*HEADER    STRUCTURAL PROTEIN                      02-FEB-14   2MK7              
*TITLE     TETRA-O-GALNAC GLYCOSYLATED MUCIN SEQUENCE FROM ALPHA DYSTROGLYCAN    
*TITLE    2 MUCIN DOMAIN                                                         
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: ALPHA-DYSTROGLYCAN;                                        
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: MUCIN DOMAIN PEPTIDE (UNP RESIDUES 419-427);               
*COMPND   5 SYNONYM: ALPHA-DG, ADG;                                              
*COMPND   6 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   4 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   5 ORGANISM_TAXID: 9606                                                 
*KEYWDS    MUCIN DOMAIN, GLYCOPROTEIN, GLYCOSYLATION, ALPHA-DYSTROGLYCAN, TN     
*KEYWDS   2 ANTIGEN, N-ACETYL-GALACTOSAMINE, STRUCTURAL PROTEIN                  
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    16                                                                    
*AUTHOR    D.LIVE, A.BORGERT                                                     
*REVDAT   1   04-FEB-15 2MK7    0                                                


assign (resid 12 and name H2) (resid 12 and name C2)
       (resid 12 and name NA) (resid 12 and name HNA) 500 180.0 0.5 2

assign (resid 13 and name H2) (resid 13 and name C2)
       (resid 13 and name NA) (resid 13 and name HNA) 500 180.0 0.5 2

assign (resid 14 and name H2) (resid 14 and name C2)
       (resid 14 and name NA) (resid 14 and name HNA) 500 180.0 0.5 2

assign (resid 15 and name H2) (resid 15 and name C2)
       (resid 15 and name NA) (resid 15 and name HNA) 500 180.0 0.5 2


  nres=100
  class phi
  potential harmonic
  degeneracy 1
  coeff 6.98 -1.38 1.72 -60
  force 5
  
  assi (resi  3 and name C   ) (resi  4 and name N   )
       (resi  4 and name CA  ) (resi  4 and name C   )  8.69 0.50
   
  assi (resi  4 and name C   ) (resi  5 and name N   )
       (resi  5 and name CA  ) (resi  5 and name C   )  9.61 0.50

  assi (resi  5 and name C   ) (resi  6 and name N   )
       (resi  6 and name CA  ) (resi  6 and name C   )  9.52 0.50
   
  assi (resi  6 and name C   ) (resi  7 and name N   )
       (resi  7 and name CA  ) (resi  7 and name C   )  9.25 0.50
  
  assi (resi  7 and name C   ) (resi  8 and name N   )
       (resi  8 and name CA  ) (resi  8 and name C   )  6.96 0.50

  assi (resi  8 and name C   ) (resi  9 and name N   )
       (resi  9 and name CA  ) (resi  9 and name C   )  4.57 0.50




assi (resi  7 and resn THR  and name H   )
     (resi  6 and resn THR  and name H   ) 3.40 1.60 1.60 ! W
assi (resi  7 and resn THR  and name HA  )
     (resi  8 and resn THR  and name HA  ) 3.40 1.60 1.60 ! W
assi (resi  4 and resn THR  and name HA  )
     (resi  5 and resn THR  and name HA  ) 3.40 1.60 1.60 ! W

assi (resi  7 and resn THR  and name HA  )
     (resi 15 and resn A2G  and name H1  ) 3.40 1.60 1.60 ! W
assi (resi  7 and resn THR  and name HA  )
     (resi 14 and resn A2G  and name H1  ) 3.40 1.60 1.60 ! W
assi (resi  7 and resn THR  and name HA  )
     (resi 13 and resn A2G  and name H1  ) 3.40 1.60 1.60 ! W
assi (resi  5 and resn THR  and name HA  )
     (resi 13 and resn A2G  and name H1  ) 3.40 1.60 1.60 ! W
assi (resi  4 and resn THR  and name HA  )
     (resi 12 and resn A2G  and name H1  ) 3.40 1.60 1.60 ! W
assi (resi  5 and resn THR  and name HA  )
     (resi 12 and resn A2G  and name H1  ) 3.40 1.60 1.60 ! W
assi (resi  6 and resn THR  and name HA  )
     (resi 14 and resn A2G  and name H1  ) 3.40 1.60 1.60 ! W
assi (resi  6 and resn THR  and name HA  )
     (resi 13 and resn A2G  and name H1  ) 3.40 1.60 1.60 ! W
assi (resi  7 and resn THR  and name HA  )
     (resi  6 and resn THR  and name HA  ) 3.40 1.60 1.60 ! W
assi (resi 15 and resn A2G  and name H1  )
     (resi  8 and resn LYS  and name H   ) 3.40 1.60 1.60 ! W

assi (resi 15 and resn A2G  and name H1  )
     (resi 15 and resn A2G  and name HN2 ) 3.40 1.60 1.60 ! W

assi (resi 14 and resn A2G  and name H1  )
     (resi  7 and resn THR  and name H   ) 3.40 1.60 1.60 ! W

assi (resi 14 and resn A2G  and name H1  )
     (resi 14 and resn A2G  and name HN2 ) 3.40 1.60 1.60 ! W
assi (resi  5 and resn THR  and name HA  )
     (resi  5 and resn THR  and name H   ) 3.40 1.60 1.60 ! W
assi (resi  5 and resn THR  and name HA  )
     (resi  6 and resn THR  and name H   ) 2.40 0.60 0.60 ! S
assi (resi  6 and resn THR  and name HA  )
     (resi  7 and resn THR  and name H   ) 2.40 0.60 0.60 ! S
assi (resi  6 and resn THR  and name HA  )
     (resi  6 and resn THR  and name H   ) 3.40 1.60 1.60 ! W

assi (resi 12 and resn A2G  and name H1  )
     (resi  5 and resn THR  and name H   ) 3.40 1.60 1.60 ! W

assi (resi 12 and resn A2G  and name H1  )
     (resi 12 and resn A2G  and name HN2 ) 3.40 1.60 1.60 ! W

assi (resi 13 and resn A2G  and name H1  )
     (resi  6 and resn THR  and name H   ) 3.40 1.60 1.60 ! W

