 and name HN) 5 3.4 1
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assign (resid 38 and name HN) (resid 39 and name HN) 5 3.4 0
assign (resid 39 and name HB#) (resid 39 and name HN) 3.4 1.8 0.6
assign (resid 39 and name HG#) (resid 39 and name HN) 3.4 1.8 1
assign (resid 38 and name HB#) (resid 39 and name HN) 3.4 1.8 1
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assign (resid 40 and name HB#) (resid 40 and name HN) 3.4 1.8 0.6
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assign (resid 39 and name HB#) (resid 40 and name HN) 3.4 1.8 1
assign (resid 22 and name HA#) (resid 1 and name HB#) 5 1.8 3
assign (resid 6 and name HB#) (resid 1 and name HB#) 5 1.8 3
assign (resid 6 and name HB#) (resid 1 and name HD#) 5 1.8 3
assign (resid 6 and name HG#) (resid 1 and name HD#) 5 1.8 3
assign (resid 22 and name HA#) (resid 1 and name HD#) 5 1.8 3
assign (resid 7 and name HB#) (resid 1 and name HB#) 5 1.8 3
assign (resid 1 and name HB#) (resid 1 and name HA) 3.4 1 0.6
assign (resid 1 and name HA) (resid 1 and name HD#) 3.4 1 1
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assign (resid 2 and name HA) (resid 2 and name HB#) 3.4 1 0.6
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assign (resid 2 and name HA) (resid 3 and name HB#) 5 1.8 1
assign (resid 3 and name HA) (resid 3 and name HB#) 3.4 1 0.6
assign (resid 9 and name HA#) (resid 5 and name HA) 5 1.8 1
assign (resid 5 and name HD#) (resid 5 and name HA) 3.4 1.8 1
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assign (resid 5 and name HB#) (resid 5 and name HG#) 3.4 1 0
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assign (resid 2 and name HA) (resid 10 and name HB#) 5 1.8 1
assign (resid 3 and name HA) (resid 10 and name HB#) 5 1.8 1
assign (resid 10 and name HA) (resid 10 and name HB#) 3.4 1 0.6
assign (resid 11 and name HB#) (resid 11 and name HE#) 3.4 1 0
assign (resid 11 and name HA) (resid 11 and name HB#) 3.4 1 0.6
assign (resid 13 and name HB#) (resid 12 and name HB#) 5 1.8 3
assign (resid 24 and name HB#) (resid 12 and name HB#) 5 1.8 3
assign (resid 16 and name HD##) (resid 12 and name HB#) 5 1.8 3.4
assign (resid 12 and name HA) (resid 12 and name HB#) 3.4 1 0.6
assign (resid 16 and name HB#) (resid 12 and name HB#) 5 1.8 3
assign (resid 16 and name HG) (resid 14 and name HB#) 5 1.8 1
assign (resid 16 and name HB#) (resid 14 and name HB#) 5 1.8 3
assign (resid 16 and name HD##) (resid 14 and name HB#) 5 1.8 3.4
assign (resid 14 and name HA) (resid 15 and name HA#) 3.4 1 1
assign (resid 38 and name HB#) (resid 16 and name HD##) 5 1.8 3.4
assign (resid 28 and name HD#) (resid 16 and name HD##) 5 1.8 3.4
assign (resid 26 and name HA) (resid 16 and name HD##) 5 1.8 2.4
assign (resid 16 and name HA) (resid 16 and name HB#) 3.4 1 0.6
assign (resid 16 and name HA) (resid 16 and name HG) 5 1.8 0
assign (resid 26 and name HB#) (resid 16 and name HD##) 5 1.8 3.4
assign (resid 16 and name HB#) (resid 16 and name HG) 3.4 1 0
assign (resid 24 and name HB#) (resid 16 and name HD##) 5 1.8 3.4
assign (resid 16 and name HG) (resid 16 and name HD##) 1.8 1 0
assign (resid 16 and name HB#) (resid 16 and name HD##) 3.4 1 0
assign (resid 24 and name HB#) (resid 17 and name HB#) 5 1.8 3
assign (resid 39 and name HG#) (resid 17 and name HB#) 5 1.8 3
assign (resid 36 and name HB#) (resid 17 and name HB#) 5 1.8 3
assign (resid 31 and name HA) (resid 17 and name HB#) 5 1.8 1
assign (resid 17 and name HA) (resid 17 and name HB#) 3.4 1 0.6
assign (resid 37 and name HB#) (resid 18 and name HB#) 5 1.8 3
assign (resid 3 and name HB#) (resid 18 and name HB#) 5 1.8 3
assign (resid 39 and name HB#) (resid 18 and name HB#) 5 1.8 3
assign (resid 18 and name HA) (resid 18 and name HB#) 3.4 1 0.6
assign (resid 20 and name HA) (resid 19 and name HA) 5 1.8 0
assign (resid 20 and name HB#) (resid 19 and name HA) 5 1.8 1
assign (resid 30 and name HA) (resid 19 and name HA) 5 1.8 0
assign (resid 19 and name HB#) (resid 19 and name HA) 3.4 1 0.6
assign (resid 35 and name HA) (resid 20 and name HD#) 5 1.8 1
assign (resid 35 and name HA) (resid 20 and name HB#) 5 1.8 1
assign (resid 37 and name HA) (resid 20 and name HD#) 5 1.8 1
assign (resid 20 and name HA) (resid 20 and name HG#) 3.4 1 1
assign (resid 37 and name HG#) (resid 20 and name HA) 5 1.8 1
assign (resid 20 and name HG#) (resid 20 and name HD#) 3.4 1 0
assign (resid 20 and name HA) (resid 20 and name HB#) 3.4 1 0.6
assign (resid 5 and name HG#) (resid 21 and name HD#) 5 3.4 3
assign (resid 6 and name HB#) (resid 21 and name HD#) 5 3.4 3
assign (resid 6 and name HG#) (resid 21 and name HD#) 5 1.8 3
assign (resid 5 and name HD#) (resid 21 and name HD#) 5 3.4 3
assign (resid 6 and name HA) (resid 21 and name HD#) 5 3.4 1
assign (resid 21 and name HA) (resid 21 and name HB#) 3.4 1 0.6
assign (resid 21 and name HA) (resid 21 and name HD#) 3.4 1.8 1
assign (resid 20 and name HB#) (resid 21 and name HD#) 5 3.4 3
assign (resid 20 and name HA) (resid 21 and name HD#) 5 3.4 1
assign (resid 22 and name HA#) (resid 21 and name HD#) 5 1.8 3
assign (resid 6 and name HB#) (resid 22 and name HA#) 5 1.8 1
assign (resid 30 and name HA) (resid 23 and name HD#) 5 3.4 1
assign (resid 30 and name HB#) (resid 23 and name HD#) 5 1.8 3
assign (resid 28 and name HD#) (resid 23 and name HD#) 5 1.8 3
assign (resid 28 and name HG#) (resid 23 and name HD#) 5 1.8 3
assign (resid 2 and name HB#) (resid 23 and name HD#) 5 1.8 3
assign (resid 19 and name HB#) (resid 23 and name HD#) 5 1.8 3
assign (resid 39 and name HD#) (resid 23 and name HD#) 5 1.8 3
assign (resid 23 and name HA) (resid 23 and name HB#) 3.4 1 0.6
assign (resid 21 and name HD#) (resid 23 and name HD#) 5 1.8 3
assign (resid 2 and name HG#) (resid 23 and name HD#) 5 1.8 3
assign (resid 21 and name HB#) (resid 23 and name HD#) 5 1.8 3
assign (resid 23 and name HA) (resid 23 and name HD#) 3.4 1 1
assign (resid 12 and name HA) (resid 24 and name HB#) 5 1.8 1
assign (resid 2 and name HB#) (resid 24 and name HB#) 5 1.8 3
assign (resid 18 and name HA) (resid 24 and name HA) 5 3.4 0
assign (resid 24 and name HA) (resid 24 and name HB#) 3.4 1 0.6
assign (resid 16 and name HD##) (resid 25 and name HA#) 5 1.8 3.4
assign (resid 16 and name HA) (resid 26 and name HA) 5 1.8 0
assign (resid 26 and name HA) (resid 26 and name HB#) 3.4 1 0.6
assign (resid 13 and name HB#) (resid 27 and name HG#) 5 1.8 3
assign (resid 29 and name HD#) (resid 27 and name HG#) 5 1.8 3
assign (resid 27 and name HA) (resid 27 and name HG#) 3.4 1 1
assign (resid 29 and name HB#) (resid 28 and name HD#) 5 1.8 3
assign (resid 28 and name HA) (resid 28 and name HG#) 3.4 1.8 1
assign (resid 31 and name HA) (resid 28 and name HD#) 5 1.8 1
assign (resid 28 and name HG#) (resid 28 and name HD#) 3.4 1 0
assign (resid 33 and name HB#) (resid 29 and name HD#) 5 1.8 3
assign (resid 30 and name HA) (resid 29 and name HA) 5 1.8 0
assign (resid 29 and name HB#) (resid 29 and name HD#) 3.4 1 0
assign (resid 25 and name HA#) (resid 30 and name HB#) 5 1.8 3
assign (resid 19 and name HB#) (resid 30 and name HB#) 5 1.8 3
assign (resid 26 and name HN) (resid 30 and name HD#) 5 1.8 1
assign (resid 16 and name HD##) (resid 30 and name HD#) 5 1.8 3.4
assign (resid 25 and name HA#) (resid 30 and name HD#) 5 1.8 3
assign (resid 24 and name HA#) (resid 30 and name HD#) 5 1.8 3
assign (resid 31 and name HB#) (resid 30 and name HB#) 3.4 1.8 3
assign (resid 19 and name HB#) (resid 30 and name HA) 5 1.8 1
assign (resid 19 and name HB#) (resid 30 and name HD#) 5 1.8 3
assign (resid 30 and name HA) (resid 30 and name HD#) 3.4 1 1
assign (resid 30 and name HA) (resid 30 and name HB#) 3.4 1 0.6
assign (resid 40 and name HA) (resid 31 and name HB#) 5 1.8 1
assign (resid 31 and name HA) (resid 31 and name HB#) 3.4 1 0.6
assign (resid 27 and name HG#) (resid 32 and name HA#) 5 1.8 3
assign (resid 29 and name HA) (resid 32 and name HA#) 5 1.8 1
assign (resid 32 and name HA#) (resid 33 and name HB#) 5 1.8 3
assign (resid 33 and name HA) (resid 33 and name HB#) 3.4 1 0.6
assign (resid 34 and name HA#) (resid 33 and name HB#) 3.4 1.8 3
assign (resid 29 and name HA) (resid 35 and name HG#) 5 1.8 1
assign (resid 35 and name HA) (resid 35 and name HG#) 3.4 1 1
assign (resid 19 and name HA) (resid 36 and name HB#) 5 1.8 1
assign (resid 31 and name HA) (resid 36 and name HB#) 5 1.8 1
assign (resid 31 and name HB#) (resid 36 and name HB#) 5 3.4 3
assign (resid 40 and name HB#) (resid 36 and name HB#) 3.4 1.8 3
assign (resid 22 and name HA#) (resid 37 and name HD#) 5 1.8 3
assign (resid 21 and name HN) (resid 37 and name HD#) 5 1.8 1
assign (resid 38 and name HB#) (resid 37 and name HG#) 5 1.8 3
assign (resid 4 and name HA#) (resid 37 and name HD#) 5 1.8 3
assign (resid 5 and name HG#) (resid 37 and name HD#) 5 1.8 3
assign (resid 18 and name HB#) (resid 37 and name HG#) 5 1.8 3
assign (resid 37 and name HG#) (resid 37 and name HD#) 3.4 1 0
assign (resid 37 and name HB#) (resid 37 and name HD#) 3.4 1 0
assign (resid 20 and name HA) (resid 37 and name HB#) 5 1.8 1
assign (resid 37 and name HA) (resid 37 and name HB#) 3.4 1 0.6
assign (resid 37 and name HA) (resid 37 and name HG#) 3.4 1 1
assign (resid 20 and name HA) (resid 37 and name HD#) 5 1.8 1
assign (resid 39 and name HB#) (resid 38 and name HB#) 3.4 1.8 3
assign (resid 38 and name HA) (resid 38 and name HB#) 3.4 1 0.6
assign (resid 14 and name HA) (resid 39 and name HD#) 5 1.8 1
assign (resid 17 and name HA) (resid 39 and name HG#) 5 1.8 1
assign (resid 35 and name HB#) (resid 39 and name HD#) 5 1.8 3
assign (resid 35 and name HG#) (resid 39 and name HD#) 5 1.8 3
assign (resid 17 and name HA) (resid 39 and name HB#) 5 1.8 1
assign (resid 39 and name HA) (resid 39 and name HB#) 3.4 1 0.6
assign (resid 39 and name HB#) (resid 39 and name HD#) 3.4 1 0
assign (resid 39 and name HG#) (resid 39 and name HD#) 3.4 1 0
assign (resid 31 and name HA) (resid 32 and name HA#) 3.4 1.8 1
assign (resid 39 and name HG#) (resid 39 and name HA) 3.4 1 1
assign (resid 12 and name HB#) (resid 39 and name HD#) 5 1.8 3
assign (resid 11 and name HB#) (resid 39 and name HD#) 5 1.8 3
assign (resid 31 and name HA) (resid 40 and name HB#) 5 1.8 1
assign (resid 36 and name HB#) (resid 40 and name HB#) 5 1.8 3
assign (resid 31 and name HB#) (resid 40 and name HB#) 5 1.8 3
assign (resid 40 and name HA) (resid 40 and name HB#) 3.4 1 0.6
  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   PHE   1           HT1      PHE   1  -7.245  -1.082   5.279
    2    H2   PHE   1           HT2      PHE   1  -6.055   0.109   5.436
    3    H3   PHE   1           HT3      PHE   1  -5.652  -1.520   5.643
    4    HA   PHE   1           HA       PHE   1  -4.904  -0.712   3.503
    5    HB2  PHE   1           HB2      PHE   1  -7.148  -2.733   3.509
    6    HB3  PHE   1           HB1      PHE   1  -6.160  -2.413   2.088
    7    HD1  PHE   1           HD1      PHE   1  -6.212  -3.834   5.458
    8    HD2  PHE   1           HD2      PHE   1  -3.873  -3.142   1.971
    9    HE1  PHE   1           HE1      PHE   1  -4.542  -5.453   6.264
   10    HE2  PHE   1           HE2      PHE   1  -2.198  -4.758   2.772
   11    HZ   PHE   1           HZ       PHE   1  -2.532  -5.918   4.918
   12    H    GLN   2           HN       GLN   2  -5.227   0.449   1.691
   13    HA   GLN   2           HA       GLN   2  -7.916   1.399   1.025
   14    HB2  GLN   2           HB2      GLN   2  -5.550   3.216   1.506
   15    HB3  GLN   2           HB1      GLN   2  -7.044   3.729   0.738
   16    HG2  GLN   2           HG2      GLN   2  -8.256   3.116   2.814
   17    HG3  GLN   2           HG1      GLN   2  -6.701   2.763   3.566
   18   HE21  GLN   2          HE21      GLN   2  -5.301   4.451   4.054
   19   HE22  GLN   2          HE22      GLN   2  -5.827   6.096   4.109
   20    H    CYS   3           HN       CYS   3  -4.565   1.055   0.153
   21    HA   CYS   3           HA       CYS   3  -5.081   1.622  -2.668
   22    HB2  CYS   3           HB2      CYS   3  -3.175   2.733  -1.655
   23    HB3  CYS   3           HB1      CYS   3  -2.526   1.197  -1.100
   24    H    GLY   4           HN       GLY   4  -3.700   0.202  -4.200
   25    HA2  GLY   4           HA2      GLY   4  -3.274  -1.792  -5.225
   26    HA3  GLY   4           HA1      GLY   4  -3.058  -2.473  -3.630
   27    H    ARG   5           HN       ARG   5  -3.895  -4.359  -4.744
   28    HA   ARG   5           HA       ARG   5  -6.661  -4.453  -5.501
   29    HB2  ARG   5           HB2      ARG   5  -6.236  -6.909  -5.775
   30    HB3  ARG   5           HB1      ARG   5  -5.141  -5.884  -6.692
   31    HG2  ARG   5           HG2      ARG   5  -3.660  -6.182  -4.503
   32    HG3  ARG   5           HG1      ARG   5  -4.593  -7.679  -4.405
   33    HD2  ARG   5           HD2      ARG   5  -3.972  -8.154  -6.750
   34    HD3  ARG   5           HD1      ARG   5  -2.949  -6.718  -6.733
   35    HE   ARG   5           HE       ARG   5  -2.250  -8.419  -4.590
   36   HH11  ARG   5          HH11      ARG   5  -1.939  -8.232  -8.084
   37   HH12  ARG   5          HH12      ARG   5  -0.491  -9.182  -8.120
   38   HH21  ARG   5          HH21      ARG   5   0.405  -9.988  -6.184
   39   HH22  ARG   5          HH22      ARG   5  -0.353  -9.658  -4.662
   40    H    GLN   6           HN       GLN   6  -5.052  -4.628  -2.515
   41    HA   GLN   6           HA       GLN   6  -6.612  -6.526  -1.103
   42    HB2  GLN   6           HB2      GLN   6  -4.438  -4.957  -0.501
   43    HB3  GLN   6           HB1      GLN   6  -5.707  -4.200   0.450
   44    HG2  GLN   6           HG2      GLN   6  -4.976  -7.132   0.564
   45    HG3  GLN   6           HG1      GLN   6  -4.445  -5.908   1.716
   46   HE21  GLN   6          HE21      GLN   6  -7.119  -7.811   0.572
   47   HE22  GLN   6          HE22      GLN   6  -8.172  -7.511   1.909
   48    H    ALA   7           HN       ALA   7  -7.218  -3.419  -2.296
   49    HA   ALA   7           HA       ALA   7  -9.775  -3.195  -0.876
   50    HB1  ALA   7           HB1      ALA   7  -9.483  -0.772  -0.869
   51    HB2  ALA   7           HB2      ALA   7  -7.907  -0.963  -1.639
   52    HB3  ALA   7           HB3      ALA   7  -8.170  -1.574  -0.006
   53    H    GLY   8           HN       GLY   8  -7.897  -2.576  -3.759
   54    HA2  GLY   8           HA2      GLY   8  -9.469  -3.267  -5.764
   55    HA3  GLY   8           HA1      GLY   8 -10.243  -1.760  -5.299
   56    H    GLY   9           HN       GLY   9  -8.757   0.157  -5.171
   57    HA2  GLY   9           HA2      GLY   9  -6.276   0.276  -6.474
   58    HA3  GLY   9           HA1      GLY   9  -7.524   0.605  -7.665
   59    H    ALA  10           HN       ALA  10  -6.135   1.693  -4.594
   60    HA   ALA  10           HA       ALA  10  -6.866   4.449  -5.277
   61    HB1  ALA  10           HB1      ALA  10  -8.653   3.636  -3.802
   62    HB2  ALA  10           HB2      ALA  10  -7.708   4.910  -3.031
   63    HB3  ALA  10           HB3      ALA  10  -7.453   3.226  -2.576
   64    H    ARG  11           HN       ARG  11  -5.928   5.845  -3.181
   65    HA   ARG  11           HA       ARG  11  -3.218   4.918  -2.543
   66    HB2  ARG  11           HB2      ARG  11  -3.910   7.515  -3.924
   67    HB3  ARG  11           HB1      ARG  11  -2.398   7.283  -3.059
   68    HG2  ARG  11           HG2      ARG  11  -1.803   5.455  -4.552
   69    HG3  ARG  11           HG1      ARG  11  -3.337   5.641  -5.404
   70    HD2  ARG  11           HD2      ARG  11  -1.331   7.870  -5.155
   71    HD3  ARG  11           HD1      ARG  11  -1.300   6.708  -6.480
   72    HE   ARG  11           HE       ARG  11  -3.878   7.826  -6.269
   73   HH11  ARG  11          HH11      ARG  11  -0.643   8.742  -7.286
   74   HH12  ARG  11          HH12      ARG  11  -1.209   9.936  -8.406
   75   HH21  ARG  11          HH21      ARG  11  -4.596   9.393  -7.741
   76   HH22  ARG  11          HH22      ARG  11  -3.445  10.303  -8.663
   77    H    CYS  12           HN       CYS  12  -2.238   6.072  -0.718
   78    HA   CYS  12           HA       CYS  12  -4.262   6.772   1.233
   79    HB2  CYS  12           HB2      CYS  12  -1.306   6.332   1.416
   80    HB3  CYS  12           HB1      CYS  12  -2.206   7.007   2.768
   81    H    SER  13           HN       SER  13  -1.382   8.483   1.881
   82    HA   SER  13           HA       SER  13  -2.787  10.958   2.030
   83    HB2  SER  13           HB2      SER  13  -1.074  10.267   3.701
   84    HB3  SER  13           HB1      SER  13   0.166  10.439   2.460
   85    HG   SER  13           HG       SER  13  -1.148  12.363   3.924
   86    H    ASN  14           HN       ASN  14   0.247  10.243   0.361
   87    HA   ASN  14           HA       ASN  14  -0.605  11.837  -1.948
   88    HB2  ASN  14           HB2      ASN  14   1.891  12.313  -0.305
   89    HB3  ASN  14           HB1      ASN  14   1.715  12.909  -1.952
   90   HD21  ASN  14          HD21      ASN  14   0.239  14.552  -2.381
   91   HD22  ASN  14          HD22      ASN  14  -0.425  15.537  -1.126
   92    H    GLY  15           HN       GLY  15   1.917  11.771  -3.275
   93    HA2  GLY  15           HA2      GLY  15   1.855   9.102  -4.318
   94    HA3  GLY  15           HA1      GLY  15   2.935  10.396  -4.821
   95    H    LEU  16           HN       LEU  16   2.335   8.360  -1.998
   96    HA   LEU  16           HA       LEU  16   5.149   8.343  -1.276
   97    HB2  LEU  16           HB2      LEU  16   3.987   6.805   0.627
   98    HB3  LEU  16           HB1      LEU  16   4.067   8.551   0.715
   99    HG   LEU  16           HG       LEU  16   1.737   8.493  -0.426
  100   HD11  LEU  16          HD11      LEU  16   0.393   6.588  -0.128
  101   HD12  LEU  16          HD12      LEU  16   1.650   5.758   0.788
  102   HD13  LEU  16          HD13      LEU  16   1.863   6.049  -0.938
  103   HD21  LEU  16          HD21      LEU  16   2.115   7.603   2.414
  104   HD22  LEU  16          HD22      LEU  16   0.628   8.266   1.742
  105   HD23  LEU  16          HD23      LEU  16   2.077   9.265   1.825
  106    H    CYS  17           HN       CYS  17   3.453   5.513  -0.382
  107    HA   CYS  17           HA       CYS  17   4.490   3.909  -2.594
  108    HB2  CYS  17           HB2      CYS  17   5.623   2.334  -1.089
  109    HB3  CYS  17           HB1      CYS  17   6.291   3.946  -0.863
  110    H    CYS  18           HN       CYS  18   3.701   1.618  -2.438
  111    HA   CYS  18           HA       CYS  18   1.252   1.301  -0.877
  112    HB2  CYS  18           HB2      CYS  18   0.562   2.235  -3.026
  113    HB3  CYS  18           HB1      CYS  18   1.402   0.944  -3.874
  114    H    SER  19           HN       SER  19   1.452  -0.486   0.235
  115    HA   SER  19           HA       SER  19   3.438  -2.416  -0.070
  116    HB2  SER  19           HB2      SER  19   0.835  -2.499   1.445
  117    HB3  SER  19           HB1      SER  19   2.055  -3.764   1.554
  118    HG   SER  19           HG       SER  19   2.869  -1.121   1.935
  119    H    GLN  20           HN       GLN  20   3.371  -4.618  -0.493
  120    HA   GLN  20           HA       GLN  20   2.668  -5.470  -2.934
  121    HB2  GLN  20           HB2      GLN  20   3.002  -7.039  -0.407
  122    HB3  GLN  20           HB1      GLN  20   2.745  -7.831  -1.954
  123    HG2  GLN  20           HG2      GLN  20   4.762  -6.798  -2.835
  124    HG3  GLN  20           HG1      GLN  20   5.008  -5.953  -1.308
  125   HE21  GLN  20          HE21      GLN  20   5.129  -9.010  -2.950
  126   HE22  GLN  20          HE22      GLN  20   6.025  -9.857  -1.739
  127    H    PHE  21           HN       PHE  21   0.584  -5.766  -0.137
  128    HA   PHE  21           HA       PHE  21  -1.476  -7.164  -1.619
  129    HB2  PHE  21           HB2      PHE  21  -1.320  -6.136   1.207
  130    HB3  PHE  21           HB1      PHE  21  -2.770  -6.874   0.544
  131    HD1  PHE  21           HD1      PHE  21  -2.870  -9.218   0.078
  132    HD2  PHE  21           HD2      PHE  21   0.636  -7.426   1.676
  133    HE1  PHE  21           HE1      PHE  21  -2.010 -11.456   0.675
  134    HE2  PHE  21           HE2      PHE  21   1.513  -9.655   2.279
  135    HZ   PHE  21           HZ       PHE  21   0.186 -11.672   1.776
  136    H    GLY  22           HN       GLY  22  -0.922  -4.022  -0.225
  137    HA2  GLY  22           HA2      GLY  22  -1.866  -2.242  -1.827
  138    HA3  GLY  22           HA1      GLY  22  -3.401  -2.985  -1.393
  139    H    TYR  23           HN       TYR  23  -0.516  -2.183   0.514
  140    HA   TYR  23           HA       TYR  23  -2.236  -0.470   2.180
  141    HB2  TYR  23           HB2      TYR  23  -1.062  -2.723   3.109
  142    HB3  TYR  23           HB1      TYR  23   0.221  -1.558   3.431
  143    HD1  TYR  23           HD1      TYR  23  -1.986  -3.222   5.172
  144    HD2  TYR  23           HD2      TYR  23  -1.286   0.858   4.187
  145    HE1  TYR  23           HE1      TYR  23  -3.188  -2.531   7.206
  146    HE2  TYR  23           HE2      TYR  23  -2.488   1.562   6.218
  147    HH   TYR  23           HH       TYR  23  -3.296  -0.591   8.713
  148    H    CYS  24           HN       CYS  24  -1.842   1.509   1.592
  149    HA   CYS  24           HA       CYS  24   0.844   2.364   0.878
  150    HB2  CYS  24           HB2      CYS  24  -0.456   4.564   0.408
  151    HB3  CYS  24           HB1      CYS  24  -0.728   3.190  -0.653
  152    H    GLY  25           HN       GLY  25   1.939   4.045   1.831
  153    HA2  GLY  25           HA2      GLY  25   1.001   5.449   4.129
  154    HA3  GLY  25           HA1      GLY  25   2.070   4.129   4.581
  155    H    SER  26           HN       SER  26   3.067   6.303   5.389
  156    HA   SER  26           HA       SER  26   5.261   6.937   3.557
  157    HB2  SER  26           HB2      SER  26   5.004   9.427   4.261
  158    HB3  SER  26           HB1      SER  26   3.915   8.813   3.022
  159    HG   SER  26           HG       SER  26   3.163  10.039   5.106
  160    H    THR  27           HN       THR  27   4.356   5.869   6.461
  161    HA   THR  27           HA       THR  27   6.855   6.529   7.718
  162    HB   THR  27           HB       THR  27   5.882   8.478   8.515
  163    HG1  THR  27           HG1      THR  27   6.349   6.586  10.236
  164   HG21  THR  27          HG21      THR  27   3.328   7.059   9.276
  165   HG22  THR  27          HG22      THR  27   3.553   7.911   7.747
  166   HG23  THR  27          HG23      THR  27   3.640   8.796   9.270
  167    HA   PRO  28           HA       PRO  28   4.661   3.076  10.270
  168    HB2  PRO  28           HB2      PRO  28   2.429   1.997   8.767
  169    HB3  PRO  28           HB1      PRO  28   2.387   2.846  10.321
  170    HG2  PRO  28           HG2      PRO  28   1.292   3.864   8.070
  171    HG3  PRO  28           HG1      PRO  28   1.966   4.874   9.366
  172    HD2  PRO  28           HD2      PRO  28   3.292   4.000   6.798
  173    HD3  PRO  28           HD1      PRO  28   3.188   5.632   7.500
  174    HA   PRO  29           HA       PRO  29   6.404  -0.587   8.240
  175    HB2  PRO  29           HB2      PRO  29   4.066  -2.344   8.787
  176    HB3  PRO  29           HB1      PRO  29   5.754  -2.522   9.302
  177    HG2  PRO  29           HG2      PRO  29   3.913  -1.845  11.051
  178    HG3  PRO  29           HG1      PRO  29   5.511  -1.067  11.079
  179    HD2  PRO  29           HD2      PRO  29   2.937  -0.024   9.955
  180    HD3  PRO  29           HD1      PRO  29   4.128   0.801  10.982
  181    H    TYR  30           HN       TYR  30   5.125   1.053   6.478
  182    HA   TYR  30           HA       TYR  30   4.379  -0.755   4.291
  183    HB2  TYR  30           HB2      TYR  30   2.956   1.887   4.546
  184    HB3  TYR  30           HB1      TYR  30   2.487   0.467   3.624
  185    HD1  TYR  30           HD1      TYR  30   1.672   2.393   6.388
  186    HD2  TYR  30           HD2      TYR  30   2.039  -1.679   5.218
  187    HE1  TYR  30           HE1      TYR  30   0.170   1.730   8.222
  188    HE2  TYR  30           HE2      TYR  30   0.540  -2.353   7.048
  189    HH   TYR  30           HH       TYR  30  -0.210  -1.491   9.221
  190    H    CYS  31           HN       CYS  31   5.634   2.219   5.540
  191    HA   CYS  31           HA       CYS  31   7.249   2.629   3.151
  192    HB2  CYS  31           HB2      CYS  31   5.100   4.353   3.931
  193    HB3  CYS  31           HB1      CYS  31   6.625   5.209   4.133
  194    H    GLY  32           HN       GLY  32   8.825   1.658   4.466
  195    HA2  GLY  32           HA2      GLY  32  10.785   3.137   5.536
  196    HA3  GLY  32           HA1      GLY  32   9.688   2.971   6.905
  197    H    ALA  33           HN       ALA  33   8.843   0.635   7.125
  198    HA   ALA  33           HA       ALA  33  10.614  -1.501   6.390
  199    HB1  ALA  33           HB1      ALA  33  10.465  -0.738   9.319
  200    HB2  ALA  33           HB2      ALA  33  11.882  -0.564   8.284
  201    HB3  ALA  33           HB3      ALA  33  11.257  -2.170   8.659
  202    H    GLY  34           HN       GLY  34   9.024  -2.737   5.655
  203    HA2  GLY  34           HA2      GLY  34   7.343  -4.176   7.381
  204    HA3  GLY  34           HA1      GLY  34   6.407  -2.871   6.667
  205    H    GLN  35           HN       GLN  35   5.769  -2.982   4.585
  206    HA   GLN  35           HA       GLN  35   6.680  -5.212   2.920
  207    HB2  GLN  35           HB2      GLN  35   4.206  -5.533   2.242
  208    HB3  GLN  35           HB1      GLN  35   4.749  -6.227   3.759
  209    HG2  GLN  35           HG2      GLN  35   3.725  -4.412   4.995
  210    HG3  GLN  35           HG1      GLN  35   3.260  -3.618   3.494
  211   HE21  GLN  35          HE21      GLN  35   2.629  -6.250   5.666
  212   HE22  GLN  35          HE22      GLN  35   1.100  -6.704   5.003
  213    H    CYS  36           HN       CYS  36   7.650  -2.823   2.487
  214    HA   CYS  36           HA       CYS  36   6.075  -1.170   0.742
  215    HB2  CYS  36           HB2      CYS  36   8.206   0.069   0.421
  216    HB3  CYS  36           HB1      CYS  36   7.794  -0.166   2.117
  217    H    GLN  37           HN       GLN  37   5.584  -1.660  -1.296
  218    HA   GLN  37           HA       GLN  37   7.346  -3.394  -2.859
  219    HB2  GLN  37           HB2      GLN  37   4.811  -3.750  -2.607
  220    HB3  GLN  37           HB1      GLN  37   4.632  -2.381  -3.692
  221    HG2  GLN  37           HG2      GLN  37   6.094  -3.653  -5.317
  222    HG3  GLN  37           HG1      GLN  37   5.876  -5.050  -4.264
  223   HE21  GLN  37          HE21      GLN  37   3.875  -6.048  -4.158
  224   HE22  GLN  37          HE22      GLN  37   2.617  -5.733  -5.299
  225    H    SER  38           HN       SER  38   5.689  -0.247  -3.135
  226    HA   SER  38           HA       SER  38   7.013   0.430  -5.590
  227    HB2  SER  38           HB2      SER  38   5.198   2.027  -3.785
  228    HB3  SER  38           HB1      SER  38   5.824   2.620  -5.323
  229    HG   SER  38           HG       SER  38   4.065   0.456  -4.855
  230    H    GLN  39           HN       GLN  39   7.034   1.914  -2.377
  231    HA   GLN  39           HA       GLN  39   9.852   2.629  -2.724
  232    HB2  GLN  39           HB2      GLN  39   7.598   4.516  -2.598
  233    HB3  GLN  39           HB1      GLN  39   8.901   4.878  -1.474
  234    HG2  GLN  39           HG2      GLN  39  10.492   4.877  -3.339
  235    HG3  GLN  39           HG1      GLN  39   9.168   4.540  -4.453
  236   HE21  GLN  39          HE21      GLN  39  10.655   6.908  -2.394
  237   HE22  GLN  39          HE22      GLN  39   9.800   8.278  -3.008
  238    H    CYS  40           HN       CYS  40  10.978   3.078  -0.762
  239    HA   CYS  40           HA       CYS  40   9.578   2.298   1.702
  240    HB2  CYS  40           HB2      CYS  40  11.361   0.641   0.394
  241    HB3  CYS  40           HB1      CYS  40  12.366   1.416   1.614
  Start of MODEL    2
    1    H1   PHE   1           HT1      PHE   1  -6.367  -3.102   1.794
    2    H2   PHE   1           HT2      PHE   1  -5.839  -1.728   0.963
    3    H3   PHE   1           HT3      PHE   1  -7.436  -2.257   0.793
    4    HA   PHE   1           HA       PHE   1  -7.882  -1.780   3.096
    5    HB2  PHE   1           HB2      PHE   1  -5.069  -0.662   3.142
    6    HB3  PHE   1           HB1      PHE   1  -6.226  -0.595   4.465
    7    HD1  PHE   1           HD1      PHE   1  -3.881  -2.692   2.617
    8    HD2  PHE   1           HD2      PHE   1  -6.738  -2.578   5.769
    9    HE1  PHE   1           HE1      PHE   1  -3.025  -4.837   3.469
   10    HE2  PHE   1           HE2      PHE   1  -5.889  -4.724   6.623
   11    HZ   PHE   1           HZ       PHE   1  -4.031  -5.856   5.472
   12    H    GLN   2           HN       GLN   2  -5.719   0.322   1.272
   13    HA   GLN   2           HA       GLN   2  -7.888   2.185   0.690
   14    HB2  GLN   2           HB2      GLN   2  -5.399   2.922   2.231
   15    HB3  GLN   2           HB1      GLN   2  -6.316   4.118   1.326
   16    HG2  GLN   2           HG2      GLN   2  -8.293   3.624   2.673
   17    HG3  GLN   2           HG1      GLN   2  -7.375   2.424   3.579
   18   HE21  GLN   2          HE21      GLN   2  -5.799   3.104   5.031
   19   HE22  GLN   2          HE22      GLN   2  -5.721   4.730   5.608
   20    H    CYS   3           HN       CYS   3  -5.190   0.488  -0.219
   21    HA   CYS   3           HA       CYS   3  -5.007   1.854  -2.789
   22    HB2  CYS   3           HB2      CYS   3  -3.236   2.935  -1.514
   23    HB3  CYS   3           HB1      CYS   3  -2.626   1.379  -0.970
   24    H    GLY   4           HN       GLY   4  -3.779   0.535  -4.390
   25    HA2  GLY   4           HA2      GLY   4  -3.223  -1.414  -5.460
   26    HA3  GLY   4           HA1      GLY   4  -2.950  -2.120  -3.881
   27    H    ARG   5           HN       ARG   5  -3.745  -4.082  -4.585
   28    HA   ARG   5           HA       ARG   5  -6.480  -4.316  -5.505
   29    HB2  ARG   5           HB2      ARG   5  -5.938  -6.795  -5.557
   30    HB3  ARG   5           HB1      ARG   5  -4.998  -5.771  -6.628
   31    HG2  ARG   5           HG2      ARG   5  -3.254  -5.770  -4.725
   32    HG3  ARG   5           HG1      ARG   5  -4.147  -7.177  -4.133
   33    HD2  ARG   5           HD2      ARG   5  -3.904  -8.208  -6.356
   34    HD3  ARG   5           HD1      ARG   5  -2.920  -6.833  -6.855
   35    HE   ARG   5           HE       ARG   5  -1.795  -7.921  -4.535
   36   HH11  ARG   5          HH11      ARG   5  -2.247  -8.833  -7.896
   37   HH12  ARG   5          HH12      ARG   5  -0.846  -9.850  -7.928
   38   HH21  ARG   5          HH21      ARG   5   0.445 -10.089  -6.063
   39   HH22  ARG   5          HH22      ARG   5   0.035  -9.257  -4.601
   40    H    GLN   6           HN       GLN   6  -4.926  -4.310  -2.476
   41    HA   GLN   6           HA       GLN   6  -6.502  -6.183  -1.039
   42    HB2  GLN   6           HB2      GLN   6  -4.324  -4.681  -0.431
   43    HB3  GLN   6           HB1      GLN   6  -5.573  -3.779   0.411
   44    HG2  GLN   6           HG2      GLN   6  -5.114  -6.741   0.770
   45    HG3  GLN   6           HG1      GLN   6  -4.396  -5.506   1.797
   46   HE21  GLN   6          HE21      GLN   6  -7.286  -7.203   0.941
   47   HE22  GLN   6          HE22      GLN   6  -8.260  -6.641   2.252
   48    H    ALA   7           HN       ALA   7  -7.018  -2.974  -2.159
   49    HA   ALA   7           HA       ALA   7  -9.440  -2.584  -0.574
   50    HB1  ALA   7           HB1      ALA   7  -9.347  -0.283  -1.375
   51    HB2  ALA   7           HB2      ALA   7  -7.967  -0.691  -2.394
   52    HB3  ALA   7           HB3      ALA   7  -7.817  -0.758  -0.639
   53    H    GLY   8           HN       GLY   8  -8.297  -3.011  -3.844
   54    HA2  GLY   8           HA2      GLY   8  -9.755  -4.192  -5.411
   55    HA3  GLY   8           HA1      GLY   8 -11.093  -3.253  -4.768
   56    H    GLY   9           HN       GLY   9  -9.908  -0.715  -4.751
   57    HA2  GLY   9           HA2      GLY   9  -8.671   0.053  -7.150
   58    HA3  GLY   9           HA1      GLY   9 -10.410   0.161  -7.376
   59    H    ALA  10           HN       ALA  10  -8.176   0.936  -4.714
   60    HA   ALA  10           HA       ALA  10  -9.467   3.572  -4.478
   61    HB1  ALA  10           HB1      ALA  10  -8.740   3.556  -2.145
   62    HB2  ALA  10           HB2      ALA  10  -7.948   2.000  -2.394
   63    HB3  ALA  10           HB3      ALA  10  -9.702   2.125  -2.516
   64    H    ARG  11           HN       ARG  11  -7.576   4.932  -2.981
   65    HA   ARG  11           HA       ARG  11  -5.080   4.868  -4.520
   66    HB2  ARG  11           HB2      ARG  11  -6.908   7.251  -4.237
   67    HB3  ARG  11           HB1      ARG  11  -5.202   7.420  -4.625
   68    HG2  ARG  11           HG2      ARG  11  -5.527   6.082  -6.646
   69    HG3  ARG  11           HG1      ARG  11  -7.238   5.909  -6.255
   70    HD2  ARG  11           HD2      ARG  11  -5.911   8.586  -6.608
   71    HD3  ARG  11           HD1      ARG  11  -6.629   7.699  -7.950
   72    HE   ARG  11           HE       ARG  11  -8.496   7.934  -5.846
   73   HH11  ARG  11          HH11      ARG  11  -6.990   9.898  -8.337
   74   HH12  ARG  11          HH12      ARG  11  -8.322  11.000  -8.433
   75   HH21  ARG  11          HH21      ARG  11 -10.229   9.388  -5.991
   76   HH22  ARG  11          HH22      ARG  11 -10.154  10.711  -7.106
   77    H    CYS  12           HN       CYS  12  -3.293   5.835  -3.509
   78    HA   CYS  12           HA       CYS  12  -3.125   5.517  -0.729
   79    HB2  CYS  12           HB2      CYS  12  -1.378   5.833  -2.880
   80    HB3  CYS  12           HB1      CYS  12  -1.018   7.182  -1.805
   81    H    SER  13           HN       SER  13  -1.748   7.464   0.496
   82    HA   SER  13           HA       SER  13  -3.734   9.499   0.977
   83    HB2  SER  13           HB2      SER  13  -2.192   8.357   2.758
   84    HB3  SER  13           HB1      SER  13  -0.975   9.508   2.214
   85    HG   SER  13           HG       SER  13  -3.565  10.267   3.073
   86    H    ASN  14           HN       ASN  14  -0.385   9.465  -0.038
   87    HA   ASN  14           HA       ASN  14  -0.788  11.799  -1.754
   88    HB2  ASN  14           HB2      ASN  14   1.375  11.529   0.356
   89    HB3  ASN  14           HB1      ASN  14   1.473  12.676  -0.976
   90   HD21  ASN  14          HD21      ASN  14  -0.133  11.849   1.989
   91   HD22  ASN  14          HD22      ASN  14  -0.918  13.370   2.226
   92    H    GLY  15           HN       GLY  15   1.697  12.043  -2.859
   93    HA2  GLY  15           HA2      GLY  15   1.949   9.602  -4.377
   94    HA3  GLY  15           HA1      GLY  15   2.903  11.067  -4.589
   95    H    LEU  16           HN       LEU  16   2.393   8.560  -2.129
   96    HA   LEU  16           HA       LEU  16   5.249   8.645  -1.486
   97    HB2  LEU  16           HB2      LEU  16   4.344   7.333   0.616
   98    HB3  LEU  16           HB1      LEU  16   4.273   9.079   0.522
   99    HG   LEU  16           HG       LEU  16   1.834   8.513  -0.442
  100   HD11  LEU  16          HD11      LEU  16   1.912   6.161  -0.342
  101   HD12  LEU  16          HD12      LEU  16   0.894   6.691   0.996
  102   HD13  LEU  16          HD13      LEU  16   2.553   6.182   1.301
  103   HD21  LEU  16          HD21      LEU  16   2.706   9.772   1.708
  104   HD22  LEU  16          HD22      LEU  16   2.070   8.331   2.502
  105   HD23  LEU  16          HD23      LEU  16   1.018   9.328   1.505
  106    H    CYS  17           HN       CYS  17   3.522   5.928  -0.314
  107    HA   CYS  17           HA       CYS  17   4.648   4.142  -2.357
  108    HB2  CYS  17           HB2      CYS  17   4.934   3.248   0.443
  109    HB3  CYS  17           HB1      CYS  17   6.056   3.080  -0.901
  110    H    CYS  18           HN       CYS  18   3.830   1.918  -2.192
  111    HA   CYS  18           HA       CYS  18   1.339   1.572  -0.693
  112    HB2  CYS  18           HB2      CYS  18   0.786   2.407  -2.995
  113    HB3  CYS  18           HB1      CYS  18   1.551   0.967  -3.655
  114    H    SER  19           HN       SER  19   1.359  -0.296   0.345
  115    HA   SER  19           HA       SER  19   3.484  -2.153   0.151
  116    HB2  SER  19           HB2      SER  19   0.858  -2.316   1.626
  117    HB3  SER  19           HB1      SER  19   2.191  -3.446   1.836
  118    HG   SER  19           HG       SER  19   2.018  -1.557   3.328
  119    H    GLN  20           HN       GLN  20   3.395  -4.402  -0.152
  120    HA   GLN  20           HA       GLN  20   2.801  -5.370  -2.563
  121    HB2  GLN  20           HB2      GLN  20   2.943  -6.798   0.058
  122    HB3  GLN  20           HB1      GLN  20   2.713  -7.679  -1.445
  123    HG2  GLN  20           HG2      GLN  20   4.974  -5.752  -1.225
  124    HG3  GLN  20           HG1      GLN  20   5.103  -7.330  -0.451
  125   HE21  GLN  20          HE21      GLN  20   5.156  -9.184  -1.724
  126   HE22  GLN  20          HE22      GLN  20   5.500  -9.126  -3.416
  127    H    PHE  21           HN       PHE  21   0.587  -5.756   0.149
  128    HA   PHE  21           HA       PHE  21  -1.419  -7.054  -1.460
  129    HB2  PHE  21           HB2      PHE  21  -1.428  -6.024   1.375
  130    HB3  PHE  21           HB1      PHE  21  -2.828  -6.783   0.627
  131    HD1  PHE  21           HD1      PHE  21  -2.935  -9.117   0.284
  132    HD2  PHE  21           HD2      PHE  21   0.590  -7.314   1.830
  133    HE1  PHE  21           HE1      PHE  21  -2.087 -11.344   0.928
  134    HE2  PHE  21           HE2      PHE  21   1.451  -9.533   2.480
  135    HZ   PHE  21           HZ       PHE  21   0.110 -11.551   2.027
  136    H    GLY  22           HN       GLY  22  -0.865  -3.902  -0.113
  137    HA2  GLY  22           HA2      GLY  22  -1.717  -2.109  -1.713
  138    HA3  GLY  22           HA1      GLY  22  -3.281  -2.860  -1.420
  139    H    TYR  23           HN       TYR  23  -0.519  -1.879   0.600
  140    HA   TYR  23           HA       TYR  23  -2.421  -0.402   2.298
  141    HB2  TYR  23           HB2      TYR  23  -0.987  -2.514   3.177
  142    HB3  TYR  23           HB1      TYR  23   0.174  -1.228   3.481
  143    HD1  TYR  23           HD1      TYR  23  -1.662   0.996   4.289
  144    HD2  TYR  23           HD2      TYR  23  -1.671  -3.137   5.308
  145    HE1  TYR  23           HE1      TYR  23  -2.850   1.519   6.380
  146    HE2  TYR  23           HE2      TYR  23  -2.859  -2.623   7.400
  147    HH   TYR  23           HH       TYR  23  -4.307   0.383   8.006
  148    H    CYS  24           HN       CYS  24  -2.161   1.669   2.379
  149    HA   CYS  24           HA       CYS  24   0.001   2.974   1.026
  150    HB2  CYS  24           HB2      CYS  24  -2.432   3.680   1.083
  151    HB3  CYS  24           HB1      CYS  24  -2.116   4.272   2.712
  152    H    GLY  25           HN       GLY  25   1.470   4.467   1.871
  153    HA2  GLY  25           HA2      GLY  25   1.719   5.330   4.474
  154    HA3  GLY  25           HA1      GLY  25   2.542   3.788   4.419
  155    H    SER  26           HN       SER  26   3.644   6.253   5.034
  156    HA   SER  26           HA       SER  26   5.822   6.432   3.067
  157    HB2  SER  26           HB2      SER  26   5.798   8.930   3.261
  158    HB3  SER  26           HB1      SER  26   4.336   8.313   2.508
  159    HG   SER  26           HG       SER  26   3.197   8.733   4.320
  160    H    THR  27           HN       THR  27   4.787   5.847   6.063
  161    HA   THR  27           HA       THR  27   7.278   6.538   7.376
  162    HB   THR  27           HB       THR  27   6.362   8.469   8.150
  163    HG1  THR  27           HG1      THR  27   4.799   6.908   9.910
  164   HG21  THR  27          HG21      THR  27   3.529   7.497   8.322
  165   HG22  THR  27          HG22      THR  27   4.215   7.907   6.751
  166   HG23  THR  27          HG23      THR  27   4.137   9.126   8.023
  167    HA   PRO  28           HA       PRO  28   4.959   3.291  10.063
  168    HB2  PRO  28           HB2      PRO  28   2.594   2.288   8.753
  169    HB3  PRO  28           HB1      PRO  28   2.675   3.331  10.182
  170    HG2  PRO  28           HG2      PRO  28   1.617   4.148   7.820
  171    HG3  PRO  28           HG1      PRO  28   2.389   5.247   8.981
  172    HD2  PRO  28           HD2      PRO  28   3.625   3.934   6.552
  173    HD3  PRO  28           HD1      PRO  28   3.637   5.655   7.014
  174    HA   PRO  29           HA       PRO  29   6.316  -0.658   8.307
  175    HB2  PRO  29           HB2      PRO  29   3.870  -2.134   9.145
  176    HB3  PRO  29           HB1      PRO  29   5.565  -2.424   9.579
  177    HG2  PRO  29           HG2      PRO  29   3.911  -1.417  11.354
  178    HG3  PRO  29           HG1      PRO  29   5.570  -0.791  11.213
  179    HD2  PRO  29           HD2      PRO  29   3.026   0.378  10.146
  180    HD3  PRO  29           HD1      PRO  29   4.355   1.180  11.009
  181    H    TYR  30           HN       TYR  30   5.134   0.888   6.438
  182    HA   TYR  30           HA       TYR  30   4.098  -1.043   4.486
  183    HB2  TYR  30           HB2      TYR  30   3.009   1.758   4.473
  184    HB3  TYR  30           HB1      TYR  30   2.335   0.318   3.737
  185    HD1  TYR  30           HD1      TYR  30   1.777  -1.556   5.655
  186    HD2  TYR  30           HD2      TYR  30   1.750   2.661   6.182
  187    HE1  TYR  30           HE1      TYR  30   0.253  -1.821   7.568
  188    HE2  TYR  30           HE2      TYR  30   0.224   2.407   8.103
  189    HH   TYR  30           HH       TYR  30  -0.392  -0.575   9.588
  190    H    CYS  31           HN       CYS  31   5.724   1.871   5.378
  191    HA   CYS  31           HA       CYS  31   7.433   1.751   3.081
  192    HB2  CYS  31           HB2      CYS  31   5.500   3.283   2.439
  193    HB3  CYS  31           HB1      CYS  31   6.125   4.392   3.652
  194    H    GLY  32           HN       GLY  32   8.977   1.219   4.499
  195    HA2  GLY  32           HA2      GLY  32  10.771   2.979   5.469
  196    HA3  GLY  32           HA1      GLY  32   9.620   2.849   6.797
  197    H    ALA  33           HN       ALA  33   8.883   0.374   6.937
  198    HA   ALA  33           HA       ALA  33  10.826  -1.645   6.537
  199    HB1  ALA  33           HB1      ALA  33  11.419  -2.121   8.872
  200    HB2  ALA  33           HB2      ALA  33  10.525  -0.697   9.404
  201    HB3  ALA  33           HB3      ALA  33  11.970  -0.510   8.410
  202    H    GLY  34           HN       GLY  34   9.241  -2.872   5.754
  203    HA2  GLY  34           HA2      GLY  34   7.632  -4.397   7.477
  204    HA3  GLY  34           HA1      GLY  34   6.640  -3.131   6.766
  205    H    GLN  35           HN       GLN  35   6.257  -3.110   4.557
  206    HA   GLN  35           HA       GLN  35   7.221  -5.296   2.908
  207    HB2  GLN  35           HB2      GLN  35   4.754  -5.740   2.187
  208    HB3  GLN  35           HB1      GLN  35   5.362  -6.492   3.652
  209    HG2  GLN  35           HG2      GLN  35   4.279  -4.711   4.978
  210    HG3  GLN  35           HG1      GLN  35   3.620  -4.038   3.491
  211   HE21  GLN  35          HE21      GLN  35   1.958  -5.113   2.434
  212   HE22  GLN  35          HE22      GLN  35   1.044  -6.367   3.192
  213    H    CYS  36           HN       CYS  36   8.136  -2.997   2.391
  214    HA   CYS  36           HA       CYS  36   6.516  -1.222   0.847
  215    HB2  CYS  36           HB2      CYS  36   9.525  -1.458   0.842
  216    HB3  CYS  36           HB1      CYS  36   8.577  -0.067   0.335
  217    H    GLN  37           HN       GLN  37   5.773  -1.511  -1.157
  218    HA   GLN  37           HA       GLN  37   7.170  -3.317  -2.989
  219    HB2  GLN  37           HB2      GLN  37   4.664  -3.515  -2.456
  220    HB3  GLN  37           HB1      GLN  37   4.461  -2.066  -3.427
  221    HG2  GLN  37           HG2      GLN  37   5.569  -3.288  -5.313
  222    HG3  GLN  37           HG1      GLN  37   5.484  -4.746  -4.325
  223   HE21  GLN  37          HE21      GLN  37   3.555  -5.788  -4.078
  224   HE22  GLN  37          HE22      GLN  37   2.121  -5.360  -4.942
  225    H    SER  38           HN       SER  38   5.724  -0.054  -2.907
  226    HA   SER  38           HA       SER  38   6.945   0.664  -5.433
  227    HB2  SER  38           HB2      SER  38   5.141   2.189  -3.551
  228    HB3  SER  38           HB1      SER  38   5.768   2.858  -5.058
  229    HG   SER  38           HG       SER  38   4.753   1.010  -6.102
  230    H    GLN  39           HN       GLN  39   7.050   1.867  -2.121
  231    HA   GLN  39           HA       GLN  39   9.846   2.623  -2.424
  232    HB2  GLN  39           HB2      GLN  39   7.610   4.570  -1.935
  233    HB3  GLN  39           HB1      GLN  39   9.208   4.881  -1.271
  234    HG2  GLN  39           HG2      GLN  39  10.144   4.724  -3.552
  235    HG3  GLN  39           HG1      GLN  39   8.509   4.523  -4.176
  236   HE21  GLN  39          HE21      GLN  39   7.104   6.271  -4.178
  237   HE22  GLN  39          HE22      GLN  39   7.650   7.894  -3.955
  238    H    CYS  40           HN       CYS  40  10.891   3.117  -0.367
  239    HA   CYS  40           HA       CYS  40   9.417   2.189   1.999
  240    HB2  CYS  40           HB2      CYS  40  11.243   0.591   0.769
  241    HB3  CYS  40           HB1      CYS  40  12.272   1.444   1.915
  Start of MODEL    3
    1    H1   PHE   1           HT1      PHE   1  -6.206  -2.064   1.566
    2    H2   PHE   1           HT2      PHE   1  -6.957  -2.223   0.059
    3    H3   PHE   1           HT3      PHE   1  -7.207  -3.390   1.258
    4    HA   PHE   1           HA       PHE   1  -9.107  -1.954   1.060
    5    HB2  PHE   1           HB2      PHE   1  -9.241  -1.232   3.462
    6    HB3  PHE   1           HB1      PHE   1  -8.695  -2.890   3.261
    7    HD1  PHE   1           HD1      PHE   1  -6.186  -3.354   3.460
    8    HD2  PHE   1           HD2      PHE   1  -7.988   0.310   4.665
    9    HE1  PHE   1           HE1      PHE   1  -4.237  -2.862   4.877
   10    HE2  PHE   1           HE2      PHE   1  -6.039   0.809   6.077
   11    HZ   PHE   1           HZ       PHE   1  -4.162  -0.778   6.183
   12    H    GLN   2           HN       GLN   2  -6.111  -0.241   1.580
   13    HA   GLN   2           HA       GLN   2  -7.438   2.337   1.193
   14    HB2  GLN   2           HB2      GLN   2  -4.711   1.573   2.189
   15    HB3  GLN   2           HB1      GLN   2  -5.055   3.216   1.668
   16    HG2  GLN   2           HG2      GLN   2  -6.893   3.300   3.331
   17    HG3  GLN   2           HG1      GLN   2  -6.390   1.711   3.901
   18   HE21  GLN   2          HE21      GLN   2  -4.452   1.497   5.020
   19   HE22  GLN   2          HE22      GLN   2  -3.631   2.855   5.702
   20    H    CYS   3           HN       CYS   3  -4.845   0.382  -0.152
   21    HA   CYS   3           HA       CYS   3  -5.314   1.299  -2.829
   22    HB2  CYS   3           HB2      CYS   3  -3.965   3.146  -2.562
   23    HB3  CYS   3           HB1      CYS   3  -3.053   2.422  -1.248
   24    H    GLY   4           HN       GLY   4  -4.689  -0.209  -4.279
   25    HA2  GLY   4           HA2      GLY   4  -2.850  -1.812  -4.874
   26    HA3  GLY   4           HA1      GLY   4  -3.026  -2.427  -3.240
   27    H    ARG   5           HN       ARG   5  -3.552  -4.488  -3.732
   28    HA   ARG   5           HA       ARG   5  -5.828  -4.981  -5.498
   29    HB2  ARG   5           HB2      ARG   5  -5.089  -7.413  -5.296
   30    HB3  ARG   5           HB1      ARG   5  -4.013  -6.325  -6.155
   31    HG2  ARG   5           HG2      ARG   5  -2.788  -6.111  -3.895
   32    HG3  ARG   5           HG1      ARG   5  -3.669  -7.583  -3.466
   33    HD2  ARG   5           HD2      ARG   5  -2.806  -8.640  -5.515
   34    HD3  ARG   5           HD1      ARG   5  -1.855  -7.189  -5.827
   35    HE   ARG   5           HE       ARG   5  -1.236  -8.103  -3.256
   36   HH11  ARG   5          HH11      ARG   5  -0.783  -9.151  -6.578
   37   HH12  ARG   5          HH12      ARG   5   0.666 -10.032  -6.223
   38   HH21  ARG   5          HH21      ARG   5   1.482 -10.094  -4.094
   39   HH22  ARG   5          HH22      ARG   5   0.661  -9.262  -2.815
   40    H    GLN   6           HN       GLN   6  -5.139  -4.853  -2.151
   41    HA   GLN   6           HA       GLN   6  -6.983  -6.826  -1.223
   42    HB2  GLN   6           HB2      GLN   6  -5.413  -4.640   0.001
   43    HB3  GLN   6           HB1      GLN   6  -6.871  -5.121   0.859
   44    HG2  GLN   6           HG2      GLN   6  -4.824  -7.137  -0.025
   45    HG3  GLN   6           HG1      GLN   6  -4.680  -6.270   1.502
   46   HE21  GLN   6          HE21      GLN   6  -6.155  -6.684   3.151
   47   HE22  GLN   6          HE22      GLN   6  -7.159  -8.089   3.155
   48    H    ALA   7           HN       ALA   7  -7.299  -3.722  -2.540
   49    HA   ALA   7           HA       ALA   7 -10.065  -3.404  -1.609
   50    HB1  ALA   7           HB1      ALA   7  -8.451  -1.566  -1.114
   51    HB2  ALA   7           HB2      ALA   7  -9.848  -1.066  -2.066
   52    HB3  ALA   7           HB3      ALA   7  -8.289  -1.318  -2.852
   53    H    GLY   8           HN       GLY   8  -7.968  -3.607  -4.382
   54    HA2  GLY   8           HA2      GLY   8  -8.780  -4.663  -6.409
   55    HA3  GLY   8           HA1      GLY   8 -10.325  -3.875  -6.137
   56    H    GLY   9           HN       GLY   9  -9.315  -1.293  -5.517
   57    HA2  GLY   9           HA2      GLY   9  -7.553  -0.234  -7.422
   58    HA3  GLY   9           HA1      GLY   9  -9.173  -0.158  -8.094
   59    H    ALA  10           HN       ALA  10  -7.092   0.937  -5.480
   60    HA   ALA  10           HA       ALA  10  -8.846   3.273  -5.121
   61    HB1  ALA  10           HB1      ALA  10  -8.344   3.203  -2.681
   62    HB2  ALA  10           HB2      ALA  10  -7.575   1.635  -2.928
   63    HB3  ALA  10           HB3      ALA  10  -9.295   1.832  -3.252
   64    H    ARG  11           HN       ARG  11  -7.149   4.527  -3.132
   65    HA   ARG  11           HA       ARG  11  -4.583   4.842  -4.504
   66    HB2  ARG  11           HB2      ARG  11  -4.816   7.376  -4.348
   67    HB3  ARG  11           HB1      ARG  11  -5.837   6.601  -5.547
   68    HG2  ARG  11           HG2      ARG  11  -7.751   6.775  -4.018
   69    HG3  ARG  11           HG1      ARG  11  -6.719   7.567  -2.828
   70    HD2  ARG  11           HD2      ARG  11  -7.866   9.304  -3.934
   71    HD3  ARG  11           HD1      ARG  11  -6.237   9.306  -4.607
   72    HE   ARG  11           HE       ARG  11  -7.834   7.696  -6.235
   73   HH11  ARG  11          HH11      ARG  11  -7.594  11.093  -5.375
   74   HH12  ARG  11          HH12      ARG  11  -8.244  11.639  -6.885
   75   HH21  ARG  11          HH21      ARG  11  -8.682   8.434  -8.203
   76   HH22  ARG  11          HH22      ARG  11  -8.860  10.133  -8.484
   77    H    CYS  12           HN       CYS  12  -3.030   6.226  -3.255
   78    HA   CYS  12           HA       CYS  12  -3.034   5.347  -0.505
   79    HB2  CYS  12           HB2      CYS  12  -0.998   6.526  -2.357
   80    HB3  CYS  12           HB1      CYS  12  -0.686   6.490  -0.625
   81    H    SER  13           HN       SER  13  -1.504   7.205   0.823
   82    HA   SER  13           HA       SER  13  -3.460   9.186   1.532
   83    HB2  SER  13           HB2      SER  13  -0.764   8.405   2.640
   84    HB3  SER  13           HB1      SER  13  -1.589   9.852   3.219
   85    HG   SER  13           HG       SER  13  -1.957   7.688   4.299
   86    H    ASN  14           HN       ASN  14  -0.097   9.364   0.495
   87    HA   ASN  14           HA       ASN  14  -0.630  11.842  -0.975
   88    HB2  ASN  14           HB2      ASN  14   1.521  11.492   1.131
   89    HB3  ASN  14           HB1      ASN  14   1.558  12.778  -0.070
   90   HD21  ASN  14          HD21      ASN  14   0.048  14.441   0.042
   91   HD22  ASN  14          HD22      ASN  14  -0.872  14.748   1.471
   92    H    GLY  15           HN       GLY  15   1.966  12.368  -1.844
   93    HA2  GLY  15           HA2      GLY  15   2.341  10.279  -3.790
   94    HA3  GLY  15           HA1      GLY  15   3.286  11.757  -3.647
   95    H    LEU  16           HN       LEU  16   2.658   8.867  -1.716
   96    HA   LEU  16           HA       LEU  16   5.513   8.683  -1.044
   97    HB2  LEU  16           HB2      LEU  16   4.395   7.191   0.884
   98    HB3  LEU  16           HB1      LEU  16   4.601   8.920   1.023
   99    HG   LEU  16           HG       LEU  16   2.146   8.909  -0.031
  100   HD11  LEU  16          HD11      LEU  16   2.330   6.294   1.433
  101   HD12  LEU  16          HD12      LEU  16   1.929   6.539  -0.267
  102   HD13  LEU  16          HD13      LEU  16   0.828   7.103   0.990
  103   HD21  LEU  16          HD21      LEU  16   2.587   8.356   2.885
  104   HD22  LEU  16          HD22      LEU  16   1.288   9.284   2.142
  105   HD23  LEU  16          HD23      LEU  16   2.935   9.907   2.120
  106    H    CYS  17           HN       CYS  17   3.803   5.933  -0.061
  107    HA   CYS  17           HA       CYS  17   4.328   4.449  -2.530
  108    HB2  CYS  17           HB2      CYS  17   5.588   2.713  -1.346
  109    HB3  CYS  17           HB1      CYS  17   6.369   4.269  -1.092
  110    H    CYS  18           HN       CYS  18   3.641   2.006  -2.064
  111    HA   CYS  18           HA       CYS  18   1.178   1.919  -0.477
  112    HB2  CYS  18           HB2      CYS  18   0.660   2.537  -2.871
  113    HB3  CYS  18           HB1      CYS  18   1.309   0.973  -3.347
  114    H    SER  19           HN       SER  19   0.978   0.094   0.630
  115    HA   SER  19           HA       SER  19   2.952  -1.998   0.347
  116    HB2  SER  19           HB2      SER  19   0.732  -1.572   2.338
  117    HB3  SER  19           HB1      SER  19   1.874  -2.910   2.411
  118    HG   SER  19           HG       SER  19   2.757  -1.367   3.674
  119    H    GLN  20           HN       GLN  20   2.493  -4.196   0.209
  120    HA   GLN  20           HA       GLN  20   0.917  -4.965  -1.927
  121    HB2  GLN  20           HB2      GLN  20   2.178  -6.603   0.255
  122    HB3  GLN  20           HB1      GLN  20   1.416  -7.311  -1.160
  123    HG2  GLN  20           HG2      GLN  20   3.021  -6.000  -2.564
  124    HG3  GLN  20           HG1      GLN  20   3.851  -5.552  -1.073
  125   HE21  GLN  20          HE21      GLN  20   4.976  -7.117   0.081
  126   HE22  GLN  20          HE22      GLN  20   5.416  -8.634  -0.618
  127    H    PHE  21           HN       PHE  21  -0.278  -4.491   1.258
  128    HA   PHE  21           HA       PHE  21  -2.566  -6.208   0.572
  129    HB2  PHE  21           HB2      PHE  21  -0.934  -6.192   2.964
  130    HB3  PHE  21           HB1      PHE  21  -2.650  -6.032   3.330
  131    HD1  PHE  21           HD1      PHE  21  -4.112  -7.855   3.135
  132    HD2  PHE  21           HD2      PHE  21  -0.170  -8.129   1.556
  133    HE1  PHE  21           HE1      PHE  21  -4.415 -10.276   2.809
  134    HE2  PHE  21           HE2      PHE  21  -0.465 -10.552   1.227
  135    HZ   PHE  21           HZ       PHE  21  -2.591 -11.627   1.852
  136    H    GLY  22           HN       GLY  22  -2.258  -3.314   0.076
  137    HA2  GLY  22           HA2      GLY  22  -3.992  -1.762  -0.191
  138    HA3  GLY  22           HA1      GLY  22  -4.907  -2.611   1.039
  139    H    TYR  23           HN       TYR  23  -1.611  -1.583   1.465
  140    HA   TYR  23           HA       TYR  23  -2.548   0.468   3.356
  141    HB2  TYR  23           HB2      TYR  23  -0.779  -1.769   3.765
  142    HB3  TYR  23           HB1      TYR  23   0.080  -0.265   4.073
  143    HD1  TYR  23           HD1      TYR  23  -1.706   1.475   5.399
  144    HD2  TYR  23           HD2      TYR  23  -1.472  -2.765   5.681
  145    HE1  TYR  23           HE1      TYR  23  -2.740   1.573   7.637
  146    HE2  TYR  23           HE2      TYR  23  -2.507  -2.682   7.915
  147    HH   TYR  23           HH       TYR  23  -2.787  -1.079   9.756
  148    H    CYS  24           HN       CYS  24  -1.107   2.261   3.713
  149    HA   CYS  24           HA       CYS  24   0.919   2.804   1.700
  150    HB2  CYS  24           HB2      CYS  24  -1.487   4.599   2.071
  151    HB3  CYS  24           HB1      CYS  24  -0.073   4.973   1.090
  152    H    GLY  25           HN       GLY  25   2.245   4.636   2.242
  153    HA2  GLY  25           HA2      GLY  25   1.870   6.216   4.518
  154    HA3  GLY  25           HA1      GLY  25   2.782   4.797   4.999
  155    H    SER  26           HN       SER  26   4.099   6.739   5.552
  156    HA   SER  26           HA       SER  26   6.302   6.964   3.669
  157    HB2  SER  26           HB2      SER  26   4.746   8.910   3.160
  158    HB3  SER  26           HB1      SER  26   5.056   9.492   4.790
  159    HG   SER  26           HG       SER  26   7.242   8.892   3.154
  160    H    THR  27           HN       THR  27   5.239   6.159   6.503
  161    HA   THR  27           HA       THR  27   7.614   6.935   7.981
  162    HB   THR  27           HB       THR  27   6.533   8.647   8.985
  163    HG1  THR  27           HG1      THR  27   4.830   7.024  10.454
  164   HG21  THR  27          HG21      THR  27   4.494   8.100   7.360
  165   HG22  THR  27          HG22      THR  27   4.334   9.244   8.691
  166   HG23  THR  27          HG23      THR  27   3.742   7.594   8.875
  167    HA   PRO  28           HA       PRO  28   5.659   3.186  10.235
  168    HB2  PRO  28           HB2      PRO  28   3.201   2.291   9.040
  169    HB3  PRO  28           HB1      PRO  28   3.390   3.195  10.553
  170    HG2  PRO  28           HG2      PRO  28   2.127   4.209   8.366
  171    HG3  PRO  28           HG1      PRO  28   2.968   5.210   9.565
  172    HD2  PRO  28           HD2      PRO  28   4.053   4.146   6.946
  173    HD3  PRO  28           HD1      PRO  28   4.047   5.827   7.542
  174    HA   PRO  29           HA       PRO  29   6.915  -0.529   7.918
  175    HB2  PRO  29           HB2      PRO  29   5.013  -2.460   8.514
  176    HB3  PRO  29           HB1      PRO  29   6.378  -2.032   9.562
  177    HG2  PRO  29           HG2      PRO  29   3.547  -1.103   9.688
  178    HG3  PRO  29           HG1      PRO  29   4.626  -1.622  11.002
  179    HD2  PRO  29           HD2      PRO  29   4.210   0.949  10.591
  180    HD3  PRO  29           HD1      PRO  29   5.842   0.360  10.961
  181    H    TYR  30           HN       TYR  30   5.635   1.229   6.331
  182    HA   TYR  30           HA       TYR  30   4.340  -0.452   4.306
  183    HB2  TYR  30           HB2      TYR  30   3.363   2.368   4.757
  184    HB3  TYR  30           HB1      TYR  30   2.594   1.075   3.853
  185    HD1  TYR  30           HD1      TYR  30   2.274  -1.113   5.642
  186    HD2  TYR  30           HD2      TYR  30   2.070   3.040   6.528
  187    HE1  TYR  30           HE1      TYR  30   0.867  -1.611   7.594
  188    HE2  TYR  30           HE2      TYR  30   0.663   2.549   8.491
  189    HH   TYR  30           HH       TYR  30   0.283  -0.569   9.748
  190    H    CYS  31           HN       CYS  31   6.143   2.355   5.314
  191    HA   CYS  31           HA       CYS  31   7.372   2.548   2.682
  192    HB2  CYS  31           HB2      CYS  31   5.802   4.565   3.887
  193    HB3  CYS  31           HB1      CYS  31   7.480   5.105   3.870
  194    H    GLY  32           HN       GLY  32   7.729   2.349   6.006
  195    HA2  GLY  32           HA2      GLY  32  10.605   2.825   5.669
  196    HA3  GLY  32           HA1      GLY  32   9.737   3.268   7.133
  197    H    ALA  33           HN       ALA  33  10.533   0.515   5.065
  198    HA   ALA  33           HA       ALA  33  11.018  -1.662   5.436
  199    HB1  ALA  33           HB1      ALA  33  12.087  -2.336   7.512
  200    HB2  ALA  33           HB2      ALA  33  11.564  -0.844   8.293
  201    HB3  ALA  33           HB3      ALA  33  12.731  -0.785   6.972
  202    H    GLY  34           HN       GLY  34   9.173  -2.705   5.058
  203    HA2  GLY  34           HA2      GLY  34   7.814  -4.001   7.155
  204    HA3  GLY  34           HA1      GLY  34   6.848  -2.637   6.616
  205    H    GLN  35           HN       GLN  35   5.731  -2.756   4.726
  206    HA   GLN  35           HA       GLN  35   6.038  -5.186   3.090
  207    HB2  GLN  35           HB2      GLN  35   3.331  -4.065   3.839
  208    HB3  GLN  35           HB1      GLN  35   3.679  -5.593   3.048
  209    HG2  GLN  35           HG2      GLN  35   4.838  -6.281   5.195
  210    HG3  GLN  35           HG1      GLN  35   4.118  -4.846   5.925
  211   HE21  GLN  35          HE21      GLN  35   3.511  -7.992   4.577
  212   HE22  GLN  35          HE22      GLN  35   1.888  -8.148   5.146
  213    H    CYS  36           HN       CYS  36   7.088  -2.663   2.456
  214    HA   CYS  36           HA       CYS  36   5.370  -1.099   0.814
  215    HB2  CYS  36           HB2      CYS  36   7.597  -0.140  -0.012
  216    HB3  CYS  36           HB1      CYS  36   7.226   0.028   1.701
  217    H    GLN  37           HN       GLN  37   4.578  -1.566  -1.110
  218    HA   GLN  37           HA       GLN  37   5.909  -3.510  -2.839
  219    HB2  GLN  37           HB2      GLN  37   3.435  -3.653  -2.223
  220    HB3  GLN  37           HB1      GLN  37   3.195  -2.249  -3.248
  221    HG2  GLN  37           HG2      GLN  37   4.066  -3.505  -5.161
  222    HG3  GLN  37           HG1      GLN  37   4.271  -4.918  -4.130
  223   HE21  GLN  37          HE21      GLN  37   1.996  -2.836  -5.732
  224   HE22  GLN  37          HE22      GLN  37   0.623  -3.871  -5.576
  225    H    SER  38           HN       SER  38   4.660  -0.177  -2.903
  226    HA   SER  38           HA       SER  38   5.471   0.332  -5.596
  227    HB2  SER  38           HB2      SER  38   4.613   2.263  -3.437
  228    HB3  SER  38           HB1      SER  38   4.786   2.657  -5.146
  229    HG   SER  38           HG       SER  38   3.232   0.752  -5.361
  230    H    GLN  39           HN       GLN  39   6.566   1.784  -2.560
  231    HA   GLN  39           HA       GLN  39   9.324   1.792  -3.518
  232    HB2  GLN  39           HB2      GLN  39   7.734   4.256  -2.866
  233    HB3  GLN  39           HB1      GLN  39   9.475   4.232  -2.620
  234    HG2  GLN  39           HG2      GLN  39   9.799   3.695  -4.980
  235    HG3  GLN  39           HG1      GLN  39   8.053   3.716  -5.223
  236   HE21  GLN  39          HE21      GLN  39  10.894   5.628  -4.641
  237   HE22  GLN  39          HE22      GLN  39  10.187   7.160  -5.010
  238    H    CYS  40           HN       CYS  40  10.887   1.953  -1.887
  239    HA   CYS  40           HA       CYS  40   9.875   1.676   0.864
  240    HB2  CYS  40           HB2      CYS  40  12.219   0.186  -0.336
  241    HB3  CYS  40           HB1      CYS  40  11.602   0.014   1.304
  Start of MODEL    4
    1    H1   PHE   1           HT1      PHE   1  -7.555  -1.204   5.249
    2    H2   PHE   1           HT2      PHE   1  -6.422   0.034   5.462
    3    H3   PHE   1           HT3      PHE   1  -5.962  -1.578   5.682
    4    HA   PHE   1           HA       PHE   1  -5.153  -0.730   3.581
    5    HB2  PHE   1           HB2      PHE   1  -7.298  -2.850   3.503
    6    HB3  PHE   1           HB1      PHE   1  -6.295  -2.473   2.106
    7    HD1  PHE   1           HD1      PHE   1  -3.992  -3.118   2.020
    8    HD2  PHE   1           HD2      PHE   1  -6.331  -3.880   5.491
    9    HE1  PHE   1           HE1      PHE   1  -2.258  -4.652   2.849
   10    HE2  PHE   1           HE2      PHE   1  -4.599  -5.415   6.329
   11    HZ   PHE   1           HZ       PHE   1  -2.559  -5.805   5.004
   12    H    GLN   2           HN       GLN   2  -5.431   0.464   1.797
   13    HA   GLN   2           HA       GLN   2  -8.123   1.296   0.992
   14    HB2  GLN   2           HB2      GLN   2  -5.861   3.216   1.575
   15    HB3  GLN   2           HB1      GLN   2  -7.368   3.661   0.791
   16    HG2  GLN   2           HG2      GLN   2  -8.570   2.928   2.848
   17    HG3  GLN   2           HG1      GLN   2  -6.999   2.693   3.614
   18   HE21  GLN   2          HE21      GLN   2  -5.740   4.482   4.123
   19   HE22  GLN   2          HE22      GLN   2  -6.391   6.081   4.177
   20    H    CYS   3           HN       CYS   3  -4.735   1.029   0.299
   21    HA   CYS   3           HA       CYS   3  -5.078   1.680  -2.528
   22    HB2  CYS   3           HB2      CYS   3  -3.252   2.766  -1.390
   23    HB3  CYS   3           HB1      CYS   3  -2.646   1.231  -0.786
   24    H    GLY   4           HN       GLY   4  -3.641   0.317  -4.034
   25    HA2  GLY   4           HA2      GLY   4  -3.171  -1.631  -5.119
   26    HA3  GLY   4           HA1      GLY   4  -2.972  -2.358  -3.544
   27    H    ARG   5           HN       ARG   5  -3.740  -4.238  -4.671
   28    HA   ARG   5           HA       ARG   5  -6.465  -4.382  -5.552
   29    HB2  ARG   5           HB2      ARG   5  -5.983  -6.834  -5.791
   30    HB3  ARG   5           HB1      ARG   5  -4.886  -5.786  -6.675
   31    HG2  ARG   5           HG2      ARG   5  -3.394  -6.023  -4.555
   32    HG3  ARG   5           HG1      ARG   5  -4.374  -7.465  -4.270
   33    HD2  ARG   5           HD2      ARG   5  -3.854  -8.205  -6.567
   34    HD3  ARG   5           HD1      ARG   5  -2.781  -6.817  -6.735
   35    HE   ARG   5           HE       ARG   5  -1.982  -8.204  -4.460
   36   HH11  ARG   5          HH11      ARG   5  -2.103  -8.803  -7.919
   37   HH12  ARG   5          HH12      ARG   5  -0.760  -9.896  -7.892
   38   HH21  ARG   5          HH21      ARG   5   0.302 -10.366  -5.930
   39   HH22  ARG   5          HH22      ARG   5  -0.225  -9.636  -4.450
   40    H    GLN   6           HN       GLN   6  -5.013  -4.528  -2.482
   41    HA   GLN   6           HA       GLN   6  -6.605  -6.461  -1.157
   42    HB2  GLN   6           HB2      GLN   6  -4.554  -4.719  -0.432
   43    HB3  GLN   6           HB1      GLN   6  -5.932  -4.171   0.511
   44    HG2  GLN   6           HG2      GLN   6  -4.868  -7.000   0.466
   45    HG3  GLN   6           HG1      GLN   6  -4.546  -5.810   1.725
   46   HE21  GLN   6          HE21      GLN   6  -6.191  -5.261   3.165
   47   HE22  GLN   6          HE22      GLN   6  -7.612  -6.226   3.351
   48    H    ALA   7           HN       ALA   7  -7.216  -3.369  -2.394
   49    HA   ALA   7           HA       ALA   7  -9.869  -3.211  -1.151
   50    HB1  ALA   7           HB1      ALA   7  -8.371  -1.557  -0.165
   51    HB2  ALA   7           HB2      ALA   7  -9.631  -0.779  -1.123
   52    HB3  ALA   7           HB3      ALA   7  -7.999  -0.938  -1.773
   53    H    GLY   8           HN       GLY   8  -7.809  -2.463  -3.882
   54    HA2  GLY   8           HA2      GLY   8  -9.216  -3.197  -6.006
   55    HA3  GLY   8           HA1      GLY   8 -10.057  -1.712  -5.584
   56    H    GLY   9           HN       GLY   9  -8.583   0.223  -5.284
   57    HA2  GLY   9           HA2      GLY   9  -6.035   0.396  -6.440
   58    HA3  GLY   9           HA1      GLY   9  -7.216   0.756  -7.689
   59    H    ALA  10           HN       ALA  10  -5.925   1.784  -4.566
   60    HA   ALA  10           HA       ALA  10  -6.665   4.545  -5.190
   61    HB1  ALA  10           HB1      ALA  10  -7.618   4.948  -2.979
   62    HB2  ALA  10           HB2      ALA  10  -7.377   3.254  -2.552
   63    HB3  ALA  10           HB3      ALA  10  -8.518   3.688  -3.824
   64    H    ARG  11           HN       ARG  11  -5.818   5.932  -3.094
   65    HA   ARG  11           HA       ARG  11  -3.183   4.970  -2.253
   66    HB2  ARG  11           HB2      ARG  11  -2.187   7.247  -2.797
   67    HB3  ARG  11           HB1      ARG  11  -2.562   6.251  -4.191
   68    HG2  ARG  11           HG2      ARG  11  -4.581   8.253  -3.286
   69    HG3  ARG  11           HG1      ARG  11  -3.146   8.814  -4.144
   70    HD2  ARG  11           HD2      ARG  11  -4.939   6.633  -5.191
   71    HD3  ARG  11           HD1      ARG  11  -5.183   8.337  -5.566
   72    HE   ARG  11           HE       ARG  11  -2.539   7.710  -6.182
   73   HH11  ARG  11          HH11      ARG  11  -5.740   6.841  -7.338
   74   HH12  ARG  11          HH12      ARG  11  -5.197   6.529  -8.953
   75   HH21  ARG  11          HH21      ARG  11  -1.852   7.296  -8.302
   76   HH22  ARG  11          HH22      ARG  11  -2.997   6.787  -9.497
   77    H    CYS  12           HN       CYS  12  -2.280   6.182  -0.406
   78    HA   CYS  12           HA       CYS  12  -4.419   6.977   1.382
   79    HB2  CYS  12           HB2      CYS  12  -1.506   6.459   1.825
   80    HB3  CYS  12           HB1      CYS  12  -2.510   7.174   3.076
   81    H    SER  13           HN       SER  13  -1.247   8.551   1.198
   82    HA   SER  13           HA       SER  13  -2.525  11.088   1.753
   83    HB2  SER  13           HB2      SER  13  -0.515  10.400   3.049
   84    HB3  SER  13           HB1      SER  13   0.436  10.462   1.566
   85    HG   SER  13           HG       SER  13  -0.897  12.761   1.833
   86    H    ASN  14           HN       ASN  14   0.393  11.323  -0.071
   87    HA   ASN  14           HA       ASN  14  -1.063  11.869  -2.552
   88    HB2  ASN  14           HB2      ASN  14  -0.712  13.965  -1.070
   89    HB3  ASN  14           HB1      ASN  14   0.973  13.848  -1.564
   90   HD21  ASN  14          HD21      ASN  14  -2.281  14.495  -2.588
   91   HD22  ASN  14          HD22      ASN  14  -1.881  15.189  -4.119
   92    H    GLY  15           HN       GLY  15  -0.115  10.013  -3.404
   93    HA2  GLY  15           HA2      GLY  15   1.429   8.795  -4.585
   94    HA3  GLY  15           HA1      GLY  15   2.225  10.327  -4.890
   95    H    LEU  16           HN       LEU  16   1.783   8.308  -1.976
   96    HA   LEU  16           HA       LEU  16   4.584   8.724  -1.294
   97    HB2  LEU  16           HB2      LEU  16   3.716   7.209   0.756
   98    HB3  LEU  16           HB1      LEU  16   3.536   8.947   0.706
   99    HG   LEU  16           HG       LEU  16   1.200   8.686  -0.009
  100   HD11  LEU  16          HD11      LEU  16   0.071   6.679  -0.250
  101   HD12  LEU  16          HD12      LEU  16   1.360   5.753   0.518
  102   HD13  LEU  16          HD13      LEU  16   1.590   6.409  -1.104
  103   HD21  LEU  16          HD21      LEU  16   1.859   7.092   2.447
  104   HD22  LEU  16          HD22      LEU  16   0.321   7.879   2.093
  105   HD23  LEU  16          HD23      LEU  16   1.767   8.850   2.359
  106    H    CYS  17           HN       CYS  17   3.159   5.813  -0.202
  107    HA   CYS  17           HA       CYS  17   4.523   4.132  -2.174
  108    HB2  CYS  17           HB2      CYS  17   4.950   3.232   0.595
  109    HB3  CYS  17           HB1      CYS  17   6.076   3.255  -0.753
  110    H    CYS  18           HN       CYS  18   3.783   1.882  -2.076
  111    HA   CYS  18           HA       CYS  18   1.389   1.430  -0.468
  112    HB2  CYS  18           HB2      CYS  18   0.626   2.365  -2.607
  113    HB3  CYS  18           HB1      CYS  18   1.448   1.068  -3.464
  114    H    SER  19           HN       SER  19   1.337  -0.462   0.440
  115    HA   SER  19           HA       SER  19   3.445  -2.329   0.198
  116    HB2  SER  19           HB2      SER  19   0.792  -2.501   1.627
  117    HB3  SER  19           HB1      SER  19   2.081  -3.689   1.793
  118    HG   SER  19           HG       SER  19   3.424  -1.985   2.557
  119    H    GLN  20           HN       GLN  20   3.361  -4.543  -0.271
  120    HA   GLN  20           HA       GLN  20   2.666  -5.305  -2.760
  121    HB2  GLN  20           HB2      GLN  20   4.006  -6.473  -0.782
  122    HB3  GLN  20           HB1      GLN  20   2.543  -7.443  -0.723
  123    HG2  GLN  20           HG2      GLN  20   2.834  -7.999  -3.099
  124    HG3  GLN  20           HG1      GLN  20   4.328  -7.061  -3.119
  125   HE21  GLN  20          HE21      GLN  20   6.141  -7.850  -2.051
  126   HE22  GLN  20          HE22      GLN  20   6.274  -9.500  -1.560
  127    H    PHE  21           HN       PHE  21   0.604  -5.656   0.034
  128    HA   PHE  21           HA       PHE  21  -1.445  -7.079  -1.424
  129    HB2  PHE  21           HB2      PHE  21  -1.219  -6.034   1.382
  130    HB3  PHE  21           HB1      PHE  21  -2.728  -6.685   0.764
  131    HD1  PHE  21           HD1      PHE  21   0.669  -7.430   1.786
  132    HD2  PHE  21           HD2      PHE  21  -2.975  -9.014   0.284
  133    HE1  PHE  21           HE1      PHE  21   1.439  -9.709   2.354
  134    HE2  PHE  21           HE2      PHE  21  -2.224 -11.301   0.846
  135    HZ   PHE  21           HZ       PHE  21  -0.014 -11.647   1.883
  136    H    GLY  22           HN       GLY  22  -0.911  -3.898  -0.123
  137    HA2  GLY  22           HA2      GLY  22  -1.862  -2.153  -1.728
  138    HA3  GLY  22           HA1      GLY  22  -3.396  -2.924  -1.343
  139    H    TYR  23           HN       TYR  23  -0.575  -1.986   0.591
  140    HA   TYR  23           HA       TYR  23  -2.387  -0.351   2.241
  141    HB2  TYR  23           HB2      TYR  23  -1.068  -2.531   3.172
  142    HB3  TYR  23           HB1      TYR  23   0.137  -1.288   3.485
  143    HD1  TYR  23           HD1      TYR  23  -2.106  -3.089   5.153
  144    HD2  TYR  23           HD2      TYR  23  -1.363   1.023   4.340
  145    HE1  TYR  23           HE1      TYR  23  -3.323  -2.468   7.200
  146    HE2  TYR  23           HE2      TYR  23  -2.580   1.654   6.384
  147    HH   TYR  23           HH       TYR  23  -4.296   0.714   7.872
  148    H    CYS  24           HN       CYS  24  -2.101   1.639   1.566
  149    HA   CYS  24           HA       CYS  24   0.440   2.616   0.648
  150    HB2  CYS  24           HB2      CYS  24  -0.950   4.833   0.576
  151    HB3  CYS  24           HB1      CYS  24  -1.287   3.555  -0.578
  152    H    GLY  25           HN       GLY  25   1.913   3.721   1.653
  153    HA2  GLY  25           HA2      GLY  25   1.358   5.235   4.054
  154    HA3  GLY  25           HA1      GLY  25   2.359   3.811   4.301
  155    H    SER  26           HN       SER  26   3.525   5.980   5.028
  156    HA   SER  26           HA       SER  26   5.643   6.430   3.068
  157    HB2  SER  26           HB2      SER  26   3.891   8.259   2.780
  158    HB3  SER  26           HB1      SER  26   4.321   8.804   4.396
  159    HG   SER  26           HG       SER  26   6.428   8.403   2.641
  160    H    THR  27           HN       THR  27   4.665   5.720   6.109
  161    HA   THR  27           HA       THR  27   7.246   6.266   7.285
  162    HB   THR  27           HB       THR  27   6.444   8.306   7.993
  163    HG1  THR  27           HG1      THR  27   5.264   7.127  10.192
  164   HG21  THR  27          HG21      THR  27   3.721   7.235   8.715
  165   HG22  THR  27          HG22      THR  27   4.098   7.855   7.108
  166   HG23  THR  27          HG23      THR  27   4.222   8.914   8.513
  167    HA   PRO  28           HA       PRO  28   4.862   3.130  10.066
  168    HB2  PRO  28           HB2      PRO  28   2.532   2.117   8.685
  169    HB3  PRO  28           HB1      PRO  28   2.580   3.089  10.165
  170    HG2  PRO  28           HG2      PRO  28   1.525   3.994   7.841
  171    HG3  PRO  28           HG1      PRO  28   2.268   5.053   9.058
  172    HD2  PRO  28           HD2      PRO  28   3.515   3.920   6.553
  173    HD3  PRO  28           HD1      PRO  28   3.529   5.597   7.147
  174    HA   PRO  29           HA       PRO  29   6.340  -0.798   8.348
  175    HB2  PRO  29           HB2      PRO  29   4.385  -2.686   8.930
  176    HB3  PRO  29           HB1      PRO  29   5.621  -2.122  10.071
  177    HG2  PRO  29           HG2      PRO  29   2.792  -1.227   9.768
  178    HG3  PRO  29           HG1      PRO  29   3.712  -1.583  11.246
  179    HD2  PRO  29           HD2      PRO  29   3.346   0.922  10.507
  180    HD3  PRO  29           HD1      PRO  29   4.927   0.398  11.123
  181    H    TYR  30           HN       TYR  30   5.130   0.779   6.461
  182    HA   TYR  30           HA       TYR  30   4.237  -1.164   4.456
  183    HB2  TYR  30           HB2      TYR  30   2.986   1.580   4.493
  184    HB3  TYR  30           HB1      TYR  30   2.418   0.123   3.693
  185    HD1  TYR  30           HD1      TYR  30   1.804   2.312   6.330
  186    HD2  TYR  30           HD2      TYR  30   1.795  -1.844   5.420
  187    HE1  TYR  30           HE1      TYR  30   0.268   1.903   8.210
  188    HE2  TYR  30           HE2      TYR  30   0.262  -2.263   7.297
  189    HH   TYR  30           HH       TYR  30  -1.383   0.224   8.912
  190    H    CYS  31           HN       CYS  31   5.593   1.875   5.417
  191    HA   CYS  31           HA       CYS  31   7.392   1.882   3.153
  192    HB2  CYS  31           HB2      CYS  31   5.385   3.422   2.654
  193    HB3  CYS  31           HB1      CYS  31   6.053   4.463   3.904
  194    H    GLY  32           HN       GLY  32   8.862   1.214   4.668
  195    HA2  GLY  32           HA2      GLY  32  10.797   2.487   5.727
  196    HA3  GLY  32           HA1      GLY  32   9.561   3.106   6.821
  197    H    ALA  33           HN       ALA  33  10.506  -0.020   5.449
  198    HA   ALA  33           HA       ALA  33  10.999  -2.048   6.314
  199    HB1  ALA  33           HB1      ALA  33  10.907  -0.784   9.063
  200    HB2  ALA  33           HB2      ALA  33  12.346  -0.927   8.053
  201    HB3  ALA  33           HB3      ALA  33  11.549  -2.378   8.662
  202    H    GLY  34           HN       GLY  34   9.395  -3.290   5.815
  203    HA2  GLY  34           HA2      GLY  34   7.575  -4.385   7.529
  204    HA3  GLY  34           HA1      GLY  34   6.739  -2.989   6.860
  205    H    GLN  35           HN       GLN  35   6.308  -2.900   4.636
  206    HA   GLN  35           HA       GLN  35   6.896  -5.171   2.947
  207    HB2  GLN  35           HB2      GLN  35   4.406  -5.436   2.351
  208    HB3  GLN  35           HB1      GLN  35   4.959  -6.155   3.853
  209    HG2  GLN  35           HG2      GLN  35   4.026  -4.269   5.101
  210    HG3  GLN  35           HG1      GLN  35   3.480  -3.539   3.594
  211   HE21  GLN  35          HE21      GLN  35   2.982  -6.087   5.897
  212   HE22  GLN  35          HE22      GLN  35   1.428  -6.581   5.327
  213    H    CYS  36           HN       CYS  36   8.038  -3.060   2.301
  214    HA   CYS  36           HA       CYS  36   6.432  -1.174   0.797
  215    HB2  CYS  36           HB2      CYS  36   9.441  -1.411   0.959
  216    HB3  CYS  36           HB1      CYS  36   8.532  -0.035   0.347
  217    H    GLN  37           HN       GLN  37   5.732  -1.561  -1.204
  218    HA   GLN  37           HA       GLN  37   7.230  -3.355  -2.961
  219    HB2  GLN  37           HB2      GLN  37   4.708  -3.564  -2.539
  220    HB3  GLN  37           HB1      GLN  37   4.535  -2.114  -3.517
  221    HG2  GLN  37           HG2      GLN  37   5.733  -3.335  -5.353
  222    HG3  GLN  37           HG1      GLN  37   5.594  -4.792  -4.373
  223   HE21  GLN  37          HE21      GLN  37   3.629  -5.800  -4.178
  224   HE22  GLN  37          HE22      GLN  37   2.248  -5.372  -5.123
  225    H    SER  38           HN       SER  38   5.823  -0.080  -2.941
  226    HA   SER  38           HA       SER  38   7.174   0.602  -5.417
  227    HB2  SER  38           HB2      SER  38   5.225   2.152  -3.709
  228    HB3  SER  38           HB1      SER  38   5.926   2.762  -5.209
  229    HG   SER  38           HG       SER  38   5.034   0.649  -6.080
  230    H    GLN  39           HN       GLN  39   6.976   1.999  -2.171
  231    HA   GLN  39           HA       GLN  39   9.787   2.796  -2.336
  232    HB2  GLN  39           HB2      GLN  39   7.473   4.671  -1.886
  233    HB3  GLN  39           HB1      GLN  39   9.079   5.046  -1.280
  234    HG2  GLN  39           HG2      GLN  39   8.620   4.386  -4.167
  235    HG3  GLN  39           HG1      GLN  39   8.363   6.014  -3.544
  236   HE21  GLN  39          HE21      GLN  39  10.702   3.543  -4.245
  237   HE22  GLN  39          HE22      GLN  39  12.104   4.543  -4.109
  238    H    CYS  40           HN       CYS  40  10.783   3.237  -0.302
  239    HA   CYS  40           HA       CYS  40   9.266   2.392   2.065
  240    HB2  CYS  40           HB2      CYS  40  11.055   0.721   0.877
  241    HB3  CYS  40           HB1      CYS  40  12.098   1.564   2.018
  Start of MODEL    5
    1    H1   PHE   1           HT1      PHE   1  -6.316  -3.621   2.013
    2    H2   PHE   1           HT2      PHE   1  -5.974  -2.256   1.072
    3    H3   PHE   1           HT3      PHE   1  -7.563  -2.824   1.194
    4    HA   PHE   1           HA       PHE   1  -7.646  -2.278   3.503
    5    HB2  PHE   1           HB2      PHE   1  -4.798  -1.368   3.062
    6    HB3  PHE   1           HB1      PHE   1  -5.739  -0.968   4.494
    7    HD1  PHE   1           HD1      PHE   1  -6.285  -2.665   6.132
    8    HD2  PHE   1           HD2      PHE   1  -3.911  -3.588   2.723
    9    HE1  PHE   1           HE1      PHE   1  -5.567  -4.757   7.208
   10    HE2  PHE   1           HE2      PHE   1  -3.185  -5.684   3.798
   11    HZ   PHE   1           HZ       PHE   1  -4.015  -6.270   6.039
   12    H    GLN   2           HN       GLN   2  -5.695  -0.166   1.463
   13    HA   GLN   2           HA       GLN   2  -7.923   1.674   1.069
   14    HB2  GLN   2           HB2      GLN   2  -5.345   2.438   2.443
   15    HB3  GLN   2           HB1      GLN   2  -6.349   3.626   1.626
   16    HG2  GLN   2           HG2      GLN   2  -8.215   3.055   3.106
   17    HG3  GLN   2           HG1      GLN   2  -7.190   1.882   3.932
   18   HE21  GLN   2          HE21      GLN   2  -5.534   2.608   5.266
   19   HE22  GLN   2          HE22      GLN   2  -5.466   4.234   5.846
   20    H    CYS   3           HN       CYS   3  -5.179   0.092  -0.016
   21    HA   CYS   3           HA       CYS   3  -5.197   1.539  -2.557
   22    HB2  CYS   3           HB2      CYS   3  -3.389   2.599  -1.351
   23    HB3  CYS   3           HB1      CYS   3  -2.737   1.045  -0.856
   24    H    GLY   4           HN       GLY   4  -3.739   0.313  -4.185
   25    HA2  GLY   4           HA2      GLY   4  -3.249  -1.568  -5.387
   26    HA3  GLY   4           HA1      GLY   4  -2.996  -2.369  -3.851
   27    H    ARG   5           HN       ARG   5  -3.904  -4.279  -4.198
   28    HA   ARG   5           HA       ARG   5  -6.631  -4.411  -5.259
   29    HB2  ARG   5           HB2      ARG   5  -6.157  -6.870  -5.513
   30    HB3  ARG   5           HB1      ARG   5  -5.132  -5.822  -6.481
   31    HG2  ARG   5           HG2      ARG   5  -3.536  -6.046  -4.385
   32    HG3  ARG   5           HG1      ARG   5  -4.441  -7.550  -4.172
   33    HD2  ARG   5           HD2      ARG   5  -3.951  -8.113  -6.527
   34    HD3  ARG   5           HD1      ARG   5  -2.948  -6.666  -6.628
   35    HE   ARG   5           HE       ARG   5  -2.095  -8.258  -4.463
   36   HH11  ARG   5          HH11      ARG   5  -2.021  -8.259  -7.975
   37   HH12  ARG   5          HH12      ARG   5  -0.571  -9.203  -8.058
   38   HH21  ARG   5          HH21      ARG   5   0.458  -9.901  -6.146
   39   HH22  ARG   5          HH22      ARG   5  -0.198  -9.492  -4.597
   40    H    GLN   6           HN       GLN   6  -4.964  -4.549  -2.308
   41    HA   GLN   6           HA       GLN   6  -6.466  -6.481  -0.869
   42    HB2  GLN   6           HB2      GLN   6  -4.263  -4.966  -0.332
   43    HB3  GLN   6           HB1      GLN   6  -5.478  -4.149   0.640
   44    HG2  GLN   6           HG2      GLN   6  -4.938  -7.116   0.788
   45    HG3  GLN   6           HG1      GLN   6  -4.169  -5.928   1.832
   46   HE21  GLN   6          HE21      GLN   6  -5.961  -8.204   2.402
   47   HE22  GLN   6          HE22      GLN   6  -7.269  -7.546   3.319
   48    H    ALA   7           HN       ALA   7  -7.125  -3.343  -1.984
   49    HA   ALA   7           HA       ALA   7  -9.576  -3.122  -0.380
   50    HB1  ALA   7           HB1      ALA   7  -7.923  -1.426   0.219
   51    HB2  ALA   7           HB2      ALA   7  -9.338  -0.700  -0.545
   52    HB3  ALA   7           HB3      ALA   7  -7.849  -0.910  -1.466
   53    H    GLY   8           HN       GLY   8  -8.029  -2.649  -3.480
   54    HA2  GLY   8           HA2      GLY   8  -9.740  -3.483  -5.282
   55    HA3  GLY   8           HA1      GLY   8 -10.572  -2.014  -4.791
   56    H    GLY   9           HN       GLY   9  -9.109  -0.018  -4.801
   57    HA2  GLY   9           HA2      GLY   9  -6.836   0.176  -6.429
   58    HA3  GLY   9           HA1      GLY   9  -8.245   0.472  -7.436
   59    H    ALA  10           HN       ALA  10  -6.741   1.518  -4.368
   60    HA   ALA  10           HA       ALA  10  -7.443   4.289  -5.033
   61    HB1  ALA  10           HB1      ALA  10  -8.006   3.041  -2.340
   62    HB2  ALA  10           HB2      ALA  10  -9.216   3.460  -3.552
   63    HB3  ALA  10           HB3      ALA  10  -8.266   4.730  -2.779
   64    H    ARG  11           HN       ARG  11  -6.472   5.703  -3.014
   65    HA   ARG  11           HA       ARG  11  -3.780   4.765  -2.338
   66    HB2  ARG  11           HB2      ARG  11  -2.870   7.069  -2.986
   67    HB3  ARG  11           HB1      ARG  11  -3.287   6.010  -4.321
   68    HG2  ARG  11           HG2      ARG  11  -5.481   7.240  -4.472
   69    HG3  ARG  11           HG1      ARG  11  -4.824   8.394  -3.312
   70    HD2  ARG  11           HD2      ARG  11  -3.397   7.715  -5.869
   71    HD3  ARG  11           HD1      ARG  11  -4.631   8.970  -5.795
   72    HE   ARG  11           HE       ARG  11  -2.599   9.300  -3.806
   73   HH11  ARG  11          HH11      ARG  11  -3.359   9.934  -7.175
   74   HH12  ARG  11          HH12      ARG  11  -2.265  11.274  -7.289
   75   HH21  ARG  11          HH21      ARG  11  -1.179  11.060  -3.977
   76   HH22  ARG  11          HH22      ARG  11  -1.033  11.909  -5.480
   77    H    CYS  12           HN       CYS  12  -2.733   6.093  -0.623
   78    HA   CYS  12           HA       CYS  12  -4.731   6.824   1.354
   79    HB2  CYS  12           HB2      CYS  12  -1.751   6.484   1.492
   80    HB3  CYS  12           HB1      CYS  12  -2.660   7.163   2.835
   81    H    SER  13           HN       SER  13  -1.888   8.621   1.879
   82    HA   SER  13           HA       SER  13  -3.303  11.087   1.889
   83    HB2  SER  13           HB2      SER  13  -1.482  10.511   3.508
   84    HB3  SER  13           HB1      SER  13  -0.320  10.656   2.190
   85    HG   SER  13           HG       SER  13  -0.326  12.716   2.539
   86    H    ASN  14           HN       ASN  14  -0.332  10.297   0.149
   87    HA   ASN  14           HA       ASN  14  -1.318  11.653  -2.255
   88    HB2  ASN  14           HB2      ASN  14   0.188  13.126  -0.642
   89    HB3  ASN  14           HB1      ASN  14   1.499  12.207  -1.374
   90   HD21  ASN  14          HD21      ASN  14  -1.010  14.548  -1.903
   91   HD22  ASN  14          HD22      ASN  14  -0.457  15.095  -3.445
   92    H    GLY  15           HN       GLY  15   1.037  11.471  -3.770
   93    HA2  GLY  15           HA2      GLY  15   1.055   8.670  -4.408
   94    HA3  GLY  15           HA1      GLY  15   1.981   9.931  -5.213
   95    H    LEU  16           HN       LEU  16   1.816   8.339  -2.058
   96    HA   LEU  16           HA       LEU  16   4.660   8.653  -1.621
   97    HB2  LEU  16           HB2      LEU  16   3.845   7.264   0.548
   98    HB3  LEU  16           HB1      LEU  16   3.749   9.006   0.416
   99    HG   LEU  16           HG       LEU  16   1.344   8.686  -0.365
  100   HD11  LEU  16          HD11      LEU  16   1.705   5.934   0.787
  101   HD12  LEU  16          HD12      LEU  16   1.512   6.297  -0.929
  102   HD13  LEU  16          HD13      LEU  16   0.206   6.655   0.200
  103   HD21  LEU  16          HD21      LEU  16   0.494   8.522   1.868
  104   HD22  LEU  16          HD22      LEU  16   1.998   9.443   1.885
  105   HD23  LEU  16          HD23      LEU  16   1.985   7.762   2.419
  106    H    CYS  17           HN       CYS  17   3.224   5.824  -0.324
  107    HA   CYS  17           HA       CYS  17   4.541   4.049  -2.251
  108    HB2  CYS  17           HB2      CYS  17   4.890   3.250   0.559
  109    HB3  CYS  17           HB1      CYS  17   6.052   3.213  -0.760
  110    H    CYS  18           HN       CYS  18   3.712   1.874  -2.198
  111    HA   CYS  18           HA       CYS  18   1.340   1.432  -0.558
  112    HB2  CYS  18           HB2      CYS  18   0.502   2.407  -2.629
  113    HB3  CYS  18           HB1      CYS  18   1.347   1.185  -3.568
  114    H    SER  19           HN       SER  19   1.365  -0.435   0.369
  115    HA   SER  19           HA       SER  19   3.431  -2.312   0.069
  116    HB2  SER  19           HB2      SER  19   0.790  -2.478   1.518
  117    HB3  SER  19           HB1      SER  19   2.055  -3.696   1.645
  118    HG   SER  19           HG       SER  19   3.388  -2.210   2.595
  119    H    GLN  20           HN       GLN  20   3.381  -4.502  -0.432
  120    HA   GLN  20           HA       GLN  20   2.666  -5.257  -2.919
  121    HB2  GLN  20           HB2      GLN  20   3.099  -6.926  -0.471
  122    HB3  GLN  20           HB1      GLN  20   2.833  -7.652  -2.050
  123    HG2  GLN  20           HG2      GLN  20   4.801  -6.502  -2.919
  124    HG3  GLN  20           HG1      GLN  20   5.059  -5.750  -1.346
  125   HE21  GLN  20          HE21      GLN  20   5.804  -7.002   0.367
  126   HE22  GLN  20          HE22      GLN  20   6.520  -8.555   0.127
  127    H    PHE  21           HN       PHE  21   0.643  -5.693  -0.094
  128    HA   PHE  21           HA       PHE  21  -1.387  -7.133  -1.567
  129    HB2  PHE  21           HB2      PHE  21  -1.352  -6.053   1.252
  130    HB3  PHE  21           HB1      PHE  21  -2.691  -6.956   0.560
  131    HD1  PHE  21           HD1      PHE  21  -2.554  -9.304   0.186
  132    HD2  PHE  21           HD2      PHE  21   0.732  -7.131   1.782
  133    HE1  PHE  21           HE1      PHE  21  -1.490 -11.428   0.866
  134    HE2  PHE  21           HE2      PHE  21   1.808  -9.245   2.469
  135    HZ   PHE  21           HZ       PHE  21   0.694 -11.396   2.008