assi (resi  4 and resn THR  and name HA  )
     (resi  5 and resn THR  and name H   ) 2.40 0.60 0.60 ! S
assi (resi  4 and resn THR  and name HA  )
     (resi  4 and resn THR  and name H   ) 3.40 1.60 1.60 ! W
assi (resi 13 and resn A2G  and name H1  )
     (resi 13 and resn A2G  and name HN2 ) 3.40 1.60 1.60 ! W
assi (resi  3 and resn PRO  and name HA  )
     (resi  4 and resn THR  and name H   ) 2.40 0.60 0.60 ! S
assi (resi  7 and resn THR  and name HA  )
     (resi  7 and resn THR  and name H   ) 3.40 1.60 1.60 ! W
assi (resi  7 and resn THR  and name HA  )
     (resi  8 and resn LYS  and name H   ) 2.40 0.60 0.60 ! S
assi (resi  5 and resn THR  and name HB  )
     (resi  6 and resn THR  and name H   ) 2.40 0.60 0.60 ! S
assi (resi  6 and resn THR  and name HB  )
     (resi  7 and resn THR  and name H   ) 2.90 1.10 1.10 ! M
assi (resi  4 and resn THR  and name HB  )
     (resi  5 and resn THR  and name H   ) 2.90 1.10 1.10 ! M
assi (resi  4 and resn THR  and name HB  )
     (resi  4 and resn THR  and name H   ) 3.40 1.60 1.60 ! W
assi (resi  5 and resn THR  and name HB  )
     (resi  5 and resn THR  and name H   ) 3.40 1.60 1.60 ! W
assi (resi  7 and resn THR  and name HB  )
     (resi  7 and resn THR  and name H   ) 3.40 1.60 1.60 ! W
assi (resi  9 and resn LYS  and name HA  )
     (resi  9 and resn LYS  and name H   ) 3.40 1.60 1.60 ! W
assi (resi 10 and resn PRO  and name HA  )
     (resi 11 and resn NH2  and name HN# ) 2.90 1.10 1.10 ! M
assi (resi  7 and resn THR  and name HB  )
     (resi  8 and resn LYS  and name H   ) 2.90 1.10 1.10 ! M
assi (resi  8 and resn LYS  and name HA  )
     (resi  9 and resn LYS  and name H   ) 2.40 0.60 0.60 ! S
assi (resi  8 and resn LYS  and name HA  )
     (resi  8 and resn LYS  and name H   ) 3.40 1.60 1.60 ! W
assi (resi 15 and resn A2G  and name H3  ) 
     (resi  7 and resn THR  and name H   ) 3.40 1.60 1.60 ! W
assi (resi 14 and resn A2G  and name H3  )
     (resi  6 and resn THR  and name H   ) 3.40 1.60 1.60 ! W
assi (resi 13 and resn A2G  and name H3  )
     (resi  5 and resn THR  and name H   ) 3.40 1.60 1.60 ! W
assi (resi 12 and resn A2G  and name H3  )
     (resi  4 and resn THR  and name H   ) 3.40 1.60 1.60 ! W
assi (resi 15 and resn A2G  and name H5  )
     (resi  7 and resn THR  and name H   ) 3.40 1.60 1.60 ! W
assi (resi 14 and resn A2G  and name H5  )
     (resi  6 and resn THR  and name H   ) 3.40 1.60 1.60 ! W
assi (resi 13 and resn A2G  and name H5  )
     (resi  5 and resn THR  and name H   ) 3.40 1.60 1.60 ! W
assi (resi 12 and resn A2G  and name H5  )
     (resi  4 and resn THR  and name H   ) 3.40 1.60 1.60 ! W
assi (resi 15 and resn A2G  and name HN2 )
     (resi  7 and resn THR  and name HB  ) 3.40 1.60 1.60 ! W
assi (resi 15 and resn A2G  and name HN2 )
     (resi  7 and resn THR  and name HA  ) 3.40 1.60 1.60 ! W
assi (resi 15 and resn A2G  and name HN2 )
     (resi  6 and resn THR  and name HB  ) 3.40 1.60 1.60 ! W
assi (resi 15 and resn A2G  and name HN2 )
     (resi  6 and resn THR  and name HA  ) 3.40 1.60 1.60 ! W

assi (resi 14 and resn A2G  and name HN2 )
     (resi  6 and resn THR  and name HB  ) 3.40 1.60 1.60 ! W
assi (resi 14 and resn A2G  and name HN2 )
     (resi  7 and resn THR  and name HA  ) 3.40 1.60 1.60 ! W
assi (resi 14 and resn A2G  and name HN2 )
     (resi  5 and resn THR  and name HB  ) 3.40 1.60 1.60 ! W

assi (resi 13 and resn A2G  and name HN2 )
     (resi  4 and resn THR  and name HB  ) 3.40 1.60 1.60 ! W
assi (resi 13 and resn A2G  and name HN2 )
     (resi  5 and resn THR  and name HB  ) 3.40 1.60 1.60 ! W
assi (resi 12 and resn A2G  and name HN2 )
     (resi  4 and resn THR  and name HB  ) 3.40 1.60 1.60 ! W
assi (resi 12 and resn A2G  and name HN2 )
     (resi  3 and resn PRO  and name HA  ) 3.40 1.60 1.60 ! W
assi (resi 12 and resn A2G  and name HN2 )
     (resi  5 and resn THR  and name HA  ) 3.40 1.60 1.60 ! W

assi (resi 15 and resn A2G  and name H1  )
     (resi 15 and resn A2G  and name H3  ) 3.40 1.60 1.60 ! W
assi (resi 15 and resn A2G  and name H1  )
     (resi  7 and resn THR  and name HB  ) 2.40 0.60 0.60 ! S
assi (resi 15 and resn A2G  and name H1  )
     (resi 15 and resn A2G  and name H2  ) 2.40 0.60 0.60 ! S
assi (resi 14 and resn A2G  and name H1  )
     (resi  6 and resn THR  and name HB  ) 2.90 1.10 1.10 ! M
assi (resi 14 and resn A2G  and name H1  )
     (resi 14 and resn A2G  and name H2  ) 2.40 0.60 0.60 ! S
assi (resi 14 and resn A2G  and name H1  )
     (resi 14 and resn A2G  and name H4  ) 3.40 1.60 1.60 ! W
assi (resi 14 and resn A2G  and name H1  )
     (resi 14 and resn A2G  and name H3  ) 3.40 1.60 1.60 ! W
assi (resi  5 and resn THR  and name HA  )
     (resi  5 and resn THR  and name HB  ) 3.40 1.60 1.60 ! W
assi (resi 12 and resn A2G  and name H1  )
     (resi  4 and resn THR  and name HB  ) 3.40 1.60 1.60 ! W
assi (resi 12 and resn A2G  and name H1  )
     (resi 12 and resn A2G  and name H2  ) 2.40 0.60 0.60 ! S
assi (resi 12 and resn A2G  and name H1  )
     (resi 12 and resn A2G  and name H3  ) 3.40 1.60 1.60 ! W
assi (resi 13 and resn A2G  and name H1  )
     (resi  5 and resn THR  and name HB  ) 3.40 1.60 1.60 ! W
assi (resi  4 and resn THR  and name HA  )
     (resi  4 and resn THR  and name HB  ) 3.40 1.60 1.60 ! W
assi (resi 13 and resn A2G  and name H1  )
     (resi 13 and resn A2G  and name H2  ) 2.40 0.60 0.60 ! S

assi (resi 13 and resn A2G  and name H1  )
     (resi 13 and resn A2G  and name H4  ) 3.40 1.60 1.60 ! W