  136    H    GLY  22           HN       GLY  22  -0.935  -3.960  -0.190
  137    HA2  GLY  22           HA2      GLY  22  -1.937  -2.239  -1.830
  138    HA3  GLY  22           HA1      GLY  22  -3.442  -3.029  -1.386
  139    H    TYR  23           HN       TYR  23  -0.599  -2.038   0.505
  140    HA   TYR  23           HA       TYR  23  -2.397  -0.380   2.146
  141    HB2  TYR  23           HB2      TYR  23  -1.025  -2.542   3.079
  142    HB3  TYR  23           HB1      TYR  23   0.138  -1.259   3.393
  143    HD1  TYR  23           HD1      TYR  23  -1.836  -3.124   5.171
  144    HD2  TYR  23           HD2      TYR  23  -1.654   1.000   4.134
  145    HE1  TYR  23           HE1      TYR  23  -3.087  -2.561   7.211
  146    HE2  TYR  23           HE2      TYR  23  -2.907   1.573   6.173
  147    HH   TYR  23           HH       TYR  23  -4.457   0.496   7.747
  148    H    CYS  24           HN       CYS  24  -2.124   1.600   1.465
  149    HA   CYS  24           HA       CYS  24   0.410   2.609   0.543
  150    HB2  CYS  24           HB2      CYS  24  -1.028   4.780   0.390
  151    HB3  CYS  24           HB1      CYS  24  -1.353   3.456  -0.718
  152    H    GLY  25           HN       GLY  25   1.752   4.000   1.471
  153    HA2  GLY  25           HA2      GLY  25   1.149   5.515   3.813
  154    HA3  GLY  25           HA1      GLY  25   2.115   4.097   4.192
  155    H    SER  26           HN       SER  26   3.339   6.211   4.882
  156    HA   SER  26           HA       SER  26   5.496   6.584   2.937
  157    HB2  SER  26           HB2      SER  26   5.495   9.083   3.398
  158    HB3  SER  26           HB1      SER  26   4.131   8.519   2.442
  159    HG   SER  26           HG       SER  26   4.200   9.475   5.057
  160    H    THR  27           HN       THR  27   4.445   5.978   6.021
  161    HA   THR  27           HA       THR  27   7.066   6.428   7.175
  162    HB   THR  27           HB       THR  27   6.274   8.500   7.831
  163    HG1  THR  27           HG1      THR  27   5.286   7.068  10.051
  164   HG21  THR  27          HG21      THR  27   3.904   8.068   7.063
  165   HG22  THR  27          HG22      THR  27   4.064   9.088   8.490
  166   HG23  THR  27          HG23      THR  27   3.590   7.400   8.665
  167    HA   PRO  28           HA       PRO  28   4.642   3.394  10.028
  168    HB2  PRO  28           HB2      PRO  28   2.292   2.388   8.667
  169    HB3  PRO  28           HB1      PRO  28   2.358   3.383  10.131
  170    HG2  PRO  28           HG2      PRO  28   1.308   4.271   7.804
  171    HG3  PRO  28           HG1      PRO  28   2.093   5.338   8.988
  172    HD2  PRO  28           HD2      PRO  28   3.290   4.101   6.506
  173    HD3  PRO  28           HD1      PRO  28   3.336   5.800   7.039
  174    HA   PRO  29           HA       PRO  29   6.053  -0.579   8.355
  175    HB2  PRO  29           HB2      PRO  29   4.109  -2.455   8.962
  176    HB3  PRO  29           HB1      PRO  29   5.323  -1.862  10.110
  177    HG2  PRO  29           HG2      PRO  29   2.492  -0.994   9.751
  178    HG3  PRO  29           HG1      PRO  29   3.392  -1.321  11.248
  179    HD2  PRO  29           HD2      PRO  29   3.014   1.170  10.451
  180    HD3  PRO  29           HD1      PRO  29   4.577   0.673  11.128
  181    H    TYR  30           HN       TYR  30   4.831   1.005   6.477
  182    HA   TYR  30           HA       TYR  30   3.933  -0.945   4.482
  183    HB2  TYR  30           HB2      TYR  30   2.689   1.790   4.440
  184    HB3  TYR  30           HB1      TYR  30   2.092   0.295   3.744
  185    HD1  TYR  30           HD1      TYR  30   1.559  -1.565   5.669
  186    HD2  TYR  30           HD2      TYR  30   1.473   2.657   6.186
  187    HE1  TYR  30           HE1      TYR  30   0.055  -1.841   7.595
  188    HE2  TYR  30           HE2      TYR  30  -0.029   2.389   8.118
  189    HH   TYR  30           HH       TYR  30  -0.588  -0.599   9.617
  190    H    CYS  31           HN       CYS  31   5.477   1.982   5.455
  191    HA   CYS  31           HA       CYS  31   7.144   1.975   3.111
  192    HB2  CYS  31           HB2      CYS  31   5.225   3.581   2.624
  193    HB3  CYS  31           HB1      CYS  31   5.903   4.596   3.893
  194    H    GLY  32           HN       GLY  32   8.684   1.276   4.499
  195    HA2  GLY  32           HA2      GLY  32  10.562   2.962   5.481
  196    HA3  GLY  32           HA1      GLY  32   9.459   2.765   6.842
  197    H    ALA  33           HN       ALA  33   8.736   0.351   7.027
  198    HA   ALA  33           HA       ALA  33  10.620  -1.686   6.382
  199    HB1  ALA  33           HB1      ALA  33  10.486  -0.854   9.296
  200    HB2  ALA  33           HB2      ALA  33  11.875  -0.634   8.232
  201    HB3  ALA  33           HB3      ALA  33  11.339  -2.260   8.658
  202    H    GLY  34           HN       GLY  34   8.900  -2.761   5.592
  203    HA2  GLY  34           HA2      GLY  34   7.370  -4.345   7.383
  204    HA3  GLY  34           HA1      GLY  34   6.379  -3.067   6.691
  205    H    GLN  35           HN       GLN  35   5.997  -3.023   4.469
  206    HA   GLN  35           HA       GLN  35   6.878  -5.238   2.816
  207    HB2  GLN  35           HB2      GLN  35   4.363  -5.581   2.134
  208    HB3  GLN  35           HB1      GLN  35   5.014  -6.412   3.536
  209    HG2  GLN  35           HG2      GLN  35   4.053  -4.607   4.966
  210    HG3  GLN  35           HG1      GLN  35   3.283  -3.945   3.526
  211   HE21  GLN  35          HE21      GLN  35   1.585  -5.081   2.563
  212   HE22  GLN  35          HE22      GLN  35   0.736  -6.334   3.393
  213    H    CYS  36           HN       CYS  36   7.837  -2.958   2.289
  214    HA   CYS  36           HA       CYS  36   6.181  -1.234   0.680
  215    HB2  CYS  36           HB2      CYS  36   8.390  -0.109   0.176
  216    HB3  CYS  36           HB1      CYS  36   7.936  -0.180   1.875
  217    H    GLN  37           HN       GLN  37   5.669  -1.479  -1.383
  218    HA   GLN  37           HA       GLN  37   7.278  -3.239  -3.087
  219    HB2  GLN  37           HB2      GLN  37   4.733  -3.525  -2.721
  220    HB3  GLN  37           HB1      GLN  37   4.566  -2.129  -3.777
  221    HG2  GLN  37           HG2      GLN  37   5.888  -3.390  -5.490
  222    HG3  GLN  37           HG1      GLN  37   5.758  -4.803  -4.446
  223   HE21  GLN  37          HE21      GLN  37   3.792  -5.842  -4.238
  224   HE22  GLN  37          HE22      GLN  37   2.455  -5.528  -5.286
  225    H    SER  38           HN       SER  38   5.653  -0.064  -3.132
  226    HA   SER  38           HA       SER  38   6.968   0.733  -5.572
  227    HB2  SER  38           HB2      SER  38   5.089   2.215  -3.731
  228    HB3  SER  38           HB1      SER  38   5.719   2.877  -5.239
  229    HG   SER  38           HG       SER  38   3.905   0.774  -4.833
  230    H    GLN  39           HN       GLN  39   6.932   1.963  -2.258
  231    HA   GLN  39           HA       GLN  39   9.715   2.815  -2.543
  232    HB2  GLN  39           HB2      GLN  39   7.404   4.619  -1.878
  233    HB3  GLN  39           HB1      GLN  39   9.016   4.972  -1.269
  234    HG2  GLN  39           HG2      GLN  39   9.859   5.017  -3.571
  235    HG3  GLN  39           HG1      GLN  39   8.230   4.697  -4.162
  236   HE21  GLN  39          HE21      GLN  39  10.343   7.028  -2.689
  237   HE22  GLN  39          HE22      GLN  39   9.332   8.406  -2.939
  238    H    CYS  40           HN       CYS  40  10.912   2.694  -0.711
  239    HA   CYS  40           HA       CYS  40   9.574   1.581   1.659
  240    HB2  CYS  40           HB2      CYS  40  12.474   1.363   0.819
  241    HB3  CYS  40           HB1      CYS  40  11.761   0.616   2.244
  Start of MODEL    6
    1    H1   PHE   1           HT1      PHE   1  -7.799  -1.917   1.605
    2    H2   PHE   1           HT2      PHE   1  -6.677  -2.916   2.381
    3    H3   PHE   1           HT3      PHE   1  -6.142  -1.608   1.451
    4    HA   PHE   1           HA       PHE   1  -7.726  -1.416   3.936
    5    HB2  PHE   1           HB2      PHE   1  -4.802  -0.863   3.404
    6    HB3  PHE   1           HB1      PHE   1  -5.638  -0.422   4.888
    7    HD1  PHE   1           HD1      PHE   1  -4.193  -3.149   2.937
    8    HD2  PHE   1           HD2      PHE   1  -6.320  -2.123   6.478
    9    HE1  PHE   1           HE1      PHE   1  -3.674  -5.360   3.890
   10    HE2  PHE   1           HE2      PHE   1  -5.810  -4.332   7.432
   11    HZ   PHE   1           HZ       PHE   1  -4.484  -5.953   6.137
   12    H    GLN   2           HN       GLN   2  -5.633   0.397   1.754
   13    HA   GLN   2           HA       GLN   2  -7.575   2.567   1.566
   14    HB2  GLN   2           HB2      GLN   2  -4.762   2.910   2.609
   15    HB3  GLN   2           HB1      GLN   2  -5.669   4.243   1.912
   16    HG2  GLN   2           HG2      GLN   2  -6.773   2.636   4.187
   17    HG3  GLN   2           HG1      GLN   2  -5.654   3.969   4.460
   18   HE21  GLN   2          HE21      GLN   2  -8.837   3.061   3.405
   19   HE22  GLN   2          HE22      GLN   2  -9.526   4.646   3.444
   20    H    CYS   3           HN       CYS   3  -5.098   0.648   0.283
   21    HA   CYS   3           HA       CYS   3  -4.542   2.345  -2.013
   22    HB2  CYS   3           HB2      CYS   3  -2.760   1.052  -0.835
   23    HB3  CYS   3           HB1      CYS   3  -3.535  -0.430  -1.371
   24    H    GLY   4           HN       GLY   4  -4.405   0.948  -4.182
   25    HA2  GLY   4           HA2      GLY   4  -7.147   0.076  -4.651
   26    HA3  GLY   4           HA1      GLY   4  -5.962   0.485  -5.876
   27    H    ARG   5           HN       ARG   5  -4.836  -1.713  -3.456
   28    HA   ARG   5           HA       ARG   5  -5.223  -3.874  -5.378
   29    HB2  ARG   5           HB2      ARG   5  -2.857  -3.093  -4.923
   30    HB3  ARG   5           HB1      ARG   5  -3.034  -3.815  -3.325
   31    HG2  ARG   5           HG2      ARG   5  -3.323  -5.966  -4.226
   32    HG3  ARG   5           HG1      ARG   5  -3.512  -5.329  -5.860
   33    HD2  ARG   5           HD2      ARG   5  -0.994  -4.951  -4.276
   34    HD3  ARG   5           HD1      ARG   5  -1.268  -6.383  -5.268
   35    HE   ARG   5           HE       ARG   5  -1.649  -3.910  -6.683
   36   HH11  ARG   5          HH11      ARG   5   0.753  -6.287  -5.728
   37   HH12  ARG   5          HH12      ARG   5   1.840  -5.874  -7.012
   38   HH21  ARG   5          HH21      ARG   5   1.293  -4.233  -8.498
   39   HH22  ARG   5          HH22      ARG   5  -0.211  -3.386  -8.356
   40    H    GLN   6           HN       GLN   6  -5.156  -3.195  -1.909
   41    HA   GLN   6           HA       GLN   6  -6.203  -5.802  -1.203
   42    HB2  GLN   6           HB2      GLN   6  -4.767  -4.000   0.203
   43    HB3  GLN   6           HB1      GLN   6  -6.377  -3.535   0.721
   44    HG2  GLN   6           HG2      GLN   6  -5.500  -6.403   0.863
   45    HG3  GLN   6           HG1      GLN   6  -5.047  -5.256   2.119
   46   HE21  GLN   6          HE21      GLN   6  -6.663  -4.342   3.417
   47   HE22  GLN   6          HE22      GLN   6  -8.222  -5.070   3.565
   48    H    ALA   7           HN       ALA   7  -7.393  -3.073  -2.556
   49    HA   ALA   7           HA       ALA   7 -10.134  -3.408  -1.563
   50    HB1  ALA   7           HB1      ALA   7  -8.817  -1.002  -2.800
   51    HB2  ALA   7           HB2      ALA   7  -9.143  -1.228  -1.082
   52    HB3  ALA   7           HB3      ALA   7 -10.480  -1.083  -2.222
   53    H    GLY   8           HN       GLY   8  -8.093  -2.986  -4.379
   54    HA2  GLY   8           HA2      GLY   8  -8.608  -4.286  -6.385
   55    HA3  GLY   8           HA1      GLY   8 -10.303  -3.920  -6.102
   56    H    GLY   9           HN       GLY   9  -9.451  -1.095  -5.350
   57    HA2  GLY   9           HA2      GLY   9  -8.252   0.185  -7.532
   58    HA3  GLY   9           HA1      GLY   9  -9.983   0.132  -7.831
   59    H    ALA  10           HN       ALA  10  -7.450   1.395  -5.800
   60    HA   ALA  10           HA       ALA  10  -9.106   3.664  -5.021
   61    HB1  ALA  10           HB1      ALA  10  -9.450   2.047  -3.202
   62    HB2  ALA  10           HB2      ALA  10  -8.551   3.456  -2.642
   63    HB3  ALA  10           HB3      ALA  10  -7.705   1.943  -2.962
   64    H    ARG  11           HN       ARG  11  -7.428   5.000  -3.336
   65    HA   ARG  11           HA       ARG  11  -4.765   5.022  -4.561
   66    HB2  ARG  11           HB2      ARG  11  -6.653   7.378  -4.448
   67    HB3  ARG  11           HB1      ARG  11  -4.916   7.577  -4.628
   68    HG2  ARG  11           HG2      ARG  11  -4.978   6.287  -6.703
   69    HG3  ARG  11           HG1      ARG  11  -6.720   6.076  -6.521
   70    HD2  ARG  11           HD2      ARG  11  -5.413   8.783  -6.655
   71    HD3  ARG  11           HD1      ARG  11  -5.954   7.916  -8.092
   72    HE   ARG  11           HE       ARG  11  -8.067   8.050  -6.239
   73   HH11  ARG  11          HH11      ARG  11  -6.282  10.167  -8.400
   74   HH12  ARG  11          HH12      ARG  11  -7.607  11.263  -8.606
   75   HH21  ARG  11          HH21      ARG  11  -9.789   9.497  -6.525
   76   HH22  ARG  11          HH22      ARG  11  -9.590  10.883  -7.546
   77    H    CYS  12           HN       CYS  12  -3.136   6.037  -3.339
   78    HA   CYS  12           HA       CYS  12  -3.428   5.700  -0.536
   79    HB2  CYS  12           HB2      CYS  12  -1.155   6.670  -2.259
   80    HB3  CYS  12           HB1      CYS  12  -1.020   6.448  -0.520
   81    H    SER  13           HN       SER  13  -1.968   7.504   0.790
   82    HA   SER  13           HA       SER  13  -3.751   9.708   1.116
   83    HB2  SER  13           HB2      SER  13  -2.300   8.468   2.925
   84    HB3  SER  13           HB1      SER  13  -1.047   9.610   2.436
   85    HG   SER  13           HG       SER  13  -3.139  10.020   4.043
   86    H    ASN  14           HN       ASN  14  -0.371   9.488   0.160
   87    HA   ASN  14           HA       ASN  14  -0.622  11.922  -1.450
   88    HB2  ASN  14           HB2      ASN  14   1.467  11.453   0.693
   89    HB3  ASN  14           HB1      ASN  14   1.657  12.654  -0.580
   90   HD21  ASN  14          HD21      ASN  14  -0.076  11.766   2.294
   91   HD22  ASN  14          HD22      ASN  14  -0.800  13.308   2.580
   92    H    GLY  15           HN       GLY  15   2.017  12.117  -2.315
   93    HA2  GLY  15           HA2      GLY  15   2.156   9.918  -4.167
   94    HA3  GLY  15           HA1      GLY  15   3.253  11.291  -4.088
   95    H    LEU  16           HN       LEU  16   2.350   8.579  -1.997
   96    HA   LEU  16           HA       LEU  16   5.171   8.170  -1.308
   97    HB2  LEU  16           HB2      LEU  16   4.046   6.722   0.571
   98    HB3  LEU  16           HB1      LEU  16   4.089   8.462   0.703
   99    HG   LEU  16           HG       LEU  16   1.692   8.278  -0.403
  100   HD11  LEU  16          HD11      LEU  16   2.216   5.545   0.602
  101   HD12  LEU  16          HD12      LEU  16   1.269   6.084  -0.784
  102   HD13  LEU  16          HD13      LEU  16   0.626   6.251   0.849
  103   HD21  LEU  16          HD21      LEU  16   0.718   8.431   1.753
  104   HD22  LEU  16          HD22      LEU  16   2.287   9.228   1.814
  105   HD23  LEU  16          HD23      LEU  16   2.087   7.611   2.492
  106    H    CYS  17           HN       CYS  17   3.591   5.414  -0.397
  107    HA   CYS  17           HA       CYS  17   3.934   4.022  -2.952
  108    HB2  CYS  17           HB2      CYS  17   5.019   2.216  -1.163
  109    HB3  CYS  17           HB1      CYS  17   5.933   3.213  -2.280
  110    H    CYS  18           HN       CYS  18   3.443   1.517  -2.437
  111    HA   CYS  18           HA       CYS  18   1.099   1.290  -0.692
  112    HB2  CYS  18           HB2      CYS  18   0.156   1.853  -2.831
  113    HB3  CYS  18           HB1      CYS  18   1.188   0.695  -3.656
  114    H    SER  19           HN       SER  19   1.158  -0.507   0.470
  115    HA   SER  19           HA       SER  19   3.299  -2.349   0.340
  116    HB2  SER  19           HB2      SER  19   2.041  -1.713   2.412
  117    HB3  SER  19           HB1      SER  19   0.697  -2.698   1.837
  118    HG   SER  19           HG       SER  19   3.313  -3.726   2.160
  119    H    GLN  20           HN       GLN  20   3.173  -4.655   0.175
  120    HA   GLN  20           HA       GLN  20   2.531  -5.668  -2.223
  121    HB2  GLN  20           HB2      GLN  20   2.737  -7.063   0.415
  122    HB3  GLN  20           HB1      GLN  20   2.507  -7.953  -1.082
  123    HG2  GLN  20           HG2      GLN  20   4.576  -7.002  -1.966
  124    HG3  GLN  20           HG1      GLN  20   4.806  -6.109  -0.464
  125   HE21  GLN  20          HE21      GLN  20   5.389  -7.218   1.403
  126   HE22  GLN  20          HE22      GLN  20   6.020  -8.826   1.358
  127    H    PHE  21           HN       PHE  21   0.359  -5.828   0.537
  128    HA   PHE  21           HA       PHE  21  -1.683  -7.221  -0.978
  129    HB2  PHE  21           HB2      PHE  21  -1.611  -6.132   1.833
  130    HB3  PHE  21           HB1      PHE  21  -3.044  -6.879   1.136
  131    HD1  PHE  21           HD1      PHE  21  -3.130  -9.243   0.707
  132    HD2  PHE  21           HD2      PHE  21   0.329  -7.432   2.392
  133    HE1  PHE  21           HE1      PHE  21  -2.297 -11.468   1.372
  134    HE2  PHE  21           HE2      PHE  21   1.174  -9.650   3.062
  135    HZ   PHE  21           HZ       PHE  21  -0.141 -11.671   2.551
  136    H    GLY  22           HN       GLY  22  -0.939  -4.019   0.049
  137    HA2  GLY  22           HA2      GLY  22  -1.855  -2.271  -1.488
  138    HA3  GLY  22           HA1      GLY  22  -3.423  -2.992  -1.163
  139    H    TYR  23           HN       TYR  23  -0.638  -2.066   0.844
  140    HA   TYR  23           HA       TYR  23  -2.471  -0.457   2.495
  141    HB2  TYR  23           HB2      TYR  23  -1.223  -2.635   3.437
  142    HB3  TYR  23           HB1      TYR  23   0.071  -1.470   3.683
  143    HD1  TYR  23           HD1      TYR  23  -1.362   0.948   4.540
  144    HD2  TYR  23           HD2      TYR  23  -2.073  -3.133   5.523
  145    HE1  TYR  23           HE1      TYR  23  -2.427   1.647   6.645
  146    HE2  TYR  23           HE2      TYR  23  -3.142  -2.443   7.628
  147    HH   TYR  23           HH       TYR  23  -4.046   0.763   8.272
  148    H    CYS  24           HN       CYS  24  -2.158   1.585   2.161
  149    HA   CYS  24           HA       CYS  24   0.248   2.652   1.020
  150    HB2  CYS  24           HB2      CYS  24  -2.264   3.969   2.030
  151    HB3  CYS  24           HB1      CYS  24  -0.978   4.796   1.161
  152    H    GLY  25           HN       GLY  25   1.561   4.292   1.883
  153    HA2  GLY  25           HA2      GLY  25   1.368   5.358   4.466
  154    HA3  GLY  25           HA1      GLY  25   2.359   3.913   4.558
  155    H    SER  26           HN       SER  26   3.561   6.026   5.347
  156    HA   SER  26           HA       SER  26   5.706   6.478   3.447
  157    HB2  SER  26           HB2      SER  26   4.083   8.298   2.880
  158    HB3  SER  26           HB1      SER  26   4.192   8.875   4.537
  159    HG   SER  26           HG       SER  26   6.074   8.990   2.471
  160    H    THR  27           HN       THR  27   4.715   5.650   6.331
  161    HA   THR  27           HA       THR  27   7.081   6.540   7.745
  162    HB   THR  27           HB       THR  27   6.023   8.244   8.776
  163    HG1  THR  27           HG1      THR  27   4.290   6.515  10.149
  164   HG21  THR  27          HG21      THR  27   3.870   8.904   8.373
  165   HG22  THR  27          HG22      THR  27   3.209   7.293   8.628
  166   HG23  THR  27          HG23      THR  27   3.996   7.688   7.101
  167    HA   PRO  28           HA       PRO  28   5.125   2.840  10.125
  168    HB2  PRO  28           HB2      PRO  28   2.777   1.815   8.810
  169    HB3  PRO  28           HB1      PRO  28   2.853   2.716  10.332
  170    HG2  PRO  28           HG2      PRO  28   1.646   3.676   8.090
  171    HG3  PRO  28           HG1      PRO  28   2.364   4.707   9.343
  172    HD2  PRO  28           HD2      PRO  28   3.610   3.788   6.749
  173    HD3  PRO  28           HD1      PRO  28   3.528   5.433   7.423
  174    HA   PRO  29           HA       PRO  29   6.647  -0.830   7.927
  175    HB2  PRO  29           HB2      PRO  29   4.343  -2.523   8.751
  176    HB3  PRO  29           HB1      PRO  29   6.075  -2.743   9.068
  177    HG2  PRO  29           HG2      PRO  29   4.473  -2.005  11.012
  178    HG3  PRO  29           HG1      PRO  29   6.078  -1.260  10.840
  179    HD2  PRO  29           HD2      PRO  29   3.409  -0.177  10.019
  180    HD3  PRO  29           HD1      PRO  29   4.731   0.634  10.884
  181    H    TYR  30           HN       TYR  30   5.266   0.798   6.266
  182    HA   TYR  30           HA       TYR  30   4.263  -1.036   4.211
  183    HB2  TYR  30           HB2      TYR  30   2.969   1.665   4.515
  184    HB3  TYR  30           HB1      TYR  30   2.375   0.253   3.659
  185    HD1  TYR  30           HD1      TYR  30   1.824   2.265   6.408
  186    HD2  TYR  30           HD2      TYR  30   1.983  -1.848   5.343
  187    HE1  TYR  30           HE1      TYR  30   0.417   1.708   8.352
  188    HE2  TYR  30           HE2      TYR  30   0.580  -2.418   7.282
  189    HH   TYR  30           HH       TYR  30  -1.102  -0.082   9.075
  190    H    CYS  31           HN       CYS  31   5.684   1.947   5.259
  191    HA   CYS  31           HA       CYS  31   7.276   2.150   2.877
  192    HB2  CYS  31           HB2      CYS  31   5.371   4.329   3.688
  193    HB3  CYS  31           HB1      CYS  31   6.748   4.604   2.620
  194    H    GLY  32           HN       GLY  32   8.929   1.640   4.200
  195    HA2  GLY  32           HA2      GLY  32  10.649   3.474   5.149
  196    HA3  GLY  32           HA1      GLY  32   9.587   3.222   6.533
  197    H    ALA  33           HN       ALA  33   9.053   0.741   6.734
  198    HA   ALA  33           HA       ALA  33  11.039  -1.173   6.103
  199    HB1  ALA  33           HB1      ALA  33  11.041  -0.237   8.988
  200    HB2  ALA  33           HB2      ALA  33  12.341   0.025   7.827
  201    HB3  ALA  33           HB3      ALA  33  11.938  -1.612   8.344
  202    H    GLY  34           HN       GLY  34   9.397  -2.451   5.496
  203    HA2  GLY  34           HA2      GLY  34   8.127  -4.082   7.396
  204    HA3  GLY  34           HA1      GLY  34   6.985  -2.858   6.867
  205    H    GLN  35           HN       GLN  35   6.169  -2.902   4.791
  206    HA   GLN  35           HA       GLN  35   6.941  -5.171   3.092
  207    HB2  GLN  35           HB2      GLN  35   4.057  -4.433   3.656
  208    HB3  GLN  35           HB1      GLN  35   4.629  -5.777   2.682
  209    HG2  GLN  35           HG2      GLN  35   5.689  -6.689   4.787
  210    HG3  GLN  35           HG1      GLN  35   4.790  -5.452   5.665
  211   HE21  GLN  35          HE21      GLN  35   4.573  -8.385   3.812
  212   HE22  GLN  35          HE22      GLN  35   2.938  -8.764   4.224
  213    H    CYS  36           HN       CYS  36   8.005  -2.930   2.389
  214    HA   CYS  36           HA       CYS  36   6.347  -1.199   0.803
  215    HB2  CYS  36           HB2      CYS  36   9.357  -1.471   0.851
  216    HB3  CYS  36           HB1      CYS  36   8.454  -0.140   0.141
  217    H    GLN  37           HN       GLN  37   5.521  -1.700  -1.151
  218    HA   GLN  37           HA       GLN  37   6.932  -3.611  -2.861
  219    HB2  GLN  37           HB2      GLN  37   4.440  -3.808  -2.281
  220    HB3  GLN  37           HB1      GLN  37   4.196  -2.440  -3.357
  221    HG2  GLN  37           HG2      GLN  37   5.286  -3.773  -5.166
  222    HG3  GLN  37           HG1      GLN  37   5.276  -5.153  -4.071
  223   HE21  GLN  37          HE21      GLN  37   3.383  -6.228  -3.681
  224   HE22  GLN  37          HE22      GLN  37   1.919  -5.918  -4.544
  225    H    SER  38           HN       SER  38   5.484  -0.355  -3.005
  226    HA   SER  38           HA       SER  38   6.631   0.161  -5.612
  227    HB2  SER  38           HB2      SER  38   4.863   1.798  -3.795
  228    HB3  SER  38           HB1      SER  38   5.486   2.408  -5.328
  229    HG   SER  38           HG       SER  38   4.146  -0.061  -5.251
  230    H    GLN  39           HN       GLN  39   6.829   1.656  -2.424
  231    HA   GLN  39           HA       GLN  39   9.627   2.347  -2.847
  232    HB2  GLN  39           HB2      GLN  39   7.480   4.282  -3.036
  233    HB3  GLN  39           HB1      GLN  39   8.526   4.671  -1.681
  234    HG2  GLN  39           HG2      GLN  39  10.461   4.555  -3.246
  235    HG3  GLN  39           HG1      GLN  39   9.309   4.354  -4.566
  236   HE21  GLN  39          HE21      GLN  39   8.006   6.081  -5.169
  237   HE22  GLN  39          HE22      GLN  39   8.351   7.704  -4.687
  238    H    CYS  40           HN       CYS  40  10.666   3.140  -0.823
  239    HA   CYS  40           HA       CYS  40   9.226   2.403   1.625
  240    HB2  CYS  40           HB2      CYS  40  11.014   0.665   0.533
  241    HB3  CYS  40           HB1      CYS  40  12.069   1.605   1.584
  Start of MODEL    7
    1    H1   PHE   1           HT1      PHE   1  -6.876  -0.664   5.609
    2    H2   PHE   1           HT2      PHE   1  -6.179  -2.202   5.701
    3    H3   PHE   1           HT3      PHE   1  -7.753  -2.023   5.111
    4    HA   PHE   1           HA       PHE   1  -5.300  -0.968   3.830
    5    HB2  PHE   1           HB2      PHE   1  -7.083  -3.306   3.116
    6    HB3  PHE   1           HB1      PHE   1  -5.849  -2.642   2.053
    7    HD1  PHE   1           HD1      PHE   1  -6.412  -4.395   5.252
    8    HD2  PHE   1           HD2      PHE   1  -3.571  -3.207   2.312
    9    HE1  PHE   1           HE1      PHE   1  -4.739  -5.882   6.273
   10    HE2  PHE   1           HE2      PHE   1  -1.894  -4.691   3.332
   11    HZ   PHE   1           HZ       PHE   1  -2.477  -6.032   5.313
   12    H    GLN   2           HN       GLN   2  -5.602   0.158   1.916
   13    HA   GLN   2           HA       GLN   2  -8.331   0.794   1.064
   14    HB2  GLN   2           HB2      GLN   2  -6.284   2.888   1.822
   15    HB3  GLN   2           HB1      GLN   2  -7.790   3.228   0.988
   16    HG2  GLN   2           HG2      GLN   2  -7.757   1.889   3.668
   17    HG3  GLN   2           HG1      GLN   2  -7.669   3.642   3.509
   18   HE21  GLN   2          HE21      GLN   2  -9.649   0.816   3.098
   19   HE22  GLN   2          HE22      GLN   2 -11.151   1.644   2.897
   20    H    CYS   3           HN       CYS   3  -4.922   0.790   0.491
   21    HA   CYS   3           HA       CYS   3  -5.160   1.665  -2.281
   22    HB2  CYS   3           HB2      CYS   3  -3.407   2.677  -1.018
   23    HB3  CYS   3           HB1      CYS   3  -2.835   1.125  -0.430
   24    H    GLY   4           HN       GLY   4  -3.693   0.484  -3.870
   25    HA2  GLY   4           HA2      GLY   4  -3.169  -1.329  -5.142
   26    HA3  GLY   4           HA1      GLY   4  -2.914  -2.186  -3.641
   27    H    ARG   5           HN       ARG   5  -3.607  -4.034  -4.775
   28    HA   ARG   5           HA       ARG   5  -6.264  -4.280  -5.797
   29    HB2  ARG   5           HB2      ARG   5  -5.695  -6.703  -6.009
   30    HB3  ARG   5           HB1      ARG   5  -4.534  -5.633  -6.779
   31    HG2  ARG   5           HG2      ARG   5  -3.285  -5.856  -4.482
   32    HG3  ARG   5           HG1      ARG   5  -4.228  -7.348  -4.374
   33    HD2  ARG   5           HD2      ARG   5  -3.400  -7.965  -6.620
   34    HD3  ARG   5           HD1      ARG   5  -2.376  -6.531  -6.596
   35    HE   ARG   5           HE       ARG   5  -1.846  -8.046  -4.297
   36   HH11  ARG   5          HH11      ARG   5  -1.358  -8.278  -7.768
   37   HH12  ARG   5          HH12      ARG   5   0.051  -9.273  -7.618
   38   HH21  ARG   5          HH21      ARG   5   0.819  -9.880  -5.558
   39   HH22  ARG   5          HH22      ARG   5  -0.000  -9.351  -4.126
   40    H    GLN   6           HN       GLN   6  -5.019  -4.343  -2.644
   41    HA   GLN   6           HA       GLN   6  -6.589  -6.324  -1.377
   42    HB2  GLN   6           HB2      GLN   6  -4.689  -4.460  -0.581
   43    HB3  GLN   6           HB1      GLN   6  -6.150  -3.932   0.236
   44    HG2  GLN   6           HG2      GLN   6  -5.041  -6.734   0.387
   45    HG3  GLN   6           HG1      GLN   6  -4.729  -5.476   1.582
   46   HE21  GLN   6          HE21      GLN   6  -7.084  -7.654   0.244
   47   HE22  GLN   6          HE22      GLN   6  -8.249  -7.505   1.512
   48    H    ALA   7           HN       ALA   7  -7.277  -3.262  -2.684
   49    HA   ALA   7           HA       ALA   7 -10.030  -3.269  -1.672
   50    HB1  ALA   7           HB1      ALA   7  -8.720  -1.553  -0.537
   51    HB2  ALA   7           HB2      ALA   7  -9.932  -0.829  -1.595
   52    HB3  ALA   7           HB3      ALA   7  -8.243  -0.887  -2.099
   53    H    GLY   8           HN       GLY   8  -7.783  -2.355  -4.196
   54    HA2  GLY   8           HA2      GLY   8  -8.943  -3.127  -6.449
   55    HA3  GLY   8           HA1      GLY   8  -9.909  -1.705  -6.085
   56    H    GLY   9           HN       GLY   9  -8.464   0.263  -5.472
   57    HA2  GLY   9           HA2      GLY   9  -5.876   0.567  -6.511
   58    HA3  GLY   9           HA1      GLY   9  -7.017   1.023  -7.766
   59    H    ALA  10           HN       ALA  10  -5.817   1.795  -4.544
   60    HA   ALA  10           HA       ALA  10  -6.651   4.578  -4.925
   61    HB1  ALA  10           HB1      ALA  10  -7.576   4.747  -2.674
   62    HB2  ALA  10           HB2      ALA  10  -7.263   3.033  -2.402
   63    HB3  ALA  10           HB3      ALA  10  -8.444   3.532  -3.613
   64    H    ARG  11           HN       ARG  11  -5.760   5.931  -2.950
   65    HA   ARG  11           HA       ARG  11  -3.148   4.962  -2.044
   66    HB2  ARG  11           HB2      ARG  11  -2.108   7.193  -2.650
   67    HB3  ARG  11           HB1      ARG  11  -2.517   6.186  -4.026
   68    HG2  ARG  11           HG2      ARG  11  -4.552   7.534  -4.381
   69    HG3  ARG  11           HG1      ARG  11  -4.083   8.563  -3.028
   70    HD2  ARG  11           HD2      ARG  11  -3.374   9.698  -4.971
   71    HD3  ARG  11           HD1      ARG  11  -1.919   8.985  -4.275
   72    HE   ARG  11           HE       ARG  11  -2.948   7.180  -6.138
   73   HH11  ARG  11          HH11      ARG  11  -1.507  10.383  -6.150
   74   HH12  ARG  11          HH12      ARG  11  -0.859  10.210  -7.746
   75   HH21  ARG  11          HH21      ARG  11  -2.089   6.977  -8.226
   76   HH22  ARG  11          HH22      ARG  11  -1.188   8.284  -8.919
   77    H    CYS  12           HN       CYS  12  -2.240   6.252  -0.249
   78    HA   CYS  12           HA       CYS  12  -4.371   7.053   1.546
   79    HB2  CYS  12           HB2      CYS  12  -1.423   6.645   1.917
   80    HB3  CYS  12           HB1      CYS  12  -2.397   7.397   3.173
   81    H    SER  13           HN       SER  13  -1.515   8.802   2.212
   82    HA   SER  13           HA       SER  13  -2.843  11.288   2.246
   83    HB2  SER  13           HB2      SER  13  -0.954  10.693   3.758
   84    HB3  SER  13           HB1      SER  13   0.141  10.770   2.379
   85    HG   SER  13           HG       SER  13  -1.431  12.908   3.393
   86    H    ASN  14           HN       ASN  14  -0.001  10.452   0.328
   87    HA   ASN  14           HA       ASN  14  -1.100  11.824  -2.016
   88    HB2  ASN  14           HB2      ASN  14   0.525  13.275  -0.503
   89    HB3  ASN  14           HB1      ASN  14   1.773  12.322  -1.296
   90   HD21  ASN  14          HD21      ASN  14  -0.710  14.713  -1.710
   91   HD22  ASN  14          HD22      ASN  14  -0.228  15.237  -3.284
   92    H    GLY  15           HN       GLY  15   1.244  11.580  -3.611
   93    HA2  GLY  15           HA2      GLY  15   1.121   8.782  -4.256
   94    HA3  GLY  15           HA1      GLY  15   2.081  10.004  -5.083
   95    H    LEU  16           HN       LEU  16   1.922   8.464  -1.898
   96    HA   LEU  16           HA       LEU  16   4.771   8.678  -1.499
   97    HB2  LEU  16           HB2      LEU  16   3.948   7.268   0.654
   98    HB3  LEU  16           HB1      LEU  16   3.869   9.012   0.552
   99    HG   LEU  16           HG       LEU  16   1.465   8.756  -0.200
  100   HD11  LEU  16          HD11      LEU  16   0.283   6.744   0.162
  101   HD12  LEU  16          HD12      LEU  16   1.703   5.959   0.850
  102   HD13  LEU  16          HD13      LEU  16   1.663   6.362  -0.867
  103   HD21  LEU  16          HD21      LEU  16   2.063   7.652   2.525
  104   HD22  LEU  16          HD22      LEU  16   0.616   8.518   2.014
  105   HD23  LEU  16          HD23      LEU  16   2.163   9.360   2.097
  106    H    CYS  17           HN       CYS  17   3.335   5.857  -0.203
  107    HA   CYS  17           HA       CYS  17   4.547   4.075  -2.185
  108    HB2  CYS  17           HB2      CYS  17   5.098   3.242   0.572
  109    HB3  CYS  17           HB1      CYS  17   6.176   3.279  -0.816
  110    H    CYS  18           HN       CYS  18   3.842   1.797  -1.879
  111    HA   CYS  18           HA       CYS  18   1.525   1.419  -0.158
  112    HB2  CYS  18           HB2      CYS  18   0.657   2.314  -2.299
  113    HB3  CYS  18           HB1      CYS  18   1.366   0.940  -3.136
  114    H    SER  19           HN       SER  19   1.229  -0.594   0.570
  115    HA   SER  19           HA       SER  19   3.418  -2.415   0.394
  116    HB2  SER  19           HB2      SER  19   0.740  -2.688   1.767
  117    HB3  SER  19           HB1      SER  19   2.111  -3.774   1.992
  118    HG   SER  19           HG       SER  19   3.274  -2.078   2.875
  119    H    GLN  20           HN       GLN  20   3.269  -4.680   0.006
  120    HA   GLN  20           HA       GLN  20   2.689  -5.469  -2.505
  121    HB2  GLN  20           HB2      GLN  20   2.922  -7.016   0.034
  122    HB3  GLN  20           HB1      GLN  20   2.569  -7.848  -1.474
  123    HG2  GLN  20           HG2      GLN  20   4.858  -5.975  -1.480
  124    HG3  GLN  20           HG1      GLN  20   5.046  -7.477  -0.576
  125   HE21  GLN  20          HE21      GLN  20   5.016  -9.437  -1.675
  126   HE22  GLN  20          HE22      GLN  20   5.232  -9.535  -3.387
  127    H    PHE  21           HN       PHE  21   0.480  -5.714   0.191
  128    HA   PHE  21           HA       PHE  21  -1.561  -7.065  -1.343
  129    HB2  PHE  21           HB2      PHE  21  -1.495  -5.926   1.446
  130    HB3  PHE  21           HB1      PHE  21  -2.936  -6.650   0.750
  131    HD1  PHE  21           HD1      PHE  21   0.398  -7.250   2.050
  132    HD2  PHE  21           HD2      PHE  21  -3.085  -9.007   0.366
  133    HE1  PHE  21           HE1      PHE  21   1.183  -9.477   2.776
  134    HE2  PHE  21           HE2      PHE  21  -2.316 -11.243   1.085
  135    HZ   PHE  21           HZ       PHE  21  -0.178 -11.476   2.291
  136    H    GLY  22           HN       GLY  22  -0.915  -3.882  -0.109
  137    HA2  GLY  22           HA2      GLY  22  -1.714  -2.122  -1.762
  138    HA3  GLY  22           HA1      GLY  22  -3.299  -2.821  -1.456
  139    H    TYR  23           HN       TYR  23  -0.533  -1.883   0.569
  140    HA   TYR  23           HA       TYR  23  -2.401  -0.242   2.147
  141    HB2  TYR  23           HB2      TYR  23  -1.145  -2.391   3.158
  142    HB3  TYR  23           HB1      TYR  23   0.109  -1.188   3.434
  143    HD1  TYR  23           HD1      TYR  23  -1.233   1.196   4.262
  144    HD2  TYR  23           HD2      TYR  23  -2.257  -2.846   5.119
  145    HE1  TYR  23           HE1      TYR  23  -2.411   1.933   6.294
  146    HE2  TYR  23           HE2      TYR  23  -3.438  -2.118   7.152
  147    HH   TYR  23           HH       TYR  23  -3.424  -0.217   8.713
  148    H    CYS  24           HN       CYS  24  -2.124   1.753   1.540
  149    HA   CYS  24           HA       CYS  24   0.364   2.800   0.579
  150    HB2  CYS  24           HB2      CYS  24  -1.035   4.983   0.617
  151    HB3  CYS  24           HB1      CYS  24  -1.498   3.710  -0.498
  152    H    GLY  25           HN       GLY  25   1.786   4.126   1.504
  153    HA2  GLY  25           HA2      GLY  25   1.365   5.533   3.944
  154    HA3  GLY  25           HA1      GLY  25   2.295   4.066   4.213
  155    H    SER  26           HN       SER  26   3.659   6.072   4.934
  156    HA   SER  26           HA       SER  26   5.736   6.436   2.920
  157    HB2  SER  26           HB2      SER  26   4.162   8.387   2.654
  158    HB3  SER  26           HB1      SER  26   4.555   8.859   4.302
  159    HG   SER  26           HG       SER  26   6.500   8.507   2.270
  160    H    THR  27           HN       THR  27   4.810   5.761   5.999
  161    HA   THR  27           HA       THR  27   7.471   6.147   7.076
  162    HB   THR  27           HB       THR  27   6.752   8.217   7.818
  163    HG1  THR  27           HG1      THR  27   5.755   6.878  10.064
  164   HG21  THR  27          HG21      THR  27   4.069   7.158   8.708
  165   HG22  THR  27          HG22      THR  27   4.349   7.864   7.116
  166   HG23  THR  27          HG23      THR  27   4.581   8.840   8.566
  167    HA   PRO  28           HA       PRO  28   5.038   3.081   9.917
  168    HB2  PRO  28           HB2      PRO  28   2.674   2.140   8.520
  169    HB3  PRO  28           HB1      PRO  28   2.754   3.061  10.030
  170    HG2  PRO  28           HG2      PRO  28   1.698   4.074   7.763
  171    HG3  PRO  28           HG1      PRO  28   2.509   5.073   8.985
  172    HD2  PRO  28           HD2      PRO  28   3.660   3.950   6.430
  173    HD3  PRO  28           HD1      PRO  28   3.739   5.616   7.052
  174    HA   PRO  29           HA       PRO  29   6.360  -0.872   8.097
  175    HB2  PRO  29           HB2      PRO  29   3.853  -2.313   8.807
  176    HB3  PRO  29           HB1      PRO  29   5.526  -2.662   9.282
  177    HG2  PRO  29           HG2      PRO  29   3.847  -1.677  11.042
  178    HG3  PRO  29           HG1      PRO  29   5.521  -1.082  10.970
  179    HD2  PRO  29           HD2      PRO  29   3.032   0.175   9.872
  180    HD3  PRO  29           HD1      PRO  29   4.351   0.919  10.800
  181    H    TYR  30           HN       TYR  30   5.177   0.806   6.288
  182    HA   TYR  30           HA       TYR  30   4.240  -1.035   4.211
  183    HB2  TYR  30           HB2      TYR  30   3.040   1.724   4.362
  184    HB3  TYR  30           HB1      TYR  30   2.437   0.306   3.520
  185    HD1  TYR  30           HD1      TYR  30   1.882   2.413   6.228
  186    HD2  TYR  30           HD2      TYR  30   1.813  -1.714   5.200
  187    HE1  TYR  30           HE1      TYR  30   0.370   1.968   8.119
  188    HE2  TYR  30           HE2      TYR  30   0.303  -2.170   7.087
  189    HH   TYR  30           HH       TYR  30  -0.303  -1.161   9.245
  190    H    CYS  31           HN       CYS  31   5.835   1.829   5.302
  191    HA   CYS  31           HA       CYS  31   7.481   1.910   2.934
  192    HB2  CYS  31           HB2      CYS  31   5.530   3.552   2.618
  193    HB3  CYS  31           HB1      CYS  31   6.309   4.505   3.876
  194    H    GLY  32           HN       GLY  32   9.031   1.120   4.328
  195    HA2  GLY  32           HA2      GLY  32  10.973   2.689   5.298
  196    HA3  GLY  32           HA1      GLY  32   9.848   2.655   6.652
  197    H    ALA  33           HN       ALA  33   9.102   0.458   7.301
  198    HA   ALA  33           HA       ALA  33  10.863  -1.766   6.739
  199    HB1  ALA  33           HB1      ALA  33  12.092  -0.605   8.532
  200    HB2  ALA  33           HB2      ALA  33  11.485  -2.169   9.076
  201    HB3  ALA  33           HB3      ALA  33  10.664  -0.686   9.562
  202    H    GLY  34           HN       GLY  34   9.128  -2.854   5.978
  203    HA2  GLY  34           HA2      GLY  34   7.564  -4.357   7.734
  204    HA3  GLY  34           HA1      GLY  34   6.592  -2.995   7.201
  205    H    GLN  35           HN       GLN  35   5.873  -2.882   5.105
  206    HA   GLN  35           HA       GLN  35   6.474  -5.151   3.334
  207    HB2  GLN  35           HB2      GLN  35   3.673  -4.096   3.818
  208    HB3  GLN  35           HB1      GLN  35   4.121  -5.444   2.786
  209    HG2  GLN  35           HG2      GLN  35   4.962  -6.602   4.862
  210    HG3  GLN  35           HG1      GLN  35   4.203  -5.308   5.788
  211   HE21  GLN  35          HE21      GLN  35   1.962  -5.163   5.853
  212   HE22  GLN  35          HE22      GLN  35   0.940  -6.473   5.382
  213    H    CYS  36           HN       CYS  36   7.795  -2.942   2.869
  214    HA   CYS  36           HA       CYS  36   6.364  -1.042   1.239
  215    HB2  CYS  36           HB2      CYS  36   8.271  -0.381   2.657
  216    HB3  CYS  36           HB1      CYS  36   9.339  -1.376   1.673
  217    H    GLN  37           HN       GLN  37   5.618  -1.700  -0.700
  218    HA   GLN  37           HA       GLN  37   7.289  -3.349  -2.440
  219    HB2  GLN  37           HB2      GLN  37   4.741  -3.671  -1.991
  220    HB3  GLN  37           HB1      GLN  37   4.539  -2.340  -3.121
  221    HG2  GLN  37           HG2      GLN  37   6.001  -3.760  -4.704
  222    HG3  GLN  37           HG1      GLN  37   5.596  -5.092  -3.625
  223   HE21  GLN  37          HE21      GLN  37   4.381  -2.795  -5.933
  224   HE22  GLN  37          HE22      GLN  37   2.855  -3.561  -6.199
  225    H    SER  38           HN       SER  38   5.432  -0.305  -2.637
  226    HA   SER  38           HA       SER  38   7.006   0.556  -4.950
  227    HB2  SER  38           HB2      SER  38   4.495   1.675  -3.675
  228    HB3  SER  38           HB1      SER  38   5.309   2.408  -5.057
  229    HG   SER  38           HG       SER  38   4.552   0.886  -6.320
  230    H    GLN  39           HN       GLN  39   8.466   2.161  -4.878
  231    HA   GLN  39           HA       GLN  39  10.037   3.563  -4.018
  232    HB2  GLN  39           HB2      GLN  39   7.462   4.741  -3.009
  233    HB3  GLN  39           HB1      GLN  39   9.003   5.522  -2.685
  234    HG2  GLN  39           HG2      GLN  39   9.428   5.664  -5.094
  235    HG3  GLN  39           HG1      GLN  39   7.870   4.900  -5.405
  236   HE21  GLN  39          HE21      GLN  39   9.493   7.775  -4.319
  237   HE22  GLN  39          HE22      GLN  39   8.128   8.829  -4.417
  238    H    CYS  40           HN       CYS  40  11.440   2.566  -2.709
  239    HA   CYS  40           HA       CYS  40  10.896   2.651   0.180
  240    HB2  CYS  40           HB2      CYS  40  12.316   0.362  -1.195
  241    HB3  CYS  40           HB1      CYS  40  11.882   0.474   0.508
  Start of MODEL    8
    1    H1   PHE   1           HT1      PHE   1  -5.952  -0.999   5.549
    2    H2   PHE   1           HT2      PHE   1  -7.390  -0.210   5.135
    3    H3   PHE   1           HT3      PHE   1  -6.015   0.692   5.528
    4    HA   PHE   1           HA       PHE   1  -4.865  -0.116   3.592
    5    HB2  PHE   1           HB2      PHE   1  -7.432  -1.655   3.201
    6    HB3  PHE   1           HB1      PHE   1  -6.304  -1.357   1.882
    7    HD1  PHE   1           HD1      PHE   1  -4.208  -2.503   1.756
    8    HD2  PHE   1           HD2      PHE   1  -6.815  -3.107   5.065
    9    HE1  PHE   1           HE1      PHE   1  -2.893  -4.472   2.426
   10    HE2  PHE   1           HE2      PHE   1  -5.506  -5.078   5.743
   11    HZ   PHE   1           HZ       PHE   1  -3.542  -5.763   4.422
   12    H    GLN   2           HN       GLN   2  -4.779   1.302   1.949
   13    HA   GLN   2           HA       GLN   2  -7.172   2.856   1.259
   14    HB2  GLN   2           HB2      GLN   2  -4.534   3.993   2.182
   15    HB3  GLN   2           HB1      GLN   2  -5.697   4.938   1.263
   16    HG2  GLN   2           HG2      GLN   2  -7.363   4.591   3.022
   17    HG3  GLN   2           HG1      GLN   2  -6.186   3.657   3.944
   18   HE21  GLN   2          HE21      GLN   2  -4.459   4.712   4.923
   19   HE22  GLN   2          HE22      GLN   2  -4.445   6.422   5.166
   20    H    CYS   3           HN       CYS   3  -4.587   1.064   0.203
   21    HA   CYS   3           HA       CYS   3  -4.034   2.539  -2.236
   22    HB2  CYS   3           HB2      CYS   3  -2.278   1.257  -0.983
   23    HB3  CYS   3           HB1      CYS   3  -3.098  -0.224  -1.450
   24    H    GLY   4           HN       GLY   4  -4.159   1.458  -4.353
   25    HA2  GLY   4           HA2      GLY   4  -6.750   0.688  -5.047
   26    HA3  GLY   4           HA1      GLY   4  -5.338   0.514  -6.071
   27    H    ARG   5           HN       ARG   5  -3.983  -1.310  -4.203
   28    HA   ARG   5           HA       ARG   5  -5.408  -3.739  -4.951
   29    HB2  ARG   5           HB2      ARG   5  -2.663  -3.002  -4.745
   30    HB3  ARG   5           HB1      ARG   5  -2.947  -4.301  -3.595
   31    HG2  ARG   5           HG2      ARG   5  -3.839  -5.703  -5.365
   32    HG3  ARG   5           HG1      ARG   5  -3.616  -4.395  -6.529
   33    HD2  ARG   5           HD2      ARG   5  -1.203  -4.450  -6.120
   34    HD3  ARG   5           HD1      ARG   5  -1.429  -5.755  -4.957
   35    HE   ARG   5           HE       ARG   5  -2.560  -6.539  -7.393
   36   HH11  ARG   5          HH11      ARG   5   0.631  -5.907  -6.069
   37   HH12  ARG   5          HH12      ARG   5   1.423  -7.005  -7.149
   38   HH21  ARG   5          HH21      ARG   5   0.215  -8.172  -8.691
   39   HH22  ARG   5          HH22      ARG   5  -1.503  -7.971  -8.796
   40    H    GLN   6           HN       GLN   6  -5.519  -5.556  -3.361
   41    HA   GLN   6           HA       GLN   6  -6.243  -6.505  -1.437
   42    HB2  GLN   6           HB2      GLN   6  -4.285  -4.806  -0.492
   43    HB3  GLN   6           HB1      GLN   6  -5.694  -4.333   0.448
   44    HG2  GLN   6           HG2      GLN   6  -4.786  -7.194   0.178
   45    HG3  GLN   6           HG1      GLN   6  -4.228  -6.121   1.459
   46   HE21  GLN   6          HE21      GLN   6  -6.920  -7.901   0.178
   47   HE22  GLN   6          HE22      GLN   6  -7.928  -7.784   1.575
   48    H    ALA   7           HN       ALA   7  -6.964  -3.108  -1.865
   49    HA   ALA   7           HA       ALA   7  -9.502  -3.227  -0.466
   50    HB1  ALA   7           HB1      ALA   7  -8.191  -0.975  -1.990
   51    HB2  ALA   7           HB2      ALA   7  -8.075  -1.244  -0.250
   52    HB3  ALA   7           HB3      ALA   7  -9.629  -0.838  -0.977
   53    H    GLY   8           HN       GLY   8  -8.240  -3.233  -3.702
   54    HA2  GLY   8           HA2      GLY   8  -9.553  -4.334  -5.436
   55    HA3  GLY   8           HA1      GLY   8 -10.974  -3.550  -4.767
   56    H    GLY   9           HN       GLY   9  -9.666  -0.960  -4.440
   57    HA2  GLY   9           HA2      GLY   9  -8.592   0.035  -6.822
   58    HA3  GLY   9           HA1      GLY   9 -10.337   0.179  -6.941
   59    H    ALA  10           HN       ALA  10  -8.184   0.628  -4.131
   60    HA   ALA  10           HA       ALA  10  -9.443   3.207  -3.609
   61    HB1  ALA  10           HB1      ALA  10  -7.466   1.641  -1.952
   62    HB2  ALA  10           HB2      ALA  10  -9.220   1.593  -1.781
   63    HB3  ALA  10           HB3      ALA  10  -8.341   3.083  -1.438
   64    H    ARG  11           HN       ARG  11  -7.768   4.883  -2.563
   65    HA   ARG  11           HA       ARG  11  -5.325   5.041  -4.178
   66    HB2  ARG  11           HB2      ARG  11  -7.515   7.109  -4.100
   67    HB3  ARG  11           HB1      ARG  11  -5.859   7.535  -4.511
   68    HG2  ARG  11           HG2      ARG  11  -5.926   5.942  -6.378
   69    HG3  ARG  11           HG1      ARG  11  -7.600   5.561  -5.976
   70    HD2  ARG  11           HD2      ARG  11  -7.717   7.126  -7.731
   71    HD3  ARG  11           HD1      ARG  11  -8.080   8.037  -6.267
   72    HE   ARG  11           HE       ARG  11  -5.362   8.291  -6.661
   73   HH11  ARG  11          HH11      ARG  11  -8.245   9.141  -8.479
   74   HH12  ARG  11          HH12      ARG  11  -7.494  10.492  -9.258
   75   HH21  ARG  11          HH21      ARG  11  -4.400  10.065  -7.694
   76   HH22  ARG  11          HH22      ARG  11  -5.319  11.014  -8.814
   77    H    CYS  12           HN       CYS  12  -3.623   5.666  -3.081
   78    HA   CYS  12           HA       CYS  12  -3.531   5.967  -0.338
   79    HB2  CYS  12           HB2      CYS  12  -1.460   7.167  -2.147
   80    HB3  CYS  12           HB1      CYS  12  -1.235   6.302  -0.633
   81    H    SER  13           HN       SER  13  -2.177   7.887   0.687
   82    HA   SER  13           HA       SER  13  -3.923  10.139   0.807
   83    HB2  SER  13           HB2      SER  13  -2.575   9.181   2.760
   84    HB3  SER  13           HB1      SER  13  -1.160   9.954   2.044
   85    HG   SER  13           HG       SER  13  -1.858  11.524   3.304
   86    H    ASN  14           HN       ASN  14  -0.560   9.774  -0.150
   87    HA   ASN  14           HA       ASN  14  -0.821  11.911  -2.134
   88    HB2  ASN  14           HB2      ASN  14   1.283  11.796   0.044
   89    HB3  ASN  14           HB1      ASN  14   1.462  12.774  -1.408
   90   HD21  ASN  14          HD21      ASN  14   0.156  14.580  -1.694
   91   HD22  ASN  14          HD22      ASN  14  -0.722  15.293  -0.388
   92    H    GLY  15           HN       GLY  15   1.706  11.957  -3.168
   93    HA2  GLY  15           HA2      GLY  15   1.886   9.408  -4.492
   94    HA3  GLY  15           HA1      GLY  15   2.926  10.801  -4.764
   95    H    LEU  16           HN       LEU  16   2.210   8.415  -2.248
   96    HA   LEU  16           HA       LEU  16   5.000   8.470  -1.380
   97    HB2  LEU  16           HB2      LEU  16   3.939   7.060   0.576
   98    HB3  LEU  16           HB1      LEU  16   3.780   8.800   0.522
   99    HG   LEU  16           HG       LEU  16   1.495   8.194  -0.696
  100   HD11  LEU  16          HD11      LEU  16   1.482   5.889  -0.770
  101   HD12  LEU  16          HD12      LEU  16   0.534   6.245   0.674
  102   HD13  LEU  16          HD13      LEU  16   2.208   5.732   0.829
  103   HD21  LEU  16          HD21      LEU  16   1.694   9.556   1.276
  104   HD22  LEU  16          HD22      LEU  16   1.963   8.124   2.269
  105   HD23  LEU  16          HD23      LEU  16   0.404   8.375   1.489
  106    H    CYS  17           HN       CYS  17   3.572   5.622  -0.331
  107    HA   CYS  17           HA       CYS  17   4.593   4.007  -2.561
  108    HB2  CYS  17           HB2      CYS  17   5.325   2.872   0.019
  109    HB3  CYS  17           HB1      CYS  17   6.337   3.165  -1.387
  110    H    CYS  18           HN       CYS  18   3.900   1.710  -2.409
  111    HA   CYS  18           HA       CYS  18   1.599   1.249  -0.664
  112    HB2  CYS  18           HB2      CYS  18   0.501   2.053  -2.615
  113    HB3  CYS  18           HB1      CYS  18   1.538   1.113  -3.679
  114    H    SER  19           HN       SER  19   1.500  -0.657   0.181
  115    HA   SER  19           HA       SER  19   3.630  -2.499  -0.036
  116    HB2  SER  19           HB2      SER  19   0.974  -2.614   1.386
  117    HB3  SER  19           HB1      SER  19   2.189  -3.883   1.513
  118    HG   SER  19           HG       SER  19   2.604  -1.149   2.155
  119    H    GLN  20           HN       GLN  20   3.561  -4.713  -0.486
  120    HA   GLN  20           HA       GLN  20   2.899  -5.481  -2.988
  121    HB2  GLN  20           HB2      GLN  20   3.329  -7.093  -0.510
  122    HB3  GLN  20           HB1      GLN  20   3.027  -7.874  -2.056
  123    HG2  GLN  20           HG2      GLN  20   4.984  -6.758  -3.002
  124    HG3  GLN  20           HG1      GLN  20   5.285  -5.975  -1.451
  125   HE21  GLN  20          HE21      GLN  20   5.372  -8.960  -3.224
  126   HE22  GLN  20          HE22      GLN  20   6.330  -9.844  -2.089
  127    H    PHE  21           HN       PHE  21   0.796  -5.803  -0.220
  128    HA   PHE  21           HA       PHE  21  -1.188  -7.288  -1.731
  129    HB2  PHE  21           HB2      PHE  21  -1.069  -6.320   1.114
  130    HB3  PHE  21           HB1      PHE  21  -2.521  -7.034   0.428
  131    HD1  PHE  21           HD1      PHE  21  -2.630  -9.362  -0.122
  132    HD2  PHE  21           HD2      PHE  21   0.882  -7.638   1.538
  133    HE1  PHE  21           HE1      PHE  21  -1.777 -11.621   0.399
  134    HE2  PHE  21           HE2      PHE  21   1.751  -9.890   2.064
  135    HZ   PHE  21           HZ       PHE  21   0.417 -11.884   1.492
  136    H    GLY  22           HN       GLY  22  -0.663  -4.086  -0.508
  137    HA2  GLY  22           HA2      GLY  22  -1.729  -2.379  -2.068
  138    HA3  GLY  22           HA1      GLY  22  -3.229  -3.182  -1.632
  139    H    TYR  23           HN       TYR  23  -0.406  -2.256   0.323
  140    HA   TYR  23           HA       TYR  23  -2.216  -0.580   1.940
  141    HB2  TYR  23           HB2      TYR  23  -0.897  -2.807   2.865
  142    HB3  TYR  23           HB1      TYR  23   0.216  -1.517   3.307
  143    HD1  TYR  23           HD1      TYR  23  -1.661  -3.457   4.982
  144    HD2  TYR  23           HD2      TYR  23  -1.850   0.656   3.895
  145    HE1  TYR  23           HE1      TYR  23  -3.059  -3.005   6.955
  146    HE2  TYR  23           HE2      TYR  23  -3.250   1.116   5.865
  147    HH   TYR  23           HH       TYR  23  -4.757  -0.099   7.380
  148    H    CYS  24           HN       CYS  24  -1.840   1.433   1.371
  149    HA   CYS  24           HA       CYS  24   0.803   2.315   0.605
  150    HB2  CYS  24           HB2      CYS  24  -1.857   3.140   0.054
  151    HB3  CYS  24           HB1      CYS  24  -0.975   4.497   0.741
  152    H    GLY  25           HN       GLY  25   2.027   3.833   1.528
  153    HA2  GLY  25           HA2      GLY  25   1.291   5.295   3.853
  154    HA3  GLY  25           HA1      GLY  25   2.284   3.905   4.265
  155    H    SER  26           HN       SER  26   3.320   6.109   4.983
  156    HA   SER  26           HA       SER  26   5.653   6.504   3.274
  157    HB2  SER  26           HB2      SER  26   5.464   9.028   3.525
  158    HB3  SER  26           HB1      SER  26   4.263   8.314   2.457
  159    HG   SER  26           HG       SER  26   3.449   9.870   4.022
  160    H    THR  27           HN       THR  27   4.396   5.740   6.094
  161    HA   THR  27           HA       THR  27   6.667   6.559   7.671
  162    HB   THR  27           HB       THR  27   5.593   8.475   8.307
  163    HG1  THR  27           HG1      THR  27   4.016   6.989  10.076
  164   HG21  THR  27          HG21      THR  27   2.834   7.278   8.361
  165   HG22  THR  27          HG22      THR  27   3.551   7.838   6.850
  166   HG23  THR  27          HG23      THR  27   3.309   8.967   8.181
  167    HA   PRO  28           HA       PRO  28   4.251   3.178  10.060
  168    HB2  PRO  28           HB2      PRO  28   2.015   2.142   8.581
  169    HB3  PRO  28           HB1      PRO  28   1.964   3.198  10.002
  170    HG2  PRO  28           HG2      PRO  28   1.086   3.964   7.539
  171    HG3  PRO  28           HG1      PRO  28   1.704   5.091   8.762
  172    HD2  PRO  28           HD2      PRO  28   3.205   3.826   6.463
  173    HD3  PRO  28           HD1      PRO  28   3.119   5.546   6.925
  174    HA   PRO  29           HA       PRO  29   5.845  -0.681   8.307
  175    HB2  PRO  29           HB2      PRO  29   3.439  -2.259   9.054
  176    HB3  PRO  29           HB1      PRO  29   5.126  -2.471   9.559
  177    HG2  PRO  29           HG2      PRO  29   3.349  -1.542  11.260
  178    HG3  PRO  29           HG1      PRO  29   4.984  -0.848  11.195
  179    HD2  PRO  29           HD2      PRO  29   2.446   0.215  10.012
  180    HD3  PRO  29           HD1      PRO  29   3.696   1.069  10.940
  181    H    TYR  30           HN       TYR  30   4.705   0.817   6.381
  182    HA   TYR  30           HA       TYR  30   3.772  -1.160   4.426
  183    HB2  TYR  30           HB2      TYR  30   2.612   1.614   4.318
  184    HB3  TYR  30           HB1      TYR  30   1.997   0.136   3.603
  185    HD1  TYR  30           HD1      TYR  30   1.507  -1.708   5.671
  186    HD2  TYR  30           HD2      TYR  30   1.182   2.529   5.859
  187    HE1  TYR  30           HE1      TYR  30  -0.090  -1.924   7.525
  188    HE2  TYR  30           HE2      TYR  30  -0.417   2.319   7.723
  189    HH   TYR  30           HH       TYR  30  -1.980   0.660   8.633
  190    H    CYS  31           HN       CYS  31   5.263   1.842   5.304
  191    HA   CYS  31           HA       CYS  31   7.130   1.656   3.158
  192    HB2  CYS  31           HB2      CYS  31   5.282   3.071   2.176
  193    HB3  CYS  31           HB1      CYS  31   5.679   4.279   3.395
  194    H    GLY  32           HN       GLY  32   8.588   1.281   4.626
  195    HA2  GLY  32           HA2      GLY  32  10.244   3.139   5.661
  196    HA3  GLY  32           HA1      GLY  32   9.030   2.964   6.928
  197    H    ALA  33           HN       ALA  33   8.392   0.386   6.852
  198    HA   ALA  33           HA       ALA  33  10.419  -1.531   6.610
  199    HB1  ALA  33           HB1      ALA  33   9.970  -0.621   9.469
  200    HB2  ALA  33           HB2      ALA  33  11.449  -0.380   8.541
  201    HB3  ALA  33           HB3      ALA  33  10.930  -2.012   8.963
  202    H    GLY  34           HN       GLY  34   8.907  -2.811   5.755
  203    HA2  GLY  34           HA2      GLY  34   7.277  -4.389   7.409
  204    HA3  GLY  34           HA1      GLY  34   6.277  -3.151   6.662
  205    H    GLN  35           HN       GLN  35   5.908  -3.179   4.469
  206    HA   GLN  35           HA       GLN  35   6.992  -5.357   2.864
  207    HB2  GLN  35           HB2      GLN  35   4.514  -5.743   2.048
  208    HB3  GLN  35           HB1      GLN  35   5.125  -6.574   3.468
  209    HG2  GLN  35           HG2      GLN  35   4.063  -4.816   4.877
  210    HG3  GLN  35           HG1      GLN  35   3.348  -4.141   3.417
  211   HE21  GLN  35          HE21      GLN  35   1.728  -5.303   2.342
  212   HE22  GLN  35          HE22      GLN  35   0.860  -6.580   3.113
  213    H    CYS  36           HN       CYS  36   7.913  -3.040   2.397
  214    HA   CYS  36           HA       CYS  36   6.366  -1.315   0.718
  215    HB2  CYS  36           HB2      CYS  36   8.672  -0.324   0.219
  216    HB3  CYS  36           HB1      CYS  36   8.125  -0.286   1.891
  217    H    GLN  37           HN       GLN  37   5.800  -1.641  -1.343
  218    HA   GLN  37           HA       GLN  37   7.432  -3.394  -3.031
  219    HB2  GLN  37           HB2      GLN  37   4.893  -3.693  -2.700
  220    HB3  GLN  37           HB1      GLN  37   4.721  -2.282  -3.733
  221    HG2  GLN  37           HG2      GLN  37   6.065  -3.509  -5.460
  222    HG3  GLN  37           HG1      GLN  37   5.927  -4.940  -4.442
  223   HE21  GLN  37          HE21      GLN  37   3.989  -6.016  -4.318
  224   HE22  GLN  37          HE22      GLN  37   2.651  -5.673  -5.355
  225    H    SER  38           HN       SER  38   5.829  -0.205  -3.105
  226    HA   SER  38           HA       SER  38   7.131   0.565  -5.556
  227    HB2  SER  38           HB2      SER  38   5.315   2.080  -3.677
  228    HB3  SER  38           HB1      SER  38   5.945   2.747  -5.184
  229    HG   SER  38           HG       SER  38   4.956   0.796  -6.172
  230    H    GLN  39           HN       GLN  39   7.159   1.862  -2.268
  231    HA   GLN  39           HA       GLN  39   9.976   2.590  -2.562
  232    HB2  GLN  39           HB2      GLN  39   7.785   4.488  -2.505
  233    HB3  GLN  39           HB1      GLN  39   8.858   4.736  -1.136
  234    HG2  GLN  39           HG2      GLN  39   9.928   4.492  -3.923
  235    HG3  GLN  39           HG1      GLN  39   9.310   6.024  -3.308
  236   HE21  GLN  39          HE21      GLN  39  10.420   7.081  -1.659
  237   HE22  GLN  39          HE22      GLN  39  12.053   6.689  -1.254
  238    H    CYS  40           HN       CYS  40  11.100   2.844  -0.586
  239    HA   CYS  40           HA       CYS  40   9.669   1.889   1.803
  240    HB2  CYS  40           HB2      CYS  40  11.435   0.340   0.424
  241    HB3  CYS  40           HB1      CYS  40  12.509   1.115   1.584
  Start of MODEL    9
    1    H1   PHE   1           HT1      PHE   1  -6.214  -2.487   0.382
    2    H2   PHE   1           HT2      PHE   1  -5.554  -3.378   1.659
    3    H3   PHE   1           HT3      PHE   1  -4.872  -1.893   1.224
    4    HA   PHE   1           HA       PHE   1  -7.571  -2.297   2.354
    5    HB2  PHE   1           HB2      PHE   1  -5.115  -1.012   3.569
    6    HB3  PHE   1           HB1      PHE   1  -6.695  -1.134   4.332
    7    HD1  PHE   1           HD1      PHE   1  -3.655  -2.925   3.395
    8    HD2  PHE   1           HD2      PHE   1  -7.484  -3.233   5.223
    9    HE1  PHE   1           HE1      PHE   1  -3.015  -5.096   4.365
   10    HE2  PHE   1           HE2      PHE   1  -6.852  -5.404   6.199
   11    HZ   PHE   1           HZ       PHE   1  -4.613  -6.338   5.768
   12    H    GLN   2           HN       GLN   2  -5.187  -0.138   1.003
   13    HA   GLN   2           HA       GLN   2  -7.287   1.854   0.519
   14    HB2  GLN   2           HB2      GLN   2  -4.615   2.376   1.808
   15    HB3  GLN   2           HB1      GLN   2  -5.537   3.651   1.025
   16    HG2  GLN   2           HG2      GLN   2  -7.393   3.255   2.560
   17    HG3  GLN   2           HG1      GLN   2  -6.474   1.970   3.341
   18   HE21  GLN   2          HE21      GLN   2  -4.709   2.502   4.632
   19   HE22  GLN   2          HE22      GLN   2  -4.460   4.103   5.232
   20    H    CYS   3           HN       CYS   3  -4.859  -0.032  -0.835
   21    HA   CYS   3           HA       CYS   3  -5.000   1.421  -3.331
   22    HB2  CYS   3           HB2      CYS   3  -2.550   1.720  -3.596
   23    HB3  CYS   3           HB1      CYS   3  -3.164   2.647  -2.230
   24    H    GLY   4           HN       GLY   4  -5.119  -0.003  -4.929
   25    HA2  GLY   4           HA2      GLY   4  -4.246  -1.726  -6.295
   26    HA3  GLY   4           HA1      GLY   4  -3.385  -2.363  -4.907
   27    H    ARG   5           HN       ARG   5  -4.036  -4.446  -5.102
   28    HA   ARG   5           HA       ARG   5  -6.866  -5.063  -5.281
   29    HB2  ARG   5           HB2      ARG   5  -5.039  -6.297  -6.574
   30    HB3  ARG   5           HB1      ARG   5  -4.616  -7.063  -5.049
   31    HG2  ARG   5           HG2      ARG   5  -6.921  -7.929  -4.885
   32    HG3  ARG   5           HG1      ARG   5  -7.262  -7.237  -6.472
   33    HD2  ARG   5           HD2      ARG   5  -5.442  -8.616  -7.419
   34    HD3  ARG   5           HD1      ARG   5  -5.206  -9.348  -5.832
   35    HE   ARG   5           HE       ARG   5  -7.879  -9.690  -6.482
   36   HH11  ARG   5          HH11      ARG   5  -4.790 -10.752  -7.773
   37   HH12  ARG   5          HH12      ARG   5  -5.438 -12.220  -8.426
   38   HH21  ARG   5          HH21      ARG   5  -7.653 -12.708  -8.182
   39   HH22  ARG   5          HH22      ARG   5  -8.705 -11.617  -7.343
   40    H    GLN   6           HN       GLN   6  -7.823  -4.657  -3.505
   41    HA   GLN   6           HA       GLN   6  -7.822  -6.402  -1.290
   42    HB2  GLN   6           HB2      GLN   6  -6.369  -3.817  -0.991
   43    HB3  GLN   6           HB1      GLN   6  -7.498  -4.233   0.289
   44    HG2  GLN   6           HG2      GLN   6  -5.439  -6.209  -0.619
   45    HG3  GLN   6           HG1      GLN   6  -5.017  -4.929   0.516
   46   HE21  GLN   6          HE21      GLN   6  -6.856  -7.834   0.019
   47   HE22  GLN   6          HE22      GLN   6  -7.239  -8.121   1.678
   48    H    ALA   7           HN       ALA   7  -8.533  -3.412  -2.828
   49    HA   ALA   7           HA       ALA   7 -11.301  -3.382  -1.833
   50    HB1  ALA   7           HB1      ALA   7  -9.566  -1.072  -2.713
   51    HB2  ALA   7           HB2      ALA   7  -9.998  -1.461  -1.048
   52    HB3  ALA   7           HB3      ALA   7 -11.246  -0.955  -2.187
   53    H    GLY   8           HN       GLY   8  -9.135  -3.485  -4.493
   54    HA2  GLY   8           HA2      GLY   8  -9.912  -4.365  -6.615
   55    HA3  GLY   8           HA1      GLY   8 -11.388  -3.436  -6.400
   56    H    GLY   9           HN       GLY   9 -10.011  -1.058  -5.487
   57    HA2  GLY   9           HA2      GLY   9  -8.099  -0.089  -7.283
   58    HA3  GLY   9           HA1      GLY   9  -9.683   0.286  -7.946
   59    H    ALA  10           HN       ALA  10  -7.357   1.009  -5.473
   60    HA   ALA  10           HA       ALA  10  -8.968   3.342  -4.672
   61    HB1  ALA  10           HB1      ALA  10  -9.107   1.627  -2.926
   62    HB2  ALA  10           HB2      ALA  10  -8.249   3.060  -2.358
   63    HB3  ALA  10           HB3      ALA  10  -7.347   1.610  -2.802
   64    H    ARG  11           HN       ARG  11  -7.270   4.698  -3.069
   65    HA   ARG  11           HA       ARG  11  -4.701   4.962  -4.460
   66    HB2  ARG  11           HB2      ARG  11  -6.737   7.163  -4.101
   67    HB3  ARG  11           HB1      ARG  11  -5.036   7.495  -4.397
   68    HG2  ARG  11           HG2      ARG  11  -5.177   6.257  -6.516
   69    HG3  ARG  11           HG1      ARG  11  -6.894   5.980  -6.222
   70    HD2  ARG  11           HD2      ARG  11  -6.802   7.827  -7.676
   71    HD3  ARG  11           HD1      ARG  11  -7.127   8.506  -6.082
   72    HE   ARG  11           HE       ARG  11  -4.393   8.565  -6.354
   73   HH11  ARG  11          HH11      ARG  11  -7.086   9.940  -8.141
   74   HH12  ARG  11          HH12      ARG  11  -6.176  11.311  -8.680
   75   HH21  ARG  11          HH21      ARG  11  -3.222  10.367  -7.074
   76   HH22  ARG  11          HH22      ARG  11  -3.991  11.551  -8.077
   77    H    CYS  12           HN       CYS  12  -3.095   6.173  -3.273
   78    HA   CYS  12           HA       CYS  12  -3.233   5.661  -0.457
   79    HB2  CYS  12           HB2      CYS  12  -1.095   6.677  -2.306
   80    HB3  CYS  12           HB1      CYS  12  -0.855   6.641  -0.564
   81    H    SER  13           HN       SER  13  -1.789   7.554   0.833
   82    HA   SER  13           HA       SER  13  -3.713   9.663   1.183
   83    HB2  SER  13           HB2      SER  13  -2.304   8.449   3.029
   84    HB3  SER  13           HB1      SER  13  -1.050   9.608   2.590
   85    HG   SER  13           HG       SER  13  -3.267  10.988   2.848
   86    H    ASN  14           HN       ASN  14  -0.294   9.565   0.359
   87    HA   ASN  14           HA       ASN  14  -0.568  11.991  -1.260
   88    HB2  ASN  14           HB2      ASN  14   1.448  11.594   0.967
   89    HB3  ASN  14           HB1      ASN  14   1.650  12.800  -0.299
   90   HD21  ASN  14          HD21      ASN  14  -0.171  11.855   2.501
   91   HD22  ASN  14          HD22      ASN  14  -0.957  13.372   2.755
   92    H    GLY  15           HN       GLY  15   2.055  12.292  -2.072
   93    HA2  GLY  15           HA2      GLY  15   2.368  10.064  -3.868
   94    HA3  GLY  15           HA1      GLY  15   3.382  11.499  -3.796
   95    H    LEU  16           HN       LEU  16   2.577   8.766  -1.693
   96    HA   LEU  16           HA       LEU  16   5.392   8.549  -0.900
   97    HB2  LEU  16           HB2      LEU  16   4.235   7.042   0.954
   98    HB3  LEU  16           HB1      LEU  16   4.291   8.782   1.089
   99    HG   LEU  16           HG       LEU  16   1.922   8.633  -0.067
  100   HD11  LEU  16          HD11      LEU  16   2.323   5.897   1.064
  101   HD12  LEU  16          HD12      LEU  16   1.665   6.370  -0.504
  102   HD13  LEU  16          HD13      LEU  16   0.731   6.640   0.966
  103   HD21  LEU  16          HD21      LEU  16   2.462   9.550   2.166
  104   HD22  LEU  16          HD22      LEU  16   2.266   7.924   2.827
  105   HD23  LEU  16          HD23      LEU  16   0.901   8.741   2.077
  106    H    CYS  17           HN       CYS  17   3.726   5.740  -0.057
  107    HA   CYS  17           HA       CYS  17   4.418   4.322  -2.525
  108    HB2  CYS  17           HB2      CYS  17   5.661   2.595  -1.287
  109    HB3  CYS  17           HB1      CYS  17   6.394   4.173  -1.020
  110    H    CYS  18           HN       CYS  18   3.772   1.898  -2.234
  111    HA   CYS  18           HA       CYS  18   1.314   1.584  -0.678
  112    HB2  CYS  18           HB2      CYS  18   0.510   2.307  -2.838
  113    HB3  CYS  18           HB1      CYS  18   1.568   1.176  -3.670
  114    H    SER  19           HN       SER  19   1.462  -0.212   0.453
  115    HA   SER  19           HA       SER  19   3.528  -2.141  -0.025
  116    HB2  SER  19           HB2      SER  19   1.423  -1.806   2.076
  117    HB3  SER  19           HB1      SER  19   2.430  -3.250   2.022
  118    HG   SER  19           HG       SER  19   4.087  -1.264   1.793
  119    H    GLN  20           HN       GLN  20   3.200  -4.419   0.013
  120    HA   GLN  20           HA       GLN  20   2.078  -5.508  -2.152
  121    HB2  GLN  20           HB2      GLN  20   2.600  -6.781   0.505
  122    HB3  GLN  20           HB1      GLN  20   2.127  -7.712  -0.908
  123    HG2  GLN  20           HG2      GLN  20   4.109  -6.981  -2.092
  124    HG3  GLN  20           HG1      GLN  20   4.568  -5.957  -0.733
  125   HE21  GLN  20          HE21      GLN  20   4.322  -9.210  -1.923
  126   HE22  GLN  20          HE22      GLN  20   5.285  -9.950  -0.694
  127    H    PHE  21           HN       PHE  21   0.279  -5.123   0.848
  128    HA   PHE  21           HA       PHE  21  -2.022  -6.249  -0.591
  129    HB2  PHE  21           HB2      PHE  21  -0.918  -7.053   1.917
  130    HB3  PHE  21           HB1      PHE  21  -2.570  -6.487   2.158
  131    HD1  PHE  21           HD1      PHE  21  -4.442  -7.616   1.119
  132    HD2  PHE  21           HD2      PHE  21  -0.453  -8.983   0.545
  133    HE1  PHE  21           HE1      PHE  21  -5.304  -9.754   0.252
  134    HE2  PHE  21           HE2      PHE  21  -1.306 -11.125  -0.322
  135    HZ   PHE  21           HZ       PHE  21  -3.735 -11.511  -0.472
  136    H    GLY  22           HN       GLY  22  -1.368  -3.512  -0.666
  137    HA2  GLY  22           HA2      GLY  22  -2.689  -1.631  -0.868
  138    HA3  GLY  22           HA1      GLY  22  -3.980  -2.488  -0.051
  139    H    TYR  23           HN       TYR  23  -0.690  -1.719   1.013
  140    HA   TYR  23           HA       TYR  23  -1.915  -0.171   3.184
  141    HB2  TYR  23           HB2      TYR  23  -0.111  -2.398   3.335
  142    HB3  TYR  23           HB1      TYR  23   0.653  -0.973   4.037
  143    HD1  TYR  23           HD1      TYR  23  -0.836  -3.759   5.003
  144    HD2  TYR  23           HD2      TYR  23  -1.479   0.431   5.371
  145    HE1  TYR  23           HE1      TYR  23  -2.109  -4.143   7.080
  146    HE2  TYR  23           HE2      TYR  23  -2.757   0.060   7.448
  147    HH   TYR  23           HH       TYR  23  -2.749  -2.904   9.103
  148    H    CYS  24           HN       CYS  24  -1.752   1.818   2.565
  149    HA   CYS  24           HA       CYS  24   0.589   2.894   1.257
  150    HB2  CYS  24           HB2      CYS  24  -1.952   4.196   2.238
  151    HB3  CYS  24           HB1      CYS  24  -0.699   5.010   1.312
  152    H    GLY  25           HN       GLY  25   1.978   4.444   2.111
  153    HA2  GLY  25           HA2      GLY  25   1.665   5.581   4.673
  154    HA3  GLY  25           HA1      GLY  25   2.678   4.155   4.792
  155    H    SER  26           HN       SER  26   3.696   6.349   5.602
  156    HA   SER  26           HA       SER  26   5.948   6.861   3.851
  157    HB2  SER  26           HB2      SER  26   4.284   8.631   3.204
  158    HB3  SER  26           HB1      SER  26   4.295   9.199   4.868
  159    HG   SER  26           HG       SER  26   6.387   9.837   4.634
  160    H    THR  27           HN       THR  27   4.838   5.877   6.586
  161    HA   THR  27           HA       THR  27   6.995   6.899   8.228
  162    HB   THR  27           HB       THR  27   5.662   8.464   9.169
  163    HG1  THR  27           HG1      THR  27   4.047   6.734  10.561
  164   HG21  THR  27          HG21      THR  27   3.801   7.717   7.426
  165   HG22  THR  27          HG22      THR  27   3.422   8.799   8.765
  166   HG23  THR  27          HG23      THR  27   3.028   7.085   8.881
  167    HA   PRO  28           HA       PRO  28   5.354   2.904  10.284
  168    HB2  PRO  28           HB2      PRO  28   3.081   1.761   8.953
  169    HB3  PRO  28           HB1      PRO  28   3.084   2.670  10.475
  170    HG2  PRO  28           HG2      PRO  28   1.843   3.554   8.216
  171    HG3  PRO  28           HG1      PRO  28   2.485   4.629   9.471
  172    HD2  PRO  28           HD2      PRO  28   3.843   3.732   6.920
  173    HD3  PRO  28           HD1      PRO  28   3.609   5.393   7.525
  174    HA   PRO  29           HA       PRO  29   7.122  -0.583   7.954
  175    HB2  PRO  29           HB2      PRO  29   4.884  -2.407   8.694
  176    HB3  PRO  29           HB1      PRO  29   6.626  -2.586   8.979
  177    HG2  PRO  29           HG2      PRO  29   5.039  -2.005  10.980
  178    HG3  PRO  29           HG1      PRO  29   6.608  -1.185  10.819
  179    HD2  PRO  29           HD2      PRO  29   3.880  -0.175  10.111
  180    HD3  PRO  29           HD1      PRO  29   5.197   0.650  10.973
  181    H    TYR  30           HN       TYR  30   5.735   1.042   6.325
  182    HA   TYR  30           HA       TYR  30   4.734  -0.740   4.219
  183    HB2  TYR  30           HB2      TYR  30   3.425   1.946   4.636
  184    HB3  TYR  30           HB1      TYR  30   2.846   0.580   3.700
  185    HD1  TYR  30           HD1      TYR  30   2.713  -1.636   5.496
  186    HD2  TYR  30           HD2      TYR  30   1.962   2.467   6.325
  187    HE1  TYR  30           HE1      TYR  30   1.276  -2.293   7.381
  188    HE2  TYR  30           HE2      TYR  30   0.521   1.816   8.218
  189    HH   TYR  30           HH       TYR  30   0.449  -1.324   9.484
  190    H    CYS  31           HN       CYS  31   6.145   2.251   5.326
  191    HA   CYS  31           HA       CYS  31   7.469   2.606   2.755
  192    HB2  CYS  31           HB2      CYS  31   5.662   4.438   3.944
  193    HB3  CYS  31           HB1      CYS  31   7.279   5.138   3.960
  194    H    GLY  32           HN       GLY  32   7.651   2.518   6.126
  195    HA2  GLY  32           HA2      GLY  32  10.503   3.172   5.914
  196    HA3  GLY  32           HA1      GLY  32   9.529   3.611   7.311
  197    H    ALA  33           HN       ALA  33  10.678   0.865   5.418
  198    HA   ALA  33           HA       ALA  33  11.321  -1.247   5.910
  199    HB1  ALA  33           HB1      ALA  33  12.202  -1.789   8.110
  200    HB2  ALA  33           HB2      ALA  33  11.472  -0.332   8.786
  201    HB3  ALA  33           HB3      ALA  33  12.772  -0.197   7.602
  202    H    GLY  34           HN       GLY  34   9.712  -2.561   5.423
  203    HA2  GLY  34           HA2      GLY  34   8.238  -3.924   7.351
  204    HA3  GLY  34           HA1      GLY  34   7.211  -2.634   6.745
  205    H    GLN  35           HN       GLN  35   6.248  -2.821   4.788
  206    HA   GLN  35           HA       GLN  35   6.894  -5.177   3.144
  207    HB2  GLN  35           HB2      GLN  35   4.054  -4.310   3.724
  208    HB3  GLN  35           HB1      GLN  35   4.579  -5.770   2.904
  209    HG2  GLN  35           HG2      GLN  35   5.652  -6.449   5.100
  210    HG3  GLN  35           HG1      GLN  35   4.766  -5.111   5.829
  211   HE21  GLN  35          HE21      GLN  35   4.517  -8.234   4.323
  212   HE22  GLN  35          HE22      GLN  35   2.879  -8.549   4.776
  213    H    CYS  36           HN       CYS  36   7.823  -2.644   2.565
  214    HA   CYS  36           HA       CYS  36   6.107  -1.138   0.863
  215    HB2  CYS  36           HB2      CYS  36   8.268  -0.017   0.172
  216    HB3  CYS  36           HB1      CYS  36   7.903   0.018   1.893
  217    H    GLN  37           HN       GLN  37   5.347  -1.793  -1.024
  218    HA   GLN  37           HA       GLN  37   6.907  -3.569  -2.739
  219    HB2  GLN  37           HB2      GLN  37   4.442  -3.942  -2.135
  220    HB3  GLN  37           HB1      GLN  37   4.088  -2.600  -3.213
  221    HG2  GLN  37           HG2      GLN  37   5.303  -3.896  -5.009
  222    HG3  GLN  37           HG1      GLN  37   5.274  -5.268  -3.904
  223   HE21  GLN  37          HE21      GLN  37   3.324  -6.283  -3.458
  224   HE22  GLN  37          HE22      GLN  37   1.904  -6.018  -4.402
  225    H    SER  38           HN       SER  38   5.230  -0.429  -2.888
  226    HA   SER  38           HA       SER  38   6.068   0.180  -5.545
  227    HB2  SER  38           HB2      SER  38   4.905   1.983  -3.416
  228    HB3  SER  38           HB1      SER  38   5.089   2.410  -5.115
  229    HG   SER  38           HG       SER  38   3.612   0.827  -5.653
  230    H    GLN  39           HN       GLN  39   6.889   1.740  -2.476
  231    HA   GLN  39           HA       GLN  39   9.647   2.104  -3.349
  232    HB2  GLN  39           HB2      GLN  39   7.724   4.340  -2.801
  233    HB3  GLN  39           HB1      GLN  39   9.430   4.550  -2.433
  234    HG2  GLN  39           HG2      GLN  39   9.988   4.056  -4.761
  235    HG3  GLN  39           HG1      GLN  39   8.275   3.853  -5.123
  236   HE21  GLN  39          HE21      GLN  39   6.937   5.657  -5.186
  237   HE22  GLN  39          HE22      GLN  39   7.563   7.264  -5.296
  238    H    CYS  40           HN       CYS  40  11.125   2.303  -1.691
  239    HA   CYS  40           HA       CYS  40  10.060   1.886   1.024
  240    HB2  CYS  40           HB2      CYS  40  12.682   0.884  -0.108
  241    HB3  CYS  40           HB1      CYS  40  12.059   0.567   1.507
  Start of MODEL   10
    1    H1   PHE   1           HT1      PHE   1  -6.382  -0.579   4.919
    2    H2   PHE   1           HT2      PHE   1  -5.709   0.912   5.345
    3    H3   PHE   1           HT3      PHE   1  -4.811  -0.507   5.544
    4    HA   PHE   1           HA       PHE   1  -4.073   0.743   3.623
    5    HB2  PHE   1           HB2      PHE   1  -4.430  -1.136   1.895
    6    HB3  PHE   1           HB1      PHE   1  -3.669  -1.593   3.414
    7    HD1  PHE   1           HD1      PHE   1  -4.748  -3.055   4.940
    8    HD2  PHE   1           HD2      PHE   1  -6.704  -1.796   1.384
    9    HE1  PHE   1           HE1      PHE   1  -6.464  -4.793   5.281
   10    HE2  PHE   1           HE2      PHE   1  -8.429  -3.530   1.711
   11    HZ   PHE   1           HZ       PHE   1  -8.309  -5.030   3.662
   12    H    GLN   2           HN       GLN   2  -4.461   1.488   1.503
   13    HA   GLN   2           HA       GLN   2  -7.216   1.787   0.594
   14    HB2  GLN   2           HB2      GLN   2  -5.458   4.064   1.482
   15    HB3  GLN   2           HB1      GLN   2  -6.703   4.315   0.268
   16    HG2  GLN   2           HG2      GLN   2  -8.398   3.537   1.856
   17    HG3  GLN   2           HG1      GLN   2  -7.141   3.307   3.071
   18   HE21  GLN   2          HE21      GLN   2  -6.177   5.102   4.020
   19   HE22  GLN   2          HE22      GLN   2  -6.878   6.679   3.926
   20    H    CYS   3           HN       CYS   3  -4.944   0.346  -0.421
   21    HA   CYS   3           HA       CYS   3  -4.774   1.504  -3.092
   22    HB2  CYS   3           HB2      CYS   3  -2.808   2.448  -2.061
   23    HB3  CYS   3           HB1      CYS   3  -2.360   0.898  -1.366
   24    H    GLY   4           HN       GLY   4  -3.813  -0.017  -4.668
   25    HA2  GLY   4           HA2      GLY   4  -3.515  -2.059  -5.659
   26    HA3  GLY   4           HA1      GLY   4  -3.241  -2.722  -4.064
   27    H    ARG   5           HN       ARG   5  -4.264  -4.608  -4.572
   28    HA   ARG   5           HA       ARG   5  -7.059  -4.585  -5.359
   29    HB2  ARG   5           HB2      ARG   5  -6.771  -7.089  -5.455
   30    HB3  ARG   5           HB1      ARG   5  -5.758  -6.170  -6.557
   31    HG2  ARG   5           HG2      ARG   5  -4.009  -6.361  -4.615
   32    HG3  ARG   5           HG1      ARG   5  -5.003  -7.747  -4.153
   33    HD2  ARG   5           HD2      ARG   5  -4.797  -8.598  -6.462
   34    HD3  ARG   5           HD1      ARG   5  -3.704  -7.263  -6.821
   35    HE   ARG   5           HE       ARG   5  -2.777  -8.713  -4.573
   36   HH11  ARG   5          HH11      ARG   5  -2.980  -8.981  -8.069
   37   HH12  ARG   5          HH12      ARG   5  -1.603 -10.026  -8.183
   38   HH21  ARG   5          HH21      ARG   5  -0.472 -10.649  -6.303
   39   HH22  ARG   5          HH22      ARG   5  -0.979 -10.082  -4.747
   40    H    GLN   6           HN       GLN   6  -5.312  -4.707  -2.428
   41    HA   GLN   6           HA       GLN   6  -6.867  -6.450  -0.854
   42    HB2  GLN   6           HB2      GLN   6  -4.915  -4.336  -0.363
   43    HB3  GLN   6           HB1      GLN   6  -6.148  -4.426   0.887
   44    HG2  GLN   6           HG2      GLN   6  -4.491  -6.776  -0.039
   45    HG3  GLN   6           HG1      GLN   6  -4.120  -5.776   1.366
   46   HE21  GLN   6          HE21      GLN   6  -5.276  -6.034   3.234
   47   HE22  GLN   6          HE22      GLN   6  -6.398  -7.324   3.483
   48    H    ALA   7           HN       ALA   7  -7.369  -3.242  -2.003
   49    HA   ALA   7           HA       ALA   7  -9.789  -2.838  -0.410
   50    HB1  ALA   7           HB1      ALA   7  -8.104  -1.074  -0.338
   51    HB2  ALA   7           HB2      ALA   7  -9.594  -0.502  -1.087
   52    HB3  ALA   7           HB3      ALA   7  -8.202  -0.910  -2.090
   53    H    GLY   8           HN       GLY   8  -8.575  -3.022  -3.687
   54    HA2  GLY   8           HA2      GLY   8 -10.042  -4.087  -5.354
   55    HA3  GLY   8           HA1      GLY   8 -11.353  -3.121  -4.694
   56    H    GLY   9           HN       GLY   9 -10.056  -0.649  -4.483
   57    HA2  GLY   9           HA2      GLY   9  -8.693   0.201  -6.786
   58    HA3  GLY   9           HA1      GLY   9 -10.416   0.409  -7.064
   59    H    ALA  10           HN       ALA  10  -7.820   1.194  -4.782
   60    HA   ALA  10           HA       ALA  10  -9.124   3.786  -4.273
   61    HB1  ALA  10           HB1      ALA  10  -8.449   3.659  -1.928
   62    HB2  ALA  10           HB2      ALA  10  -7.753   2.062  -2.204
   63    HB3  ALA  10           HB3      ALA  10  -9.494   2.304  -2.357
   64    H    ARG  11           HN       ARG  11  -7.381   5.220  -2.963
   65    HA   ARG  11           HA       ARG  11  -4.715   4.899  -4.144
   66    HB2  ARG  11           HB2      ARG  11  -6.485   7.328  -4.440
   67    HB3  ARG  11           HB1      ARG  11  -4.740   7.409  -4.635
   68    HG2  ARG  11           HG2      ARG  11  -4.878   5.775  -6.460
   69    HG3  ARG  11           HG1      ARG  11  -6.632   5.728  -6.273
   70    HD2  ARG  11           HD2      ARG  11  -6.230   7.203  -8.063
   71    HD3  ARG  11           HD1      ARG  11  -6.596   8.232  -6.680
   72    HE   ARG  11           HE       ARG  11  -3.834   7.920  -6.767
   73   HH11  ARG  11          HH11      ARG  11  -6.321   9.369  -8.780
   74   HH12  ARG  11          HH12      ARG  11  -5.252  10.559  -9.443
   75   HH21  ARG  11          HH21      ARG  11  -2.453   9.487  -7.649
   76   HH22  ARG  11          HH22      ARG  11  -3.065  10.625  -8.802
   77    H    CYS  12           HN       CYS  12  -3.042   6.032  -3.065
   78    HA   CYS  12           HA       CYS  12  -3.359   6.167  -0.244
   79    HB2  CYS  12           HB2      CYS  12  -1.041   6.892  -2.035
   80    HB3  CYS  12           HB1      CYS  12  -0.952   6.773  -0.280
   81    H    SER  13           HN       SER  13  -2.201   8.032   0.990
   82    HA   SER  13           HA       SER  13  -3.815  10.310   0.919
   83    HB2  SER  13           HB2      SER  13  -2.476   9.444   2.907
   84    HB3  SER  13           HB1      SER  13  -1.056  10.186   2.170
   85    HG   SER  13           HG       SER  13  -1.927  12.174   2.465
   86    H    ASN  14           HN       ASN  14  -0.466   9.941  -0.063
   87    HA   ASN  14           HA       ASN  14  -0.751  12.041  -2.082
   88    HB2  ASN  14           HB2      ASN  14   1.392  11.957   0.062
   89    HB3  ASN  14           HB1      ASN  14   1.544  12.913  -1.408
   90   HD21  ASN  14          HD21      ASN  14   0.233  14.718  -1.695
   91   HD22  ASN  14          HD22      ASN  14  -0.615  15.452  -0.382
   92    H    GLY  15           HN       GLY  15   1.814  12.039  -3.101
   93    HA2  GLY  15           HA2      GLY  15   1.930   9.469  -4.397
   94    HA3  GLY  15           HA1      GLY  15   2.999  10.836  -4.691
   95    H    LEU  16           HN       LEU  16   2.224   8.607  -2.046
   96    HA   LEU  16           HA       LEU  16   4.997   8.620  -1.169
   97    HB2  LEU  16           HB2      LEU  16   3.977   7.243   0.776
   98    HB3  LEU  16           HB1      LEU  16   3.638   8.957   0.675
   99    HG   LEU  16           HG       LEU  16   1.513   7.797  -0.686
  100   HD11  LEU  16          HD11      LEU  16   2.361   6.048   1.582
  101   HD12  LEU  16          HD12      LEU  16   1.786   5.599  -0.025
  102   HD13  LEU  16          HD13      LEU  16   0.662   6.242   1.169
  103   HD21  LEU  16          HD21      LEU  16   1.423   9.713   0.804
  104   HD22  LEU  16          HD22      LEU  16   1.676   8.650   2.189
  105   HD23  LEU  16          HD23      LEU  16   0.205   8.510   1.227
  106    H    CYS  17           HN       CYS  17   3.476   5.775  -0.194
  107    HA   CYS  17           HA       CYS  17   4.662   4.150  -2.332
  108    HB2  CYS  17           HB2      CYS  17   5.135   3.174   0.425
  109    HB3  CYS  17           HB1      CYS  17   6.199   3.126  -0.976
  110    H    CYS  18           HN       CYS  18   3.972   1.855  -2.211
  111    HA   CYS  18           HA       CYS  18   1.518   1.387  -0.682
  112    HB2  CYS  18           HB2      CYS  18   0.709   2.221  -2.801
  113    HB3  CYS  18           HB1      CYS  18   1.761   1.129  -3.690
  114    H    SER  19           HN       SER  19   1.613  -0.478   0.320
  115    HA   SER  19           HA       SER  19   3.727  -2.325   0.037
  116    HB2  SER  19           HB2      SER  19   1.107  -2.515   1.521
  117    HB3  SER  19           HB1      SER  19   2.413  -3.687   1.674
  118    HG   SER  19           HG       SER  19   3.017  -0.983   2.037
  119    H    GLN  20           HN       GLN  20   3.563  -4.614  -0.315
  120    HA   GLN  20           HA       GLN  20   2.866  -5.406  -2.810
  121    HB2  GLN  20           HB2      GLN  20   4.203  -6.548  -0.824
  122    HB3  GLN  20           HB1      GLN  20   2.722  -7.486  -0.717
  123    HG2  GLN  20           HG2      GLN  20   2.968  -8.133  -3.067
  124    HG3  GLN  20           HG1      GLN  20   4.465  -7.205  -3.158
  125   HE21  GLN  20          HE21      GLN  20   6.302  -7.965  -2.109
  126   HE22  GLN  20          HE22      GLN  20   6.439  -9.597  -1.561
  127    H    PHE  21           HN       PHE  21   0.782  -5.587  -0.032
  128    HA   PHE  21           HA       PHE  21  -1.262  -7.027  -1.511
  129    HB2  PHE  21           HB2      PHE  21  -0.833  -6.236   1.321
  130    HB3  PHE  21           HB1      PHE  21  -2.478  -6.523   0.783
  131    HD1  PHE  21           HD1      PHE  21   0.758  -7.999   1.436
  132    HD2  PHE  21           HD2      PHE  21  -3.207  -8.703   0.081
  133    HE1  PHE  21           HE1      PHE  21   1.107 -10.430   1.713
  134    HE2  PHE  21           HE2      PHE  21  -2.877 -11.137   0.354
  135    HZ   PHE  21           HZ       PHE  21  -0.716 -11.999   1.170
  136    H    GLY  22           HN       GLY  22  -0.443  -3.811  -0.728
  137    HA2  GLY  22           HA2      GLY  22  -1.505  -2.065  -2.055
  138    HA3  GLY  22           HA1      GLY  22  -3.036  -2.884  -1.774
  139    H    TYR  23           HN       TYR  23  -0.343  -1.799   0.272
  140    HA   TYR  23           HA       TYR  23  -2.311  -0.413   1.968
  141    HB2  TYR  23           HB2      TYR  23  -0.745  -2.483   2.791
  142    HB3  TYR  23           HB1      TYR  23   0.296  -1.118   3.181
  143    HD1  TYR  23           HD1      TYR  23  -1.430   0.938   4.191
  144    HD2  TYR  23           HD2      TYR  23  -1.758  -3.279   4.687
  145    HE1  TYR  23           HE1      TYR  23  -2.733   1.287   6.248
  146    HE2  TYR  23           HE2      TYR  23  -3.060  -2.938   6.745
  147    HH   TYR  23           HH       TYR  23  -3.385  -1.204   8.456
  148    H    CYS  24           HN       CYS  24  -2.037   1.640   2.383
  149    HA   CYS  24           HA       CYS  24   0.109   3.044   1.026
  150    HB2  CYS  24           HB2      CYS  24  -2.428   3.962   2.362
  151    HB3  CYS  24           HB1      CYS  24  -1.261   5.057   1.623
  152    H    GLY  25           HN       GLY  25   1.756   4.020   1.944
  153    HA2  GLY  25           HA2      GLY  25   1.706   4.932   4.663
  154    HA3  GLY  25           HA1      GLY  25   2.700   3.513   4.439
  155    H    SER  26           HN       SER  26   3.352   6.177   5.243
  156    HA   SER  26           HA       SER  26   5.621   6.680   3.462
  157    HB2  SER  26           HB2      SER  26   5.188   9.147   3.524
  158    HB3  SER  26           HB1      SER  26   3.905   8.281   2.689
  159    HG   SER  26           HG       SER  26   2.709   8.370   4.671
  160    H    THR  27           HN       THR  27   4.505   5.885   6.298
  161    HA   THR  27           HA       THR  27   6.709   6.900   7.847
  162    HB   THR  27           HB       THR  27   5.456   8.737   8.441
  163    HG1  THR  27           HG1      THR  27   4.023   7.720  10.394
  164   HG21  THR  27          HG21      THR  27   3.450   7.994   7.075
  165   HG22  THR  27          HG22      THR  27   3.089   8.948   8.511
  166   HG23  THR  27          HG23      THR  27   2.857   7.201   8.535
  167    HA   PRO  28           HA       PRO  28   4.581   3.257  10.142
  168    HB2  PRO  28           HB2      PRO  28   2.410   2.113   8.681
  169    HB3  PRO  28           HB1      PRO  28   2.293   3.204  10.073
  170    HG2  PRO  28           HG2      PRO  28   1.407   3.843   7.560