assi (resi 13 and resn A2G  and name H1  ) 
     (resi 13 and resn A2G  and name H3  ) 3.40 1.60 1.60 ! W
assi (resi  2 and resn PRO  and name HA  )
     (resi  3 and resn PRO  and name HD2 ) 2.90 1.10 1.10 ! M
assi (resi  7 and resn THR  and name HA  )
     (resi  7 and resn THR  and name HB  ) 3.40 1.60 1.60 ! W
assi (resi  9 and resn LYS  and name HA  )
     (resi 10 and resn PRO  and name HD3 ) 2.90 1.10 1.10 ! M
assi (resi  9 and resn LYS  and name HA  )
     (resi 10 and resn PRO  and name HD2 ) 2.40 0.60 0.60 ! S
assi (resi  5 and resn THR  and name HB  )
     (resi 13 and resn A2G  and name H2  ) 3.40 1.60 1.60 ! W
assi (resi  4 and resn THR  and name HB  )
     (resi 12 and resn A2G  and name H2  ) 3.40 1.60 1.60 ! W
assi (resi  2 and resn PRO  and name HA  )
     (resi  2 and resn PRO  and name HB2 ) 2.90 1.10 1.10 ! M
assi (resi  3 and resn PRO  and name HA  )
     (resi  3 and resn PRO  and name HB2 ) 3.40 1.60 1.60 ! W
assi (resi 10 and resn PRO  and name HA  )
     (resi 10 and resn PRO  and name HB2 ) 3.40 1.60 1.60 ! W
assi (resi 15 and resn A2G  and name H1  )
     (resi  7 and resn THR  and name HG2# ) 3.40 1.60 1.60 ! W
assi (resi  5 and resn THR  and name HA  )
     (resi  5 and resn THR  and name HG2# ) 3.40 1.60 1.60 ! W
assi (resi  6 and resn THR  and name HA  )
     (resi  6 and resn THR  and name HG2# ) 3.40 1.60 1.60 ! W
assi (resi  2 and resn PRO  and name HA  )
     (resi  2 and resn PRO  and name HG# ) 3.40 1.60 1.60 ! W
assi (resi  4 and resn THR  and name HA  )
     (resi  4 and resn THR  and name HG2# ) 3.40 1.60 1.60 ! W

assi (resi 13 and resn A2G  and name H1  )
     (resi  5 and resn THR  and name HG2# ) 3.40 1.60 1.60 ! W


assi (resi 13 and resn A2G  and name H1  )
     (resi  7 and resn THR  and name HG2# ) 3.40 1.60 1.60 ! W
assi (resi  2 and resn PRO  and name HA  )
     (resi  2 and resn PRO  and name HB3 ) 3.40 1.60 1.60 ! W

assi (resi  3 and resn PRO  and name HA  )
     (resi  4 and resn THR  and name HG2# ) 3.40 1.60 1.60 ! W

assi (resi  6 and resn THR  and name HA  )
     (resi  7 and resn THR  and name HG2# ) 3.40 1.60 1.60 ! W
assi (resi  3 and resn PRO  and name HA  )
     (resi  3 and resn PRO  and name HB3 ) 3.40 1.60 1.60 ! W
assi (resi  7 and resn THR  and name HA  )
     (resi  7 and resn THR  and name HG2# ) 3.40 1.60 1.60 ! W
assi (resi  5 and resn THR  and name HB  )
     (resi  5 and resn THR  and name HG2# ) 3.40 1.60 1.60 ! W
assi (resi  6 and resn THR  and name HB  )
     (resi  6 and resn THR  and name HG2# ) 3.40 1.60 1.60 ! W
assi (resi  4 and resn THR  and name HB  )
     (resi  4 and resn THR  and name HG2# ) 3.40 1.60 1.60 ! W
assi (resi  9 and resn LYS  and name HA  )
     (resi  9 and resn LYS  and name HB# ) 3.40 1.60 1.60 ! W
assi (resi  9 and resn LYS  and name HA  )
     (resi  9 and resn LYS  and name HG# ) 3.40 1.60 1.60 ! W
assi (resi 10 and resn PRO  and name HA  )
     (resi 10 and resn PRO  and name HB3 ) 3.40 1.60 1.60 ! W
assi (resi  7 and resn THR  and name HB  )
     (resi  7 and resn THR  and name HG2# ) 3.40 1.60 1.60 ! W
assi (resi  8 and resn LYS  and name HA  )
     (resi  8 and resn LYS  and name HB# ) 3.40 1.60 1.60 ! W
assi (resi 12 and resn A2G  and name H5  )
     (resi  4 and resn THR  and name HG2# ) 3.40 1.60 1.60 ! W
assi (resi 13 and resn A2G  and name H5  )
     (resi  5 and resn THR  and name HG2# ) 3.40 1.60 1.60 ! W
assi (resi 14 and resn A2G  and name H5  )
     (resi  6 and resn THR  and name HG2# ) 3.40 1.60 1.60 ! W
assi (resi 15 and resn A2G  and name H5  )
     (resi  7 and resn THR  and name HG2# ) 3.40 1.60 1.60 ! W

assi (resi 12 and resn A2G  and name H4  )
     (resi  4 and resn THR  and name HG2# ) 3.40 1.60 1.60 ! W


assi (resi 13 and resn A2G  and name H4  )
     (resi  5 and resn THR  and name HG2# ) 3.40 1.60 1.60 ! W


assi (resi 12 and resn A2G  and name H3  )
     (resi  4 and resn THR  and name HG2# ) 3.40 1.60 1.60 ! W


assi (resi 13 and resn A2G  and name H3  )
     (resi  5 and resn THR  and name HG2# ) 3.40 1.60 1.60 ! W


assi (resi 14 and resn A2G  and name H3  )
     (resi  6 and resn THR  and name HG2# ) 3.40 1.60 1.60 ! W


assi (resi 15 and resn A2G  and name H3  )
     (resi  7 and resn THR  and name HG2# ) 3.40 1.60 1.60 ! W

assi (resi 12 and resn A2G  and name H8# )
     (resi  4 and resn THR  and name H   ) 3.40 1.60 1.60 ! W

assi (resi 13 and resn A2G  and name H8# )
     (resi  5 and resn THR  and name H   ) 3.40 1.60 1.60 ! W

assi (resi 14 and resn A2G  and name H8# )
     (resi  6 and resn THR  and name H   ) 3.40 1.60 1.60 ! W

assi (resi 15 and resn A2G  and name H8# )
     (resi  7 and resn THR  and name H   ) 3.40 1.60 1.60 ! W

assi (resi 15 and resn A2G  and (name H14 or name H6 ) )
     (resi  7 and resn THR  and name HG2# ) 3.40 1.60 1.60 ! W

assi (resi 14 and resn A2G  and (name H14 or name H6 ) )
     (resi  6 and resn THR  and name HG2# ) 3.40 1.60 1.60 ! W

assi (resi 13 and resn A2G  and (name H14 or name H6 ) )
     (resi  5 and resn THR  and name HG2# ) 3.40 1.60 1.60 ! W

assi (resi 12 and resn A2G  and (name H14 or name H6 ) )
     (resi  4 and resn THR  and name HG2# ) 3.40 1.60 1.60 ! W

assi (resi  2 and resn PRO  and name HD# )
     (resi  2 and resn PRO  and name HG# ) 2.90 1.10 1.10 ! M
assi (resi  3 and resn PRO  and name HD3 )
     (resi  3 and resn PRO  and name HB3 ) 2.90 1.10 1.10 ! M