  171    HG3  PRO  28           HG1      PRO  28   1.899   5.032   8.779
  172    HD2  PRO  28           HD2      PRO  28   3.575   3.856   6.547
  173    HD3  PRO  28           HD1      PRO  28   3.343   5.571   6.982
  174    HA   PRO  29           HA       PRO  29   6.422  -0.475   8.347
  175    HB2  PRO  29           HB2      PRO  29   4.660  -2.531   8.920
  176    HB3  PRO  29           HB1      PRO  29   5.816  -1.847  10.078
  177    HG2  PRO  29           HG2      PRO  29   2.918  -1.230   9.727
  178    HG3  PRO  29           HG1      PRO  29   3.841  -1.505  11.221
  179    HD2  PRO  29           HD2      PRO  29   3.252   0.959  10.475
  180    HD3  PRO  29           HD1      PRO  29   4.857   0.584  11.134
  181    H    TYR  30           HN       TYR  30   5.275   0.947   6.399
  182    HA   TYR  30           HA       TYR  30   4.426  -1.072   4.448
  183    HB2  TYR  30           HB2      TYR  30   3.170   1.664   4.405
  184    HB3  TYR  30           HB1      TYR  30   2.663   0.224   3.546
  185    HD1  TYR  30           HD1      TYR  30   1.835   2.354   6.152
  186    HD2  TYR  30           HD2      TYR  30   2.016  -1.786   5.224
  187    HE1  TYR  30           HE1      TYR  30   0.213   1.884   7.946
  188    HE2  TYR  30           HE2      TYR  30   0.398  -2.273   7.013
  189    HH   TYR  30           HH       TYR  30  -0.396  -1.247   9.101
  190    H    CYS  31           HN       CYS  31   5.756   2.025   5.309
  191    HA   CYS  31           HA       CYS  31   7.560   1.895   3.064
  192    HB2  CYS  31           HB2      CYS  31   5.611   3.517   2.572
  193    HB3  CYS  31           HB1      CYS  31   6.434   4.574   3.717
  194    H    GLY  32           HN       GLY  32   7.514   1.511   5.989
  195    HA2  GLY  32           HA2      GLY  32  10.042   2.862   6.499
  196    HA3  GLY  32           HA1      GLY  32   8.735   3.114   7.655
  197    H    ALA  33           HN       ALA  33  10.105   0.402   5.841
  198    HA   ALA  33           HA       ALA  33  10.853  -1.657   6.371
  199    HB1  ALA  33           HB1      ALA  33  10.848  -0.769   9.265
  200    HB2  ALA  33           HB2      ALA  33  12.200  -0.592   8.145
  201    HB3  ALA  33           HB3      ALA  33  11.644  -2.200   8.610
  202    H    GLY  34           HN       GLY  34   9.131  -2.715   5.652
  203    HA2  GLY  34           HA2      GLY  34   7.592  -4.236   7.483
  204    HA3  GLY  34           HA1      GLY  34   6.612  -2.955   6.783
  205    H    GLN  35           HN       GLN  35   6.373  -2.871   4.491
  206    HA   GLN  35           HA       GLN  35   7.185  -5.123   2.880
  207    HB2  GLN  35           HB2      GLN  35   4.710  -5.501   2.159
  208    HB3  GLN  35           HB1      GLN  35   5.287  -6.258   3.633
  209    HG2  GLN  35           HG2      GLN  35   4.197  -4.573   4.976
  210    HG3  GLN  35           HG1      GLN  35   3.714  -3.687   3.532
  211   HE21  GLN  35          HE21      GLN  35   3.151  -6.483   5.512
  212   HE22  GLN  35          HE22      GLN  35   1.638  -6.932   4.810
  213    H    CYS  36           HN       CYS  36   8.229  -2.999   2.209
  214    HA   CYS  36           HA       CYS  36   6.596  -1.184   0.662
  215    HB2  CYS  36           HB2      CYS  36   8.821  -0.143   0.100
  216    HB3  CYS  36           HB1      CYS  36   8.439  -0.219   1.817
  217    H    GLN  37           HN       GLN  37   5.903  -1.604  -1.325
  218    HA   GLN  37           HA       GLN  37   7.495  -3.305  -3.104
  219    HB2  GLN  37           HB2      GLN  37   4.981  -3.678  -2.580
  220    HB3  GLN  37           HB1      GLN  37   4.710  -2.321  -3.664
  221    HG2  GLN  37           HG2      GLN  37   5.924  -3.553  -5.433
  222    HG3  GLN  37           HG1      GLN  37   6.033  -4.934  -4.343
  223   HE21  GLN  37          HE21      GLN  37   3.908  -2.951  -6.261
  224   HE22  GLN  37          HE22      GLN  37   2.571  -4.044  -6.275
  225    H    SER  38           HN       SER  38   5.743  -0.203  -3.066
  226    HA   SER  38           HA       SER  38   6.798   0.643  -5.600
  227    HB2  SER  38           HB2      SER  38   5.160   2.109  -3.527
  228    HB3  SER  38           HB1      SER  38   5.592   2.777  -5.101
  229    HG   SER  38           HG       SER  38   3.471   1.669  -4.871
  230    H    GLN  39           HN       GLN  39   7.181   1.770  -2.276
  231    HA   GLN  39           HA       GLN  39   9.918   2.600  -2.835
  232    HB2  GLN  39           HB2      GLN  39   7.719   4.479  -2.018
  233    HB3  GLN  39           HB1      GLN  39   9.380   4.794  -1.535
  234    HG2  GLN  39           HG2      GLN  39  10.043   4.747  -3.911
  235    HG3  GLN  39           HG1      GLN  39   8.350   4.528  -4.350
  236   HE21  GLN  39          HE21      GLN  39   6.921   6.241  -4.129
  237   HE22  GLN  39          HE22      GLN  39   7.457   7.868  -3.906
  238    H    CYS  40           HN       CYS  40  11.265   2.468  -1.109
  239    HA   CYS  40           HA       CYS  40  10.108   1.406   1.375
  240    HB2  CYS  40           HB2      CYS  40  12.913   1.150   0.269
  241    HB3  CYS  40           HB1      CYS  40  12.368   0.476   1.800
  Start of MODEL   11
    1    H1   PHE   1           HT1      PHE   1  -5.927  -2.358   1.215
    2    H2   PHE   1           HT2      PHE   1  -7.519  -2.931   1.209
    3    H3   PHE   1           HT3      PHE   1  -6.319  -3.775   2.053
    4    HA   PHE   1           HA       PHE   1  -7.727  -2.526   3.548
    5    HB2  PHE   1           HB2      PHE   1  -4.915  -1.428   3.334
    6    HB3  PHE   1           HB1      PHE   1  -5.937  -1.329   4.763
    7    HD1  PHE   1           HD1      PHE   1  -6.333  -3.270   6.144
    8    HD2  PHE   1           HD2      PHE   1  -3.866  -3.511   2.684
    9    HE1  PHE   1           HE1      PHE   1  -5.456  -5.432   6.927
   10    HE2  PHE   1           HE2      PHE   1  -2.982  -5.673   3.463
   11    HZ   PHE   1           HZ       PHE   1  -3.778  -6.636   5.585
   12    H    GLN   2           HN       GLN   2  -5.785  -0.349   1.577
   13    HA   GLN   2           HA       GLN   2  -8.006   1.519   1.294
   14    HB2  GLN   2           HB2      GLN   2  -5.347   2.271   2.521
   15    HB3  GLN   2           HB1      GLN   2  -6.452   3.454   1.840
   16    HG2  GLN   2           HG2      GLN   2  -8.167   2.730   3.458
   17    HG3  GLN   2           HG1      GLN   2  -6.991   1.628   4.171
   18   HE21  GLN   2          HE21      GLN   2  -5.268   2.463   5.350
   19   HE22  GLN   2          HE22      GLN   2  -5.260   4.086   5.941
   20    H    CYS   3           HN       CYS   3  -5.040   0.157   0.271
   21    HA   CYS   3           HA       CYS   3  -5.196   1.561  -2.308
   22    HB2  CYS   3           HB2      CYS   3  -3.403   2.633  -1.116
   23    HB3  CYS   3           HB1      CYS   3  -2.748   1.090  -0.591
   24    H    GLY   4           HN       GLY   4  -3.711   0.375  -3.959
   25    HA2  GLY   4           HA2      GLY   4  -3.238  -1.484  -5.202
   26    HA3  GLY   4           HA1      GLY   4  -2.946  -2.301  -3.683
   27    H    ARG   5           HN       ARG   5  -3.742  -4.204  -4.622
   28    HA   ARG   5           HA       ARG   5  -6.475  -4.364  -5.520
   29    HB2  ARG   5           HB2      ARG   5  -5.974  -6.825  -5.733
   30    HB3  ARG   5           HB1      ARG   5  -4.920  -5.772  -6.662
   31    HG2  ARG   5           HG2      ARG   5  -3.386  -5.962  -4.541
   32    HG3  ARG   5           HG1      ARG   5  -4.312  -7.445  -4.283
   33    HD2  ARG   5           HD2      ARG   5  -3.780  -8.118  -6.597
   34    HD3  ARG   5           HD1      ARG   5  -2.765  -6.685  -6.746
   35    HE   ARG   5           HE       ARG   5  -1.985  -8.219  -4.496
   36   HH11  ARG   5          HH11      ARG   5  -1.755  -8.236  -8.001
   37   HH12  ARG   5          HH12      ARG   5  -0.290  -9.160  -8.013
   38   HH21  ARG   5          HH21      ARG   5   0.663  -9.832  -6.054
   39   HH22  ARG   5          HH22      ARG   5  -0.067  -9.427  -4.538
   40    H    GLN   6           HN       GLN   6  -4.973  -4.498  -2.475
   41    HA   GLN   6           HA       GLN   6  -6.592  -6.418  -1.133
   42    HB2  GLN   6           HB2      GLN   6  -4.376  -5.006  -0.456
   43    HB3  GLN   6           HB1      GLN   6  -5.601  -4.090   0.408
   44    HG2  GLN   6           HG2      GLN   6  -5.198  -7.072   0.689
   45    HG3  GLN   6           HG1      GLN   6  -4.501  -5.867   1.767
   46   HE21  GLN   6          HE21      GLN   6  -7.377  -7.526   0.794
   47   HE22  GLN   6          HE22      GLN   6  -8.378  -6.997   2.099
   48    H    ALA   7           HN       ALA   7  -7.085  -3.260  -2.273
   49    HA   ALA   7           HA       ALA   7  -9.650  -2.995  -0.868
   50    HB1  ALA   7           HB1      ALA   7  -8.010  -1.390  -0.037
   51    HB2  ALA   7           HB2      ALA   7  -9.320  -0.579  -0.896
   52    HB3  ALA   7           HB3      ALA   7  -7.756  -0.802  -1.680
   53    H    GLY   8           HN       GLY   8  -7.807  -2.511  -3.796
   54    HA2  GLY   8           HA2      GLY   8  -9.406  -3.195  -5.762
   55    HA3  GLY   8           HA1      GLY   8 -10.178  -1.684  -5.306
   56    H    GLY   9           HN       GLY   9  -8.630   0.219  -5.174
   57    HA2  GLY   9           HA2      GLY   9  -6.203   0.308  -6.573
   58    HA3  GLY   9           HA1      GLY   9  -7.491   0.678  -7.709
   59    H    ALA  10           HN       ALA  10  -6.074   1.668  -4.600
   60    HA   ALA  10           HA       ALA  10  -6.704   4.459  -5.255
   61    HB1  ALA  10           HB1      ALA  10  -7.542   4.911  -3.008
   62    HB2  ALA  10           HB2      ALA  10  -7.333   3.214  -2.575
   63    HB3  ALA  10           HB3      ALA  10  -8.517   3.672  -3.799
   64    H    ARG  11           HN       ARG  11  -5.702   5.870  -3.286
   65    HA   ARG  11           HA       ARG  11  -3.058   4.845  -2.529
   66    HB2  ARG  11           HB2      ARG  11  -3.587   7.376  -4.091
   67    HB3  ARG  11           HB1      ARG  11  -2.109   7.133  -3.172
   68    HG2  ARG  11           HG2      ARG  11  -1.573   5.179  -4.524
   69    HG3  ARG  11           HG1      ARG  11  -3.072   5.384  -5.429
   70    HD2  ARG  11           HD2      ARG  11  -0.961   7.524  -5.267
   71    HD3  ARG  11           HD1      ARG  11  -0.954   6.275  -6.511
   72    HE   ARG  11           HE       ARG  11  -3.473   7.568  -6.417
   73   HH11  ARG  11          HH11      ARG  11  -0.183   8.103  -7.527
   74   HH12  ARG  11          HH12      ARG  11  -0.661   9.212  -8.770
   75   HH21  ARG  11          HH21      ARG  11  -4.074   9.021  -8.050
   76   HH22  ARG  11          HH22      ARG  11  -2.862   9.731  -9.064
   77    H    CYS  12           HN       CYS  12  -2.039   6.090  -0.779
   78    HA   CYS  12           HA       CYS  12  -4.030   6.947   1.123
   79    HB2  CYS  12           HB2      CYS  12  -1.108   6.407   1.277
   80    HB3  CYS  12           HB1      CYS  12  -1.867   7.346   2.555
   81    H    SER  13           HN       SER  13  -1.103   8.707   1.513
   82    HA   SER  13           HA       SER  13  -2.592  11.188   1.366
   83    HB2  SER  13           HB2      SER  13  -1.194  10.652   3.360
   84    HB3  SER  13           HB1      SER  13   0.242  10.720   2.339
   85    HG   SER  13           HG       SER  13  -1.085  12.732   3.512
   86    H    ASN  14           HN       ASN  14   0.810  11.274   0.755
   87    HA   ASN  14           HA       ASN  14   0.340  12.571  -1.824
   88    HB2  ASN  14           HB2      ASN  14   2.619  12.551   0.142
   89    HB3  ASN  14           HB1      ASN  14   2.835  13.162  -1.496
   90   HD21  ASN  14          HD21      ASN  14   1.307  13.666   1.578
   91   HD22  ASN  14          HD22      ASN  14   0.818  15.299   1.299
   92    H    GLY  15           HN       GLY  15   2.859  12.204  -2.990
   93    HA2  GLY  15           HA2      GLY  15   2.522   9.657  -4.234
   94    HA3  GLY  15           HA1      GLY  15   3.815  10.806  -4.545
   95    H    LEU  16           HN       LEU  16   2.695   8.578  -2.048
   96    HA   LEU  16           HA       LEU  16   5.417   8.084  -1.138
   97    HB2  LEU  16           HB2      LEU  16   4.057   6.628   0.592
   98    HB3  LEU  16           HB1      LEU  16   4.097   8.369   0.741
   99    HG   LEU  16           HG       LEU  16   1.865   8.184  -0.684
  100   HD11  LEU  16          HD11      LEU  16   2.140   5.674  -0.811
  101   HD12  LEU  16          HD12      LEU  16   0.564   6.298  -0.328
  102   HD13  LEU  16          HD13      LEU  16   1.669   5.659   0.890
  103   HD21  LEU  16          HD21      LEU  16   1.938   7.604   2.260
  104   HD22  LEU  16          HD22      LEU  16   0.605   8.322   1.359
  105   HD23  LEU  16          HD23      LEU  16   2.121   9.203   1.540
  106    H    CYS  17           HN       CYS  17   3.861   5.338  -0.337
  107    HA   CYS  17           HA       CYS  17   4.342   3.913  -2.844
  108    HB2  CYS  17           HB2      CYS  17   5.424   2.123  -1.059
  109    HB3  CYS  17           HB1      CYS  17   6.361   3.187  -2.098
  110    H    CYS  18           HN       CYS  18   3.719   1.498  -2.526
  111    HA   CYS  18           HA       CYS  18   1.461   1.221  -0.677
  112    HB2  CYS  18           HB2      CYS  18   0.632   2.055  -2.885
  113    HB3  CYS  18           HB1      CYS  18   1.238   0.577  -3.621
  114    H    SER  19           HN       SER  19   1.377  -0.655   0.293
  115    HA   SER  19           HA       SER  19   3.441  -2.562   0.047
  116    HB2  SER  19           HB2      SER  19   0.842  -2.650   1.575
  117    HB3  SER  19           HB1      SER  19   2.133  -3.836   1.744
  118    HG   SER  19           HG       SER  19   3.452  -2.285   2.584
  119    H    GLN  20           HN       GLN  20   3.365  -4.757  -0.316
  120    HA   GLN  20           HA       GLN  20   2.681  -5.743  -2.688
  121    HB2  GLN  20           HB2      GLN  20   2.947  -7.126  -0.057
  122    HB3  GLN  20           HB1      GLN  20   2.639  -8.044  -1.524
  123    HG2  GLN  20           HG2      GLN  20   4.679  -7.137  -2.517
  124    HG3  GLN  20           HG1      GLN  20   4.983  -6.217  -1.045
  125   HE21  GLN  20          HE21      GLN  20   4.956  -9.366  -2.509
  126   HE22  GLN  20          HE22      GLN  20   5.831 -10.180  -1.261
  127    H    PHE  21           HN       PHE  21   0.500  -5.936   0.061
  128    HA   PHE  21           HA       PHE  21  -1.526  -7.301  -1.499
  129    HB2  PHE  21           HB2      PHE  21  -1.492  -6.279   1.339
  130    HB3  PHE  21           HB1      PHE  21  -2.908  -7.018   0.604
  131    HD1  PHE  21           HD1      PHE  21  -2.980  -9.368   0.123
  132    HD2  PHE  21           HD2      PHE  21   0.439  -7.580   1.906
  133    HE1  PHE  21           HE1      PHE  21  -2.151 -11.605   0.757
  134    HE2  PHE  21           HE2      PHE  21   1.283  -9.808   2.546
  135    HZ   PHE  21           HZ       PHE  21  -0.015 -11.824   1.969
  136    H    GLY  22           HN       GLY  22  -1.002  -4.175  -0.055
  137    HA2  GLY  22           HA2      GLY  22  -1.850  -2.380  -1.709
  138    HA3  GLY  22           HA1      GLY  22  -3.411  -3.096  -1.326
  139    H    TYR  23           HN       TYR  23  -0.555  -2.260   0.613
  140    HA   TYR  23           HA       TYR  23  -2.308  -0.601   2.303
  141    HB2  TYR  23           HB2      TYR  23  -1.031  -2.831   3.180
  142    HB3  TYR  23           HB1      TYR  23   0.199  -1.618   3.510
  143    HD1  TYR  23           HD1      TYR  23  -1.838  -3.422   5.274
  144    HD2  TYR  23           HD2      TYR  23  -1.472   0.711   4.320
  145    HE1  TYR  23           HE1      TYR  23  -3.026  -2.842   7.349
  146    HE2  TYR  23           HE2      TYR  23  -2.661   1.300   6.393
  147    HH   TYR  23           HH       TYR  23  -3.232  -0.933   8.882
  148    H    CYS  24           HN       CYS  24  -1.961   1.413   1.783
  149    HA   CYS  24           HA       CYS  24   0.698   2.325   1.013
  150    HB2  CYS  24           HB2      CYS  24  -0.551   4.460   0.456
  151    HB3  CYS  24           HB1      CYS  24  -1.053   3.046  -0.459
  152    H    GLY  25           HN       GLY  25   1.745   4.060   1.959
  153    HA2  GLY  25           HA2      GLY  25   0.785   5.429   4.265
  154    HA3  GLY  25           HA1      GLY  25   1.885   4.134   4.719
  155    H    SER  26           HN       SER  26   2.984   6.161   5.560
  156    HA   SER  26           HA       SER  26   5.142   6.848   3.736
  157    HB2  SER  26           HB2      SER  26   4.887   9.343   4.276
  158    HB3  SER  26           HB1      SER  26   3.703   8.683   3.152
  159    HG   SER  26           HG       SER  26   2.228   9.285   4.504
  160    H    THR  27           HN       THR  27   4.100   5.923   6.646
  161    HA   THR  27           HA       THR  27   6.530   6.755   8.037
  162    HB   THR  27           HB       THR  27   5.253   7.253  10.115
  163    HG1  THR  27           HG1      THR  27   3.276   6.138   9.130
  164   HG21  THR  27          HG21      THR  27   6.029   9.088   8.718
  165   HG22  THR  27          HG22      THR  27   4.470   9.477   9.446
  166   HG23  THR  27          HG23      THR  27   4.556   8.992   7.753
  167    HA   PRO  28           HA       PRO  28   4.674   2.875  10.142
  168    HB2  PRO  28           HB2      PRO  28   2.461   1.787   8.663
  169    HB3  PRO  28           HB1      PRO  28   2.404   2.621  10.225
  170    HG2  PRO  28           HG2      PRO  28   1.262   3.603   7.956
  171    HG3  PRO  28           HG1      PRO  28   1.836   4.617   9.296
  172    HD2  PRO  28           HD2      PRO  28   3.286   3.901   6.742
  173    HD3  PRO  28           HD1      PRO  28   3.064   5.503   7.490
  174    HA   PRO  29           HA       PRO  29   6.610  -0.500   7.904
  175    HB2  PRO  29           HB2      PRO  29   4.994  -2.699   8.431
  176    HB3  PRO  29           HB1      PRO  29   6.216  -2.052   9.540
  177    HG2  PRO  29           HG2      PRO  29   3.272  -1.599   9.510
  178    HG3  PRO  29           HG1      PRO  29   4.359  -1.887  10.886
  179    HD2  PRO  29           HD2      PRO  29   3.511   0.574  10.321
  180    HD3  PRO  29           HD1      PRO  29   5.177   0.290  10.864
  181    H    TYR  30           HN       TYR  30   5.135   1.032   6.223
  182    HA   TYR  30           HA       TYR  30   4.316  -0.851   4.127
  183    HB2  TYR  30           HB2      TYR  30   2.824   1.748   4.424
  184    HB3  TYR  30           HB1      TYR  30   2.357   0.308   3.536
  185    HD1  TYR  30           HD1      TYR  30   2.129  -1.837   5.229
  186    HD2  TYR  30           HD2      TYR  30   1.522   2.248   6.236
  187    HE1  TYR  30           HE1      TYR  30   0.710  -2.529   7.115
  188    HE2  TYR  30           HE2      TYR  30   0.101   1.568   8.132
  189    HH   TYR  30           HH       TYR  30  -0.048  -1.623   9.273
  190    H    CYS  31           HN       CYS  31   5.534   2.195   5.233
  191    HA   CYS  31           HA       CYS  31   7.005   2.574   2.777
  192    HB2  CYS  31           HB2      CYS  31   5.021   4.542   3.839
  193    HB3  CYS  31           HB1      CYS  31   6.436   5.103   2.949
  194    H    GLY  32           HN       GLY  32   8.711   1.883   4.015
  195    HA2  GLY  32           HA2      GLY  32  10.585   3.567   4.893
  196    HA3  GLY  32           HA1      GLY  32   9.577   3.413   6.329
  197    H    ALA  33           HN       ALA  33   8.928   1.024   6.729
  198    HA   ALA  33           HA       ALA  33  10.851  -0.995   6.041
  199    HB1  ALA  33           HB1      ALA  33  12.097   0.161   7.825
  200    HB2  ALA  33           HB2      ALA  33  11.634  -1.468   8.315
  201    HB3  ALA  33           HB3      ALA  33  10.740  -0.076   8.925
  202    H    GLY  34           HN       GLY  34   9.356  -2.417   5.447
  203    HA2  GLY  34           HA2      GLY  34   7.902  -3.932   7.279
  204    HA3  GLY  34           HA1      GLY  34   6.809  -2.714   6.640
  205    H    GLN  35           HN       GLN  35   5.898  -3.001   4.715
  206    HA   GLN  35           HA       GLN  35   6.869  -5.161   2.973
  207    HB2  GLN  35           HB2      GLN  35   4.379  -5.622   2.488
  208    HB3  GLN  35           HB1      GLN  35   5.067  -6.249   3.976
  209    HG2  GLN  35           HG2      GLN  35   4.083  -4.313   5.183
  210    HG3  GLN  35           HG1      GLN  35   3.304  -3.821   3.682
  211   HE21  GLN  35          HE21      GLN  35   1.617  -5.073   2.854
  212   HE22  GLN  35          HE22      GLN  35   0.774  -6.228   3.822
  213    H    CYS  36           HN       CYS  36   7.639  -2.664   2.501
  214    HA   CYS  36           HA       CYS  36   5.855  -1.241   0.739
  215    HB2  CYS  36           HB2      CYS  36   7.505  -0.082   2.176
  216    HB3  CYS  36           HB1      CYS  36   8.806  -0.818   1.249
  217    H    GLN  37           HN       GLN  37   5.476  -1.781  -1.289
  218    HA   GLN  37           HA       GLN  37   7.468  -3.305  -2.806
  219    HB2  GLN  37           HB2      GLN  37   5.065  -4.120  -2.416
  220    HB3  GLN  37           HB1      GLN  37   4.587  -2.877  -3.560
  221    HG2  GLN  37           HG2      GLN  37   6.046  -3.915  -5.249
  222    HG3  GLN  37           HG1      GLN  37   6.420  -5.198  -4.100
  223   HE21  GLN  37          HE21      GLN  37   3.988  -3.800  -6.154
  224   HE22  GLN  37          HE22      GLN  37   2.898  -5.140  -6.119
  225    H    SER  38           HN       SER  38   5.234  -0.549  -3.127
  226    HA   SER  38           HA       SER  38   6.222   0.212  -5.714
  227    HB2  SER  38           HB2      SER  38   3.848   0.527  -4.833
  228    HB3  SER  38           HB1      SER  38   4.482   1.882  -3.903
  229    HG   SER  38           HG       SER  38   4.188   2.986  -5.656
  230    H    GLN  39           HN       GLN  39   6.323   2.951  -5.631
  231    HA   GLN  39           HA       GLN  39   8.970   3.556  -5.148
  232    HB2  GLN  39           HB2      GLN  39   6.499   5.179  -5.555
  233    HB3  GLN  39           HB1      GLN  39   8.005   5.995  -5.158
  234    HG2  GLN  39           HG2      GLN  39   9.068   4.959  -7.111
  235    HG3  GLN  39           HG1      GLN  39   7.543   4.170  -7.509
  236   HE21  GLN  39          HE21      GLN  39   5.839   5.397  -8.309
  237   HE22  GLN  39          HE22      GLN  39   6.068   6.992  -8.932
  238    H    CYS  40           HN       CYS  40   9.850   3.197  -3.180
  239    HA   CYS  40           HA       CYS  40   8.621   4.368  -0.797
  240    HB2  CYS  40           HB2      CYS  40  10.087   1.991  -1.287
  241    HB3  CYS  40           HB1      CYS  40  11.070   2.990  -0.222
  Start of MODEL   12
    1    H1   PHE   1           HT1      PHE   1  -6.738   0.596   5.608
    2    H2   PHE   1           HT2      PHE   1  -6.576  -1.087   5.602
    3    H3   PHE   1           HT3      PHE   1  -7.974  -0.371   4.977
    4    HA   PHE   1           HA       PHE   1  -5.244  -0.082   3.866
    5    HB2  PHE   1           HB2      PHE   1  -7.629  -1.677   2.899
    6    HB3  PHE   1           HB1      PHE   1  -6.173  -1.397   1.951
    7    HD1  PHE   1           HD1      PHE   1  -7.624  -3.186   4.784
    8    HD2  PHE   1           HD2      PHE   1  -4.095  -2.522   2.500
    9    HE1  PHE   1           HE1      PHE   1  -6.594  -5.173   5.806
   10    HE2  PHE   1           HE2      PHE   1  -3.060  -4.509   3.516
   11    HZ   PHE   1           HZ       PHE   1  -4.309  -5.838   5.171
   12    H    GLN   2           HN       GLN   2  -5.101   1.137   1.953
   13    HA   GLN   2           HA       GLN   2  -7.429   2.740   1.185
   14    HB2  GLN   2           HB2      GLN   2  -4.788   3.855   2.129
   15    HB3  GLN   2           HB1      GLN   2  -5.901   4.789   1.141
   16    HG2  GLN   2           HG2      GLN   2  -6.783   3.547   3.722
   17    HG3  GLN   2           HG1      GLN   2  -5.959   5.103   3.686
   18   HE21  GLN   2          HE21      GLN   2  -6.992   6.882   2.776
   19   HE22  GLN   2          HE22      GLN   2  -8.694   6.904   2.478
   20    H    CYS   3           HN       CYS   3  -4.762   0.926   0.293
   21    HA   CYS   3           HA       CYS   3  -4.183   2.263  -2.209
   22    HB2  CYS   3           HB2      CYS   3  -2.451   1.059  -0.866
   23    HB3  CYS   3           HB1      CYS   3  -3.266  -0.450  -1.251
   24    H    GLY   4           HN       GLY   4  -4.083   0.725  -4.230
   25    HA2  GLY   4           HA2      GLY   4  -6.821  -0.200  -4.616
   26    HA3  GLY   4           HA1      GLY   4  -5.666   0.165  -5.878
   27    H    ARG   5           HN       ARG   5  -4.506  -1.923  -3.344
   28    HA   ARG   5           HA       ARG   5  -4.784  -4.139  -5.240
   29    HB2  ARG   5           HB2      ARG   5  -2.903  -4.198  -2.884
   30    HB3  ARG   5           HB1      ARG   5  -2.877  -5.214  -4.309
   31    HG2  ARG   5           HG2      ARG   5  -2.557  -2.425  -4.998
   32    HG3  ARG   5           HG1      ARG   5  -1.332  -2.963  -3.846
   33    HD2  ARG   5           HD2      ARG   5  -0.725  -4.802  -5.293
   34    HD3  ARG   5           HD1      ARG   5  -2.013  -4.379  -6.421
   35    HE   ARG   5           HE       ARG   5  -0.418  -2.132  -6.179
   36   HH11  ARG   5          HH11      ARG   5   0.015  -5.430  -7.310
   37   HH12  ARG   5          HH12      ARG   5   1.257  -5.001  -8.437
   38   HH21  ARG   5          HH21      ARG   5   1.934  -2.832  -8.635
   39   HH22  ARG   5          HH22      ARG   5   1.211  -1.595  -7.663
   40    H    GLN   6           HN       GLN   6  -5.137  -3.337  -1.842
   41    HA   GLN   6           HA       GLN   6  -6.346  -5.898  -1.199
   42    HB2  GLN   6           HB2      GLN   6  -4.992  -3.982   0.283
   43    HB3  GLN   6           HB1      GLN   6  -6.661  -3.775   0.788
   44    HG2  GLN   6           HG2      GLN   6  -5.319  -6.472   0.760
   45    HG3  GLN   6           HG1      GLN   6  -5.219  -5.384   2.143
   46   HE21  GLN   6          HE21      GLN   6  -7.287  -7.429   0.243
   47   HE22  GLN   6          HE22      GLN   6  -8.606  -7.479   1.357
   48    H    ALA   7           HN       ALA   7  -7.255  -2.739  -2.167
   49    HA   ALA   7           HA       ALA   7 -10.068  -3.086  -1.479
   50    HB1  ALA   7           HB1      ALA   7 -10.311  -0.740  -2.110
   51    HB2  ALA   7           HB2      ALA   7  -8.626  -0.702  -2.630
   52    HB3  ALA   7           HB3      ALA   7  -9.018  -0.946  -0.928
   53    H    GLY   8           HN       GLY   8  -7.897  -2.868  -4.211
   54    HA2  GLY   8           HA2      GLY   8  -8.509  -4.218  -6.174
   55    HA3  GLY   8           HA1      GLY   8 -10.136  -3.588  -5.998
   56    H    GLY   9           HN       GLY   9  -8.749  -0.874  -5.359
   57    HA2  GLY   9           HA2      GLY   9  -7.393   0.000  -7.637
   58    HA3  GLY   9           HA1      GLY   9  -9.102   0.223  -7.950
   59    H    ALA  10           HN       ALA  10  -8.238   0.607  -4.647
   60    HA   ALA  10           HA       ALA  10  -9.014   3.335  -4.585
   61    HB1  ALA  10           HB1      ALA  10  -9.355   1.792  -2.713
   62    HB2  ALA  10           HB2      ALA  10  -8.465   3.230  -2.214
   63    HB3  ALA  10           HB3      ALA  10  -7.611   1.708  -2.466
   64    H    ARG  11           HN       ARG  11  -7.391   4.810  -3.044
   65    HA   ARG  11           HA       ARG  11  -4.702   4.773  -4.204
   66    HB2  ARG  11           HB2      ARG  11  -4.814   7.240  -4.660
   67    HB3  ARG  11           HB1      ARG  11  -5.875   6.292  -5.687
   68    HG2  ARG  11           HG2      ARG  11  -7.779   6.921  -4.241
   69    HG3  ARG  11           HG1      ARG  11  -6.689   7.929  -3.290
   70    HD2  ARG  11           HD2      ARG  11  -7.757   9.388  -4.805
   71    HD3  ARG  11           HD1      ARG  11  -6.134   9.134  -5.444
   72    HE   ARG  11           HE       ARG  11  -7.911   7.269  -6.593
   73   HH11  ARG  11          HH11      ARG  11  -7.156  10.696  -6.743
   74   HH12  ARG  11          HH12      ARG  11  -7.713  10.864  -8.374
   75   HH21  ARG  11          HH21      ARG  11  -8.634   7.513  -8.728
   76   HH22  ARG  11          HH22      ARG  11  -8.549   9.063  -9.496
   77    H    CYS  12           HN       CYS  12  -3.122   5.926  -3.044
   78    HA   CYS  12           HA       CYS  12  -3.458   5.806  -0.223
   79    HB2  CYS  12           HB2      CYS  12  -1.145   6.777  -1.901
   80    HB3  CYS  12           HB1      CYS  12  -1.076   6.460  -0.172
   81    H    SER  13           HN       SER  13  -2.219   7.646   1.094
   82    HA   SER  13           HA       SER  13  -3.952   9.845   1.270
   83    HB2  SER  13           HB2      SER  13  -2.408   8.851   3.104
   84    HB3  SER  13           HB1      SER  13  -1.147   9.864   2.403
   85    HG   SER  13           HG       SER  13  -1.979  11.261   3.759
   86    H    ASN  14           HN       ASN  14  -0.640   9.673   0.127
   87    HA   ASN  14           HA       ASN  14  -1.082  11.910  -1.708
   88    HB2  ASN  14           HB2      ASN  14   1.159  11.738   0.328
   89    HB3  ASN  14           HB1      ASN  14   1.211  12.808  -1.069
   90   HD21  ASN  14          HD21      ASN  14  -0.163  14.584  -1.152
   91   HD22  ASN  14          HD22      ASN  14  -0.974  15.183   0.251
   92    H    GLY  15           HN       GLY  15   1.492  12.055  -2.776
   93    HA2  GLY  15           HA2      GLY  15   1.584   9.622  -4.317
   94    HA3  GLY  15           HA1      GLY  15   2.632  11.021  -4.509
   95    H    LEU  16           HN       LEU  16   1.965   8.598  -2.002
   96    HA   LEU  16           HA       LEU  16   4.805   8.488  -1.349
   97    HB2  LEU  16           HB2      LEU  16   3.882   7.076   0.635
   98    HB3  LEU  16           HB1      LEU  16   3.681   8.814   0.631
   99    HG   LEU  16           HG       LEU  16   1.328   8.057  -0.486
  100   HD11  LEU  16          HD11      LEU  16   1.292   5.787  -0.308
  101   HD12  LEU  16          HD12      LEU  16   0.596   6.240   1.249
  102   HD13  LEU  16          HD13      LEU  16   2.288   5.772   1.146
  103   HD21  LEU  16          HD21      LEU  16   2.038   8.385   2.409
  104   HD22  LEU  16          HD22      LEU  16   0.389   8.356   1.792
  105   HD23  LEU  16          HD23      LEU  16   1.498   9.629   1.283
  106    H    CYS  17           HN       CYS  17   3.356   5.658  -0.291
  107    HA   CYS  17           HA       CYS  17   4.156   4.102  -2.644
  108    HB2  CYS  17           HB2      CYS  17   5.072   2.853  -0.178
  109    HB3  CYS  17           HB1      CYS  17   5.969   3.182  -1.655
  110    H    CYS  18           HN       CYS  18   3.669   1.666  -2.194
  111    HA   CYS  18           HA       CYS  18   1.298   1.309  -0.519
  112    HB2  CYS  18           HB2      CYS  18   0.320   1.833  -2.633
  113    HB3  CYS  18           HB1      CYS  18   1.442   0.786  -3.490
  114    H    SER  19           HN       SER  19   1.044  -0.711   0.323
  115    HA   SER  19           HA       SER  19   3.339  -2.456   0.259
  116    HB2  SER  19           HB2      SER  19   0.728  -2.624   1.770
  117    HB3  SER  19           HB1      SER  19   2.055  -3.768   1.958
  118    HG   SER  19           HG       SER  19   2.487  -2.322   3.487
  119    H    GLN  20           HN       GLN  20   3.247  -4.717  -0.080
  120    HA   GLN  20           HA       GLN  20   2.515  -5.591  -2.513
  121    HB2  GLN  20           HB2      GLN  20   2.844  -7.165   0.016
  122    HB3  GLN  20           HB1      GLN  20   2.623  -7.936  -1.547
  123    HG2  GLN  20           HG2      GLN  20   4.648  -6.872  -2.377
  124    HG3  GLN  20           HG1      GLN  20   4.862  -6.054  -0.830
  125   HE21  GLN  20          HE21      GLN  20   5.029  -9.079  -2.527
  126   HE22  GLN  20          HE22      GLN  20   5.909  -9.944  -1.317
  127    H    PHE  21           HN       PHE  21   0.438  -5.761   0.295
  128    HA   PHE  21           HA       PHE  21  -1.622  -7.205  -1.176
  129    HB2  PHE  21           HB2      PHE  21  -1.303  -6.363   1.682
  130    HB3  PHE  21           HB1      PHE  21  -2.866  -6.897   1.068
  131    HD1  PHE  21           HD1      PHE  21  -3.230  -9.161   0.397
  132    HD2  PHE  21           HD2      PHE  21   0.528  -7.869   1.897
  133    HE1  PHE  21           HE1      PHE  21  -2.568 -11.520   0.742
  134    HE2  PHE  21           HE2      PHE  21   1.209 -10.221   2.249
  135    HZ   PHE  21           HZ       PHE  21  -0.344 -12.047   1.668
  136    H    GLY  22           HN       GLY  22  -0.856  -4.014  -0.203
  137    HA2  GLY  22           HA2      GLY  22  -1.990  -2.271  -1.544
  138    HA3  GLY  22           HA1      GLY  22  -3.496  -3.074  -1.119
  139    H    TYR  23           HN       TYR  23  -0.626  -2.147   0.761
  140    HA   TYR  23           HA       TYR  23  -2.421  -0.606   2.518
  141    HB2  TYR  23           HB2      TYR  23  -1.013  -2.795   3.327
  142    HB3  TYR  23           HB1      TYR  23   0.135  -1.515   3.692
  143    HD1  TYR  23           HD1      TYR  23  -1.755   0.672   4.520
  144    HD2  TYR  23           HD2      TYR  23  -1.708  -3.486   5.436
  145    HE1  TYR  23           HE1      TYR  23  -2.977   1.123   6.608
  146    HE2  TYR  23           HE2      TYR  23  -2.931  -3.044   7.524
  147    HH   TYR  23           HH       TYR  23  -3.310  -1.180   9.078
  148    H    CYS  24           HN       CYS  24  -2.154   1.430   2.244
  149    HA   CYS  24           HA       CYS  24   0.148   2.588   1.017
  150    HB2  CYS  24           HB2      CYS  24  -2.352   3.746   2.215
  151    HB3  CYS  24           HB1      CYS  24  -1.110   4.720   1.434
  152    H    GLY  25           HN       GLY  25   1.597   4.044   1.819
  153    HA2  GLY  25           HA2      GLY  25   1.610   5.118   4.404
  154    HA3  GLY  25           HA1      GLY  25   2.537   3.633   4.429
  155    H    SER  26           HN       SER  26   3.606   5.992   5.075
  156    HA   SER  26           HA       SER  26   5.780   6.298   3.143
  157    HB2  SER  26           HB2      SER  26   5.649   8.825   3.379
  158    HB3  SER  26           HB1      SER  26   4.330   8.124   2.457
  159    HG   SER  26           HG       SER  26   4.309   9.276   4.996
  160    H    THR  27           HN       THR  27   4.774   5.567   6.055
  161    HA   THR  27           HA       THR  27   7.161   6.393   7.451
  162    HB   THR  27           HB       THR  27   6.125   8.283   8.203
  163    HG1  THR  27           HG1      THR  27   4.592   6.865  10.029
  164   HG21  THR  27          HG21      THR  27   4.010   7.649   6.830
  165   HG22  THR  27          HG22      THR  27   3.848   8.789   8.164
  166   HG23  THR  27          HG23      THR  27   3.364   7.108   8.381
  167    HA   PRO  28           HA       PRO  28   4.962   2.963   9.989
  168    HB2  PRO  28           HB2      PRO  28   2.601   1.954   8.699
  169    HB3  PRO  28           HB1      PRO  28   2.678   3.001  10.125
  170    HG2  PRO  28           HG2      PRO  28   1.596   3.792   7.755
  171    HG3  PRO  28           HG1      PRO  28   2.334   4.906   8.922
  172    HD2  PRO  28           HD2      PRO  28   3.623   3.626   6.502
  173    HD3  PRO  28           HD1      PRO  28   3.583   5.350   6.960
  174    HA   PRO  29           HA       PRO  29   6.357  -0.901   8.065
  175    HB2  PRO  29           HB2      PRO  29   3.999  -2.465   8.970
  176    HB3  PRO  29           HB1      PRO  29   5.716  -2.694   9.351
  177    HG2  PRO  29           HG2      PRO  29   4.071  -1.776  11.185
  178    HG3  PRO  29           HG1      PRO  29   5.704  -1.094  11.014
  179    HD2  PRO  29           HD2      PRO  29   3.099   0.006  10.023
  180    HD3  PRO  29           HD1      PRO  29   4.416   0.838  10.877
  181    H    TYR  30           HN       TYR  30   5.124   0.634   6.246
  182    HA   TYR  30           HA       TYR  30   3.969  -1.290   4.355
  183    HB2  TYR  30           HB2      TYR  30   2.903   1.525   4.427
  184    HB3  TYR  30           HB1      TYR  30   2.197   0.110   3.673
  185    HD1  TYR  30           HD1      TYR  30   1.789  -1.831   5.655
  186    HD2  TYR  30           HD2      TYR  30   1.600   2.391   6.108
  187    HE1  TYR  30           HE1      TYR  30   0.317  -2.120   7.603
  188    HE2  TYR  30           HE2      TYR  30   0.128   2.112   8.066
  189    HH   TYR  30           HH       TYR  30  -0.332  -0.864   9.616
  190    H    CYS  31           HN       CYS  31   5.555   1.726   5.096
  191    HA   CYS  31           HA       CYS  31   7.261   1.494   2.807
  192    HB2  CYS  31           HB2      CYS  31   5.327   2.882   1.978
  193    HB3  CYS  31           HB1      CYS  31   5.804   4.102   3.153
  194    H    GLY  32           HN       GLY  32   8.825   1.124   4.215
  195    HA2  GLY  32           HA2      GLY  32  10.559   3.016   5.056
  196    HA3  GLY  32           HA1      GLY  32   9.440   2.891   6.413
  197    H    ALA  33           HN       ALA  33   8.829   0.399   6.694
  198    HA   ALA  33           HA       ALA  33  10.810  -1.571   6.315
  199    HB1  ALA  33           HB1      ALA  33  10.689  -0.456   9.133
  200    HB2  ALA  33           HB2      ALA  33  12.050  -0.292   8.024
  201    HB3  ALA  33           HB3      ALA  33  11.587  -1.886   8.621
  202    H    GLY  34           HN       GLY  34   9.007  -2.660   5.616
  203    HA2  GLY  34           HA2      GLY  34   7.712  -4.341   7.434
  204    HA3  GLY  34           HA1      GLY  34   6.621  -3.010   7.076
  205    H    GLN  35           HN       GLN  35   5.933  -2.684   4.903
  206    HA   GLN  35           HA       GLN  35   6.318  -4.970   3.097
  207    HB2  GLN  35           HB2      GLN  35   3.623  -3.717   3.702
  208    HB3  GLN  35           HB1      GLN  35   3.925  -5.020   2.563
  209    HG2  GLN  35           HG2      GLN  35   4.715  -6.405   4.494
  210    HG3  GLN  35           HG1      GLN  35   4.159  -5.116   5.560
  211   HE21  GLN  35          HE21      GLN  35   3.205  -7.641   3.370
  212   HE22  GLN  35          HE22      GLN  35   1.535  -7.670   3.809
  213    H    CYS  36           HN       CYS  36   7.836  -3.079   2.452
  214    HA   CYS  36           HA       CYS  36   6.540  -1.001   0.882
  215    HB2  CYS  36           HB2      CYS  36   8.463  -0.440   2.267
  216    HB3  CYS  36           HB1      CYS  36   9.452  -1.611   1.406
  217    H    GLN  37           HN       GLN  37   5.655  -1.812  -0.999
  218    HA   GLN  37           HA       GLN  37   7.329  -3.477  -2.728
  219    HB2  GLN  37           HB2      GLN  37   4.875  -3.996  -2.144
  220    HB3  GLN  37           HB1      GLN  37   4.472  -2.696  -3.254
  221    HG2  GLN  37           HG2      GLN  37   5.973  -4.004  -4.919
  222    HG3  GLN  37           HG1      GLN  37   5.694  -5.358  -3.827
  223   HE21  GLN  37          HE21      GLN  37   3.679  -6.294  -3.732
  224   HE22  GLN  37          HE22      GLN  37   2.416  -5.926  -4.850
  225    H    SER  38           HN       SER  38   5.340  -0.517  -2.924
  226    HA   SER  38           HA       SER  38   6.181   0.175  -5.553
  227    HB2  SER  38           HB2      SER  38   4.773   1.836  -3.453
  228    HB3  SER  38           HB1      SER  38   4.959   2.293  -5.144
  229    HG   SER  38           HG       SER  38   3.428   0.210  -4.025
  230    H    GLN  39           HN       GLN  39   6.368   2.839  -3.380
  231    HA   GLN  39           HA       GLN  39   9.167   3.257  -4.120
  232    HB2  GLN  39           HB2      GLN  39   6.989   5.066  -3.101
  233    HB3  GLN  39           HB1      GLN  39   8.672   5.573  -3.091
  234    HG2  GLN  39           HG2      GLN  39   8.783   5.249  -5.512
  235    HG3  GLN  39           HG1      GLN  39   7.093   4.744  -5.517
  236   HE21  GLN  39          HE21      GLN  39   9.294   7.408  -5.166
  237   HE22  GLN  39          HE22      GLN  39   8.118   8.665  -5.308
  238    H    CYS  40           HN       CYS  40  10.741   3.921  -2.577
  239    HA   CYS  40           HA       CYS  40  10.138   3.487   0.246
  240    HB2  CYS  40           HB2      CYS  40  11.507   1.559  -1.364
  241    HB3  CYS  40           HB1      CYS  40  12.652   2.239  -0.213
  Start of MODEL   13
    1    H1   PHE   1           HT1      PHE   1  -5.752  -1.527   1.061
    2    H2   PHE   1           HT2      PHE   1  -7.368  -2.002   0.918
    3    H3   PHE   1           HT3      PHE   1  -6.292  -2.937   1.828
    4    HA   PHE   1           HA       PHE   1  -7.735  -1.637   3.248
    5    HB2  PHE   1           HB2      PHE   1  -4.866  -0.679   3.288
    6    HB3  PHE   1           HB1      PHE   1  -5.989  -0.605   4.639
    7    HD1  PHE   1           HD1      PHE   1  -6.508  -2.561   5.929
    8    HD2  PHE   1           HD2      PHE   1  -3.897  -2.798   2.576
    9    HE1  PHE   1           HE1      PHE   1  -5.765  -4.785   6.672
   10    HE2  PHE   1           HE2      PHE   1  -3.146  -5.022   3.317
   11    HZ   PHE   1           HZ       PHE   1  -4.082  -6.019   5.365
   12    H    GLN   2           HN       GLN   2  -5.511   0.467   1.506
   13    HA   GLN   2           HA       GLN   2  -7.593   2.488   1.150
   14    HB2  GLN   2           HB2      GLN   2  -4.951   2.976   2.530
   15    HB3  GLN   2           HB1      GLN   2  -5.872   4.275   1.785
   16    HG2  GLN   2           HG2      GLN   2  -7.755   3.788   3.264
   17    HG3  GLN   2           HG1      GLN   2  -6.829   2.488   4.012
   18   HE21  GLN   2          HE21      GLN   2  -7.196   5.925   3.674
   19   HE22  GLN   2          HE22      GLN   2  -6.174   6.370   4.994
   20    H    CYS   3           HN       CYS   3  -5.069   0.680  -0.013
   21    HA   CYS   3           HA       CYS   3  -4.295   2.533  -2.143
   22    HB2  CYS   3           HB2      CYS   3  -2.524   1.344  -0.897
   23    HB3  CYS   3           HB1      CYS   3  -3.212  -0.196  -1.393
   24    H    GLY   4           HN       GLY   4  -3.996   1.432  -4.356
   25    HA2  GLY   4           HA2      GLY   4  -6.448   0.698  -5.454
   26    HA3  GLY   4           HA1      GLY   4  -4.894   0.464  -6.232
   27    H    ARG   5           HN       ARG   5  -3.918  -1.332  -4.127
   28    HA   ARG   5           HA       ARG   5  -5.357  -3.746  -4.947
   29    HB2  ARG   5           HB2      ARG   5  -2.599  -3.110  -4.647
   30    HB3  ARG   5           HB1      ARG   5  -2.984  -4.331  -3.442
   31    HG2  ARG   5           HG2      ARG   5  -3.888  -5.775  -5.195
   32    HG3  ARG   5           HG1      ARG   5  -3.487  -4.552  -6.402
   33    HD2  ARG   5           HD2      ARG   5  -1.121  -4.750  -5.820
   34    HD3  ARG   5           HD1      ARG   5  -1.519  -5.962  -4.602
   35    HE   ARG   5           HE       ARG   5  -2.510  -6.761  -7.124
   36   HH11  ARG   5          HH11      ARG   5   0.529  -6.486  -5.384
   37   HH12  ARG   5          HH12      ARG   5   1.294  -7.749  -6.290
   38   HH21  ARG   5          HH21      ARG   5   0.152  -8.836  -7.937
   39   HH22  ARG   5          HH22      ARG   5  -1.488  -8.410  -8.296
   40    H    GLN   6           HN       GLN   6  -5.560  -5.503  -3.246
   41    HA   GLN   6           HA       GLN   6  -6.374  -6.317  -1.292
   42    HB2  GLN   6           HB2      GLN   6  -4.467  -4.545  -0.380
   43    HB3  GLN   6           HB1      GLN   6  -5.918  -4.004   0.447
   44    HG2  GLN   6           HG2      GLN   6  -5.035  -6.880   0.449
   45    HG3  GLN   6           HG1      GLN   6  -4.477  -5.714   1.645
   46   HE21  GLN   6          HE21      GLN   6  -5.954  -4.875   3.145
   47   HE22  GLN   6          HE22      GLN   6  -7.465  -5.649   3.464
   48    H    ALA   7           HN       ALA   7  -7.064  -2.960  -1.995
   49    HA   ALA   7           HA       ALA   7  -9.687  -3.012  -0.746
   50    HB1  ALA   7           HB1      ALA   7  -8.264  -1.034  -0.479
   51    HB2  ALA   7           HB2      ALA   7  -9.756  -0.639  -1.332
   52    HB3  ALA   7           HB3      ALA   7  -8.249  -0.815  -2.229
   53    H    GLY   8           HN       GLY   8  -8.197  -3.019  -3.896
   54    HA2  GLY   8           HA2      GLY   8  -9.432  -4.206  -5.672
   55    HA3  GLY   8           HA1      GLY   8 -10.856  -3.322  -5.150
   56    H    GLY   9           HN       GLY   9  -9.501  -0.786  -4.821
   57    HA2  GLY   9           HA2      GLY   9  -8.143   0.071  -7.112
   58    HA3  GLY   9           HA1      GLY   9  -9.859   0.272  -7.415
   59    H    ALA  10           HN       ALA  10  -7.888   0.771  -4.481
   60    HA   ALA  10           HA       ALA  10  -9.109   3.416  -4.172
   61    HB1  ALA  10           HB1      ALA  10  -9.239   1.864  -2.284
   62    HB2  ALA  10           HB2      ALA  10  -8.317   3.308  -1.868
   63    HB3  ALA  10           HB3      ALA  10  -7.479   1.796  -2.215
   64    H    ARG  11           HN       ARG  11  -7.435   4.967  -2.880
   65    HA   ARG  11           HA       ARG  11  -4.824   4.959  -4.219
   66    HB2  ARG  11           HB2      ARG  11  -6.835   7.208  -4.305
   67    HB3  ARG  11           HB1      ARG  11  -5.121   7.471  -4.587
   68    HG2  ARG  11           HG2      ARG  11  -5.198   5.919  -6.481
   69    HG3  ARG  11           HG1      ARG  11  -6.922   5.673  -6.201
   70    HD2  ARG  11           HD2      ARG  11  -6.784   7.258  -7.937
   71    HD3  ARG  11           HD1      ARG  11  -7.184   8.178  -6.487
   72    HE   ARG  11           HE       ARG  11  -4.386   8.122  -6.830
   73   HH11  ARG  11          HH11      ARG  11  -7.230   9.602  -8.266
   74   HH12  ARG  11          HH12      ARG  11  -6.360  10.984  -8.842
   75   HH21  ARG  11          HH21      ARG  11  -3.268   9.940  -7.595
   76   HH22  ARG  11          HH22      ARG  11  -4.120  11.174  -8.463
   77    H    CYS  12           HN       CYS  12  -3.173   5.943  -3.096
   78    HA   CYS  12           HA       CYS  12  -3.442   6.092  -0.279
   79    HB2  CYS  12           HB2      CYS  12  -1.166   6.810  -2.124
   80    HB3  CYS  12           HB1      CYS  12  -1.033   6.745  -0.371
   81    H    SER  13           HN       SER  13  -2.086   8.030   0.829
   82    HA   SER  13           HA       SER  13  -3.793  10.236   0.933
   83    HB2  SER  13           HB2      SER  13  -2.174   9.450   2.748
   84    HB3  SER  13           HB1      SER  13  -0.903  10.273   1.844
   85    HG   SER  13           HG       SER  13  -3.254  11.472   2.893
   86    H    ASN  14           HN       ASN  14  -0.524  10.086  -0.376
   87    HA   ASN  14           HA       ASN  14  -1.202  12.080  -2.406
   88    HB2  ASN  14           HB2      ASN  14   1.089  12.293  -0.444
   89    HB3  ASN  14           HB1      ASN  14   1.072  13.172  -1.970
   90   HD21  ASN  14          HD21      ASN  14  -0.402  14.842  -2.267
   91   HD22  ASN  14          HD22      ASN  14  -1.236  15.576  -0.944
   92    H    GLY  15           HN       GLY  15  -0.832   9.209  -2.417
   93    HA2  GLY  15           HA2      GLY  15  -0.037   7.863  -4.181
   94    HA3  GLY  15           HA1      GLY  15   1.237   9.044  -4.478
   95    H    LEU  16           HN       LEU  16   2.613   9.380  -2.407
   96    HA   LEU  16           HA       LEU  16   4.498   8.501  -1.448
   97    HB2  LEU  16           HB2      LEU  16   3.728   7.167   0.681
   98    HB3  LEU  16           HB1      LEU  16   3.445   8.886   0.523
   99    HG   LEU  16           HG       LEU  16   1.104   8.006  -0.433
  100   HD11  LEU  16          HD11      LEU  16   1.311   5.705  -0.270
  101   HD12  LEU  16          HD12      LEU  16   0.416   6.147   1.184
  102   HD13  LEU  16          HD13      LEU  16   2.135   5.791   1.285
  103   HD21  LEU  16          HD21      LEU  16   1.845   8.302   2.462
  104   HD22  LEU  16          HD22      LEU  16   0.201   8.308   1.834
  105   HD23  LEU  16          HD23      LEU  16   1.329   9.580   1.362
  106    H    CYS  17           HN       CYS  17   3.121   5.639  -0.204
  107    HA   CYS  17           HA       CYS  17   4.464   3.925  -2.166
  108    HB2  CYS  17           HB2      CYS  17   4.883   3.154   0.659
  109    HB3  CYS  17           HB1      CYS  17   6.010   3.099  -0.692
  110    H    CYS  18           HN       CYS  18   3.761   1.681  -2.047
  111    HA   CYS  18           HA       CYS  18   1.347   1.196  -0.461
  112    HB2  CYS  18           HB2      CYS  18   0.473   2.008  -2.556
  113    HB3  CYS  18           HB1      CYS  18   1.523   0.935  -3.473
  114    H    SER  19           HN       SER  19   1.401  -0.686   0.503
  115    HA   SER  19           HA       SER  19   3.536  -2.516   0.229
  116    HB2  SER  19           HB2      SER  19   0.910  -2.761   1.697
  117    HB3  SER  19           HB1      SER  19   2.261  -3.875   1.874
  118    HG   SER  19           HG       SER  19   2.209  -2.209   3.485
  119    H    GLN  20           HN       GLN  20   3.442  -4.758  -0.184
  120    HA   GLN  20           HA       GLN  20   2.759  -5.578  -2.645
  121    HB2  GLN  20           HB2      GLN  20   3.062  -7.168  -0.132
  122    HB3  GLN  20           HB1      GLN  20   2.798  -7.948  -1.686
  123    HG2  GLN  20           HG2      GLN  20   4.826  -6.908  -2.559
  124    HG3  GLN  20           HG1      GLN  20   5.087  -6.112  -1.007
  125   HE21  GLN  20          HE21      GLN  20   5.746  -7.332   0.763
  126   HE22  GLN  20          HE22      GLN  20   6.401  -8.921   0.592
  127    H    PHE  21           HN       PHE  21   0.612  -5.826   0.105
  128    HA   PHE  21           HA       PHE  21  -1.398  -7.261  -1.409
  129    HB2  PHE  21           HB2      PHE  21  -1.308  -6.207   1.408
  130    HB3  PHE  21           HB1      PHE  21  -2.761  -6.917   0.716
  131    HD1  PHE  21           HD1      PHE  21  -2.899  -9.262   0.242
  132    HD2  PHE  21           HD2      PHE  21   0.612  -7.546   1.912
  133    HE1  PHE  21           HE1      PHE  21  -2.098 -11.517   0.853
  134    HE2  PHE  21           HE2      PHE  21   1.428  -9.793   2.530
  135    HZ   PHE  21           HZ       PHE  21   0.070 -11.780   1.998
  136    H    GLY  22           HN       GLY  22  -0.797  -4.048  -0.265
  137    HA2  GLY  22           HA2      GLY  22  -1.738  -2.302  -1.816
  138    HA3  GLY  22           HA1      GLY  22  -3.283  -3.087  -1.525
  139    H    TYR  23           HN       TYR  23  -0.549  -1.996   0.467
  140    HA   TYR  23           HA       TYR  23  -2.483  -0.588   2.191
  141    HB2  TYR  23           HB2      TYR  23  -0.950  -2.634   3.042
  142    HB3  TYR  23           HB1      TYR  23   0.180  -1.312   3.302
  143    HD1  TYR  23           HD1      TYR  23  -1.628  -3.287   5.157
  144    HD2  TYR  23           HD2      TYR  23  -1.617   0.866   4.212
  145    HE1  TYR  23           HE1      TYR  23  -2.754  -2.802   7.288
  146    HE2  TYR  23           HE2      TYR  23  -2.744   1.358   6.342
  147    HH   TYR  23           HH       TYR  23  -4.162   0.205   7.986
  148    H    CYS  24           HN       CYS  24  -2.265   1.509   2.364
  149    HA   CYS  24           HA       CYS  24  -0.110   2.850   0.978
  150    HB2  CYS  24           HB2      CYS  24  -2.662   3.771   2.266
  151    HB3  CYS  24           HB1      CYS  24  -1.472   4.903   1.630
  152    H    GLY  25           HN       GLY  25   1.524   3.941   1.820
  153    HA2  GLY  25           HA2      GLY  25   1.547   4.994   4.465
  154    HA3  GLY  25           HA1      GLY  25   2.483   3.518   4.362
  155    H    SER  26           HN       SER  26   3.377   6.083   5.023
  156    HA   SER  26           HA       SER  26   5.566   6.423   3.095
  157    HB2  SER  26           HB2      SER  26   5.312   8.960   3.355
  158    HB3  SER  26           HB1      SER  26   4.091   8.181   2.365
  159    HG   SER  26           HG       SER  26   3.691   9.700   4.447
  160    H    THR  27           HN       THR  27   4.510   5.863   6.086
  161    HA   THR  27           HA       THR  27   6.913   6.762   7.419
  162    HB   THR  27           HB       THR  27   5.829   8.674   8.056
  163    HG1  THR  27           HG1      THR  27   4.367   7.688  10.059
  164   HG21  THR  27          HG21      THR  27   3.715   7.969   6.776
  165   HG22  THR  27          HG22      THR  27   3.516   9.089   8.122
  166   HG23  THR  27          HG23      THR  27   3.119   7.384   8.331
  167    HA   PRO  28           HA       PRO  28   4.754   3.361  10.039
  168    HB2  PRO  28           HB2      PRO  28   2.517   2.186   8.672
  169    HB3  PRO  28           HB1      PRO  28   2.468   3.274  10.069
  170    HG2  PRO  28           HG2      PRO  28   1.463   3.929   7.622
  171    HG3  PRO  28           HG1      PRO  28   2.062   5.116   8.797
  172    HD2  PRO  28           HD2      PRO  28   3.549   3.889   6.465
  173    HD3  PRO  28           HD1      PRO  28   3.394   5.608   6.909
  174    HA   PRO  29           HA       PRO  29   6.503  -0.461   8.355
  175    HB2  PRO  29           HB2      PRO  29   4.753  -2.484   9.056
  176    HB3  PRO  29           HB1      PRO  29   5.933  -1.754  10.160
  177    HG2  PRO  29           HG2      PRO  29   3.029  -1.150   9.844
  178    HG3  PRO  29           HG1      PRO  29   3.983  -1.364  11.329
  179    HD2  PRO  29           HD2      PRO  29   3.375   1.068  10.488
  180    HD3  PRO  29           HD1      PRO  29   4.988   0.721  11.141
  181    H    TYR  30           HN       TYR  30   5.228   0.920   6.409
  182    HA   TYR  30           HA       TYR  30   4.361  -1.176   4.547
  183    HB2  TYR  30           HB2      TYR  30   3.036   1.519   4.423
  184    HB3  TYR  30           HB1      TYR  30   2.507   0.005   3.715
  185    HD1  TYR  30           HD1      TYR  30   2.006  -1.871   5.602
  186    HD2  TYR  30           HD2      TYR  30   1.778   2.334   6.168
  187    HE1  TYR  30           HE1      TYR  30   0.479  -2.224   7.499
  188    HE2  TYR  30           HE2      TYR  30   0.251   1.995   8.071
  189    HH   TYR  30           HH       TYR  30  -1.310   0.292   8.902
  190    H    CYS  31           HN       CYS  31   5.801   1.873   5.295
  191    HA   CYS  31           HA       CYS  31   7.239   1.842   2.775
  192    HB2  CYS  31           HB2      CYS  31   5.417   3.608   2.744
  193    HB3  CYS  31           HB1      CYS  31   6.364   4.434   3.979
  194    H    GLY  32           HN       GLY  32   7.308   1.880   6.042
  195    HA2  GLY  32           HA2      GLY  32  10.136   2.655   5.987
  196    HA3  GLY  32           HA1      GLY  32   9.070   3.152   7.297
  197    H    ALA  33           HN       ALA  33  10.236   0.293   5.584
  198    HA   ALA  33           HA       ALA  33  10.872  -1.783   6.204
  199    HB1  ALA  33           HB1      ALA  33  11.618  -2.252   8.473
  200    HB2  ALA  33           HB2      ALA  33  10.867  -0.766   9.053
  201    HB3  ALA  33           HB3      ALA  33  12.235  -0.687   7.944
  202    H    GLY  34           HN       GLY  34   9.283  -3.052   5.644
  203    HA2  GLY  34           HA2      GLY  34   7.673  -4.398   7.462
  204    HA3  GLY  34           HA1      GLY  34   6.700  -3.090   6.801
  205    H    GLN  35           HN       GLN  35   6.285  -3.026   4.569
  206    HA   GLN  35           HA       GLN  35   6.985  -5.295   2.908
  207    HB2  GLN  35           HB2      GLN  35   4.454  -5.529   2.285
  208    HB3  GLN  35           HB1      GLN  35   5.070  -6.352   3.707
  209    HG2  GLN  35           HG2      GLN  35   4.170  -4.579   5.130
  210    HG3  GLN  35           HG1      GLN  35   3.565  -3.738   3.705
  211   HE21  GLN  35          HE21      GLN  35   3.167  -6.460   5.819
  212   HE22  GLN  35          HE22      GLN  35   1.594  -6.922   5.270
  213    H    CYS  36           HN       CYS  36   8.104  -3.237   2.209
  214    HA   CYS  36           HA       CYS  36   6.509  -1.329   0.728
  215    HB2  CYS  36           HB2      CYS  36   8.787  -0.379   0.153
  216    HB3  CYS  36           HB1      CYS  36   8.377  -0.421   1.865
  217    H    GLN  37           HN       GLN  37   5.774  -1.725  -1.252
  218    HA   GLN  37           HA       GLN  37   7.320  -3.419  -3.074
  219    HB2  GLN  37           HB2      GLN  37   4.835  -3.831  -2.522
  220    HB3  GLN  37           HB1      GLN  37   4.514  -2.433  -3.538
  221    HG2  GLN  37           HG2      GLN  37   5.716  -3.586  -5.386
  222    HG3  GLN  37           HG1      GLN  37   5.817  -5.014  -4.360
  223   HE21  GLN  37          HE21      GLN  37   4.008  -6.253  -4.023
  224   HE22  GLN  37          HE22      GLN  37   2.536  -6.035  -4.901
  225    H    SER  38           HN       SER  38   5.587  -0.306  -2.965
  226    HA   SER  38           HA       SER  38   6.593   0.539  -5.526
  227    HB2  SER  38           HB2      SER  38   4.946   1.984  -3.447
  228    HB3  SER  38           HB1      SER  38   5.366   2.660  -5.021
  229    HG   SER  38           HG       SER  38   3.261   1.409  -4.659
  230    H    GLN  39           HN       GLN  39   6.937   1.799  -2.239
  231    HA   GLN  39           HA       GLN  39   9.658   2.679  -2.869
  232    HB2  GLN  39           HB2      GLN  39   7.422   4.433  -1.892
  233    HB3  GLN  39           HB1      GLN  39   9.090   4.810  -1.491
  234    HG2  GLN  39           HG2      GLN  39   9.622   4.854  -3.899
  235    HG3  GLN  39           HG1      GLN  39   7.918   4.573  -4.252
  236   HE21  GLN  39          HE21      GLN  39  10.268   6.840  -3.064
  237   HE22  GLN  39          HE22      GLN  39   9.259   8.240  -3.147
  238    H    CYS  40           HN       CYS  40  11.074   2.707  -1.153
  239    HA   CYS  40           HA       CYS  40  10.043   1.799   1.448
  240    HB2  CYS  40           HB2      CYS  40  11.332   0.106  -0.207
  241    HB3  CYS  40           HB1      CYS  40  12.716   0.814   0.620
  Start of MODEL   14
    1    H1   PHE   1           HT1      PHE   1  -7.251  -2.053   0.633
    2    H2   PHE   1           HT2      PHE   1  -6.258  -2.845   1.750
    3    H3   PHE   1           HT3      PHE   1  -5.651  -1.546   0.853
    4    HA   PHE   1           HA       PHE   1  -7.819  -1.390   2.851
    5    HB2  PHE   1           HB2      PHE   1  -4.952  -0.440   3.011
    6    HB3  PHE   1           HB1      PHE   1  -6.189  -0.140   4.226
    7    HD1  PHE   1           HD1      PHE   1  -3.965  -2.637   2.744
    8    HD2  PHE   1           HD2      PHE   1  -6.916  -1.892   5.719
    9    HE1  PHE   1           HE1      PHE   1  -3.370  -4.749   3.858
   10    HE2  PHE   1           HE2      PHE   1  -6.325  -4.001   6.839
   11    HZ   PHE   1           HZ       PHE   1  -4.551  -5.434   5.909
   12    H    GLN   2           HN       GLN   2  -5.617   0.339   0.726
   13    HA   GLN   2           HA       GLN   2  -7.642   2.378   0.222
   14    HB2  GLN   2           HB2      GLN   2  -4.896   2.974   1.327
   15    HB3  GLN   2           HB1      GLN   2  -5.829   4.175   0.448
   16    HG2  GLN   2           HG2      GLN   2  -6.954   2.778   2.849
   17    HG3  GLN   2           HG1      GLN   2  -5.918   4.195   3.007
   18   HE21  GLN   2          HE21      GLN   2  -9.003   2.997   1.948
   19   HE22  GLN   2          HE22      GLN   2  -9.771   4.536   1.776
   20    H    CYS   3           HN       CYS   3  -5.091   0.411  -0.817
   21    HA   CYS   3           HA       CYS   3  -5.290   1.426  -3.538
   22    HB2  CYS   3           HB2      CYS   3  -3.420   2.707  -3.136
   23    HB3  CYS   3           HB1      CYS   3  -2.862   1.676  -1.831
   24    H    GLY   4           HN       GLY   4  -4.293  -0.041  -5.122
   25    HA2  GLY   4           HA2      GLY   4  -3.652  -2.094  -5.959
   26    HA3  GLY   4           HA1      GLY   4  -3.381  -2.642  -4.317
   27    H    ARG   5           HN       ARG   5  -4.314  -4.589  -4.460
   28    HA   ARG   5           HA       ARG   5  -7.079  -4.801  -5.386
   29    HB2  ARG   5           HB2      ARG   5  -6.654  -7.289  -5.261
   30    HB3  ARG   5           HB1      ARG   5  -5.676  -6.416  -6.429
   31    HG2  ARG   5           HG2      ARG   5  -3.950  -6.341  -4.452
   32    HG3  ARG   5           HG1      ARG   5  -4.871  -7.744  -3.895
   33    HD2  ARG   5           HD2      ARG   5  -4.568  -8.763  -6.119
   34    HD3  ARG   5           HD1      ARG   5  -3.557  -7.395  -6.577
   35    HE   ARG   5           HE       ARG   5  -2.572  -8.584  -4.208
   36   HH11  ARG   5          HH11      ARG   5  -2.719  -9.184  -7.665
   37   HH12  ARG   5          HH12      ARG   5  -1.283 -10.152  -7.673
   38   HH21  ARG   5          HH21      ARG   5  -0.139 -10.529  -5.737
   39   HH22  ARG   5          HH22      ARG   5  -0.695  -9.852  -4.243
   40    H    GLN   6           HN       GLN   6  -5.346  -4.572  -2.464
   41    HA   GLN   6           HA       GLN   6  -6.877  -6.233  -0.750
   42    HB2  GLN   6           HB2      GLN   6  -4.638  -4.744  -0.427
   43    HB3  GLN   6           HB1      GLN   6  -5.812  -3.695   0.351
   44    HG2  GLN   6           HG2      GLN   6  -5.355  -6.596   1.076
   45    HG3  GLN   6           HG1      GLN   6  -4.649  -5.225   1.927
   46   HE21  GLN   6          HE21      GLN   6  -7.509  -7.081   1.343
   47   HE22  GLN   6          HE22      GLN   6  -8.479  -6.374   2.585
   48    H    ALA   7           HN       ALA   7  -7.402  -3.177  -2.203
   49    HA   ALA   7           HA       ALA   7  -9.823  -2.654  -0.628
   50    HB1  ALA   7           HB1      ALA   7  -8.186  -0.795  -2.341
   51    HB2  ALA   7           HB2      ALA   7  -8.141  -0.885  -0.581
   52    HB3  ALA   7           HB3      ALA   7  -9.609  -0.347  -1.398
   53    H    GLY   8           HN       GLY   8  -8.521  -3.144  -3.816
   54    HA2  GLY   8           HA2      GLY   8  -9.992  -4.267  -5.439
   55    HA3  GLY   8           HA1      GLY   8 -11.257  -3.155  -4.937
   56    H    GLY   9           HN       GLY   9 -10.084  -0.746  -4.970
   57    HA2  GLY   9           HA2      GLY   9  -8.420  -0.112  -7.136
   58    HA3  GLY   9           HA1      GLY   9 -10.084  -0.031  -7.692
   59    H    ALA  10           HN       ALA  10  -7.864   1.200  -5.222
   60    HA   ALA  10           HA       ALA  10  -9.357   3.739  -5.229
   61    HB1  ALA  10           HB1      ALA  10  -8.998   3.955  -2.820
   62    HB2  ALA  10           HB2      ALA  10  -8.188   2.389  -2.792
   63    HB3  ALA  10           HB3      ALA  10  -9.902   2.487  -3.194
   64    H    ARG  11           HN       ARG  11  -7.484   4.949  -3.296
   65    HA   ARG  11           HA       ARG  11  -4.934   4.914  -4.736
   66    HB2  ARG  11           HB2      ARG  11  -4.883   7.445  -4.734
   67    HB3  ARG  11           HB1      ARG  11  -6.056   6.743  -5.833
   68    HG2  ARG  11           HG2      ARG  11  -7.840   7.219  -4.200
   69    HG3  ARG  11           HG1      ARG  11  -6.645   7.967  -3.141
   70    HD2  ARG  11           HD2      ARG  11  -7.114   8.876  -5.972
   71    HD3  ARG  11           HD1      ARG  11  -8.006   9.534  -4.601
   72    HE   ARG  11           HE       ARG  11  -5.300   9.734  -3.993
   73   HH11  ARG  11          HH11      ARG  11  -7.505  11.087  -6.369
   74   HH12  ARG  11          HH12      ARG  11  -6.597  12.552  -6.545
   75   HH21  ARG  11          HH21      ARG  11  -4.130  11.659  -4.240
   76   HH22  ARG  11          HH22      ARG  11  -4.689  12.874  -5.340
   77    H    CYS  12           HN       CYS  12  -3.165   5.904  -3.590
   78    HA   CYS  12           HA       CYS  12  -3.110   5.196  -0.853
   79    HB2  CYS  12           HB2      CYS  12  -1.158   6.490  -2.734
   80    HB3  CYS  12           HB1      CYS  12  -0.772   6.302  -1.027
   81    H    SER  13           HN       SER  13  -1.710   6.892   0.625
   82    HA   SER  13           HA       SER  13  -3.581   8.921   1.353
   83    HB2  SER  13           HB2      SER  13  -0.937   7.992   2.456
   84    HB3  SER  13           HB1      SER  13  -1.638   9.502   3.041
   85    HG   SER  13           HG       SER  13  -3.588   7.765   3.069
   86    H    ASN  14           HN       ASN  14  -0.195   9.104   0.396
   87    HA   ASN  14           HA       ASN  14  -0.689  11.583  -1.081
   88    HB2  ASN  14           HB2      ASN  14   1.401  11.244   1.088
   89    HB3  ASN  14           HB1      ASN  14   1.461  12.534  -0.108
   90   HD21  ASN  14          HD21      ASN  14  -0.075  14.180  -0.037
   91   HD22  ASN  14          HD22      ASN  14  -1.035  14.474   1.368
   92    H    GLY  15           HN       GLY  15   1.938  12.110  -1.871
   93    HA2  GLY  15           HA2      GLY  15   2.366  10.028  -3.810
   94    HA3  GLY  15           HA1      GLY  15   3.329  11.489  -3.617
   95    H    LEU  16           HN       LEU  16   2.600   8.494  -1.894
   96    HA   LEU  16           HA       LEU  16   5.405   8.304  -1.032
   97    HB2  LEU  16           HB2      LEU  16   4.185   6.784   0.807
   98    HB3  LEU  16           HB1      LEU  16   4.378   8.512   0.992
   99    HG   LEU  16           HG       LEU  16   1.985   8.474  -0.240
  100   HD11  LEU  16          HD11      LEU  16   2.110   5.901   1.303
  101   HD12  LEU  16          HD12      LEU  16   1.795   6.102  -0.422
  102   HD13  LEU  16          HD13      LEU  16   0.628   6.690   0.763
  103   HD21  LEU  16          HD21      LEU  16   2.665   9.517   1.946
  104   HD22  LEU  16          HD22      LEU  16   2.205   7.993   2.709
  105   HD23  LEU  16          HD23      LEU  16   1.005   8.943   1.838
  106    H    CYS  17           HN       CYS  17   3.688   5.534  -0.162
  107    HA   CYS  17           HA       CYS  17   4.312   4.088  -2.635
  108    HB2  CYS  17           HB2      CYS  17   5.541   2.347  -1.407
  109    HB3  CYS  17           HB1      CYS  17   6.303   3.910  -1.142
  110    H    CYS  18           HN       CYS  18   3.639   1.667  -2.298
  111    HA   CYS  18           HA       CYS  18   1.193   1.402  -0.709
  112    HB2  CYS  18           HB2      CYS  18   0.507   2.134  -2.970
  113    HB3  CYS  18           HB1      CYS  18   1.375   0.773  -3.669
  114    H    SER  19           HN       SER  19   1.288  -0.416   0.431
  115    HA   SER  19           HA       SER  19   3.388  -2.293   0.184
  116    HB2  SER  19           HB2      SER  19   0.842  -2.370   1.799
  117    HB3  SER  19           HB1      SER  19   2.110  -3.586   1.924
  118    HG   SER  19           HG       SER  19   3.287  -2.240   3.034
  119    H    GLN  20           HN       GLN  20   3.268  -4.552  -0.085
  120    HA   GLN  20           HA       GLN  20   2.587  -5.522  -2.463
  121    HB2  GLN  20           HB2      GLN  20   2.673  -7.001   0.145
  122    HB3  GLN  20           HB1      GLN  20   2.519  -7.824  -1.400
  123    HG2  GLN  20           HG2      GLN  20   4.648  -6.897  -2.126
  124    HG3  GLN  20           HG1      GLN  20   4.796  -6.020  -0.604
  125   HE21  GLN  20          HE21      GLN  20   4.938  -9.123  -2.155
  126   HE22  GLN  20          HE22      GLN  20   5.686  -9.970  -0.849
  127    H    PHE  21           HN       PHE  21   0.377  -5.624   0.266
  128    HA   PHE  21           HA       PHE  21  -1.694  -6.929  -1.289
  129    HB2  PHE  21           HB2      PHE  21  -1.626  -5.899   1.546
  130    HB3  PHE  21           HB1      PHE  21  -3.061  -6.606   0.817
  131    HD1  PHE  21           HD1      PHE  21   0.266  -7.244   2.136
  132    HD2  PHE  21           HD2      PHE  21  -3.181  -8.963   0.335
  133    HE1  PHE  21           HE1      PHE  21   1.055  -9.488   2.786
  134    HE2  PHE  21           HE2      PHE  21  -2.404 -11.214   0.980
  135    HZ   PHE  21           HZ       PHE  21  -0.283 -11.476   2.208
  136    H    GLY  22           HN       GLY  22  -1.051  -3.812   0.130
  137    HA2  GLY  22           HA2      GLY  22  -1.868  -2.006  -1.542
  138    HA3  GLY  22           HA1      GLY  22  -3.441  -2.664  -1.111
  139    H    TYR  23           HN       TYR  23  -0.527  -1.932   0.793
  140    HA   TYR  23           HA       TYR  23  -2.198  -0.177   2.475
  141    HB2  TYR  23           HB2      TYR  23  -1.057  -2.471   3.366
  142    HB3  TYR  23           HB1      TYR  23   0.243  -1.332   3.695
  143    HD1  TYR  23           HD1      TYR  23  -1.941  -3.004   5.434
  144    HD2  TYR  23           HD2      TYR  23  -1.240   1.092   4.509
  145    HE1  TYR  23           HE1      TYR  23  -3.089  -2.343   7.508
  146    HE2  TYR  23           HE2      TYR  23  -2.389   1.763   6.582
  147    HH   TYR  23           HH       TYR  23  -4.054   0.845   8.145
  148    H    CYS  24           HN       CYS  24  -1.719   1.839   2.031
  149    HA   CYS  24           HA       CYS  24   0.962   2.576   1.182
  150    HB2  CYS  24           HB2      CYS  24  -1.405   4.405   1.457
  151    HB3  CYS  24           HB1      CYS  24   0.039   4.629   0.478
  152    H    GLY  25           HN       GLY  25   2.151   4.242   2.077
  153    HA2  GLY  25           HA2      GLY  25   1.461   5.595   4.468
  154    HA3  GLY  25           HA1      GLY  25   2.480   4.208   4.827
  155    H    SER  26           HN       SER  26   3.590   6.325   5.603
  156    HA   SER  26           HA       SER  26   5.809   6.826   3.781
  157    HB2  SER  26           HB2      SER  26   4.222   8.660   3.266
  158    HB3  SER  26           HB1      SER  26   4.219   9.127   4.962
  159    HG   SER  26           HG       SER  26   5.674  10.379   3.700
  160    H    THR  27           HN       THR  27   4.787   5.825   6.601
  161    HA   THR  27           HA       THR  27   7.151   6.616   8.077
  162    HB   THR  27           HB       THR  27   6.098   8.308   9.139
  163    HG1  THR  27           HG1      THR  27   4.619   6.243  10.424
  164   HG21  THR  27          HG21      THR  27   3.293   7.309   8.998
  165   HG22  THR  27          HG22      THR  27   4.057   7.806   7.489
  166   HG23  THR  27          HG23      THR  27   3.917   8.949   8.824
  167    HA   PRO  28           HA       PRO  28   5.117   2.878  10.330
  168    HB2  PRO  28           HB2      PRO  28   2.789   1.905   8.933
  169    HB3  PRO  28           HB1      PRO  28   2.841   2.749  10.489
  170    HG2  PRO  28           HG2      PRO  28   1.678   3.799   8.270
  171    HG3  PRO  28           HG1      PRO  28   2.395   4.782   9.563
  172    HD2  PRO  28           HD2      PRO  28   3.662   3.923   6.957
  173    HD3  PRO  28           HD1      PRO  28   3.583   5.551   7.673
  174    HA   PRO  29           HA       PRO  29   6.652  -0.764   8.085
  175    HB2  PRO  29           HB2      PRO  29   4.259  -2.416   8.731
  176    HB3  PRO  29           HB1      PRO  29   5.968  -2.714   9.101
  177    HG2  PRO  29           HG2      PRO  29   4.326  -2.006  11.018
  178    HG3  PRO  29           HG1      PRO  29   5.958  -1.305  10.934
  179    HD2  PRO  29           HD2      PRO  29   3.351  -0.104  10.078
  180    HD3  PRO  29           HD1      PRO  29   4.672   0.628  11.013
  181    H    TYR  30           HN       TYR  30   5.378   0.976   6.434
  182    HA   TYR  30           HA       TYR  30   4.418  -0.735   4.256
  183    HB2  TYR  30           HB2      TYR  30   3.157   1.973   4.661
  184    HB3  TYR  30           HB1      TYR  30   2.572   0.620   3.708
  185    HD1  TYR  30           HD1      TYR  30   1.895   2.491   6.508
  186    HD2  TYR  30           HD2      TYR  30   2.148  -1.582   5.309
  187    HE1  TYR  30           HE1      TYR  30   0.425   1.849   8.376
  188    HE2  TYR  30           HE2      TYR  30   0.680  -2.233   7.171
  189    HH   TYR  30           HH       TYR  30   0.003  -1.366   9.369
  190    H    CYS  31           HN       CYS  31   5.819   2.195   5.496
  191    HA   CYS  31           HA       CYS  31   7.517   2.478   3.175
  192    HB2  CYS  31           HB2      CYS  31   5.329   4.261   3.632
  193    HB3  CYS  31           HB1      CYS  31   6.844   5.121   3.879
  194    H    GLY  32           HN       GLY  32   9.091   1.740   4.527
  195    HA2  GLY  32           HA2      GLY  32  10.864   3.402   5.690
  196    HA3  GLY  32           HA1      GLY  32   9.730   3.089   7.003
  197    H    ALA  33           HN       ALA  33   9.092   0.659   7.060
  198    HA   ALA  33           HA       ALA  33  10.980  -1.321   6.326
  199    HB1  ALA  33           HB1      ALA  33  12.317  -0.306   8.136
  200    HB2  ALA  33           HB2      ALA  33  11.817  -1.947   8.545
  201    HB3  ALA  33           HB3      ALA  33  10.986  -0.568   9.263
  202    H    GLY  34           HN       GLY  34   9.199  -2.381   5.588
  203    HA2  GLY  34           HA2      GLY  34   7.826  -4.064   7.400
  204    HA3  GLY  34           HA1      GLY  34   6.774  -2.749   6.902
  205    H    GLN  35           HN       GLN  35   6.003  -2.658   4.808
  206    HA   GLN  35           HA       GLN  35   6.636  -4.933   3.055
  207    HB2  GLN  35           HB2      GLN  35   3.817  -3.945   3.565
  208    HB3  GLN  35           HB1      GLN  35   4.289  -5.315   2.573
  209    HG2  GLN  35           HG2      GLN  35   5.200  -6.371   4.677
  210    HG3  GLN  35           HG1      GLN  35   4.407  -5.071   5.566
  211   HE21  GLN  35          HE21      GLN  35   3.944  -7.922   3.628
  212   HE22  GLN  35          HE22      GLN  35   2.272  -8.150   4.001
  213    H    CYS  36           HN       CYS  36   7.869  -2.653   2.530
  214    HA   CYS  36           HA       CYS  36   6.335  -0.886   0.842
  215    HB2  CYS  36           HB2      CYS  36   8.619   0.113   0.371
  216    HB3  CYS  36           HB1      CYS  36   8.106   0.121   2.054
  217    H    GLN  37           HN       GLN  37   5.601  -1.652  -1.072
  218    HA   GLN  37           HA       GLN  37   7.336  -3.317  -2.731
  219    HB2  GLN  37           HB2      GLN  37   4.871  -3.836  -2.240
  220    HB3  GLN  37           HB1      GLN  37   4.494  -2.523  -3.345
  221    HG2  GLN  37           HG2      GLN  37   5.883  -3.743  -5.065
  222    HG3  GLN  37           HG1      GLN  37   5.887  -5.111  -3.955
  223   HE21  GLN  37          HE21      GLN  37   4.024  -6.292  -3.660
  224   HE22  GLN  37          HE22      GLN  37   2.629  -6.114  -4.663
  225    H    SER  38           HN       SER  38   5.450  -0.294  -2.977
  226    HA   SER  38           HA       SER  38   6.419   0.360  -5.581
  227    HB2  SER  38           HB2      SER  38   4.872   1.969  -3.551
  228    HB3  SER  38           HB1      SER  38   5.278   2.568  -5.158
  229    HG   SER  38           HG       SER  38   3.547   1.568  -5.779
  230    H    GLN  39           HN       GLN  39   6.955   1.873  -2.431
  231    HA   GLN  39           HA       GLN  39   9.688   2.551  -3.188
  232    HB2  GLN  39           HB2      GLN  39   7.515   4.508  -2.915
  233    HB3  GLN  39           HB1      GLN  39   8.929   4.886  -1.941
  234    HG2  GLN  39           HG2      GLN  39  10.329   4.770  -3.944
  235    HG3  GLN  39           HG1      GLN  39   8.903   4.399  -4.913
  236   HE21  GLN  39          HE21      GLN  39   7.391   6.011  -5.316
  237   HE22  GLN  39          HE22      GLN  39   7.744   7.685  -5.071
  238    H    CYS  40           HN       CYS  40  11.088   2.866  -1.452
  239    HA   CYS  40           HA       CYS  40   9.981   2.409   1.233
  240    HB2  CYS  40           HB2      CYS  40  11.192   0.403  -0.102
  241    HB3  CYS  40           HB1      CYS  40  12.602   1.154   0.637
  Start of MODEL   15
    1    H1   PHE   1           HT1      PHE   1  -7.597  -2.461   0.873
    2    H2   PHE   1           HT2      PHE   1  -6.487  -3.230   1.890
    3    H3   PHE   1           HT3      PHE   1  -6.001  -1.904   0.960
    4    HA   PHE   1           HA       PHE   1  -7.971  -1.850   3.159
    5    HB2  PHE   1           HB2      PHE   1  -5.179  -0.690   3.025
    6    HB3  PHE   1           HB1      PHE   1  -6.290  -0.539   4.381
    7    HD1  PHE   1           HD1      PHE   1  -6.751  -2.446   5.825
    8    HD2  PHE   1           HD2      PHE   1  -3.954  -2.718   2.629
    9    HE1  PHE   1           HE1      PHE   1  -5.839  -4.509   6.807
   10    HE2  PHE   1           HE2      PHE   1  -3.034  -4.782   3.609
   11    HZ   PHE   1           HZ       PHE   1  -3.979  -5.681   5.697
   12    H    GLN   2           HN       GLN   2  -5.901   0.185   1.156
   13    HA   GLN   2           HA       GLN   2  -8.122   1.945   0.479
   14    HB2  GLN   2           HB2      GLN   2  -5.691   2.852   2.021
   15    HB3  GLN   2           HB1      GLN   2  -6.626   3.966   1.037
   16    HG2  GLN   2           HG2      GLN   2  -8.616   3.465   2.370
   17    HG3  GLN   2           HG1      GLN   2  -7.665   2.361   3.362
   18   HE21  GLN   2          HE21      GLN   2  -8.295   5.680   2.557
   19   HE22  GLN   2          HE22      GLN   2  -7.465   6.377   3.903
   20    H    CYS   3           HN       CYS   3  -5.371   0.293  -0.346
   21    HA   CYS   3           HA       CYS   3  -5.169   1.632  -2.936
   22    HB2  CYS   3           HB2      CYS   3  -3.414   2.723  -1.695
   23    HB3  CYS   3           HB1      CYS   3  -2.844   1.194  -1.044
   24    H    GLY   4           HN       GLY   4  -3.911   0.331  -4.513
   25    HA2  GLY   4           HA2      GLY   4  -3.356  -1.605  -5.601
   26    HA3  GLY   4           HA1      GLY   4  -3.073  -2.320  -4.027
   27    H    ARG   5           HN       ARG   5  -3.935  -4.264  -4.317
   28    HA   ARG   5           HA       ARG   5  -6.655  -4.523  -5.355
   29    HB2  ARG   5           HB2      ARG   5  -6.132  -6.978  -5.432
   30    HB3  ARG   5           HB1      ARG   5  -5.104  -5.982  -6.447
   31    HG2  ARG   5           HG2      ARG   5  -3.536  -6.035  -4.331
   32    HG3  ARG   5           HG1      ARG   5  -4.435  -7.520  -3.998
   33    HD2  ARG   5           HD2      ARG   5  -3.918  -8.281  -6.290
   34    HD3  ARG   5           HD1      ARG   5  -2.923  -6.841  -6.507
   35    HE   ARG   5           HE       ARG   5  -2.077  -8.227  -4.205
   36   HH11  ARG   5          HH11      ARG   5  -1.986  -8.559  -7.700
   37   HH12  ARG   5          HH12      ARG   5  -0.534  -9.503  -7.688
   38   HH21  ARG   5          HH21      ARG   5   0.489 -10.014  -5.715
   39   HH22  ARG   5          HH22      ARG   5  -0.176  -9.463  -4.214
   40    H    GLN   6           HN       GLN   6  -5.037  -4.432  -2.363
   41    HA   GLN   6           HA       GLN   6  -6.533  -6.296  -0.836
   42    HB2  GLN   6           HB2      GLN   6  -4.378  -4.727  -0.334
   43    HB3  GLN   6           HB1      GLN   6  -5.624  -3.826   0.513
   44    HG2  GLN   6           HG2      GLN   6  -5.053  -6.759   0.955
   45    HG3  GLN   6           HG1      GLN   6  -4.386  -5.458   1.937
   46   HE21  GLN   6          HE21      GLN   6  -7.200  -7.317   1.159
   47   HE22  GLN   6          HE22      GLN   6  -8.188  -6.764   2.464
   48    H    ALA   7           HN       ALA   7  -7.193  -3.189  -2.093
   49    HA   ALA   7           HA       ALA   7  -9.675  -2.918  -0.546
   50    HB1  ALA   7           HB1      ALA   7  -8.060  -0.810  -1.961
   51    HB2  ALA   7           HB2      ALA   7  -8.077  -1.100  -0.222
   52    HB3  ALA   7           HB3      ALA   7  -9.536  -0.534  -1.037
   53    H    GLY   8           HN       GLY   8  -8.216  -2.949  -3.707
   54    HA2  GLY   8           HA2      GLY   8  -9.760  -4.027  -5.409
   55    HA3  GLY   8           HA1      GLY   8 -10.866  -2.728  -4.986
   56    H    GLY   9           HN       GLY   9  -9.687  -0.485  -5.074
   57    HA2  GLY   9           HA2      GLY   9  -7.613  -0.013  -6.902
   58    HA3  GLY   9           HA1      GLY   9  -9.132   0.054  -7.781
   59    H    ALA  10           HN       ALA  10  -7.250   1.500  -5.182
   60    HA   ALA  10           HA       ALA  10  -8.754   4.004  -5.545
   61    HB1  ALA  10           HB1      ALA  10  -9.547   2.917  -3.496
   62    HB2  ALA  10           HB2      ALA  10  -8.694   4.419  -3.138
   63    HB3  ALA  10           HB3      ALA  10  -7.895   2.868  -2.879
   64    H    ARG  11           HN       ARG  11  -7.204   5.483  -3.610
   65    HA   ARG  11           HA       ARG  11  -4.450   5.319  -4.609
   66    HB2  ARG  11           HB2      ARG  11  -6.238   7.745  -4.780
   67    HB3  ARG  11           HB1      ARG  11  -4.485   7.864  -4.832
   68    HG2  ARG  11           HG2      ARG  11  -4.445   6.454  -6.828
   69    HG3  ARG  11           HG1      ARG  11  -6.203   6.329  -6.775
   70    HD2  ARG  11           HD2      ARG  11  -5.737   8.002  -8.365
   71    HD3  ARG  11           HD1      ARG  11  -6.247   8.860  -6.912
   72    HE   ARG  11           HE       ARG  11  -3.461   8.638  -6.859
   73   HH11  ARG  11          HH11      ARG  11  -5.913  10.292  -8.754
   74   HH12  ARG  11          HH12      ARG  11  -4.864  11.606  -9.175
   75   HH21  ARG  11          HH21      ARG  11  -2.107  10.367  -7.423
   76   HH22  ARG  11          HH22      ARG  11  -2.712  11.646  -8.421
   77    H    CYS  12           HN       CYS  12  -2.881   6.270  -3.280
   78    HA   CYS  12           HA       CYS  12  -3.500   6.211  -0.488
   79    HB2  CYS  12           HB2      CYS  12  -0.999   6.585  -2.100
   80    HB3  CYS  12           HB1      CYS  12  -0.991   6.766  -0.350
   81    H    SER  13           HN       SER  13  -1.806   8.010   0.708
   82    HA   SER  13           HA       SER  13  -3.349  10.248   1.126
   83    HB2  SER  13           HB2      SER  13  -1.508   9.379   2.634
   84    HB3  SER  13           HB1      SER  13  -0.356  10.192   1.571
   85    HG   SER  13           HG       SER  13  -1.092  11.406   3.463
   86    H    ASN  14           HN       ASN  14  -0.153  10.576  -0.368
   87    HA   ASN  14           HA       ASN  14  -1.256  12.422  -2.351
   88    HB2  ASN  14           HB2      ASN  14  -0.301  13.594  -0.208
   89    HB3  ASN  14           HB1      ASN  14   1.265  13.207  -0.913
   90   HD21  ASN  14          HD21      ASN  14  -1.641  15.081  -1.229
   91   HD22  ASN  14          HD22      ASN  14  -1.053  16.169  -2.434
   92    H    GLY  15           HN       GLY  15  -0.183   9.689  -2.406
   93    HA2  GLY  15           HA2      GLY  15   0.863   8.571  -4.172
   94    HA3  GLY  15           HA1      GLY  15   1.653  10.074  -4.628
   95    H    LEU  16           HN       LEU  16   1.595   8.369  -1.520
   96    HA   LEU  16           HA       LEU  16   4.451   8.645  -1.251
   97    HB2  LEU  16           HB2      LEU  16   3.843   7.183   0.912
   98    HB3  LEU  16           HB1      LEU  16   3.663   8.921   0.847
   99    HG   LEU  16           HG       LEU  16   1.197   8.420   0.192
  100   HD11  LEU  16          HD11      LEU  16   0.383   6.312   1.286
  101   HD12  LEU  16          HD12      LEU  16   2.057   5.764   1.284
  102   HD13  LEU  16          HD13      LEU  16   1.240   6.105  -0.242
  103   HD21  LEU  16          HD21      LEU  16   2.080   7.736   2.978
  104   HD22  LEU  16          HD22      LEU  16   0.538   8.411   2.477
  105   HD23  LEU  16          HD23      LEU  16   2.004   9.379   2.340
  106    H    CYS  17           HN       CYS  17   3.076   5.720  -0.052
  107    HA   CYS  17           HA       CYS  17   4.377   4.089  -2.106
  108    HB2  CYS  17           HB2      CYS  17   4.774   3.152   0.670
  109    HB3  CYS  17           HB1      CYS  17   5.889   3.117  -0.690
  110    H    CYS  18           HN       CYS  18   3.667   1.802  -2.000
  111    HA   CYS  18           HA       CYS  18   1.181   1.370  -0.514
  112    HB2  CYS  18           HB2      CYS  18   0.594   2.258  -2.767
  113    HB3  CYS  18           HB1      CYS  18   1.423   0.889  -3.497
  114    H    SER  19           HN       SER  19   1.430  -0.406   0.614
  115    HA   SER  19           HA       SER  19   3.473  -2.290   0.320
  116    HB2  SER  19           HB2      SER  19   0.847  -2.607   1.777
  117    HB3  SER  19           HB1      SER  19   2.291  -3.581   2.028
  118    HG   SER  19           HG       SER  19   1.874  -1.698   3.487
  119    H    GLN  20           HN       GLN  20   3.399  -4.518  -0.088
  120    HA   GLN  20           HA       GLN  20   2.720  -5.364  -2.535
  121    HB2  GLN  20           HB2      GLN  20   3.049  -6.917  -0.005
  122    HB3  GLN  20           HB1      GLN  20   2.755  -7.730  -1.534
  123    HG2  GLN  20           HG2      GLN  20   4.764  -6.702  -2.468
  124    HG3  GLN  20           HG1      GLN  20   5.058  -5.886  -0.933
  125   HE21  GLN  20          HE21      GLN  20   5.748  -7.083   0.840
  126   HE22  GLN  20          HE22      GLN  20   6.398  -8.675   0.676
  127    H    PHE  21           HN       PHE  21   0.566  -5.612   0.212
  128    HA   PHE  21           HA       PHE  21  -1.438  -7.069  -1.287
  129    HB2  PHE  21           HB2      PHE  21  -1.414  -5.922   1.502
  130    HB3  PHE  21           HB1      PHE  21  -2.810  -6.738   0.810
  131    HD1  PHE  21           HD1      PHE  21  -2.852  -9.094   0.516
  132    HD2  PHE  21           HD2      PHE  21   0.606  -7.142   2.029
  133    HE1  PHE  21           HE1      PHE  21  -1.948 -11.274   1.241
  134    HE2  PHE  21           HE2      PHE  21   1.525  -9.314   2.761
  135    HZ   PHE  21           HZ       PHE  21   0.244 -11.383   2.364
  136    H    GLY  22           HN       GLY  22  -0.943  -3.861  -0.032
  137    HA2  GLY  22           HA2      GLY  22  -1.838  -2.123  -1.670
  138    HA3  GLY  22           HA1      GLY  22  -3.382  -2.909  -1.364
  139    H    TYR  23           HN       TYR  23  -0.639  -1.726   0.555
  140    HA   TYR  23           HA       TYR  23  -2.566  -0.367   2.328
  141    HB2  TYR  23           HB2      TYR  23  -0.999  -2.350   3.171
  142    HB3  TYR  23           HB1      TYR  23   0.184  -1.054   3.287
  143    HD1  TYR  23           HD1      TYR  23  -0.912   1.172   4.474
  144    HD2  TYR  23           HD2      TYR  23  -2.077  -2.868   5.128
  145    HE1  TYR  23           HE1      TYR  23  -1.832   1.799   6.668
  146    HE2  TYR  23           HE2      TYR  23  -3.004  -2.251   7.322
  147    HH   TYR  23           HH       TYR  23  -3.505   0.966   8.269
  148    H    CYS  24           HN       CYS  24  -2.255   1.733   2.798
  149    HA   CYS  24           HA       CYS  24  -0.256   3.153   1.224
  150    HB2  CYS  24           HB2      CYS  24  -2.732   4.026   2.695
  151    HB3  CYS  24           HB1      CYS  24  -1.588   5.177   2.005
  152    H    GLY  25           HN       GLY  25   1.448   4.154   2.006
  153    HA2  GLY  25           HA2      GLY  25   1.647   5.222   4.620
  154    HA3  GLY  25           HA1      GLY  25   2.468   3.675   4.538
  155    H    SER  26           HN       SER  26   3.711   6.019   5.157
  156    HA   SER  26           HA       SER  26   5.750   6.231   3.053
  157    HB2  SER  26           HB2      SER  26   4.075   8.150   2.815
  158    HB3  SER  26           HB1      SER  26   4.649   8.720   4.373
  159    HG   SER  26           HG       SER  26   5.998   9.734   3.065
  160    H    THR  27           HN       THR  27   4.838   5.830   6.206
  161    HA   THR  27           HA       THR  27   7.455   6.560   7.294
  162    HB   THR  27           HB       THR  27   6.675   7.939   8.961
  163    HG1  THR  27           HG1      THR  27   4.220   6.495   8.827
  164   HG21  THR  27          HG21      THR  27   4.858   9.409   8.203
  165   HG22  THR  27          HG22      THR  27   4.403   8.223   6.981
  166   HG23  THR  27          HG23      THR  27   5.963   9.038   6.877
  167    HA   PRO  28           HA       PRO  28   5.467   3.232  10.154
  168    HB2  PRO  28           HB2      PRO  28   3.006   2.205   9.061
  169    HB3  PRO  28           HB1      PRO  28   3.210   3.235  10.486
  170    HG2  PRO  28           HG2      PRO  28   1.926   4.043   8.230
  171    HG3  PRO  28           HG1      PRO  28   2.759   5.148   9.344
  172    HD2  PRO  28           HD2      PRO  28   3.806   3.938   6.781
  173    HD3  PRO  28           HD1      PRO  28   3.851   5.637   7.316
  174    HA   PRO  29           HA       PRO  29   6.690  -0.740   8.386
  175    HB2  PRO  29           HB2      PRO  29   4.271  -2.135   9.435
  176    HB3  PRO  29           HB1      PRO  29   5.986  -2.475   9.732
  177    HG2  PRO  29           HG2      PRO  29   4.521  -1.383  11.617
  178    HG3  PRO  29           HG1      PRO  29   6.181  -0.817  11.327
  179    HD2  PRO  29           HD2      PRO  29   3.595   0.433  10.478
  180    HD3  PRO  29           HD1      PRO  29   5.039   1.197  11.174
  181    H    TYR  30           HN       TYR  30   5.264   0.824   6.618
  182    HA   TYR  30           HA       TYR  30   4.223  -1.173   4.732
  183    HB2  TYR  30           HB2      TYR  30   2.965   1.551   4.776
  184    HB3  TYR  30           HB1      TYR  30   2.321   0.050   4.139
  185    HD1  TYR  30           HD1      TYR  30   1.853  -1.789   6.026
  186    HD2  TYR  30           HD2      TYR  30   2.019   2.408   6.693
  187    HE1  TYR  30           HE1      TYR  30   0.510  -2.072   8.068
  188    HE2  TYR  30           HE2      TYR  30   0.678   2.136   8.740
  189    HH   TYR  30           HH       TYR  30   0.100  -0.880  10.179
  190    H    CYS  31           HN       CYS  31   5.908   1.692   5.551
  191    HA   CYS  31           HA       CYS  31   7.347   1.700   3.081
  192    HB2  CYS  31           HB2      CYS  31   5.383   3.239   2.676
  193    HB3  CYS  31           HB1      CYS  31   6.061   4.283   3.919
  194    H    GLY  32           HN       GLY  32   9.043   1.103   4.339
  195    HA2  GLY  32           HA2      GLY  32  10.936   2.831   5.145
  196    HA3  GLY  32           HA1      GLY  32   9.921   2.713   6.580
  197    H    ALA  33           HN       ALA  33   9.207   0.265   6.867
  198    HA   ALA  33           HA       ALA  33  11.139  -1.747   6.275
  199    HB1  ALA  33           HB1      ALA  33  12.372  -0.602   8.082
  200    HB2  ALA  33           HB2      ALA  33  11.878  -2.224   8.567
  201    HB3  ALA  33           HB3      ALA  33  10.991  -0.819   9.158
  202    H    GLY  34           HN       GLY  34   9.534  -3.002   5.577
  203    HA2  GLY  34           HA2      GLY  34   8.072  -4.586   7.362
  204    HA3  GLY  34           HA1      GLY  34   7.010  -3.314   6.776
  205    H    GLN  35           HN       GLN  35   6.495  -3.204   4.581
  206    HA   GLN  35           HA       GLN  35   7.320  -5.355   2.812