assi (resi 10 and resn PRO  and name HD3 )
     (resi  9 and resn LYS  and name HB# ) 3.40 1.60 1.60 ! W

assi (resi  2 and resn PRO  and name HD# )
     (resi  1 and resn ACE  and name HA# ) 2.90 1.10 1.10 ! M
assi (resi  3 and resn PRO  and name HD2 )
     (resi  3 and resn PRO  and name HB3 ) 3.40 1.60 1.60 ! W
assi (resi 14 and resn A2G  and name H1  )
     (resi  6 and resn THR  and name HG2# ) 3.40 1.60 1.60 ! W
assi (resi 12 and resn A2G  and name H1  )
     (resi  4 and resn THR  and name HG2# ) 3.40 1.60 1.60 ! W

assi (resi 15 and resn A2G  and name H2  )
     (resi 15 and resn A2G  and name HN2 ) 3.40 1.60 1.60 ! W
assi (resi 14 and resn A2G  and name H2  )
     (resi 14 and resn A2G  and name HN2 ) 3.40 1.60 1.60 ! W
assi (resi 12 and resn A2G  and name H2  )
     (resi 12 and resn A2G  and name HN2 ) 3.40 1.60 1.60 ! W
assi (resi 13 and resn A2G  and name H2  )
     (resi 13 and resn A2G  and name HN2 ) 3.40 1.60 1.60 ! W
assi (resi 12 and resn A2G  and name H3  )
     (resi 12 and resn A2G  and name HN2 ) 3.40 1.60 1.60 ! W
assi (resi 13 and resn A2G  and name H3  )
     (resi 13 and resn A2G  and name HN2 ) 3.40 1.60 1.60 ! W
assi (resi 15 and resn A2G  and name H3  )
     (resi 15 and resn A2G  and name HN2 ) 3.40 1.60 1.60 ! W
assi (resi 14 and resn A2G  and name H3  )
     (resi 14 and resn A2G  and name HN2 ) 2.90 1.10 1.10 ! M
assi (resi  6 and resn THR  and name H   )
     (resi 14 and resn A2G  and name HN2 ) 3.40 1.60 1.60 ! W
assi (resi  5 and resn THR  and name H   )
     (resi 13 and resn A2G  and name HN2 ) 3.40 1.60 1.60 ! W
assi (resi  7 and resn THR  and name H   )
     (resi 15 and resn A2G  and name HN2 ) 3.40 1.60 1.60 ! W
assi (resi  4 and resn THR  and name H   )
     (resi 12 and resn A2G  and name HN2 ) 3.40 1.60 1.60 ! W
assi (resi 13 and resn A2G  and name H8# )
     (resi  7 and resn THR  and name H   ) 3.40 1.60 1.60 ! W

assi (resi 15 and resn A2G  and name H8# )
     (resi  9 and resn LYS  and name H   ) 3.40 1.60 1.60 ! W

assi (resi 15 and resn A2G  and name H8# )
     (resi 15 and resn A2G  and name HN2 ) 3.40 1.60 1.60 ! W
assi (resi 12 and resn A2G  and name H8# )
     (resi  6 and resn THR  and name H   ) 3.40 1.60 1.60 ! W
assi (resi 12 and resn A2G  and name H8# )
     (resi 12 and resn A2G  and name HN2 ) 3.40 1.60 1.60 ! W
assi (resi 13 and resn A2G  and name H8# )
     (resi 13 and resn A2G  and name HN2 ) 3.40 1.60 1.60 ! W

assi (resi 14 and resn A2G  and name H8# )
     (resi  8 and resn LYS  and name H   ) 3.40 1.60 1.60 ! W

assi (resi 14 and resn A2G  and name H8# )
     (resi 14 and resn A2G  and name HN2 ) 3.40 1.60 1.60 ! W
assi (resi 10 and resn PRO  and name HB3 )
     (resi 11 and resn NH2  and name HN# ) 3.40 1.60 1.60 ! W
assi (resi  9 and resn LYS  and name HB# )
     (resi  9 and resn LYS  and name H   ) 3.40 1.60 1.60 ! W
assi (resi  8 and resn LYS  and name HB# )
     (resi  8 and resn LYS  and name H   ) 3.40 1.60 1.60 ! W

assi (resi  9 and resn LYS  and name HG# )
     (resi  9 and resn LYS  and name H   ) 3.40 1.60 1.60 ! W


assi (resi  8 and resn LYS  and name HG# )
     (resi  9 and resn LYS  and name H   ) 3.40 1.60 1.60 ! W


assi (resi  8 and resn LYS  and name HG# )
     (resi  8 and resn LYS  and name H   ) 3.40 1.60 1.60 ! W


assi (resi  4 and resn THR  and name HG2# )
     (resi  5 and resn THR  and name H   ) 3.40 1.60 1.60 ! W

assi (resi  4 and resn THR  and name HG2# )
     (resi  4 and resn THR  and name H   ) 3.40 1.60 1.60 ! W

assi (resi  5 and resn THR  and name HG2# )
     (resi  6 and resn THR  and name H   ) 3.40 1.60 1.60 ! W

assi (resi  5 and resn THR  and name HG2# )
     (resi  5 and resn THR  and name H   ) 3.40 1.60 1.60 ! W
assi (resi  6 and resn THR  and name HG2# )
     (resi  6 and resn THR  and name H   ) 3.40 1.60 1.60 ! W
assi (resi  7 and resn THR  and name HG2# )
     (resi  7 and resn THR  and name H   ) 3.40 1.60 1.60 ! W

assi (resi  7 and resn THR  and name HG2# )
     (resi  8 and resn LYS  and name H   ) 3.40 1.60 1.60 ! W

assi (resi 10 and resn PRO  and name HB2 )
     (resi 11 and resn NH2  and name HN# ) 3.40 1.60 1.60 ! W
assi (resi  2 and resn PRO  and name HG# )
     (resi  2 and resn PRO  and name HB2 ) 3.40 1.60 1.60 ! W
assi (resi  3 and resn PRO  and name HB3 )
     (resi  3 and resn PRO  and name HB2 ) 2.40 0.80 0.60 ! S
assi (resi 10 and resn PRO  and name HB3 )
     (resi 10 and resn PRO  and name HB2 ) 2.40 0.80 0.60 ! S
assi (resi  9 and resn LYS  and name HD# )
     (resi  9 and resn LYS  and name HE# ) 3.40 1.60 1.60 ! W
assi (resi  8 and resn LYS  and name HD# )
     (resi  8 and resn LYS  and name HE# ) 3.40 1.60 1.60 ! W

assi (resi 12 and resn A2G  and name H8# )
     (resi  6 and resn THR  and name HG2# ) 3.40 1.60 1.60 ! W
assi (resi 13 and resn A2G  and name H8# )
     (resi  7 and resn THR  and name HG2# ) 3.40 1.60 1.60 ! W

assi (resi  9 and resn LYS  and name HB# )
     (resi  9 and resn LYS  and name HG# ) 2.90 1.10 1.10 ! M
assi (resi  9 and resn LYS  and name HD# )
     (resi  9 and resn LYS  and name HG# ) 2.40 0.60 0.60 ! S
assi (resi 10 and resn PRO  and name HG3 )
     (resi 10 and resn PRO  and name HB3 ) 2.40 0.60 0.60 ! S
assi (resi  3 and resn PRO  and name HG# )
     (resi  3 and resn PRO  and name HB3 ) 2.40 0.60 0.60 ! S

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   ACE   1           H1       ACE   1  -2.866 -22.268   6.851
    2    H2   ACE   1           H2       ACE   1  -3.069 -23.045   8.421
    3    H3   ACE   1           H3       ACE   1  -3.139 -24.007   6.944
    4    HA   PRO   2           HA       PRO   2   1.109 -25.049   6.826
    5    HB2  PRO   2           HB2      PRO   2   1.901 -23.451   4.564
    6    HB3  PRO   2           HB3      PRO   2   1.569 -25.189   4.614
    7    HG2  PRO   2           HG2      PRO   2  -0.125 -22.996   3.692
    8    HG3  PRO   2           HG3      PRO   2  -0.238 -24.729   3.357
    9    HD2  PRO   2           HD2      PRO   2  -2.017 -23.395   4.957
   10    HD3  PRO   2           HD3      PRO   2  -1.635 -25.120   5.156
   11    HA   PRO   3           HA       PRO   3   3.654 -22.204   8.984
   12    HB2  PRO   3           HB2      PRO   3   5.880 -22.213   7.156
   13    HB3  PRO   3           HB3      PRO   3   5.725 -23.071   8.696
   14    HG2  PRO   3           HG2      PRO   3   5.391 -24.064   5.970
   15    HG3  PRO   3           HG3      PRO   3   5.676 -24.956   7.471
   16    HD2  PRO   3           HD2      PRO   3   3.282 -24.992   6.139
   17    HD3  PRO   3           HD3      PRO   3   3.420 -25.220   7.898
   18    H    THR   4           H        THR   4   2.905 -20.148   8.907
   19    HA   THR   4           HA       THR   4   3.054 -18.634   6.400
   20    HB   THR   4           HB       THR   4   1.657 -16.981   7.574
   21   HG21  THR   4          HG21      THR   4  -0.296 -18.223   7.443
   22   HG22  THR   4          HG22      THR   4   0.411 -19.613   8.267
   23   HG23  THR   4          HG23      THR   4   0.809 -19.292   6.579
   24    H    THR   5           H        THR   5   3.741 -16.310   6.591
   25    HA   THR   5           HA       THR   5   5.908 -15.945   8.560
   26    HB   THR   5           HB       THR   5   7.400 -15.109   6.843
   27   HG21  THR   5          HG21      THR   5   6.424 -17.531   5.442
   28   HG22  THR   5          HG22      THR   5   6.755 -17.728   7.163
   29   HG23  THR   5          HG23      THR   5   8.028 -17.169   6.079
   30    H    THR   6           H        THR   6   6.185 -13.869   9.290
   31    HA   THR   6           HA       THR   6   4.128 -11.935   8.441
   32    HB   THR   6           HB       THR   6   4.420 -10.887  10.601
   33   HG21  THR   6          HG21      THR   6   3.230 -13.239  10.287
   34   HG22  THR   6          HG22      THR   6   3.435 -12.541  11.894
   35   HG23  THR   6          HG23      THR   6   4.545 -13.788  11.326
   36    H    THR   7           H        THR   7   4.697  -9.734   8.118
   37    HA   THR   7           HA       THR   7   7.463  -9.398   7.169
   38    HB   THR   7           HB       THR   7   6.588  -7.503   5.882
   39   HG21  THR   7          HG21      THR   7   5.510  -8.780   4.270
   40   HG22  THR   7          HG22      THR   7   4.544  -9.652   5.460
   41   HG23  THR   7          HG23      THR   7   6.248 -10.052   5.242
   42    H    LYS   8           H        LYS   8   8.767  -7.741   7.877
   43    HA   LYS   8           HA       LYS   8   8.150  -6.668  10.492
   44    HB2  LYS   8           HB2      LYS   8  10.421  -7.445   9.963
   45    HB3  LYS   8           HB3      LYS   8  10.547  -6.226   8.695
   46    HG2  LYS   8           HG2      LYS   8  11.041  -4.603  10.182
   47    HG3  LYS   8           HG3      LYS   8   9.699  -5.063  11.230
   48    HD2  LYS   8           HD2      LYS   8  11.882  -5.339  12.373
   49    HD3  LYS   8           HD3      LYS   8  11.046  -6.881  12.187
   50    HE2  LYS   8           HE2      LYS   8  12.657  -7.711  10.833
   51    HE3  LYS   8           HE3      LYS   8  12.742  -6.223   9.890
   52    HZ1  LYS   8           HZ1      LYS   8  14.437  -5.455  11.106
   53    HZ2  LYS   8           HZ2      LYS   8  14.651  -7.074  11.576
   54    HZ3  LYS   8           HZ3      LYS   8  13.785  -6.004  12.572
   55    H    LYS   9           H        LYS   9   7.243  -4.759  10.894
   56    HA   LYS   9           HA       LYS   9   6.341  -3.028   8.852
   57    HB2  LYS   9           HB2      LYS   9   5.358  -3.251  11.164
   58    HB3  LYS   9           HB3      LYS   9   6.726  -2.314  11.765
   59    HG2  LYS   9           HG2      LYS   9   6.108  -0.520  10.086
   60    HG3  LYS   9           HG3      LYS   9   4.626  -1.425   9.773
   61    HD2  LYS   9           HD2      LYS   9   4.023  -1.264  12.163
   62    HD3  LYS   9           HD3      LYS   9   5.498  -0.348  12.471
   63    HE2  LYS   9           HE2      LYS   9   4.554   1.565  11.745
   64    HE3  LYS   9           HE3      LYS   9   4.003   0.794  10.257
   65    HZ1  LYS   9           HZ1      LYS   9   2.581   1.259  12.734
   66    HZ2  LYS   9           HZ2      LYS   9   2.347  -0.282  12.057
   67    HZ3  LYS   9           HZ3      LYS   9   1.988   1.111  11.152
   68    HA   PRO  10           HA       PRO  10   9.968  -0.828   7.664
   69    HB2  PRO  10           HB2      PRO  10   8.484   1.629   7.428
   70    HB3  PRO  10           HB3      PRO  10   9.025   0.549   6.134
   71    HG2  PRO  10           HG2      PRO  10   6.390   0.804   7.365
   72    HG3  PRO  10           HG3      PRO  10   6.850   0.077   5.819
   73    HD2  PRO  10           HD2      PRO  10   6.020  -1.394   7.975
   74    HD3  PRO  10           HD3      PRO  10   7.132  -2.024   6.738
   75    HN1  NH2  11           HN1      NH2  11   7.830   0.828  10.150
   76    HN2  NH2  11           HN2      NH2  11   9.125   0.701  11.240
   77    H1   A2G 101           H1       A2G  12   2.685 -16.090   9.424
   78    H2   A2G 101           H2       A2G  12   2.164 -15.684  11.791
   79    HN2  A2G 101           HN2      A2G  12   3.428 -18.331  11.388
   80    H3   A2G 101           H3       A2G  12   0.883 -18.429  11.724