  207    HB2  GLN  35           HB2      GLN  35   4.803  -5.749   2.249
  208    HB3  GLN  35           HB1      GLN  35   5.505  -6.555   3.640
  209    HG2  GLN  35           HG2      GLN  35   4.547  -4.787   5.091
  210    HG3  GLN  35           HG1      GLN  35   3.764  -4.095   3.673
  211   HE21  GLN  35          HE21      GLN  35   2.042  -5.192   2.722
  212   HE22  GLN  35          HE22      GLN  35   1.195  -6.456   3.539
  213    H    CYS  36           HN       CYS  36   8.230  -3.056   2.283
  214    HA   CYS  36           HA       CYS  36   6.482  -1.283   0.844
  215    HB2  CYS  36           HB2      CYS  36   9.496  -1.359   0.747
  216    HB3  CYS  36           HB1      CYS  36   8.452  -0.000   0.351
  217    H    GLN  37           HN       GLN  37   5.751  -1.540  -1.162
  218    HA   GLN  37           HA       GLN  37   7.219  -3.244  -3.040
  219    HB2  GLN  37           HB2      GLN  37   4.724  -3.577  -2.477
  220    HB3  GLN  37           HB1      GLN  37   4.445  -2.139  -3.449
  221    HG2  GLN  37           HG2      GLN  37   5.537  -3.265  -5.356
  222    HG3  GLN  37           HG1      GLN  37   5.680  -4.721  -4.374
  223   HE21  GLN  37          HE21      GLN  37   3.880  -5.961  -3.979
  224   HE22  GLN  37          HE22      GLN  37   2.377  -5.727  -4.798
  225    H    SER  38           HN       SER  38   5.634  -0.062  -2.827
  226    HA   SER  38           HA       SER  38   6.771   0.796  -5.349
  227    HB2  SER  38           HB2      SER  38   4.939   2.190  -3.395
  228    HB3  SER  38           HB1      SER  38   5.491   2.906  -4.908
  229    HG   SER  38           HG       SER  38   3.815   1.929  -5.718
  230    H    GLN  39           HN       GLN  39   6.846   1.950  -2.011
  231    HA   GLN  39           HA       GLN  39   9.609   2.834  -2.341
  232    HB2  GLN  39           HB2      GLN  39   7.310   4.656  -1.660
  233    HB3  GLN  39           HB1      GLN  39   8.945   5.023  -1.132
  234    HG2  GLN  39           HG2      GLN  39   9.692   5.025  -3.461
  235    HG3  GLN  39           HG1      GLN  39   8.048   4.663  -3.984
  236   HE21  GLN  39          HE21      GLN  39  10.176   7.069  -2.663
  237   HE22  GLN  39          HE22      GLN  39   9.132   8.423  -2.914
  238    H    CYS  40           HN       CYS  40  10.715   3.227  -0.334
  239    HA   CYS  40           HA       CYS  40   9.352   2.214   2.065
  240    HB2  CYS  40           HB2      CYS  40  11.140   0.676   0.702
  241    HB3  CYS  40           HB1      CYS  40  12.207   1.501   1.833
  Start of MODEL   16
    1    H1   PHE   1           HT1      PHE   1  -6.210  -2.380   5.733
    2    H2   PHE   1           HT2      PHE   1  -7.786  -2.218   5.143
    3    H3   PHE   1           HT3      PHE   1  -6.935  -0.853   5.665
    4    HA   PHE   1           HA       PHE   1  -5.349  -1.098   3.886
    5    HB2  PHE   1           HB2      PHE   1  -7.088  -3.455   3.130
    6    HB3  PHE   1           HB1      PHE   1  -5.867  -2.751   2.079
    7    HD1  PHE   1           HD1      PHE   1  -6.403  -4.586   5.231
    8    HD2  PHE   1           HD2      PHE   1  -3.572  -3.256   2.345
    9    HE1  PHE   1           HE1      PHE   1  -4.702  -6.057   6.231
   10    HE2  PHE   1           HE2      PHE   1  -1.865  -4.723   3.342
   11    HZ   PHE   1           HZ       PHE   1  -2.430  -6.127   5.285
   12    H    GLN   2           HN       GLN   2  -5.666   0.059   1.995
   13    HA   GLN   2           HA       GLN   2  -8.405   0.661   1.149
   14    HB2  GLN   2           HB2      GLN   2  -6.392   2.775   1.940
   15    HB3  GLN   2           HB1      GLN   2  -7.904   3.105   1.113
   16    HG2  GLN   2           HG2      GLN   2  -7.843   1.724   3.773
   17    HG3  GLN   2           HG1      GLN   2  -7.791   3.480   3.640
   18   HE21  GLN   2          HE21      GLN   2  -9.600   4.585   2.880
   19   HE22  GLN   2          HE22      GLN   2 -11.163   3.853   2.814
   20    H    CYS   3           HN       CYS   3  -4.992   0.764   0.583
   21    HA   CYS   3           HA       CYS   3  -5.241   1.662  -2.176
   22    HB2  CYS   3           HB2      CYS   3  -3.511   2.692  -0.908
   23    HB3  CYS   3           HB1      CYS   3  -2.921   1.149  -0.315
   24    H    GLY   4           HN       GLY   4  -3.742   0.538  -3.776
   25    HA2  GLY   4           HA2      GLY   4  -3.179  -1.243  -5.079
   26    HA3  GLY   4           HA1      GLY   4  -2.917  -2.122  -3.593
   27    H    ARG   5           HN       ARG   5  -3.575  -3.959  -4.772
   28    HA   ARG   5           HA       ARG   5  -6.226  -4.223  -5.807
   29    HB2  ARG   5           HB2      ARG   5  -5.623  -6.628  -6.077
   30    HB3  ARG   5           HB1      ARG   5  -4.458  -5.530  -6.802
   31    HG2  ARG   5           HG2      ARG   5  -3.297  -5.818  -4.429
   32    HG3  ARG   5           HG1      ARG   5  -4.164  -7.357  -4.495
   33    HD2  ARG   5           HD2      ARG   5  -3.191  -7.745  -6.734
   34    HD3  ARG   5           HD1      ARG   5  -2.247  -6.270  -6.542
   35    HE   ARG   5           HE       ARG   5  -1.783  -7.987  -4.352
   36   HH11  ARG   5          HH11      ARG   5  -0.999  -7.728  -7.766
   37   HH12  ARG   5          HH12      ARG   5   0.476  -8.621  -7.613
   38   HH21  ARG   5          HH21      ARG   5   1.126  -9.427  -5.582
   39   HH22  ARG   5          HH22      ARG   5   0.152  -9.154  -4.175
   40    H    GLN   6           HN       GLN   6  -4.984  -4.343  -2.650
   41    HA   GLN   6           HA       GLN   6  -6.533  -6.366  -1.428
   42    HB2  GLN   6           HB2      GLN   6  -4.665  -4.490  -0.588
   43    HB3  GLN   6           HB1      GLN   6  -6.139  -4.000   0.233
   44    HG2  GLN   6           HG2      GLN   6  -4.987  -6.788   0.336
   45    HG3  GLN   6           HG1      GLN   6  -4.700  -5.548   1.556
   46   HE21  GLN   6          HE21      GLN   6  -7.020  -7.731   0.161
   47   HE22  GLN   6          HE22      GLN   6  -8.190  -7.625   1.427
   48    H    ALA   7           HN       ALA   7  -7.265  -3.296  -2.687
   49    HA   ALA   7           HA       ALA   7 -10.023  -3.366  -1.695
   50    HB1  ALA   7           HB1      ALA   7  -8.278  -0.942  -2.043
   51    HB2  ALA   7           HB2      ALA   7  -8.745  -1.661  -0.502
   52    HB3  ALA   7           HB3      ALA   7  -9.968  -0.931  -1.544
   53    H    GLY   8           HN       GLY   8  -7.767  -2.331  -4.164
   54    HA2  GLY   8           HA2      GLY   8  -8.879  -3.061  -6.456
   55    HA3  GLY   8           HA1      GLY   8  -9.883  -1.672  -6.061
   56    H    GLY   9           HN       GLY   9  -8.473   0.299  -5.347
   57    HA2  GLY   9           HA2      GLY   9  -5.887   0.694  -6.358
   58    HA3  GLY   9           HA1      GLY   9  -7.029   1.179  -7.601
   59    H    ALA  10           HN       ALA  10  -5.718   1.912  -4.440
   60    HA   ALA  10           HA       ALA  10  -6.691   4.661  -4.683
   61    HB1  ALA  10           HB1      ALA  10  -7.147   3.027  -2.183
   62    HB2  ALA  10           HB2      ALA  10  -8.392   3.517  -3.331
   63    HB3  ALA  10           HB3      ALA  10  -7.530   4.735  -2.393
   64    H    ARG  11           HN       ARG  11  -5.753   6.021  -2.769
   65    HA   ARG  11           HA       ARG  11  -3.081   5.127  -1.949
   66    HB2  ARG  11           HB2      ARG  11  -3.695   7.650  -3.491
   67    HB3  ARG  11           HB1      ARG  11  -2.233   7.467  -2.535
   68    HG2  ARG  11           HG2      ARG  11  -1.545   5.581  -3.899
   69    HG3  ARG  11           HG1      ARG  11  -3.040   5.687  -4.828
   70    HD2  ARG  11           HD2      ARG  11  -1.087   7.967  -4.624
   71    HD3  ARG  11           HD1      ARG  11  -0.968   6.725  -5.869
   72    HE   ARG  11           HE       ARG  11  -3.568   7.906  -5.768
   73   HH11  ARG  11          HH11      ARG  11  -0.325   8.421  -7.015
   74   HH12  ARG  11          HH12      ARG  11  -0.861   9.443  -8.308
   75   HH21  ARG  11          HH21      ARG  11  -4.247   9.244  -7.466
   76   HH22  ARG  11          HH22      ARG  11  -3.080   9.908  -8.561
   77    H    CYS  12           HN       CYS  12  -2.218   6.294  -0.103
   78    HA   CYS  12           HA       CYS  12  -4.330   7.162   1.671
   79    HB2  CYS  12           HB2      CYS  12  -1.418   6.633   2.089
   80    HB3  CYS  12           HB1      CYS  12  -2.378   7.424   3.329
   81    H    SER  13           HN       SER  13  -1.165   8.737   1.373
   82    HA   SER  13           HA       SER  13  -2.434  11.286   1.901
   83    HB2  SER  13           HB2      SER  13  -0.384  10.636   3.155
   84    HB3  SER  13           HB1      SER  13   0.522  10.665   1.643
   85    HG   SER  13           HG       SER  13  -0.215  12.920   1.482
   86    H    ASN  14           HN       ASN  14   0.429  11.446  -0.031
   87    HA   ASN  14           HA       ASN  14  -1.112  11.948  -2.470
   88    HB2  ASN  14           HB2      ASN  14  -0.673  14.079  -1.059
   89    HB3  ASN  14           HB1      ASN  14   0.989  13.923  -1.617
   90   HD21  ASN  14          HD21      ASN  14   1.457  14.238  -3.797
   91   HD22  ASN  14          HD22      ASN  14   0.352  15.020  -4.870
   92    H    GLY  15           HN       GLY  15  -0.226  10.064  -3.318
   93    HA2  GLY  15           HA2      GLY  15   1.260   8.786  -4.515
   94    HA3  GLY  15           HA1      GLY  15   2.064  10.298  -4.893
   95    H    LEU  16           HN       LEU  16   1.700   8.332  -1.933
   96    HA   LEU  16           HA       LEU  16   4.521   8.752  -1.340
   97    HB2  LEU  16           HB2      LEU  16   3.694   7.296   0.773
   98    HB3  LEU  16           HB1      LEU  16   3.542   9.035   0.684
   99    HG   LEU  16           HG       LEU  16   1.183   8.787   0.020
  100   HD11  LEU  16          HD11      LEU  16   0.018   6.776  -0.075
  101   HD12  LEU  16          HD12      LEU  16   1.348   5.871   0.648
  102   HD13  LEU  16          HD13      LEU  16   1.490   6.482  -1.000
  103   HD21  LEU  16          HD21      LEU  16   0.342   8.119   2.170
  104   HD22  LEU  16          HD22      LEU  16   1.837   9.027   2.372
  105   HD23  LEU  16          HD23      LEU  16   1.846   7.271   2.522
  106    H    CYS  17           HN       CYS  17   3.117   5.885  -0.118
  107    HA   CYS  17           HA       CYS  17   4.427   4.136  -2.067
  108    HB2  CYS  17           HB2      CYS  17   4.931   3.346   0.723
  109    HB3  CYS  17           HB1      CYS  17   6.017   3.309  -0.656
  110    H    CYS  18           HN       CYS  18   3.784   1.821  -1.717
  111    HA   CYS  18           HA       CYS  18   1.448   1.412  -0.041
  112    HB2  CYS  18           HB2      CYS  18   0.598   2.326  -2.193
  113    HB3  CYS  18           HB1      CYS  18   1.295   0.940  -3.021
  114    H    SER  19           HN       SER  19   1.220  -0.590   0.702
  115    HA   SER  19           HA       SER  19   3.404  -2.399   0.489
  116    HB2  SER  19           HB2      SER  19   0.713  -2.731   1.825
  117    HB3  SER  19           HB1      SER  19   2.096  -3.802   2.046
  118    HG   SER  19           HG       SER  19   2.919  -1.318   2.464
  119    H    GLN  20           HN       GLN  20   3.284  -4.656   0.024
  120    HA   GLN  20           HA       GLN  20   2.696  -5.337  -2.528
  121    HB2  GLN  20           HB2      GLN  20   2.932  -7.061  -0.091
  122    HB3  GLN  20           HB1      GLN  20   2.718  -7.753  -1.692
  123    HG2  GLN  20           HG2      GLN  20   4.770  -6.678  -2.444
  124    HG3  GLN  20           HG1      GLN  20   4.981  -5.952  -0.851
  125   HE21  GLN  20          HE21      GLN  20   5.587  -7.251   0.882
  126   HE22  GLN  20          HE22      GLN  20   6.252  -8.830   0.659
  127    H    PHE  21           HN       PHE  21   0.513  -5.668   0.170
  128    HA   PHE  21           HA       PHE  21  -1.509  -7.045  -1.370
  129    HB2  PHE  21           HB2      PHE  21  -1.451  -5.932   1.429
  130    HB3  PHE  21           HB1      PHE  21  -2.884  -6.667   0.730
  131    HD1  PHE  21           HD1      PHE  21   0.458  -7.234   2.018
  132    HD2  PHE  21           HD2      PHE  21  -3.002  -9.022   0.317
  133    HE1  PHE  21           HE1      PHE  21   1.275  -9.459   2.720
  134    HE2  PHE  21           HE2      PHE  21  -2.201 -11.255   1.012
  135    HZ   PHE  21           HZ       PHE  21  -0.059 -11.471   2.215
  136    H    GLY  22           HN       GLY  22  -0.921  -3.867  -0.088
  137    HA2  GLY  22           HA2      GLY  22  -1.739  -2.098  -1.723
  138    HA3  GLY  22           HA1      GLY  22  -3.314  -2.825  -1.433
  139    H    TYR  23           HN       TYR  23  -0.570  -1.862   0.604
  140    HA   TYR  23           HA       TYR  23  -2.466  -0.278   2.209
  141    HB2  TYR  23           HB2      TYR  23  -1.171  -2.415   3.190
  142    HB3  TYR  23           HB1      TYR  23   0.073  -1.202   3.464
  143    HD1  TYR  23           HD1      TYR  23  -2.318  -2.894   5.121
  144    HD2  TYR  23           HD2      TYR  23  -1.224   1.150   4.368
  145    HE1  TYR  23           HE1      TYR  23  -3.486  -2.200   7.173
  146    HE2  TYR  23           HE2      TYR  23  -2.390   1.855   6.419
  147    HH   TYR  23           HH       TYR  23  -4.187   1.042   7.887
  148    H    CYS  24           HN       CYS  24  -2.221   1.741   1.614
  149    HA   CYS  24           HA       CYS  24   0.252   2.819   0.657
  150    HB2  CYS  24           HB2      CYS  24  -1.129   5.004   0.742
  151    HB3  CYS  24           HB1      CYS  24  -1.628   3.749  -0.376
  152    H    GLY  25           HN       GLY  25   1.737   3.998   1.624
  153    HA2  GLY  25           HA2      GLY  25   1.322   5.360   4.117
  154    HA3  GLY  25           HA1      GLY  25   2.297   3.909   4.287
  155    H    SER  26           HN       SER  26   3.530   6.046   5.042
  156    HA   SER  26           HA       SER  26   5.601   6.497   3.035
  157    HB2  SER  26           HB2      SER  26   3.902   8.359   2.781
  158    HB3  SER  26           HB1      SER  26   4.316   8.867   4.413
  159    HG   SER  26           HG       SER  26   5.812   9.016   2.061
  160    H    THR  27           HN       THR  27   4.730   5.710   6.072
  161    HA   THR  27           HA       THR  27   7.342   6.214   7.184
  162    HB   THR  27           HB       THR  27   6.637   8.243   7.983
  163    HG1  THR  27           HG1      THR  27   5.425   6.822  10.086
  164   HG21  THR  27          HG21      THR  27   4.449   8.954   8.451
  165   HG22  THR  27          HG22      THR  27   3.866   7.309   8.690
  166   HG23  THR  27          HG23      THR  27   4.267   7.874   7.068
  167    HA   PRO  28           HA       PRO  28   4.958   3.089  10.003
  168    HB2  PRO  28           HB2      PRO  28   2.603   2.129   8.601
  169    HB3  PRO  28           HB1      PRO  28   2.674   3.034  10.122
  170    HG2  PRO  28           HG2      PRO  28   1.597   4.055   7.869
  171    HG3  PRO  28           HG1      PRO  28   2.397   5.053   9.100
  172    HD2  PRO  28           HD2      PRO  28   3.554   3.975   6.528
  173    HD3  PRO  28           HD1      PRO  28   3.614   5.636   7.170
  174    HA   PRO  29           HA       PRO  29   6.367  -0.830   8.169
  175    HB2  PRO  29           HB2      PRO  29   4.422  -2.724   8.711
  176    HB3  PRO  29           HB1      PRO  29   5.643  -2.180   9.876
  177    HG2  PRO  29           HG2      PRO  29   2.812  -1.293   9.566
  178    HG3  PRO  29           HG1      PRO  29   3.719  -1.681  11.044
  179    HD2  PRO  29           HD2      PRO  29   3.342   0.840  10.351
  180    HD3  PRO  29           HD1      PRO  29   4.908   0.315  10.997
  181    H    TYR  30           HN       TYR  30   5.132   0.835   6.374
  182    HA   TYR  30           HA       TYR  30   4.223  -1.021   4.299
  183    HB2  TYR  30           HB2      TYR  30   2.960   1.709   4.481
  184    HB3  TYR  30           HB1      TYR  30   2.389   0.290   3.619
  185    HD1  TYR  30           HD1      TYR  30   1.818   2.334   6.382
  186    HD2  TYR  30           HD2      TYR  30   1.795  -1.764   5.244
  187    HE1  TYR  30           HE1      TYR  30   0.322   1.819   8.269
  188    HE2  TYR  30           HE2      TYR  30   0.301  -2.291   7.127
  189    HH   TYR  30           HH       TYR  30  -1.311   0.100   8.912
  190    H    CYS  31           HN       CYS  31   5.742   1.890   5.388
  191    HA   CYS  31           HA       CYS  31   7.373   2.010   3.010
  192    HB2  CYS  31           HB2      CYS  31   5.404   3.625   2.719
  193    HB3  CYS  31           HB1      CYS  31   6.169   4.574   3.988
  194    H    GLY  32           HN       GLY  32   8.945   1.226   4.370
  195    HA2  GLY  32           HA2      GLY  32  10.853   2.869   5.350
  196    HA3  GLY  32           HA1      GLY  32   9.770   2.677   6.727
  197    H    ALA  33           HN       ALA  33   9.155   0.397   7.218
  198    HA   ALA  33           HA       ALA  33  10.950  -1.713   6.440
  199    HB1  ALA  33           HB1      ALA  33  10.984  -0.784   9.325
  200    HB2  ALA  33           HB2      ALA  33  12.309  -0.604   8.175
  201    HB3  ALA  33           HB3      ALA  33  11.798  -2.212   8.686
  202    H    GLY  34           HN       GLY  34   9.044  -2.620   5.733
  203    HA2  GLY  34           HA2      GLY  34   7.711  -4.313   7.564
  204    HA3  GLY  34           HA1      GLY  34   6.678  -2.951   7.154
  205    H    GLN  35           HN       GLN  35   6.098  -2.622   4.942
  206    HA   GLN  35           HA       GLN  35   6.469  -4.923   3.162
  207    HB2  GLN  35           HB2      GLN  35   3.769  -3.689   3.797
  208    HB3  GLN  35           HB1      GLN  35   4.061  -4.932   2.591
  209    HG2  GLN  35           HG2      GLN  35   4.774  -5.406   5.457
  210    HG3  GLN  35           HG1      GLN  35   3.112  -5.592   4.904
  211   HE21  GLN  35          HE21      GLN  35   6.353  -6.828   4.729
  212   HE22  GLN  35          HE22      GLN  35   5.960  -8.333   3.977
  213    H    CYS  36           HN       CYS  36   7.988  -3.019   2.500
  214    HA   CYS  36           HA       CYS  36   6.668  -0.942   0.960
  215    HB2  CYS  36           HB2      CYS  36   8.989  -0.179   0.476
  216    HB3  CYS  36           HB1      CYS  36   8.631  -0.303   2.193
  217    H    GLN  37           HN       GLN  37   5.765  -1.572  -0.918
  218    HA   GLN  37           HA       GLN  37   7.204  -3.384  -2.700
  219    HB2  GLN  37           HB2      GLN  37   4.672  -3.491  -2.082
  220    HB3  GLN  37           HB1      GLN  37   4.504  -2.201  -3.264
  221    HG2  GLN  37           HG2      GLN  37   5.522  -3.657  -4.965
  222    HG3  GLN  37           HG1      GLN  37   5.613  -4.954  -3.778
  223   HE21  GLN  37          HE21      GLN  37   4.298  -6.343  -4.890
  224   HE22  GLN  37          HE22      GLN  37   2.603  -6.084  -5.102
  225    H    SER  38           HN       SER  38   5.666  -0.163  -2.803
  226    HA   SER  38           HA       SER  38   6.829   0.451  -5.373
  227    HB2  SER  38           HB2      SER  38   5.092   2.079  -3.515
  228    HB3  SER  38           HB1      SER  38   5.640   2.638  -5.096
  229    HG   SER  38           HG       SER  38   4.513   0.918  -6.037
  230    H    GLN  39           HN       GLN  39   7.060   1.813  -2.124
  231    HA   GLN  39           HA       GLN  39   9.794   2.690  -2.700
  232    HB2  GLN  39           HB2      GLN  39   7.518   4.432  -1.821
  233    HB3  GLN  39           HB1      GLN  39   9.154   4.814  -1.306
  234    HG2  GLN  39           HG2      GLN  39   9.856   4.919  -3.650
  235    HG3  GLN  39           HG1      GLN  39   8.203   4.557  -4.150
  236   HE21  GLN  39          HE21      GLN  39  10.332   6.932  -2.772
  237   HE22  GLN  39          HE22      GLN  39   9.269   8.283  -2.941
  238    H    CYS  40           HN       CYS  40  11.194   2.519  -1.029
  239    HA   CYS  40           HA       CYS  40  10.108   1.566   1.540
  240    HB2  CYS  40           HB2      CYS  40  11.608   0.064  -0.102
  241    HB3  CYS  40           HB1      CYS  40  12.897   0.873   0.784
  Start of MODEL   17
    1    H1   PHE   1           HT1      PHE   1  -5.864  -1.548   5.649
    2    H2   PHE   1           HT2      PHE   1  -7.456  -1.196   5.199
    3    H3   PHE   1           HT3      PHE   1  -6.350   0.060   5.446
    4    HA   PHE   1           HA       PHE   1  -5.043  -0.653   3.571
    5    HB2  PHE   1           HB2      PHE   1  -7.166  -2.793   3.389
    6    HB3  PHE   1           HB1      PHE   1  -6.088  -2.397   2.057
    7    HD1  PHE   1           HD1      PHE   1  -6.314  -3.852   5.412
    8    HD2  PHE   1           HD2      PHE   1  -3.781  -3.042   2.091
    9    HE1  PHE   1           HE1      PHE   1  -4.633  -5.401   6.324
   10    HE2  PHE   1           HE2      PHE   1  -2.094  -4.587   2.998
   11    HZ   PHE   1           HZ       PHE   1  -2.519  -5.771   5.115
   12    H    GLN   2           HN       GLN   2  -5.339   0.485   1.729
   13    HA   GLN   2           HA       GLN   2  -8.038   1.323   0.958
   14    HB2  GLN   2           HB2      GLN   2  -5.770   3.235   1.535
   15    HB3  GLN   2           HB1      GLN   2  -7.255   3.688   0.714
   16    HG2  GLN   2           HG2      GLN   2  -8.514   3.005   2.745
   17    HG3  GLN   2           HG1      GLN   2  -6.970   2.729   3.551
   18   HE21  GLN   2          HE21      GLN   2  -9.153   5.108   2.268
   19   HE22  GLN   2          HE22      GLN   2  -8.415   6.482   3.010
   20    H    CYS   3           HN       CYS   3  -4.654   1.075   0.224
   21    HA   CYS   3           HA       CYS   3  -5.034   1.697  -2.605
   22    HB2  CYS   3           HB2      CYS   3  -3.193   2.795  -1.517
   23    HB3  CYS   3           HB1      CYS   3  -2.590   1.275  -0.872
   24    H    GLY   4           HN       GLY   4  -3.606   0.316  -4.115
   25    HA2  GLY   4           HA2      GLY   4  -3.147  -1.643  -5.184
   26    HA3  GLY   4           HA1      GLY   4  -2.937  -2.355  -3.603
   27    H    ARG   5           HN       ARG   5  -3.712  -4.246  -4.695
   28    HA   ARG   5           HA       ARG   5  -6.441  -4.410  -5.562
   29    HB2  ARG   5           HB2      ARG   5  -5.957  -6.858  -5.783
   30    HB3  ARG   5           HB1      ARG   5  -4.835  -5.826  -6.657
   31    HG2  ARG   5           HG2      ARG   5  -3.469  -6.076  -4.381
   32    HG3  ARG   5           HG1      ARG   5  -4.373  -7.593  -4.334
   33    HD2  ARG   5           HD2      ARG   5  -3.607  -8.056  -6.639
   34    HD3  ARG   5           HD1      ARG   5  -2.620  -6.597  -6.567
   35    HE   ARG   5           HE       ARG   5  -2.009  -8.286  -4.385
   36   HH11  ARG   5          HH11      ARG   5  -1.490  -8.071  -7.852
   37   HH12  ARG   5          HH12      ARG   5  -0.018  -8.981  -7.804
   38   HH21  ARG   5          HH21      ARG   5   0.779  -9.775  -5.821
   39   HH22  ARG   5          HH22      ARG   5  -0.080  -9.476  -4.347
   40    H    GLN   6           HN       GLN   6  -4.960  -4.511  -2.503
   41    HA   GLN   6           HA       GLN   6  -6.535  -6.420  -1.127
   42    HB2  GLN   6           HB2      GLN   6  -4.449  -4.753  -0.456
   43    HB3  GLN   6           HB1      GLN   6  -5.792  -4.039   0.424
   44    HG2  GLN   6           HG2      GLN   6  -4.946  -6.935   0.613
   45    HG3  GLN   6           HG1      GLN   6  -4.516  -5.677   1.769
   46   HE21  GLN   6          HE21      GLN   6  -7.050  -7.711   0.544
   47   HE22  GLN   6          HE22      GLN   6  -8.176  -7.436   1.826
   48    H    ALA   7           HN       ALA   7  -7.169  -3.350  -2.406
   49    HA   ALA   7           HA       ALA   7  -9.807  -3.182  -1.132
   50    HB1  ALA   7           HB1      ALA   7  -9.582  -0.753  -1.144
   51    HB2  ALA   7           HB2      ALA   7  -7.962  -0.908  -1.824
   52    HB3  ALA   7           HB3      ALA   7  -8.298  -1.505  -0.199
   53    H    GLY   8           HN       GLY   8  -7.786  -2.506  -3.907
   54    HA2  GLY   8           HA2      GLY   8  -9.201  -3.276  -6.000
   55    HA3  GLY   8           HA1      GLY   8 -10.066  -1.801  -5.591
   56    H    GLY   9           HN       GLY   9  -8.616   0.163  -5.327
   57    HA2  GLY   9           HA2      GLY   9  -6.089   0.361  -6.526
   58    HA3  GLY   9           HA1      GLY   9  -7.294   0.692  -7.758
   59    H    ALA  10           HN       ALA  10  -6.058   1.736  -4.605
   60    HA   ALA  10           HA       ALA  10  -6.805   4.494  -5.262
   61    HB1  ALA  10           HB1      ALA  10  -8.648   3.621  -3.894
   62    HB2  ALA  10           HB2      ALA  10  -7.763   4.894  -3.053
   63    HB3  ALA  10           HB3      ALA  10  -7.502   3.204  -2.619
   64    H    ARG  11           HN       ARG  11  -5.975   5.899  -3.170
   65    HA   ARG  11           HA       ARG  11  -3.308   4.987  -2.350
   66    HB2  ARG  11           HB2      ARG  11  -3.915   7.552  -3.826
   67    HB3  ARG  11           HB1      ARG  11  -2.462   7.347  -2.859
   68    HG2  ARG  11           HG2      ARG  11  -1.801   5.451  -4.269
   69    HG3  ARG  11           HG1      ARG  11  -3.248   5.690  -5.251
   70    HD2  ARG  11           HD2      ARG  11  -1.191   7.846  -4.828
   71    HD3  ARG  11           HD1      ARG  11  -1.087   6.679  -6.144
   72    HE   ARG  11           HE       ARG  11  -3.631   7.882  -6.169
   73   HH11  ARG  11          HH11      ARG  11  -0.288   8.708  -6.864
   74   HH12  ARG  11          HH12      ARG  11  -0.710   9.924  -8.023
   75   HH21  ARG  11          HH21      ARG  11  -4.159   9.478  -7.690
   76   HH22  ARG  11          HH22      ARG  11  -2.900  10.359  -8.489
   77    H    CYS  12           HN       CYS  12  -2.439   6.164  -0.496
   78    HA   CYS  12           HA       CYS  12  -4.555   6.896   1.337
   79    HB2  CYS  12           HB2      CYS  12  -1.596   6.532   1.664
   80    HB3  CYS  12           HB1      CYS  12  -2.581   7.198   2.958
   81    H    SER  13           HN       SER  13  -1.697   8.661   1.997
   82    HA   SER  13           HA       SER  13  -3.098  11.133   2.072
   83    HB2  SER  13           HB2      SER  13  -1.290  10.519   3.682
   84    HB3  SER  13           HB1      SER  13  -0.119  10.656   2.372
   85    HG   SER  13           HG       SER  13  -0.068  12.621   3.265
   86    H    ASN  14           HN       ASN  14  -0.159  10.317   0.300
   87    HA   ASN  14           HA       ASN  14  -1.111  11.762  -2.063
   88    HB2  ASN  14           HB2      ASN  14   1.478  12.311  -0.594
   89    HB3  ASN  14           HB1      ASN  14   1.216  12.794  -2.266
   90   HD21  ASN  14          HD21      ASN  14   0.340  13.332   1.050
   91   HD22  ASN  14          HD22      ASN  14  -0.469  14.838   0.805
   92    H    GLY  15           HN       GLY  15   1.216  11.535  -3.603
   93    HA2  GLY  15           HA2      GLY  15   1.154   8.739  -4.274
   94    HA3  GLY  15           HA1      GLY  15   2.096   9.987  -5.082
   95    H    LEU  16           HN       LEU  16   1.943   8.432  -1.905
   96    HA   LEU  16           HA       LEU  16   4.791   8.686  -1.497
   97    HB2  LEU  16           HB2      LEU  16   3.978   7.275   0.659
   98    HB3  LEU  16           HB1      LEU  16   3.884   9.019   0.547
   99    HG   LEU  16           HG       LEU  16   1.481   8.736  -0.202
  100   HD11  LEU  16          HD11      LEU  16   0.320   6.709   0.207
  101   HD12  LEU  16          HD12      LEU  16   1.770   5.943   0.855
  102   HD13  LEU  16          HD13      LEU  16   1.677   6.348  -0.859
  103   HD21  LEU  16          HD21      LEU  16   2.157   9.379   2.076
  104   HD22  LEU  16          HD22      LEU  16   2.126   7.674   2.530
  105   HD23  LEU  16          HD23      LEU  16   0.642   8.480   2.025
  106    H    CYS  17           HN       CYS  17   3.347   5.852  -0.223
  107    HA   CYS  17           HA       CYS  17   4.649   4.093  -2.173
  108    HB2  CYS  17           HB2      CYS  17   5.017   3.273   0.634
  109    HB3  CYS  17           HB1      CYS  17   6.164   3.230  -0.699
  110    H    CYS  18           HN       CYS  18   3.844   1.886  -2.083
  111    HA   CYS  18           HA       CYS  18   1.445   1.471  -0.475
  112    HB2  CYS  18           HB2      CYS  18   0.651   2.413  -2.581
  113    HB3  CYS  18           HB1      CYS  18   1.503   1.166  -3.479
  114    H    SER  19           HN       SER  19   1.362  -0.418   0.426
  115    HA   SER  19           HA       SER  19   3.451  -2.305   0.204
  116    HB2  SER  19           HB2      SER  19   0.787  -2.422   1.616
  117    HB3  SER  19           HB1      SER  19   2.035  -3.651   1.779
  118    HG   SER  19           HG       SER  19   2.609  -2.355   3.364
  119    H    GLN  20           HN       GLN  20   3.361  -4.515  -0.256
  120    HA   GLN  20           HA       GLN  20   2.675  -5.293  -2.747
  121    HB2  GLN  20           HB2      GLN  20   3.031  -6.934  -0.269
  122    HB3  GLN  20           HB1      GLN  20   2.779  -7.677  -1.842
  123    HG2  GLN  20           HG2      GLN  20   4.784  -6.576  -2.690
  124    HG3  GLN  20           HG1      GLN  20   5.032  -5.814  -1.120
  125   HE21  GLN  20          HE21      GLN  20   5.719  -7.063   0.618
  126   HE22  GLN  20          HE22      GLN  20   6.406  -8.633   0.407
  127    H    PHE  21           HN       PHE  21   0.608  -5.634   0.047
  128    HA   PHE  21           HA       PHE  21  -1.442  -7.059  -1.407
  129    HB2  PHE  21           HB2      PHE  21  -1.293  -5.933   1.381
  130    HB3  PHE  21           HB1      PHE  21  -2.748  -6.683   0.742
  131    HD1  PHE  21           HD1      PHE  21   0.671  -7.223   1.852
  132    HD2  PHE  21           HD2      PHE  21  -2.881  -9.032   0.384
  133    HE1  PHE  21           HE1      PHE  21   1.534  -9.440   2.525
  134    HE2  PHE  21           HE2      PHE  21  -2.036 -11.258   1.050
  135    HZ   PHE  21           HZ       PHE  21   0.176 -11.458   2.122
  136    H    GLY  22           HN       GLY  22  -0.917  -3.872  -0.106
  137    HA2  GLY  22           HA2      GLY  22  -1.826  -2.138  -1.761
  138    HA3  GLY  22           HA1      GLY  22  -3.370  -2.886  -1.373
  139    H    TYR  23           HN       TYR  23  -0.552  -1.949   0.576
  140    HA   TYR  23           HA       TYR  23  -2.366  -0.264   2.171
  141    HB2  TYR  23           HB2      TYR  23  -1.109  -2.437   3.177
  142    HB3  TYR  23           HB1      TYR  23   0.125  -1.216   3.472
  143    HD1  TYR  23           HD1      TYR  23  -2.193  -2.906   5.158
  144    HD2  TYR  23           HD2      TYR  23  -1.322   1.157   4.237
  145    HE1  TYR  23           HE1      TYR  23  -3.428  -2.191   7.163
  146    HE2  TYR  23           HE2      TYR  23  -2.555   1.883   6.241
  147    HH   TYR  23           HH       TYR  23  -3.512  -0.265   8.687
  148    H    CYS  24           HN       CYS  24  -2.054   1.705   1.510
  149    HA   CYS  24           HA       CYS  24   0.499   2.671   0.604
  150    HB2  CYS  24           HB2      CYS  24  -0.918   4.873   0.480
  151    HB3  CYS  24           HB1      CYS  24  -1.221   3.574  -0.661
  152    H    GLY  25           HN       GLY  25   1.899   3.959   1.565
  153    HA2  GLY  25           HA2      GLY  25   1.306   5.475   3.930
  154    HA3  GLY  25           HA1      GLY  25   2.284   4.054   4.259
  155    H    SER  26           HN       SER  26   3.529   6.119   4.986
  156    HA   SER  26           HA       SER  26   5.651   6.561   3.023
  157    HB2  SER  26           HB2      SER  26   5.645   9.049   3.524
  158    HB3  SER  26           HB1      SER  26   4.266   8.498   2.581
  159    HG   SER  26           HG       SER  26   3.267   9.606   4.102
  160    H    THR  27           HN       THR  27   4.626   5.917   6.112
  161    HA   THR  27           HA       THR  27   7.259   6.319   7.251
  162    HB   THR  27           HB       THR  27   6.500   8.397   7.936
  163    HG1  THR  27           HG1      THR  27   5.513   6.939  10.143
  164   HG21  THR  27          HG21      THR  27   4.124   8.019   7.177
  165   HG22  THR  27          HG22      THR  27   4.302   9.002   8.629
  166   HG23  THR  27          HG23      THR  27   3.806   7.316   8.764
  167    HA   PRO  28           HA       PRO  28   4.749   3.281  10.052
  168    HB2  PRO  28           HB2      PRO  28   2.453   2.290   8.578
  169    HB3  PRO  28           HB1      PRO  28   2.462   3.234  10.077
  170    HG2  PRO  28           HG2      PRO  28   1.483   4.199   7.755
  171    HG3  PRO  28           HG1      PRO  28   2.236   5.228   8.992
  172    HD2  PRO  28           HD2      PRO  28   3.495   4.076   6.502
  173    HD3  PRO  28           HD1      PRO  28   3.531   5.753   7.097
  174    HA   PRO  29           HA       PRO  29   6.242  -0.645   8.349
  175    HB2  PRO  29           HB2      PRO  29   4.327  -2.565   8.893
  176    HB3  PRO  29           HB1      PRO  29   5.491  -1.951  10.082
  177    HG2  PRO  29           HG2      PRO  29   2.653  -1.146   9.642
  178    HG3  PRO  29           HG1      PRO  29   3.512  -1.467  11.164
  179    HD2  PRO  29           HD2      PRO  29   3.101   1.024  10.368
  180    HD3  PRO  29           HD1      PRO  29   4.645   0.557  11.108
  181    H    TYR  30           HN       TYR  30   5.050   0.942   6.465
  182    HA   TYR  30           HA       TYR  30   4.201  -0.988   4.429
  183    HB2  TYR  30           HB2      TYR  30   2.933   1.745   4.460
  184    HB3  TYR  30           HB1      TYR  30   2.381   0.284   3.655
  185    HD1  TYR  30           HD1      TYR  30   1.771  -1.688   5.389
  186    HD2  TYR  30           HD2      TYR  30   1.715   2.473   6.272
  187    HE1  TYR  30           HE1      TYR  30   0.229  -2.117   7.258
  188    HE2  TYR  30           HE2      TYR  30   0.172   2.054   8.146
  189    HH   TYR  30           HH       TYR  30  -1.459   0.358   8.847
  190    H    CYS  31           HN       CYS  31   5.701   1.943   5.460
  191    HA   CYS  31           HA       CYS  31   7.391   1.982   3.130
  192    HB2  CYS  31           HB2      CYS  31   5.437   3.598   2.715
  193    HB3  CYS  31           HB1      CYS  31   6.181   4.598   3.958
  194    H    GLY  32           HN       GLY  32   8.911   1.244   4.533
  195    HA2  GLY  32           HA2      GLY  32  10.801   2.889   5.546
  196    HA3  GLY  32           HA1      GLY  32   9.677   2.716   6.894
  197    H    ALA  33           HN       ALA  33   8.908   0.319   7.084
  198    HA   ALA  33           HA       ALA  33  10.759  -1.757   6.464
  199    HB1  ALA  33           HB1      ALA  33  10.612  -0.913   9.373
  200    HB2  ALA  33           HB2      ALA  33  12.016  -0.723   8.321
  201    HB3  ALA  33           HB3      ALA  33  11.445  -2.337   8.746
  202    H    GLY  34           HN       GLY  34   9.074  -2.869   5.686
  203    HA2  GLY  34           HA2      GLY  34   7.486  -4.397   7.459
  204    HA3  GLY  34           HA1      GLY  34   6.520  -3.108   6.755
  205    H    GLN  35           HN       GLN  35   6.043  -3.120   4.587
  206    HA   GLN  35           HA       GLN  35   6.952  -5.326   2.921
  207    HB2  GLN  35           HB2      GLN  35   4.451  -5.674   2.233
  208    HB3  GLN  35           HB1      GLN  35   5.072  -6.471   3.667
  209    HG2  GLN  35           HG2      GLN  35   4.095  -4.629   5.033
  210    HG3  GLN  35           HG1      GLN  35   3.361  -3.992   3.564
  211   HE21  GLN  35          HE21      GLN  35   1.682  -5.146   2.580
  212   HE22  GLN  35          HE22      GLN  35   0.800  -6.368   3.422
  213    H    CYS  36           HN       CYS  36   7.926  -3.050   2.418
  214    HA   CYS  36           HA       CYS  36   6.322  -1.279   0.822
  215    HB2  CYS  36           HB2      CYS  36   8.607  -0.264   0.293
  216    HB3  CYS  36           HB1      CYS  36   8.095  -0.255   1.978
  217    H    GLN  37           HN       GLN  37   5.740  -1.555  -1.222
  218    HA   GLN  37           HA       GLN  37   7.315  -3.304  -2.968
  219    HB2  GLN  37           HB2      GLN  37   4.778  -3.589  -2.561
  220    HB3  GLN  37           HB1      GLN  37   4.592  -2.182  -3.597
  221    HG2  GLN  37           HG2      GLN  37   5.861  -3.414  -5.358
  222    HG3  GLN  37           HG1      GLN  37   5.787  -4.841  -4.325
  223   HE21  GLN  37          HE21      GLN  37   3.855  -5.923  -4.078
  224   HE22  GLN  37          HE22      GLN  37   2.476  -5.619  -5.074
  225    H    SER  38           HN       SER  38   5.709  -0.116  -2.967
  226    HA   SER  38           HA       SER  38   6.977   0.682  -5.430
  227    HB2  SER  38           HB2      SER  38   4.627   1.353  -4.772
  228    HB3  SER  38           HB1      SER  38   5.353   2.420  -3.572
  229    HG   SER  38           HG       SER  38   4.886   3.478  -5.570
  230    H    GLN  39           HN       GLN  39   6.984   1.987  -2.144
  231    HA   GLN  39           HA       GLN  39   9.803   2.713  -2.421
  232    HB2  GLN  39           HB2      GLN  39   7.559   4.625  -1.836
  233    HB3  GLN  39           HB1      GLN  39   9.175   4.930  -1.216
  234    HG2  GLN  39           HG2      GLN  39  10.042   4.845  -3.521
  235    HG3  GLN  39           HG1      GLN  39   8.393   4.629  -4.107
  236   HE21  GLN  39          HE21      GLN  39   6.958   6.352  -4.030
  237   HE22  GLN  39          HE22      GLN  39   7.483   7.979  -3.787
  238    H    CYS  40           HN       CYS  40  10.947   2.842  -0.487
  239    HA   CYS  40           HA       CYS  40   9.513   1.858   1.892
  240    HB2  CYS  40           HB2      CYS  40  11.399   0.454   0.514
  241    HB3  CYS  40           HB1      CYS  40  12.397   1.268   1.714
  Start of MODEL   18
    1    H1   PHE   1           HT1      PHE   1  -6.597  -0.336   5.550
    2    H2   PHE   1           HT2      PHE   1  -6.065  -1.934   5.705
    3    H3   PHE   1           HT3      PHE   1  -7.670  -1.615   5.281
    4    HA   PHE   1           HA       PHE   1  -5.291  -0.963   3.644
    5    HB2  PHE   1           HB2      PHE   1  -7.341  -3.168   3.460
    6    HB3  PHE   1           HB1      PHE   1  -6.341  -2.692   2.092
    7    HD1  PHE   1           HD1      PHE   1  -3.995  -3.207   2.026
    8    HD2  PHE   1           HD2      PHE   1  -6.370  -4.275   5.392
    9    HE1  PHE   1           HE1      PHE   1  -2.209  -4.706   2.807
   10    HE2  PHE   1           HE2      PHE   1  -4.586  -5.775   6.181
   11    HZ   PHE   1           HZ       PHE   1  -2.501  -5.994   4.886
   12    H    GLN   2           HN       GLN   2  -5.626   0.260   1.877
   13    HA   GLN   2           HA       GLN   2  -8.353   1.008   1.116
   14    HB2  GLN   2           HB2      GLN   2  -6.169   2.992   1.778
   15    HB3  GLN   2           HB1      GLN   2  -7.672   3.413   0.974
   16    HG2  GLN   2           HG2      GLN   2  -7.658   2.099   3.668
   17    HG3  GLN   2           HG1      GLN   2  -7.470   3.842   3.490
   18   HE21  GLN   2          HE21      GLN   2  -9.622   1.135   3.149
   19   HE22  GLN   2          HE22      GLN   2 -11.077   2.051   2.975
   20    H    CYS   3           HN       CYS   3  -4.937   1.101   0.413
   21    HA   CYS   3           HA       CYS   3  -5.358   1.690  -2.414
   22    HB2  CYS   3           HB2      CYS   3  -3.623   2.955  -1.385
   23    HB3  CYS   3           HB1      CYS   3  -2.928   1.530  -0.630
   24    H    GLY   4           HN       GLY   4  -3.922   0.451  -3.978
   25    HA2  GLY   4           HA2      GLY   4  -3.201  -1.463  -5.007
   26    HA3  GLY   4           HA1      GLY   4  -3.054  -2.192  -3.426
   27    H    ARG   5           HN       ARG   5  -3.681  -4.087  -4.651
   28    HA   ARG   5           HA       ARG   5  -6.375  -4.327  -5.619
   29    HB2  ARG   5           HB2      ARG   5  -5.765  -6.736  -5.952
   30    HB3  ARG   5           HB1      ARG   5  -4.680  -5.604  -6.746
   31    HG2  ARG   5           HG2      ARG   5  -3.339  -5.897  -4.470
   32    HG3  ARG   5           HG1      ARG   5  -4.177  -7.452  -4.490
   33    HD2  ARG   5           HD2      ARG   5  -3.365  -7.794  -6.802
   34    HD3  ARG   5           HD1      ARG   5  -2.441  -6.300  -6.660
   35    HE   ARG   5           HE       ARG   5  -1.807  -8.079  -4.542
   36   HH11  ARG   5          HH11      ARG   5  -1.187  -7.587  -7.965
   37   HH12  ARG   5          HH12      ARG   5   0.335  -8.414  -7.925
   38   HH21  ARG   5          HH21      ARG   5   1.112  -9.300  -5.972
   39   HH22  ARG   5          HH22      ARG   5   0.188  -9.156  -4.514
   40    H    GLN   6           HN       GLN   6  -4.976  -4.523  -2.528
   41    HA   GLN   6           HA       GLN   6  -6.497  -6.581  -1.308
   42    HB2  GLN   6           HB2      GLN   6  -4.487  -4.899  -0.491
   43    HB3  GLN   6           HB1      GLN   6  -5.868  -4.261   0.389
   44    HG2  GLN   6           HG2      GLN   6  -4.977  -7.147   0.453
   45    HG3  GLN   6           HG1      GLN   6  -4.562  -5.940   1.668
   46   HE21  GLN   6          HE21      GLN   6  -7.079  -7.929   0.333
   47   HE22  GLN   6          HE22      GLN   6  -8.211  -7.723   1.622
   48    H    ALA   7           HN       ALA   7  -7.249  -3.488  -2.448
   49    HA   ALA   7           HA       ALA   7  -9.910  -3.504  -1.215
   50    HB1  ALA   7           HB1      ALA   7  -8.160  -1.109  -1.718
   51    HB2  ALA   7           HB2      ALA   7  -8.501  -1.824  -0.143
   52    HB3  ALA   7           HB3      ALA   7  -9.800  -1.072  -1.070
   53    H    GLY   8           HN       GLY   8  -7.868  -2.555  -3.897
   54    HA2  GLY   8           HA2      GLY   8  -9.238  -3.264  -6.055
   55    HA3  GLY   8           HA1      GLY   8 -10.138  -1.832  -5.580
   56    H    GLY   9           HN       GLY   9  -8.725   0.143  -5.182
   57    HA2  GLY   9           HA2      GLY   9  -6.192   0.454  -6.344
   58    HA3  GLY   9           HA1      GLY   9  -7.394   0.835  -7.567
   59    H    ALA  10           HN       ALA  10  -5.958   1.814  -4.527
   60    HA   ALA  10           HA       ALA  10  -6.967   4.532  -4.942
   61    HB1  ALA  10           HB1      ALA  10  -7.650   4.781  -2.614
   62    HB2  ALA  10           HB2      ALA  10  -7.225   3.100  -2.294
   63    HB3  ALA  10           HB3      ALA  10  -8.553   3.480  -3.390
   64    H    ARG  11           HN       ARG  11  -5.952   5.951  -2.986
   65    HA   ARG  11           HA       ARG  11  -3.160   5.181  -2.499
   66    HB2  ARG  11           HB2      ARG  11  -4.086   7.704  -3.877
   67    HB3  ARG  11           HB1      ARG  11  -2.522   7.594  -3.084
   68    HG2  ARG  11           HG2      ARG  11  -1.779   5.916  -4.592
   69    HG3  ARG  11           HG1      ARG  11  -3.399   5.709  -5.258
   70    HD2  ARG  11           HD2      ARG  11  -2.169   6.984  -6.835
   71    HD3  ARG  11           HD1      ARG  11  -3.272   8.098  -6.033
   72    HE   ARG  11           HE       ARG  11  -0.879   8.208  -4.640
   73   HH11  ARG  11          HH11      ARG  11  -1.960   8.954  -7.897
   74   HH12  ARG  11          HH12      ARG  11  -0.769  10.189  -8.133
   75   HH21  ARG  11          HH21      ARG  11   0.666   9.834  -4.969
   76   HH22  ARG  11          HH22      ARG  11   0.717  10.685  -6.476
   77    H    CYS  12           HN       CYS  12  -2.170   6.297  -0.705
   78    HA   CYS  12           HA       CYS  12  -4.114   7.018   1.311
   79    HB2  CYS  12           HB2      CYS  12  -1.205   6.421   1.341
   80    HB3  CYS  12           HB1      CYS  12  -1.878   7.335   2.682
   81    H    SER  13           HN       SER  13  -1.168   8.713   1.749
   82    HA   SER  13           HA       SER  13  -2.583  11.211   1.900
   83    HB2  SER  13           HB2      SER  13  -0.945  10.530   3.638
   84    HB3  SER  13           HB1      SER  13   0.342  10.638   2.439
   85    HG   SER  13           HG       SER  13  -0.489  12.558   3.954
   86    H    ASN  14           HN       ASN  14   0.585  10.615   0.454
   87    HA   ASN  14           HA       ASN  14  -0.206  12.159  -1.922
   88    HB2  ASN  14           HB2      ASN  14   2.240  12.570  -0.194
   89    HB3  ASN  14           HB1      ASN  14   2.129  13.190  -1.837
   90   HD21  ASN  14          HD21      ASN  14   0.955  13.460   1.418
   91   HD22  ASN  14          HD22      ASN  14   0.165  14.984   1.224
   92    H    GLY  15           HN       GLY  15   2.390  12.068  -3.133
   93    HA2  GLY  15           HA2      GLY  15   2.277   9.474  -4.313
   94    HA3  GLY  15           HA1      GLY  15   3.463  10.723  -4.656
   95    H    LEU  16           HN       LEU  16   2.544   8.456  -2.114
   96    HA   LEU  16           HA       LEU  16   5.312   8.206  -1.225
   97    HB2  LEU  16           HB2      LEU  16   4.027   6.710   0.571
   98    HB3  LEU  16           HB1      LEU  16   4.073   8.453   0.695
   99    HG   LEU  16           HG       LEU  16   1.800   8.308  -0.625
  100   HD11  LEU  16          HD11      LEU  16   2.009   5.834  -0.932
  101   HD12  LEU  16          HD12      LEU  16   0.485   6.399  -0.252
  102   HD13  LEU  16          HD13      LEU  16   1.704   5.677   0.798
  103   HD21  LEU  16          HD21      LEU  16   1.985   7.594   2.286