   81    HO3  A2G 101           HO3      A2G  12   1.841 -16.848  13.666
   82    H4   A2G 101           H4       A2G  12  -1.234 -17.272  12.019
   83    HO4  A2G 101           HO4      A2G  12  -0.275 -14.769  11.496
   84    H5   A2G 101           H5       A2G  12  -0.501 -17.602   9.699
   85    H6   A2G 101           H6       A2G  12  -1.559 -14.778   9.855
   86    H8   A2G 101           H8       A2G  12   5.429 -18.408  13.249
   87    H8A  A2G 101           H8A      A2G  12   6.405 -17.001  12.828
   88    H8B  A2G 101           H8B      A2G  12   5.858 -18.104  11.566
   89    H14  A2G 101           H14      A2G  12  -1.953 -16.034   8.681
   90    H15  A2G 101           H15      A2G  12  -2.705 -17.181  10.727
   91    H1   A2G 102           H1       A2G  13   6.500 -13.225   5.769
   92    H2   A2G 102           H2       A2G  13   6.320 -12.471   3.437
   93    HN2  A2G 102           HN2      A2G  13   3.924 -13.986   4.292
   94    H3   A2G 102           H3       A2G  13   5.552 -15.339   2.829
   95    HO3  A2G 102           HO3      A2G  13   4.683 -14.338   1.211
   96    H4   A2G 102           H4       A2G  13   7.669 -15.486   1.645
   97    HO4  A2G 102           HO4      A2G  13   7.598 -12.779   2.056
   98    H5   A2G 102           H5       A2G  13   7.730 -16.050   4.033
   99    H6   A2G 102           H6       A2G  13  10.152 -14.366   3.324
  100    H8   A2G 102           H8       A2G  13   1.858 -12.083   3.244
  101    H8A  A2G 102           H8A      A2G  13   2.159 -11.002   4.604
  102    H8B  A2G 102           H8B      A2G  13   2.129 -12.747   4.855
  103    H14  A2G 102           H14      A2G  13  10.104 -15.753   4.413
  104    H15  A2G 102           H15      A2G  13   9.619 -15.750   1.620
  105    H1   A2G 103           H1       A2G  14   6.568  -9.971  10.697
  106    H2   A2G 103           H2       A2G  14   8.381  -9.863  12.353
  107    HN2  A2G 103           HN2      A2G  14   8.662 -12.202  10.557
  108    H3   A2G 103           H3       A2G  14   7.741 -12.777  12.886
  109    HO3  A2G 103           HO3      A2G  14   9.376 -11.151  14.459
  110    H4   A2G 103           H4       A2G  14   6.939 -12.051  15.057
  111    HO4  A2G 103           HO4      A2G  14   7.396 -10.147  15.795
  112    H5   A2G 103           H5       A2G  14   5.264 -12.022  13.267
  113    H6   A2G 103           H6       A2G  14   4.686  -9.422  14.594
  114    H8   A2G 103           H8       A2G  14  11.472 -11.904   9.768
  115    H8A  A2G 103           H8A      A2G  14  11.152 -10.465   8.799
  116    H8B  A2G 103           H8B      A2G  14  10.029 -11.825   8.757
  117    H14  A2G 103           H14      A2G  14   3.691 -10.875  14.486
  118    H15  A2G 103           H15      A2G  14   4.361 -11.306  16.410
  119    H1   A2G 104           H1       A2G  15   5.742  -5.897   7.342
  120    H2   A2G 104           H2       A2G  15   3.722  -4.504   7.488
  121    HN2  A2G 104           HN2      A2G  15   3.401  -7.064   8.941
  122    H3   A2G 104           H3       A2G  15   2.231  -7.008   6.658
  123    HO3  A2G 104           HO3      A2G  15   1.122  -5.603   8.062
  124    H4   A2G 104           H4       A2G  15   1.769  -5.863   4.569
  125    HO4  A2G 104           HO4      A2G  15   3.353  -3.820   4.551
  126    H5   A2G 104           H5       A2G  15   3.864  -7.136   4.613
  127    H6   A2G 104           H6       A2G  15   4.966  -4.806   3.249
  128    H8   A2G 104           H8       A2G  15   2.472  -5.755  11.670
  129    H8A  A2G 104           H8A      A2G  15   4.215  -5.564  11.857
  130    H8B  A2G 104           H8B      A2G  15   3.563  -7.022  11.109
  131    H14  A2G 104           H14      A2G  15   4.421  -6.340   2.571
  132    H15  A2G 104           H15      A2G  15   2.876  -5.127   1.817
  Start of MODEL    2
    1    H1   ACE   1           H1       ACE   1   1.605 -25.465   2.756
    2    H2   ACE   1           H2       ACE   1   3.111 -25.027   3.564
    3    H3   ACE   1           H3       ACE   1   2.381 -23.923   2.397
    4    HA   PRO   2           HA       PRO   2  -0.966 -23.999   5.979
    5    HB2  PRO   2           HB2      PRO   2   0.354 -25.242   8.217
    6    HB3  PRO   2           HB3      PRO   2  -1.124 -25.759   7.392
    7    HG2  PRO   2           HG2      PRO   2   1.605 -26.761   7.123
    8    HG3  PRO   2           HG3      PRO   2   0.074 -27.519   6.667
    9    HD2  PRO   2           HD2      PRO   2   1.876 -26.572   4.837
   10    HD3  PRO   2           HD3      PRO   2   0.127 -26.650   4.528
   11    HA   PRO   3           HA       PRO   3   2.407 -22.160   9.143
   12    HB2  PRO   3           HB2      PRO   3   4.753 -21.952   7.484
   13    HB3  PRO   3           HB3      PRO   3   4.563 -22.836   9.006
   14    HG2  PRO   3           HG2      PRO   3   4.521 -23.828   6.260
   15    HG3  PRO   3           HG3      PRO   3   4.773 -24.706   7.776
   16    HD2  PRO   3           HD2      PRO   3   2.496 -24.943   6.270
   17    HD3  PRO   3           HD3      PRO   3   2.525 -25.174   8.034
   18    H    THR   4           H        THR   4   3.323 -19.937   9.048
   19    HA   THR   4           HA       THR   4   2.817 -18.483   6.551
   20    HB   THR   4           HB       THR   4   1.443 -16.800   7.713
   21   HG21  THR   4          HG21      THR   4   0.521 -19.020   6.668
   22   HG22  THR   4          HG22      THR   4  -0.553 -18.020   7.646
   23   HG23  THR   4          HG23      THR   4   0.191 -19.459   8.343
   24    H    THR   5           H        THR   5   3.558 -16.182   6.734
   25    HA   THR   5           HA       THR   5   5.705 -15.850   8.730
   26    HB   THR   5           HB       THR   5   7.235 -15.053   7.022
   27   HG21  THR   5          HG21      THR   5   6.242 -17.482   5.647
   28   HG22  THR   5          HG22      THR   5   6.546 -17.657   7.375