  104   HD22  LEU  16          HD22      LEU  16   0.596   8.310   1.469
  105   HD23  LEU  16          HD23      LEU  16   2.095   9.225   1.621
  106    H    CYS  17           HN       CYS  17   3.707   5.427  -0.373
  107    HA   CYS  17           HA       CYS  17   4.355   3.901  -2.774
  108    HB2  CYS  17           HB2      CYS  17   5.371   2.227  -0.829
  109    HB3  CYS  17           HB1      CYS  17   6.336   3.219  -1.911
  110    H    CYS  18           HN       CYS  18   3.608   1.550  -2.491
  111    HA   CYS  18           HA       CYS  18   1.393   1.310  -0.598
  112    HB2  CYS  18           HB2      CYS  18   0.516   2.231  -2.748
  113    HB3  CYS  18           HB1      CYS  18   1.059   0.766  -3.552
  114    H    SER  19           HN       SER  19   1.501  -0.494   0.443
  115    HA   SER  19           HA       SER  19   3.435  -2.450   0.133
  116    HB2  SER  19           HB2      SER  19   0.814  -2.507   1.616
  117    HB3  SER  19           HB1      SER  19   2.025  -3.779   1.743
  118    HG   SER  19           HG       SER  19   2.413  -2.345   3.385
  119    H    GLN  20           HN       GLN  20   3.387  -4.625  -0.319
  120    HA   GLN  20           HA       GLN  20   2.703  -5.495  -2.752
  121    HB2  GLN  20           HB2      GLN  20   3.042  -7.023  -0.206
  122    HB3  GLN  20           HB1      GLN  20   2.759  -7.853  -1.728
  123    HG2  GLN  20           HG2      GLN  20   4.767  -6.852  -2.666
  124    HG3  GLN  20           HG1      GLN  20   5.040  -5.971  -1.163
  125   HE21  GLN  20          HE21      GLN  20   5.119  -9.069  -2.731
  126   HE22  GLN  20          HE22      GLN  20   6.029  -9.891  -1.514
  127    H    PHE  21           HN       PHE  21   0.585  -5.803   0.021
  128    HA   PHE  21           HA       PHE  21  -1.445  -7.203  -1.500
  129    HB2  PHE  21           HB2      PHE  21  -1.313  -6.213   1.341
  130    HB3  PHE  21           HB1      PHE  21  -2.768  -6.924   0.659
  131    HD1  PHE  21           HD1      PHE  21  -2.892  -9.260   0.151
  132    HD2  PHE  21           HD2      PHE  21   0.627  -7.534   1.794
  133    HE1  PHE  21           HE1      PHE  21  -2.057 -11.517   0.711
  134    HE2  PHE  21           HE2      PHE  21   1.478  -9.783   2.361
  135    HZ   PHE  21           HZ       PHE  21   0.132 -11.777   1.817
  136    H    GLY  22           HN       GLY  22  -0.957  -4.076  -0.043
  137    HA2  GLY  22           HA2      GLY  22  -1.866  -2.285  -1.653
  138    HA3  GLY  22           HA1      GLY  22  -3.409  -3.039  -1.268
  139    H    TYR  23           HN       TYR  23  -0.558  -2.183   0.662
  140    HA   TYR  23           HA       TYR  23  -2.327  -0.538   2.349
  141    HB2  TYR  23           HB2      TYR  23  -1.010  -2.757   3.233
  142    HB3  TYR  23           HB1      TYR  23   0.172  -1.506   3.597
  143    HD1  TYR  23           HD1      TYR  23  -1.568   0.767   4.374
  144    HD2  TYR  23           HD2      TYR  23  -1.879  -3.377   5.293
  145    HE1  TYR  23           HE1      TYR  23  -2.832   1.321   6.412
  146    HE2  TYR  23           HE2      TYR  23  -3.144  -2.834   7.332
  147    HH   TYR  23           HH       TYR  23  -3.434  -0.934   8.870
  148    H    CYS  24           HN       CYS  24  -2.001   1.468   1.807
  149    HA   CYS  24           HA       CYS  24   0.634   2.404   1.015
  150    HB2  CYS  24           HB2      CYS  24  -0.646   4.533   0.493
  151    HB3  CYS  24           HB1      CYS  24  -1.139   3.116  -0.423
  152    H    GLY  25           HN       GLY  25   1.690   4.140   1.927
  153    HA2  GLY  25           HA2      GLY  25   0.821   5.536   4.236
  154    HA3  GLY  25           HA1      GLY  25   1.884   4.211   4.693
  155    H    SER  26           HN       SER  26   3.068   6.211   5.486
  156    HA   SER  26           HA       SER  26   5.217   6.800   3.621
  157    HB2  SER  26           HB2      SER  26   5.043   9.313   4.121
  158    HB3  SER  26           HB1      SER  26   3.836   8.668   3.013
  159    HG   SER  26           HG       SER  26   3.449   9.071   5.796
  160    H    THR  27           HN       THR  27   4.221   5.906   6.538
  161    HA   THR  27           HA       THR  27   6.702   6.580   7.843
  162    HB   THR  27           HB       THR  27   5.606   8.520   8.556
  163    HG1  THR  27           HG1      THR  27   6.538   7.389  10.309
  164   HG21  THR  27          HG21      THR  27   3.153   6.929   9.326
  165   HG22  THR  27          HG22      THR  27   3.311   7.884   7.851
  166   HG23  THR  27          HG23      THR  27   3.356   8.678   9.425
  167    HA   PRO  28           HA       PRO  28   4.506   3.043  10.262
  168    HB2  PRO  28           HB2      PRO  28   2.316   1.964   8.712
  169    HB3  PRO  28           HB1      PRO  28   2.228   2.825  10.258
  170    HG2  PRO  28           HG2      PRO  28   1.192   3.814   7.961
  171    HG3  PRO  28           HG1      PRO  28   1.812   4.839   9.274
  172    HD2  PRO  28           HD2      PRO  28   3.240   3.954   6.761
  173    HD3  PRO  28           HD1      PRO  28   3.088   5.596   7.439
  174    HA   PRO  29           HA       PRO  29   6.371  -0.523   8.200
  175    HB2  PRO  29           HB2      PRO  29   4.739  -2.695   8.659
  176    HB3  PRO  29           HB1      PRO  29   5.832  -2.004   9.873
  177    HG2  PRO  29           HG2      PRO  29   2.906  -1.559   9.510
  178    HG3  PRO  29           HG1      PRO  29   3.824  -1.863  11.000
  179    HD2  PRO  29           HD2      PRO  29   3.073   0.602  10.357
  180    HD3  PRO  29           HD1      PRO  29   4.661   0.294  11.085
  181    H    TYR  30           HN       TYR  30   5.022   1.021   6.420
  182    HA   TYR  30           HA       TYR  30   4.255  -0.881   4.320
  183    HB2  TYR  30           HB2      TYR  30   2.805   1.752   4.469
  184    HB3  TYR  30           HB1      TYR  30   2.332   0.279   3.640
  185    HD1  TYR  30           HD1      TYR  30   1.981  -1.770   5.416
  186    HD2  TYR  30           HD2      TYR  30   1.476   2.374   6.233
  187    HE1  TYR  30           HE1      TYR  30   0.492  -2.336   7.291
  188    HE2  TYR  30           HE2      TYR  30  -0.014   1.817   8.116
  189    HH   TYR  30           HH       TYR  30  -1.456  -0.040   8.843
  190    H    CYS  31           HN       CYS  31   5.479   2.163   5.417
  191    HA   CYS  31           HA       CYS  31   7.061   2.469   3.010
  192    HB2  CYS  31           HB2      CYS  31   5.133   4.535   4.023
  193    HB3  CYS  31           HB1      CYS  31   6.544   4.987   3.068
  194    H    GLY  32           HN       GLY  32   8.683   1.735   4.352
  195    HA2  GLY  32           HA2      GLY  32  10.534   3.442   5.314
  196    HA3  GLY  32           HA1      GLY  32   9.484   3.202   6.708
  197    H    ALA  33           HN       ALA  33   8.845   0.779   6.933
  198    HA   ALA  33           HA       ALA  33  10.752  -1.209   6.187
  199    HB1  ALA  33           HB1      ALA  33  10.728  -0.392   9.106
  200    HB2  ALA  33           HB2      ALA  33  12.060  -0.130   7.980
  201    HB3  ALA  33           HB3      ALA  33  11.589  -1.770   8.422
  202    H    GLY  34           HN       GLY  34   9.135  -2.472   5.522
  203    HA2  GLY  34           HA2      GLY  34   7.698  -4.039   7.383
  204    HA3  GLY  34           HA1      GLY  34   6.634  -2.818   6.699
  205    H    GLN  35           HN       GLN  35   5.881  -3.028   4.670
  206    HA   GLN  35           HA       GLN  35   6.877  -5.210   2.990
  207    HB2  GLN  35           HB2      GLN  35   4.406  -5.709   2.423
  208    HB3  GLN  35           HB1      GLN  35   5.061  -6.341   3.923
  209    HG2  GLN  35           HG2      GLN  35   4.008  -4.446   5.127
  210    HG3  GLN  35           HG1      GLN  35   3.278  -3.931   3.610
  211   HE21  GLN  35          HE21      GLN  35   1.640  -5.192   2.690
  212   HE22  GLN  35          HE22      GLN  35   0.774  -6.371   3.607
  213    H    CYS  36           HN       CYS  36   7.708  -2.824   2.452
  214    HA   CYS  36           HA       CYS  36   5.966  -1.300   0.732
  215    HB2  CYS  36           HB2      CYS  36   8.066   0.021   0.290
  216    HB3  CYS  36           HB1      CYS  36   7.592  -0.080   1.982
  217    H    GLN  37           HN       GLN  37   5.598  -1.609  -1.354
  218    HA   GLN  37           HA       GLN  37   7.317  -3.428  -2.875
  219    HB2  GLN  37           HB2      GLN  37   4.769  -3.732  -2.610
  220    HB3  GLN  37           HB1      GLN  37   4.624  -2.398  -3.741
  221    HG2  GLN  37           HG2      GLN  37   6.023  -3.726  -5.337
  222    HG3  GLN  37           HG1      GLN  37   5.875  -5.084  -4.224
  223   HE21  GLN  37          HE21      GLN  37   3.893  -6.112  -3.996
  224   HE22  GLN  37          HE22      GLN  37   2.598  -5.884  -5.115
  225    H    SER  38           HN       SER  38   5.682  -0.270  -3.218
  226    HA   SER  38           HA       SER  38   7.005   0.340  -5.688
  227    HB2  SER  38           HB2      SER  38   5.241   2.020  -3.907
  228    HB3  SER  38           HB1      SER  38   5.845   2.540  -5.480
  229    HG   SER  38           HG       SER  38   4.771   0.668  -6.358
  230    H    GLN  39           HN       GLN  39   7.078   1.920  -2.523
  231    HA   GLN  39           HA       GLN  39   9.867   2.676  -2.994
  232    HB2  GLN  39           HB2      GLN  39   7.764   4.476  -3.112
  233    HB3  GLN  39           HB1      GLN  39   8.362   4.666  -1.468
  234    HG2  GLN  39           HG2      GLN  39  10.629   5.008  -2.404
  235    HG3  GLN  39           HG1      GLN  39   9.918   4.968  -4.016
  236   HE21  GLN  39          HE21      GLN  39  10.227   6.762  -1.059
  237   HE22  GLN  39          HE22      GLN  39   9.593   8.254  -1.657
  238    H    CYS  40           HN       CYS  40  11.175   2.797  -1.184
  239    HA   CYS  40           HA       CYS  40   9.980   1.950   1.369
  240    HB2  CYS  40           HB2      CYS  40  12.586   0.954   0.193
  241    HB3  CYS  40           HB1      CYS  40  11.956   0.537   1.783
  Start of MODEL   19
    1    H1   PHE   1           HT1      PHE   1  -7.872  -0.722   4.552
    2    H2   PHE   1           HT2      PHE   1  -6.716   0.415   5.033
    3    H3   PHE   1           HT3      PHE   1  -6.400  -1.236   5.211
    4    HA   PHE   1           HA       PHE   1  -5.206  -0.311   3.331
    5    HB2  PHE   1           HB2      PHE   1  -7.410  -2.294   2.767
    6    HB3  PHE   1           HB1      PHE   1  -6.166  -1.905   1.583
    7    HD1  PHE   1           HD1      PHE   1  -6.834  -3.455   4.844
    8    HD2  PHE   1           HD2      PHE   1  -3.934  -2.718   1.817
    9    HE1  PHE   1           HE1      PHE   1  -5.353  -5.134   5.863
   10    HE2  PHE   1           HE2      PHE   1  -2.447  -4.400   2.830
   11    HZ   PHE   1           HZ       PHE   1  -3.156  -5.609   4.856
   12    H    GLN   2           HN       GLN   2  -5.134   0.969   1.574
   13    HA   GLN   2           HA       GLN   2  -7.620   1.993   0.407
   14    HB2  GLN   2           HB2      GLN   2  -5.447   3.702   1.629
   15    HB3  GLN   2           HB1      GLN   2  -6.613   4.335   0.477
   16    HG2  GLN   2           HG2      GLN   2  -8.433   3.712   2.005
   17    HG3  GLN   2           HG1      GLN   2  -7.239   3.133   3.165
   18   HE21  GLN   2          HE21      GLN   2  -5.960   4.616   4.268
   19   HE22  GLN   2          HE22      GLN   2  -6.355   6.296   4.342
   20    H    CYS   3           HN       CYS   3  -5.249   0.246  -0.406
   21    HA   CYS   3           HA       CYS   3  -4.854   1.441  -3.032
   22    HB2  CYS   3           HB2      CYS   3  -2.972   2.337  -1.714
   23    HB3  CYS   3           HB1      CYS   3  -2.506   0.703  -1.261
   24    H    GLY   4           HN       GLY   4  -3.752  -0.043  -4.543
   25    HA2  GLY   4           HA2      GLY   4  -3.431  -2.057  -5.575
   26    HA3  GLY   4           HA1      GLY   4  -3.176  -2.739  -3.983
   27    H    ARG   5           HN       ARG   5  -4.142  -4.639  -4.573
   28    HA   ARG   5           HA       ARG   5  -6.939  -4.670  -5.366
   29    HB2  ARG   5           HB2      ARG   5  -6.601  -7.137  -5.545
   30    HB3  ARG   5           HB1      ARG   5  -5.532  -6.190  -6.567
   31    HG2  ARG   5           HG2      ARG   5  -3.753  -6.468  -4.853
   32    HG3  ARG   5           HG1      ARG   5  -4.838  -7.563  -3.986
   33    HD2  ARG   5           HD2      ARG   5  -5.004  -8.948  -5.990
   34    HD3  ARG   5           HD1      ARG   5  -3.868  -7.876  -6.808
   35    HE   ARG   5           HE       ARG   5  -2.533  -8.665  -4.570
   36   HH11  ARG   5          HH11      ARG   5  -4.063 -10.428  -7.195
   37   HH12  ARG   5          HH12      ARG   5  -2.981 -11.775  -7.072
   38   HH21  ARG   5          HH21      ARG   5  -1.325 -11.782  -5.506
   39   HH22  ARG   5          HH22      ARG   5  -1.132 -10.441  -4.427
   40    H    GLN   6           HN       GLN   6  -5.187  -4.716  -2.473
   41    HA   GLN   6           HA       GLN   6  -6.650  -6.536  -0.880
   42    HB2  GLN   6           HB2      GLN   6  -4.480  -4.872  -0.502
   43    HB3  GLN   6           HB1      GLN   6  -5.711  -4.142   0.519
   44    HG2  GLN   6           HG2      GLN   6  -4.881  -7.044   0.646
   45    HG3  GLN   6           HG1      GLN   6  -4.275  -5.777   1.710
   46   HE21  GLN   6          HE21      GLN   6  -5.743  -8.243   2.303
   47   HE22  GLN   6          HE22      GLN   6  -7.151  -7.760   3.180
   48    H    ALA   7           HN       ALA   7  -7.257  -3.350  -2.018
   49    HA   ALA   7           HA       ALA   7  -9.646  -3.027  -0.351
   50    HB1  ALA   7           HB1      ALA   7  -8.098  -0.993  -1.940
   51    HB2  ALA   7           HB2      ALA   7  -7.984  -1.243  -0.198
   52    HB3  ALA   7           HB3      ALA   7  -9.489  -0.658  -0.909
   53    H    GLY   8           HN       GLY   8  -8.435  -3.105  -3.622
   54    HA2  GLY   8           HA2      GLY   8 -10.020  -4.167  -5.245
   55    HA3  GLY   8           HA1      GLY   8 -11.198  -3.001  -4.665
   56    H    GLY   9           HN       GLY   9  -9.915  -0.666  -4.618
   57    HA2  GLY   9           HA2      GLY   9  -8.224  -0.031  -6.765
   58    HA3  GLY   9           HA1      GLY   9  -9.884   0.161  -7.308
   59    H    ALA  10           HN       ALA  10  -7.521   1.221  -4.910
   60    HA   ALA  10           HA       ALA  10  -8.909   3.813  -4.751
   61    HB1  ALA  10           HB1      ALA  10  -9.459   2.517  -2.746
   62    HB2  ALA  10           HB2      ALA  10  -8.474   3.926  -2.350
   63    HB3  ALA  10           HB3      ALA  10  -7.741   2.323  -2.398
   64    H    ARG  11           HN       ARG  11  -7.195   5.248  -3.193
   65    HA   ARG  11           HA       ARG  11  -4.499   4.911  -4.285
   66    HB2  ARG  11           HB2      ARG  11  -4.400   7.375  -4.850
   67    HB3  ARG  11           HB1      ARG  11  -5.464   6.438  -5.885
   68    HG2  ARG  11           HG2      ARG  11  -7.401   7.263  -4.603
   69    HG3  ARG  11           HG1      ARG  11  -6.311   8.237  -3.617
   70    HD2  ARG  11           HD2      ARG  11  -6.461   8.479  -6.613
   71    HD3  ARG  11           HD1      ARG  11  -7.476   9.428  -5.529
   72    HE   ARG  11           HE       ARG  11  -4.844   9.767  -4.699
   73   HH11  ARG  11          HH11      ARG  11  -6.757  10.540  -7.541
   74   HH12  ARG  11          HH12      ARG  11  -5.804  11.928  -7.945
   75   HH21  ARG  11          HH21      ARG  11  -3.612  11.587  -5.248
   76   HH22  ARG  11          HH22      ARG  11  -4.025  12.519  -6.648
   77    H    CYS  12           HN       CYS  12  -2.851   6.142  -3.190
   78    HA   CYS  12           HA       CYS  12  -3.175   6.117  -0.365
   79    HB2  CYS  12           HB2      CYS  12  -0.905   6.950  -2.162
   80    HB3  CYS  12           HB1      CYS  12  -0.786   6.920  -0.407
   81    H    SER  13           HN       SER  13  -2.147   7.931   0.994
   82    HA   SER  13           HA       SER  13  -3.818  10.161   1.031
   83    HB2  SER  13           HB2      SER  13  -2.407   9.181   2.959
   84    HB3  SER  13           HB1      SER  13  -1.073  10.133   2.307
   85    HG   SER  13           HG       SER  13  -1.919  11.597   3.577
   86    H    ASN  14           HN       ASN  14  -0.455   9.941   0.055
   87    HA   ASN  14           HA       ASN  14  -0.775  12.174  -1.811
   88    HB2  ASN  14           HB2      ASN  14   1.340  11.984   0.349
   89    HB3  ASN  14           HB1      ASN  14   1.514  13.022  -1.061
   90   HD21  ASN  14          HD21      ASN  14   0.185  14.825  -1.277
   91   HD22  ASN  14          HD22      ASN  14  -0.695  15.479   0.059
   92    H    GLY  15           HN       GLY  15   1.846  12.282  -2.755
   93    HA2  GLY  15           HA2      GLY  15   1.981   9.846  -4.286
   94    HA3  GLY  15           HA1      GLY  15   3.060  11.228  -4.426
   95    H    LEU  16           HN       LEU  16   2.228   8.780  -1.996
   96    HA   LEU  16           HA       LEU  16   5.017   8.648  -1.155
   97    HB2  LEU  16           HB2      LEU  16   3.977   7.200   0.729
   98    HB3  LEU  16           HB1      LEU  16   3.719   8.931   0.742
   99    HG   LEU  16           HG       LEU  16   1.507   7.991  -0.626
  100   HD11  LEU  16          HD11      LEU  16   1.677   5.733  -0.183
  101   HD12  LEU  16          HD12      LEU  16   0.634   6.313   1.115
  102   HD13  LEU  16          HD13      LEU  16   2.334   5.996   1.431
  103   HD21  LEU  16          HD21      LEU  16   0.283   8.588   1.374
  104   HD22  LEU  16          HD22      LEU  16   1.558   9.761   1.043
  105   HD23  LEU  16          HD23      LEU  16   1.774   8.554   2.311
  106    H    CYS  17           HN       CYS  17   3.474   5.794  -0.282
  107    HA   CYS  17           HA       CYS  17   4.443   4.297  -2.610
  108    HB2  CYS  17           HB2      CYS  17   5.144   2.951  -0.131
  109    HB3  CYS  17           HB1      CYS  17   6.163   3.327  -1.515
  110    H    CYS  18           HN       CYS  18   3.882   1.886  -2.339
  111    HA   CYS  18           HA       CYS  18   1.406   1.460  -0.828
  112    HB2  CYS  18           HB2      CYS  18   0.710   2.199  -3.056
  113    HB3  CYS  18           HB1      CYS  18   1.695   0.946  -3.798
  114    H    SER  19           HN       SER  19   1.390  -0.425   0.189
  115    HA   SER  19           HA       SER  19   3.563  -2.249   0.046
  116    HB2  SER  19           HB2      SER  19   0.922  -2.389   1.501
  117    HB3  SER  19           HB1      SER  19   2.225  -3.555   1.712
  118    HG   SER  19           HG       SER  19   3.447  -2.042   2.675
  119    H    GLN  20           HN       GLN  20   3.513  -4.484  -0.317
  120    HA   GLN  20           HA       GLN  20   2.865  -5.439  -2.728
  121    HB2  GLN  20           HB2      GLN  20   3.067  -6.927  -0.138
  122    HB3  GLN  20           HB1      GLN  20   2.903  -7.754  -1.680
  123    HG2  GLN  20           HG2      GLN  20   4.974  -6.757  -2.460
  124    HG3  GLN  20           HG1      GLN  20   5.126  -5.857  -0.952
  125   HE21  GLN  20          HE21      GLN  20   5.678  -6.952   0.936
  126   HE22  GLN  20          HE22      GLN  20   6.367  -8.535   0.909
  127    H    PHE  21           HN       PHE  21   0.682  -5.702   0.010
  128    HA   PHE  21           HA       PHE  21  -1.307  -7.115  -1.551
  129    HB2  PHE  21           HB2      PHE  21  -1.230  -6.118   1.285
  130    HB3  PHE  21           HB1      PHE  21  -2.685  -6.796   0.574
  131    HD1  PHE  21           HD1      PHE  21  -2.871  -9.121   0.080
  132    HD2  PHE  21           HD2      PHE  21   0.688  -7.493   1.736
  133    HE1  PHE  21           HE1      PHE  21  -2.103 -11.399   0.645
  134    HE2  PHE  21           HE2      PHE  21   1.472  -9.765   2.308
  135    HZ   PHE  21           HZ       PHE  21   0.073 -11.720   1.760
  136    H    GLY  22           HN       GLY  22  -0.720  -3.920  -0.366
  137    HA2  GLY  22           HA2      GLY  22  -1.682  -2.175  -1.911
  138    HA3  GLY  22           HA1      GLY  22  -3.220  -2.969  -1.593
  139    H    TYR  23           HN       TYR  23  -0.480  -1.973   0.446
  140    HA   TYR  23           HA       TYR  23  -2.402  -0.466   2.100
  141    HB2  TYR  23           HB2      TYR  23  -0.995  -2.586   3.011
  142    HB3  TYR  23           HB1      TYR  23   0.160  -1.299   3.345
  143    HD1  TYR  23           HD1      TYR  23  -1.738  -3.199   5.133
  144    HD2  TYR  23           HD2      TYR  23  -1.704   0.926   4.087
  145    HE1  TYR  23           HE1      TYR  23  -2.991  -2.673   7.185
  146    HE2  TYR  23           HE2      TYR  23  -2.958   1.462   6.135
  147    HH   TYR  23           HH       TYR  23  -4.457   0.341   7.724
  148    H    CYS  24           HN       CYS  24  -2.114   1.608   2.253
  149    HA   CYS  24           HA       CYS  24   0.142   2.868   0.974
  150    HB2  CYS  24           HB2      CYS  24  -2.398   3.886   2.208
  151    HB3  CYS  24           HB1      CYS  24  -1.144   4.968   1.607
  152    H    GLY  25           HN       GLY  25   1.629   4.199   1.851
  153    HA2  GLY  25           HA2      GLY  25   1.671   5.153   4.484
  154    HA3  GLY  25           HA1      GLY  25   2.568   3.652   4.428
  155    H    SER  26           HN       SER  26   3.601   6.090   5.127
  156    HA   SER  26           HA       SER  26   5.839   6.344   3.270
  157    HB2  SER  26           HB2      SER  26   3.969   8.119   2.771
  158    HB3  SER  26           HB1      SER  26   4.548   8.884   4.244
  159    HG   SER  26           HG       SER  26   6.205   8.199   2.047
  160    H    THR  27           HN       THR  27   4.747   5.693   6.134
  161    HA   THR  27           HA       THR  27   7.056   6.557   7.614
  162    HB   THR  27           HB       THR  27   6.013   8.498   8.237
  163    HG1  THR  27           HG1      THR  27   4.413   7.202  10.086
  164   HG21  THR  27          HG21      THR  27   3.728   9.011   8.153
  165   HG22  THR  27          HG22      THR  27   3.241   7.331   8.367
  166   HG23  THR  27          HG23      THR  27   3.934   7.859   6.833
  167    HA   PRO  28           HA       PRO  28   4.659   3.224  10.098
  168    HB2  PRO  28           HB2      PRO  28   2.345   2.238   8.723
  169    HB3  PRO  28           HB1      PRO  28   2.372   3.338  10.112
  170    HG2  PRO  28           HG2      PRO  28   1.446   4.053   7.645
  171    HG3  PRO  28           HG1      PRO  28   2.115   5.196   8.823
  172    HD2  PRO  28           HD2      PRO  28   3.540   3.837   6.528
  173    HD3  PRO  28           HD1      PRO  28   3.503   5.571   6.945
  174    HA   PRO  29           HA       PRO  29   6.087  -0.676   8.311
  175    HB2  PRO  29           HB2      PRO  29   3.711  -2.225   9.185
  176    HB3  PRO  29           HB1      PRO  29   5.414  -2.423   9.640
  177    HG2  PRO  29           HG2      PRO  29   3.682  -1.457  11.373
  178    HG3  PRO  29           HG1      PRO  29   5.320  -0.777  11.252
  179    HD2  PRO  29           HD2      PRO  29   2.760   0.283  10.110
  180    HD3  PRO  29           HD1      PRO  29   4.036   1.145  10.999
  181    H    TYR  30           HN       TYR  30   4.907   0.788   6.395
  182    HA   TYR  30           HA       TYR  30   3.844  -1.214   4.528
  183    HB2  TYR  30           HB2      TYR  30   2.751   1.581   4.405
  184    HB3  TYR  30           HB1      TYR  30   2.075   0.110   3.741
  185    HD1  TYR  30           HD1      TYR  30   1.554  -1.683   5.773
  186    HD2  TYR  30           HD2      TYR  30   1.477   2.557   6.059
  187    HE1  TYR  30           HE1      TYR  30   0.037  -1.855   7.701
  188    HE2  TYR  30           HE2      TYR  30  -0.040   2.396   7.995
  189    HH   TYR  30           HH       TYR  30  -1.642   0.816   8.955
  190    H    CYS  31           HN       CYS  31   5.457   1.762   5.272
  191    HA   CYS  31           HA       CYS  31   7.226   1.488   3.054
  192    HB2  CYS  31           HB2      CYS  31   5.340   2.859   2.105
  193    HB3  CYS  31           HB1      CYS  31   5.771   4.109   3.268
  194    H    GLY  32           HN       GLY  32   8.752   1.169   4.498
  195    HA2  GLY  32           HA2      GLY  32  10.436   3.090   5.380
  196    HA3  GLY  32           HA1      GLY  32   9.276   2.955   6.702
  197    H    ALA  33           HN       ALA  33   8.672   0.388   6.810
  198    HA   ALA  33           HA       ALA  33  10.764  -1.490   6.574
  199    HB1  ALA  33           HB1      ALA  33  11.278  -1.879   8.944
  200    HB2  ALA  33           HB2      ALA  33  10.265  -0.510   9.402
  201    HB3  ALA  33           HB3      ALA  33  11.739  -0.243   8.474
  202    H    GLY  34           HN       GLY  34   9.198  -2.718   5.674
  203    HA2  GLY  34           HA2      GLY  34   7.682  -4.410   7.325
  204    HA3  GLY  34           HA1      GLY  34   6.619  -3.165   6.682
  205    H    GLN  35           HN       GLN  35   6.170  -3.091   4.496
  206    HA   GLN  35           HA       GLN  35   7.233  -5.186   2.770
  207    HB2  GLN  35           HB2      GLN  35   4.822  -5.661   1.984
  208    HB3  GLN  35           HB1      GLN  35   5.358  -6.387   3.489
  209    HG2  GLN  35           HG2      GLN  35   4.112  -4.816   4.780
  210    HG3  GLN  35           HG1      GLN  35   3.747  -3.848   3.355
  211   HE21  GLN  35          HE21      GLN  35   3.030  -6.756   5.113
  212   HE22  GLN  35          HE22      GLN  35   1.574  -7.151   4.270
  213    H    CYS  36           HN       CYS  36   8.114  -2.808   2.391
  214    HA   CYS  36           HA       CYS  36   6.481  -1.097   0.766
  215    HB2  CYS  36           HB2      CYS  36   8.432  -0.361   2.189
  216    HB3  CYS  36           HB1      CYS  36   9.495  -1.079   0.984
  217    H    GLN  37           HN       GLN  37   5.833  -1.635  -1.229
  218    HA   GLN  37           HA       GLN  37   7.597  -3.214  -2.957
  219    HB2  GLN  37           HB2      GLN  37   5.109  -3.771  -2.470
  220    HB3  GLN  37           HB1      GLN  37   4.758  -2.468  -3.596
  221    HG2  GLN  37           HG2      GLN  37   6.247  -3.704  -5.243
  222    HG3  GLN  37           HG1      GLN  37   6.150  -5.068  -4.132
  223   HE21  GLN  37          HE21      GLN  37   4.229  -6.186  -3.927
  224   HE22  GLN  37          HE22      GLN  37   2.905  -5.979  -5.016
  225    H    SER  38           HN       SER  38   5.533  -0.314  -3.089
  226    HA   SER  38           HA       SER  38   6.508   0.569  -5.627
  227    HB2  SER  38           HB2      SER  38   4.924   2.085  -3.535
  228    HB3  SER  38           HB1      SER  38   5.114   2.545  -5.226
  229    HG   SER  38           HG       SER  38   3.407   1.368  -5.537
  230    H    GLN  39           HN       GLN  39   6.743   3.377  -5.086
  231    HA   GLN  39           HA       GLN  39   9.483   3.712  -4.808
  232    HB2  GLN  39           HB2      GLN  39   7.122   5.539  -4.665
  233    HB3  GLN  39           HB1      GLN  39   8.715   6.170  -4.274
  234    HG2  GLN  39           HG2      GLN  39   9.527   5.476  -6.475
  235    HG3  GLN  39           HG1      GLN  39   7.925   4.849  -6.861
  236   HE21  GLN  39          HE21      GLN  39   9.846   7.703  -6.359
  237   HE22  GLN  39          HE22      GLN  39   8.728   8.824  -7.049
  238    H    CYS  40           HN       CYS  40  10.630   3.150  -3.074
  239    HA   CYS  40           HA       CYS  40   9.617   3.721  -0.385
  240    HB2  CYS  40           HB2      CYS  40  12.058   2.116  -1.171
  241    HB3  CYS  40           HB1      CYS  40  11.313   2.192   0.422
  Start of MODEL   20
    1    H1   PHE   1           HT1      PHE   1  -5.294  -1.647   0.827
    2    H2   PHE   1           HT2      PHE   1  -6.897  -2.146   0.624
    3    H3   PHE   1           HT3      PHE   1  -5.834  -3.076   1.555
    4    HA   PHE   1           HA       PHE   1  -7.365  -1.804   2.922
    5    HB2  PHE   1           HB2      PHE   1  -4.447  -1.050   3.073
    6    HB3  PHE   1           HB1      PHE   1  -5.607  -0.683   4.343
    7    HD1  PHE   1           HD1      PHE   1  -3.742  -3.343   2.645
    8    HD2  PHE   1           HD2      PHE   1  -6.432  -2.390   5.801
    9    HE1  PHE   1           HE1      PHE   1  -3.321  -5.545   3.664
   10    HE2  PHE   1           HE2      PHE   1  -6.019  -4.591   6.824
   11    HZ   PHE   1           HZ       PHE   1  -4.461  -6.170   5.755
   12    H    GLN   2           HN       GLN   2  -5.162   0.233   1.079
   13    HA   GLN   2           HA       GLN   2  -7.181   2.340   0.965
   14    HB2  GLN   2           HB2      GLN   2  -4.429   2.691   2.137
   15    HB3  GLN   2           HB1      GLN   2  -5.322   4.047   1.463
   16    HG2  GLN   2           HG2      GLN   2  -7.129   3.652   3.057
   17    HG3  GLN   2           HG1      GLN   2  -6.235   2.290   3.731
   18   HE21  GLN   2          HE21      GLN   2  -4.399   2.677   4.969
   19   HE22  GLN   2          HE22      GLN   2  -4.052   4.231   5.636
   20    H    CYS   3           HN       CYS   3  -4.717   0.565  -0.568
   21    HA   CYS   3           HA       CYS   3  -4.925   2.302  -2.915
   22    HB2  CYS   3           HB2      CYS   3  -2.418   2.008  -3.315
   23    HB3  CYS   3           HB1      CYS   3  -2.866   3.103  -2.011
   24    H    GLY   4           HN       GLY   4  -5.269   1.263  -4.705
   25    HA2  GLY   4           HA2      GLY   4  -5.559  -0.389  -6.251
   26    HA3  GLY   4           HA1      GLY   4  -3.974  -0.930  -5.749
   27    H    ARG   5           HN       ARG   5  -3.760  -2.797  -4.697
   28    HA   ARG   5           HA       ARG   5  -5.901  -4.658  -4.768
   29    HB2  ARG   5           HB2      ARG   5  -3.051  -4.703  -4.487
   30    HB3  ARG   5           HB1      ARG   5  -3.762  -5.721  -3.240
   31    HG2  ARG   5           HG2      ARG   5  -5.012  -6.942  -4.944
   32    HG3  ARG   5           HG1      ARG   5  -4.301  -5.918  -6.193
   33    HD2  ARG   5           HD2      ARG   5  -2.070  -6.718  -5.573
   34    HD3  ARG   5           HD1      ARG   5  -2.785  -7.745  -4.331
   35    HE   ARG   5           HE       ARG   5  -4.008  -8.417  -6.724
   36   HH11  ARG   5          HH11      ARG   5  -0.756  -8.545  -5.404
   37   HH12  ARG   5          HH12      ARG   5  -0.296  -9.911  -6.365
   38   HH21  ARG   5          HH21      ARG   5  -1.784 -10.848  -7.817
   39   HH22  ARG   5          HH22      ARG   5  -3.384 -10.204  -7.972
   40    H    GLN   6           HN       GLN   6  -6.189  -6.232  -2.817
   41    HA   GLN   6           HA       GLN   6  -6.925  -6.703  -0.724
   42    HB2  GLN   6           HB2      GLN   6  -5.312  -4.333  -0.158
   43    HB3  GLN   6           HB1      GLN   6  -6.698  -4.486   0.911
   44    HG2  GLN   6           HG2      GLN   6  -4.711  -6.703   0.432
   45    HG3  GLN   6           HG1      GLN   6  -4.584  -5.539   1.750
   46   HE21  GLN   6          HE21      GLN   6  -6.129  -5.596   3.420
   47   HE22  GLN   6          HE22      GLN   6  -7.087  -7.003   3.717
   48    H    ALA   7           HN       ALA   7  -7.638  -3.619  -2.149
   49    HA   ALA   7           HA       ALA   7 -10.378  -3.648  -1.089
   50    HB1  ALA   7           HB1      ALA   7  -8.772  -1.344  -2.185
   51    HB2  ALA   7           HB2      ALA   7  -9.070  -1.671  -0.477
   52    HB3  ALA   7           HB3      ALA   7 -10.411  -1.248  -1.541
   53    H    GLY   8           HN       GLY   8  -8.382  -3.466  -3.934
   54    HA2  GLY   8           HA2      GLY   8  -9.256  -4.539  -5.967
   55    HA3  GLY   8           HA1      GLY   8 -10.781  -3.731  -5.639
   56    H    GLY   9           HN       GLY   9  -9.605  -1.199  -4.915
   57    HA2  GLY   9           HA2      GLY   9  -7.902  -0.133  -6.868
   58    HA3  GLY   9           HA1      GLY   9  -9.552   0.057  -7.439
   59    H    ALA  10           HN       ALA  10  -7.179   1.059  -5.093
   60    HA   ALA  10           HA       ALA  10  -8.853   3.379  -4.418
   61    HB1  ALA  10           HB1      ALA  10  -8.228   3.221  -2.062
   62    HB2  ALA  10           HB2      ALA  10  -7.320   1.744  -2.391
   63    HB3  ALA  10           HB3      ALA  10  -9.073   1.764  -2.587
   64    H    ARG  11           HN       ARG  11  -7.298   4.915  -2.925
   65    HA   ARG  11           HA       ARG  11  -4.618   5.026  -4.108
   66    HB2  ARG  11           HB2      ARG  11  -6.775   7.055  -4.422
   67    HB3  ARG  11           HB1      ARG  11  -5.136   7.642  -4.181
   68    HG2  ARG  11           HG2      ARG  11  -5.579   5.550  -6.242
   69    HG3  ARG  11           HG1      ARG  11  -6.108   7.195  -6.592
   70    HD2  ARG  11           HD2      ARG  11  -3.329   6.536  -5.639
   71    HD3  ARG  11           HD1      ARG  11  -3.769   6.580  -7.345
   72    HE   ARG  11           HE       ARG  11  -4.571   8.990  -6.173
   73   HH11  ARG  11          HH11      ARG  11  -1.574   7.333  -6.952
   74   HH12  ARG  11          HH12      ARG  11  -0.676   8.803  -7.135
   75   HH21  ARG  11          HH21      ARG  11  -3.376  10.900  -6.418
   76   HH22  ARG  11          HH22      ARG  11  -1.696  10.820  -6.833
   77    H    CYS  12           HN       CYS  12  -3.083   6.184  -2.943
   78    HA   CYS  12           HA       CYS  12  -3.487   6.194  -0.098
   79    HB2  CYS  12           HB2      CYS  12  -1.111   6.834  -1.842
   80    HB3  CYS  12           HB1      CYS  12  -1.056   6.819  -0.081
   81    H    SER  13           HN       SER  13  -2.240   8.063   1.137
   82    HA   SER  13           HA       SER  13  -3.835  10.352   1.096
   83    HB2  SER  13           HB2      SER  13  -2.425   9.490   3.044
   84    HB3  SER  13           HB1      SER  13  -1.033  10.230   2.254
   85    HG   SER  13           HG       SER  13  -2.070  12.239   2.427
   86    H    ASN  14           HN       ASN  14  -0.519   9.957   0.013
   87    HA   ASN  14           HA       ASN  14  -0.858  12.033  -2.022
   88    HB2  ASN  14           HB2      ASN  14   1.347  11.967   0.057
   89    HB3  ASN  14           HB1      ASN  14   1.462  12.899  -1.431
   90   HD21  ASN  14          HD21      ASN  14   0.152  14.707  -1.707
   91   HD22  ASN  14          HD22      ASN  14  -0.653  15.467  -0.380
   92    H    GLY  15           HN       GLY  15   1.684  11.999  -3.112
   93    HA2  GLY  15           HA2      GLY  15   1.738   9.412  -4.380
   94    HA3  GLY  15           HA1      GLY  15   2.810  10.766  -4.721
   95    H    LEU  16           HN       LEU  16   2.093   8.583  -2.020
   96    HA   LEU  16           HA       LEU  16   4.892   8.580  -1.229
   97    HB2  LEU  16           HB2      LEU  16   3.926   7.237   0.764
   98    HB3  LEU  16           HB1      LEU  16   3.582   8.949   0.654
   99    HG   LEU  16           HG       LEU  16   1.432   7.716  -0.644
  100   HD11  LEU  16          HD11      LEU  16   0.615   6.268   1.297
  101   HD12  LEU  16          HD12      LEU  16   2.314   6.133   1.733
  102   HD13  LEU  16          HD13      LEU  16   1.759   5.565   0.158
  103   HD21  LEU  16          HD21      LEU  16   1.620   8.739   2.173
  104   HD22  LEU  16          HD22      LEU  16   0.147   8.552   1.224
  105   HD23  LEU  16          HD23      LEU  16   1.368   9.725   0.733
  106    H    CYS  17           HN       CYS  17   3.401   5.770  -0.151
  107    HA   CYS  17           HA       CYS  17   4.478   4.090  -2.303
  108    HB2  CYS  17           HB2      CYS  17   5.054   3.156   0.446
  109    HB3  CYS  17           HB1      CYS  17   6.065   3.085  -0.991
  110    H    CYS  18           HN       CYS  18   3.753   1.817  -2.129
  111    HA   CYS  18           HA       CYS  18   1.391   1.399  -0.449
  112    HB2  CYS  18           HB2      CYS  18   0.531   2.239  -2.584
  113    HB3  CYS  18           HB1      CYS  18   1.417   0.991  -3.452
  114    H    SER  19           HN       SER  19   1.434  -0.486   0.515
  115    HA   SER  19           HA       SER  19   3.541  -2.341   0.204
  116    HB2  SER  19           HB2      SER  19   0.946  -2.540   1.731
  117    HB3  SER  19           HB1      SER  19   2.280  -3.679   1.882
  118    HG   SER  19           HG       SER  19   2.026  -1.643   3.336
  119    H    GLN  20           HN       GLN  20   3.348  -4.636  -0.112
  120    HA   GLN  20           HA       GLN  20   2.571  -5.439  -2.590
  121    HB2  GLN  20           HB2      GLN  20   3.015  -7.029  -0.096
  122    HB3  GLN  20           HB1      GLN  20   2.680  -7.802  -1.639
  123    HG2  GLN  20           HG2      GLN  20   4.659  -6.748  -2.603
  124    HG3  GLN  20           HG1      GLN  20   4.993  -5.964  -1.061
  125   HE21  GLN  20          HE21      GLN  20   5.741  -7.195   0.666
  126   HE22  GLN  20          HE22      GLN  20   6.391  -8.780   0.451
  127    H    PHE  21           HN       PHE  21   0.594  -5.569   0.265
  128    HA   PHE  21           HA       PHE  21  -1.510  -7.038  -1.097
  129    HB2  PHE  21           HB2      PHE  21  -1.018  -6.121   1.697
  130    HB3  PHE  21           HB1      PHE  21  -2.662  -6.498   1.205
  131    HD1  PHE  21           HD1      PHE  21   0.658  -7.823   1.838
  132    HD2  PHE  21           HD2      PHE  21  -3.317  -8.735   0.637
  133    HE1  PHE  21           HE1      PHE  21   1.106 -10.222   2.214
  134    HE2  PHE  21           HE2      PHE  21  -2.886 -11.139   1.009
  135    HZ   PHE  21           HZ       PHE  21  -0.670 -11.881   1.798
  136    H    GLY  22           HN       GLY  22  -0.631  -3.807  -0.478
  137    HA2  GLY  22           HA2      GLY  22  -1.727  -2.082  -1.792
  138    HA3  GLY  22           HA1      GLY  22  -3.256  -2.884  -1.450
  139    H    TYR  23           HN       TYR  23  -0.487  -1.777   0.500
  140    HA   TYR  23           HA       TYR  23  -2.417  -0.367   2.227
  141    HB2  TYR  23           HB2      TYR  23  -0.891  -2.421   3.074
  142    HB3  TYR  23           HB1      TYR  23   0.230  -1.094   3.359
  143    HD1  TYR  23           HD1      TYR  23  -1.417   1.080   4.333
  144    HD2  TYR  23           HD2      TYR  23  -1.774  -3.095   5.087
  145    HE1  TYR  23           HE1      TYR  23  -2.586   1.566   6.443
  146    HE2  TYR  23           HE2      TYR  23  -2.945  -2.618   7.197
  147    HH   TYR  23           HH       TYR  23  -3.140  -0.787   8.823
  148    H    CYS  24           HN       CYS  24  -2.060   1.687   2.743
  149    HA   CYS  24           HA       CYS  24   0.003   3.080   1.246
  150    HB2  CYS  24           HB2      CYS  24  -2.437   4.015   2.742
  151    HB3  CYS  24           HB1      CYS  24  -1.293   5.110   1.966
  152    H    GLY  25           HN       GLY  25   1.697   4.070   2.051
  153    HA2  GLY  25           HA2      GLY  25   1.868   4.981   4.750
  154    HA3  GLY  25           HA1      GLY  25   2.790   3.518   4.495
  155    H    SER  26           HN       SER  26   3.569   6.197   5.186
  156    HA   SER  26           HA       SER  26   5.775   6.553   3.298
  157    HB2  SER  26           HB2      SER  26   3.769   8.157   2.779
  158    HB3  SER  26           HB1      SER  26   4.272   8.990   4.244
  159    HG   SER  26           HG       SER  26   5.209   9.656   2.104
  160    H    THR  27           HN       THR  27   4.769   5.888   6.183
  161    HA   THR  27           HA       THR  27   7.029   6.935   7.621
  162    HB   THR  27           HB       THR  27   5.815   8.802   8.199
  163    HG1  THR  27           HG1      THR  27   4.429   7.849  10.224
  164   HG21  THR  27          HG21      THR  27   3.198   7.315   8.442
  165   HG22  THR  27          HG22      THR  27   3.755   8.010   6.921
  166   HG23  THR  27          HG23      THR  27   3.461   9.055   8.310
  167    HA   PRO  28           HA       PRO  28   4.949   3.388  10.098
  168    HB2  PRO  28           HB2      PRO  28   2.691   2.245   8.776
  169    HB3  PRO  28           HB1      PRO  28   2.659   3.382  10.134
  170    HG2  PRO  28           HG2      PRO  28   1.673   3.958   7.641
  171    HG3  PRO  28           HG1      PRO  28   2.237   5.175   8.801
  172    HD2  PRO  28           HD2      PRO  28   3.794   3.906   6.535
  173    HD3  PRO  28           HD1      PRO  28   3.611   5.635   6.930
  174    HA   PRO  29           HA       PRO  29   6.608  -0.421   8.284
  175    HB2  PRO  29           HB2      PRO  29   4.299  -2.065   9.186
  176    HB3  PRO  29           HB1      PRO  29   6.021  -2.232   9.573
  177    HG2  PRO  29           HG2      PRO  29   4.351  -1.339  11.391
  178    HG3  PRO  29           HG1      PRO  29   5.954  -0.596  11.201
  179    HD2  PRO  29           HD2      PRO  29   3.304   0.380  10.206
  180    HD3  PRO  29           HD1      PRO  29   4.597   1.279  11.027
  181    H    TYR  30           HN       TYR  30   5.398   0.969   6.367
  182    HA   TYR  30           HA       TYR  30   4.417  -1.078   4.511
  183    HB2  TYR  30           HB2      TYR  30   3.216   1.681   4.451
  184    HB3  TYR  30           HB1      TYR  30   2.640   0.229   3.658
  185    HD1  TYR  30           HD1      TYR  30   2.001  -1.714   5.392
  186    HD2  TYR  30           HD2      TYR  30   2.005   2.443   6.258
  187    HE1  TYR  30           HE1      TYR  30   0.453  -2.118   7.263
  188    HE2  TYR  30           HE2      TYR  30   0.456   2.057   8.135
  189    HH   TYR  30           HH       TYR  30  -1.198   0.385   8.846
  190    H    CYS  31           HN       CYS  31   5.890   1.979   5.237
  191    HA   CYS  31           HA       CYS  31   7.497   1.794   2.842
  192    HB2  CYS  31           HB2      CYS  31   5.629   3.534   2.558
  193    HB3  CYS  31           HB1      CYS  31   6.571   4.494   3.698
  194    H    GLY  32           HN       GLY  32   7.457   1.695   5.960
  195    HA2  GLY  32           HA2      GLY  32  10.200   2.689   6.165
  196    HA3  GLY  32           HA1      GLY  32   9.014   3.142   7.387
  197    H    ALA  33           HN       ALA  33  10.124   0.250   5.683
  198    HA   ALA  33           HA       ALA  33  10.753  -1.826   6.312
  199    HB1  ALA  33           HB1      ALA  33  12.132  -0.777   8.069
  200    HB2  ALA  33           HB2      ALA  33  11.466  -2.325   8.588
  201    HB3  ALA  33           HB3      ALA  33  10.751  -0.821   9.167
  202    H    GLY  34           HN       GLY  34   9.121  -3.018   5.714
  203    HA2  GLY  34           HA2      GLY  34   7.453  -4.320   7.531
  204    HA3  GLY  34           HA1      GLY  34   6.530  -3.001   6.824
  205    H    GLN  35           HN       GLN  35   6.291  -2.932   4.527
  206    HA   GLN  35           HA       GLN  35   6.955  -5.237   2.930
  207    HB2  GLN  35           HB2      GLN  35   4.422  -5.467   2.269
  208    HB3  GLN  35           HB1      GLN  35   5.034  -6.306   3.684
  209    HG2  GLN  35           HG2      GLN  35   4.108  -4.596   5.134
  210    HG3  GLN  35           HG1      GLN  35   3.562  -3.673   3.736
  211   HE21  GLN  35          HE21      GLN  35   3.037  -6.479   5.711
  212   HE22  GLN  35          HE22      GLN  35   1.468  -6.870   5.102
  213    H    CYS  36           HN       CYS  36   8.075  -3.189   2.199
  214    HA   CYS  36           HA       CYS  36   6.499  -1.289   0.701
  215    HB2  CYS  36           HB2      CYS  36   8.800  -0.427   0.039
  216    HB3  CYS  36           HB1      CYS  36   8.404  -0.385   1.754
  217    H    GLN  37           HN       GLN  37   5.719  -1.659  -1.269
  218    HA   GLN  37           HA       GLN  37   7.177  -3.421  -3.104
  219    HB2  GLN  37           HB2      GLN  37   4.687  -3.746  -2.502
  220    HB3  GLN  37           HB1      GLN  37   4.396  -2.350  -3.529
  221    HG2  GLN  37           HG2      GLN  37   5.561  -3.576  -5.371
  222    HG3  GLN  37           HG1      GLN  37   5.569  -4.997  -4.329
  223   HE21  GLN  37          HE21      GLN  37   3.686  -6.118  -3.987
  224   HE22  GLN  37          HE22      GLN  37   2.234  -5.820  -4.875
  225    H    SER  38           HN       SER  38   5.525  -0.262  -2.999
  226    HA   SER  38           HA       SER  38   6.522   0.539  -5.576
  227    HB2  SER  38           HB2      SER  38   4.942   2.037  -3.481
  228    HB3  SER  38           HB1      SER  38   5.366   2.703  -5.058
  229    HG   SER  38           HG       SER  38   3.232   1.621  -4.799
  230    H    GLN  39           HN       GLN  39   6.950   1.795  -2.300
  231    HA   GLN  39           HA       GLN  39   9.693   2.571  -2.950
  232    HB2  GLN  39           HB2      GLN  39   7.513   4.434  -2.079
  233    HB3  GLN  39           HB1      GLN  39   9.169   4.749  -1.585
  234    HG2  GLN  39           HG2      GLN  39   9.838   4.721  -3.966
  235    HG3  GLN  39           HG1      GLN  39   8.142   4.528  -4.403
  236   HE21  GLN  39          HE21      GLN  39   6.730   6.252  -4.145
  237   HE22  GLN  39          HE22      GLN  39   7.284   7.870  -3.899
  238    H    CYS  40           HN       CYS  40  11.103   2.609  -1.220
  239    HA   CYS  40           HA       CYS  40  10.023   1.729   1.373
  240    HB2  CYS  40           HB2      CYS  40  11.380   0.058  -0.252
  241    HB3  CYS  40           HB1      CYS  40  12.730   0.785   0.614