   29   HG23  THR   5          HG23      THR   5   7.843 -17.133   6.300
   30    H    THR   6           H        THR   6   6.088 -13.746   9.384
   31    HA   THR   6           HA       THR   6   4.040 -11.794   8.554
   32    HB   THR   6           HB       THR   6   4.433 -10.695  10.678
   33   HG21  THR   6          HG21      THR   6   4.493 -13.577  11.477
   34   HG22  THR   6          HG22      THR   6   3.171 -13.024  10.450
   35   HG23  THR   6          HG23      THR   6   3.428 -12.285  12.030
   36    H    THR   7           H        THR   7   4.653  -9.589   8.221
   37    HA   THR   7           HA       THR   7   7.373  -9.339   7.124
   38    HB   THR   7           HB       THR   7   6.478  -7.389   5.908
   39   HG21  THR   7          HG21      THR   7   5.320  -8.634   4.318
   40   HG22  THR   7          HG22      THR   7   4.427  -9.546   5.536
   41   HG23  THR   7          HG23      THR   7   6.123  -9.916   5.225
   42    H    LYS   8           H        LYS   8   8.764  -7.723   7.759
   43    HA   LYS   8           HA       LYS   8   8.323  -6.632  10.402
   44    HB2  LYS   8           HB2      LYS   8  10.537  -7.377   9.984
   45    HB3  LYS   8           HB3      LYS   8  10.619  -6.514   8.448
   46    HG2  LYS   8           HG2      LYS   8  10.883  -4.438   9.473
   47    HG3  LYS   8           HG3      LYS   8  10.124  -4.970  10.974
   48    HD2  LYS   8           HD2      LYS   8  12.063  -6.330  11.529
   49    HD3  LYS   8           HD3      LYS   8  12.810  -5.959   9.975
   50    HE2  LYS   8           HE2      LYS   8  13.661  -4.578  11.929
   51    HE3  LYS   8           HE3      LYS   8  13.066  -3.642  10.558
   52    HZ1  LYS   8           HZ1      LYS   8  11.334  -2.868  11.726
   53    HZ2  LYS   8           HZ2      LYS   8  12.275  -3.274  13.082
   54    HZ3  LYS   8           HZ3      LYS   8  11.069  -4.337  12.533
   55    H    LYS   9           H        LYS   9   8.173  -4.461  10.957
   56    HA   LYS   9           HA       LYS   9   6.737  -2.784   9.193
   57    HB2  LYS   9           HB2      LYS   9   8.163  -2.259  11.801
   58    HB3  LYS   9           HB3      LYS   9   7.268  -1.007  10.941
   59    HG2  LYS   9           HG2      LYS   9   5.739  -3.482  11.160
   60    HG3  LYS   9           HG3      LYS   9   6.191  -2.843  12.741
   61    HD2  LYS   9           HD2      LYS   9   5.280  -0.631  12.096
   62    HD3  LYS   9           HD3      LYS   9   4.795  -1.297  10.536
   63    HE2  LYS   9           HE2      LYS   9   2.922  -2.179  11.424
   64    HE3  LYS   9           HE3      LYS   9   3.846  -2.980  12.694
   65    HZ1  LYS   9           HZ1      LYS   9   2.445  -1.496  13.801
   66    HZ2  LYS   9           HZ2      LYS   9   2.728  -0.243  12.688
   67    HZ3  LYS   9           HZ3      LYS   9   3.947  -0.709  13.776
   68    HA   PRO  10           HA       PRO  10   9.592  -0.792   6.553
   69    HB2  PRO  10           HB2      PRO  10   8.887   1.884   7.356
   70    HB3  PRO  10           HB3      PRO  10   8.385   1.009   5.901
   71    HG2  PRO  10           HG2      PRO  10   6.932   1.467   8.393
   72    HG3  PRO  10           HG3      PRO  10   6.323   0.999   6.799
   73    HD2  PRO  10           HD2      PRO  10   6.381  -0.709   8.939
   74    HD3  PRO  10           HD3      PRO  10   6.490  -1.261   7.251
   75    HN1  NH2  11           HN1      NH2  11  11.991  -0.279   7.031
   76    HN2  NH2  11           HN2      NH2  11  12.122   1.236   7.784
   77    H1   A2G 101           H1       A2G  12   2.411 -15.903   9.548
   78    H2   A2G 101           H2       A2G  12   1.944 -15.510  11.928
   79    HN2  A2G 101           HN2      A2G  12   3.236 -18.136  11.479
   80    H3   A2G 101           H3       A2G  12   0.706 -18.275  11.895
   81    HO3  A2G 101           HO3      A2G  12   1.788 -16.885  13.800
   82    H4   A2G 101           H4       A2G  12  -1.426 -17.165  12.224
   83    HO4  A2G 101           HO4      A2G  12  -0.667 -14.636  11.699
   84    H5   A2G 101           H5       A2G  12  -0.752 -17.452   9.884
   85    H6   A2G 101           H6       A2G  12  -1.947 -14.703  10.370
   86    H8   A2G 101           H8       A2G  12   5.104 -18.368  13.173
   87    H8A  A2G 101           H8A      A2G  12   6.086 -16.904  13.252
   88    H8B  A2G 101           H8B      A2G  12   5.830 -17.713  11.705
   89    H14  A2G 101           H14      A2G  12  -2.079 -15.636   8.879
   90    H15  A2G 101           H15      A2G  12  -3.606 -15.765  11.037
   91    H1   A2G 102           H1       A2G  13   6.378 -13.172   5.907
   92    H2   A2G 102           H2       A2G  13   6.239 -12.453   3.562
   93    HN2  A2G 102           HN2      A2G  13   3.807 -13.923   4.395
   94    H3   A2G 102           H3       A2G  13   5.436 -15.319   2.989
   95    HO3  A2G 102           HO3      A2G  13   4.494 -13.724   1.657
   96    H4   A2G 102           H4       A2G  13   7.566 -15.516   1.835
   97    HO4  A2G 102           HO4      A2G  13   8.567 -13.145   2.811
   98    H5   A2G 102           H5       A2G  13   7.588 -16.043   4.233
   99    H6   A2G 102           H6       A2G  13  10.032 -14.421   3.449
  100    H8   A2G 102           H8       A2G  13   1.754 -12.208   3.495
  101    H8A  A2G 102           H8A      A2G  13   2.092 -10.823   4.533
  102    H8B  A2G 102           H8B      A2G  13   2.126 -12.454   5.201
  103    H14  A2G 102           H14      A2G  13   9.975 -15.696   4.666
  104    H15  A2G 102           H15      A2G  13   9.396 -17.149   3.010
  105    H1   A2G 103           H1       A2G  14   6.614  -9.845  10.690
  106    H2   A2G 103           H2       A2G  14   8.466  -9.757  12.304
  107    HN2  A2G 103           HN2      A2G  14   8.636 -12.153  10.572
  108    H3   A2G 103           H3       A2G  14   7.729 -12.629  12.929
  109    HO3  A2G 103           HO3      A2G  14   9.975 -11.341  13.126
  110    H4   A2G 103           H4       A2G  14   7.020 -11.807  15.103
  111    HO4  A2G 103           HO4      A2G  14   7.821  -9.991  15.728
  112    H5   A2G 103           H5       A2G  14   5.314 -11.795  13.338
  113    H6   A2G 103           H6       A2G  14   4.780  -9.152  14.572
  114    H8   A2G 103           H8       A2G  14  11.484 -11.954   9.806
  115    H8A  A2G 103           H8A      A2G  14  11.169 -10.594   8.728
  116    H8B  A2G 103           H8B      A2G  14  10.041 -11.949   8.792
  117    H14  A2G 103           H14      A2G  14   3.801 -10.620  14.591
  118    H15  A2G 103           H15      A2G  14   5.427 -11.468  16.068
  119    H1   A2G 104           H1       A2G  15   5.685  -5.811   7.433
  120    H2   A2G 104           H2       A2G  15   3.677  -4.417   7.674
  121    HN2  A2G 104           HN2      A2G  15   3.393  -7.011   9.076
  122    H3   A2G 104           H3       A2G  15   2.157  -6.896   6.822
  123    HO3  A2G 104           HO3      A2G  15   0.403  -5.466   6.942
  124    H4   A2G 104           H4       A2G  15   1.627  -5.677   4.788
  125    HO4  A2G 104           HO4      A2G  15   2.868  -3.649   4.504
  126    H5   A2G 104           H5       A2G  15   3.704  -6.986   4.749
  127    H6   A2G 104           H6       A2G  15   4.355  -4.348   3.436
  128    H8   A2G 104           H8       A2G  15   2.446  -6.284  11.567
  129    H8A  A2G 104           H8A      A2G  15   3.759  -5.265  12.156
  130    H8B  A2G 104           H8B      A2G  15   4.121  -6.805  11.377
  131    H14  A2G 104           H14      A2G  15   4.676  -5.977   2.844
  132    H15  A2G 104           H15      A2G  15   2.825  -5.901   1.901
  Start of MODEL    3
    1    H1   ACE   1           H1       ACE   1  -0.758 -24.253   5.132
    2    H2   ACE   1           H2       ACE   1  -1.774 -22.826   4.927
    3    H3   ACE   1           H3       ACE   1  -2.168 -24.018   6.166
    4    HA   PRO   2           HA       PRO   2   0.071 -22.120   9.410
    5    HB2  PRO   2           HB2      PRO   2   2.210 -24.033   9.660
    6    HB3  PRO   2           HB3      PRO   2   0.770 -23.863  10.675
    7    HG2  PRO   2           HG2      PRO   2   1.314 -25.755   8.519
    8    HG3  PRO   2           HG3      PRO   2   0.112 -25.833   9.815
    9    HD2  PRO   2           HD2      PRO   2  -0.540 -25.391   7.191
   10    HD3  PRO   2           HD3      PRO   2  -1.512 -24.781   8.550
   11    HA   PRO   3           HA       PRO   3   4.665 -22.064   7.497
   12    HB2  PRO   3           HB2      PRO   3   4.167 -22.525   4.697
   13    HB3  PRO   3           HB3      PRO   3   5.191 -23.461   5.796
   14    HG2  PRO   3           HG2      PRO   3   2.483 -24.012   4.851
   15    HG3  PRO   3           HG3      PRO   3   3.674 -25.106   5.569
   16    HD2  PRO   3           HD2      PRO   3   1.406 -24.299   6.875
   17    HD3  PRO   3           HD3      PRO   3   2.906 -24.745   7.718
   18    H    THR   4           H        THR   4   4.163 -19.875   7.992
   19    HA   THR   4           HA       THR   4   3.692 -18.223   5.619
   20    HB   THR   4           HB       THR   4   2.077 -16.801   6.878
   21   HG21  THR   4          HG21      THR   4   0.229 -18.119   6.337
   22   HG22  THR   4          HG22      THR   4   0.996 -19.601   6.906
   23   HG23  THR   4          HG23      THR   4   1.496 -18.881   5.376
   24    H    THR   5           H        THR   5   4.607 -16.164   5.744
   25    HA   THR   5           HA       THR   5   6.520 -15.823   7.965
   26    HB   THR   5           HB       THR   5   7.773 -14.376   6.422
   27   HG21  THR   5          HG21      THR   5   7.216 -16.685   4.656
   28   HG22  THR   5          HG22      THR   5   7.615 -17.095   6.323
   29   HG23  THR   5          HG23      THR   5   8.743 -16.145   5.356
   30    H    THR   6           H        THR   6   6.583 -13.956   9.150
   31    HA   THR   6           HA       THR   6   4.296 -12.128   8.785
   32    HB   THR   6           HB       THR   6   4.523 -11.585  11.122
   33   HG21  THR   6          HG21      THR   6   5.049 -14.545  11.084
   34   HG22  THR   6          HG22      THR   6   3.586 -13.903  10.335
   35   HG23  THR   6          HG23      THR   6   3.887 -13.637  12.053
   36    H    THR   7           H        THR   7   4.582  -9.946   8.578
   37    HA   THR   7           HA       THR   7   7.336  -9.059   8.033
   38    HB   THR   7           HB       THR   7   6.333  -7.244   6.776
   39   HG21  THR   7          HG21      THR   7   5.545  -8.502   4.988
   40   HG22  THR   7          HG22      THR   7   4.603  -9.573   6.025
   41   HG23  THR   7          HG23      THR   7   6.355  -9.752   5.933
   42    H    LYS   8           H        LYS   8   7.704  -6.665   8.563
   43    HA   LYS   8           HA       LYS   8   6.309  -5.634  10.877
   44    HB2  LYS   8           HB2      LYS   8   7.687  -7.132  12.102
   45    HB3  LYS   8           HB3      LYS   8   9.098  -6.763  11.110
   46    HG2  LYS   8           HG2      LYS   8   9.468  -4.726  12.147
   47    HG3  LYS   8           HG3      LYS   8   7.770  -4.516  12.574
   48    HD2  LYS   8           HD2      LYS   8   7.923  -6.076  14.371
   49    HD3  LYS   8           HD3      LYS   8   9.486  -6.675  13.813
   50    HE2  LYS   8           HE2      LYS   8   9.270  -4.867  15.791
   51    HE3  LYS   8           HE3      LYS   8  10.639  -4.886  14.679
   52    HZ1  LYS   8           HZ1      LYS   8   8.190  -3.365  14.050
   53    HZ2  LYS   8           HZ2      LYS   8   9.760  -3.157  13.435
   54    HZ3  LYS   8           HZ3      LYS   8   9.401  -2.696  15.031
   55    H    LYS   9           H        LYS   9   6.116  -3.565  10.315
   56    HA   LYS   9           HA       LYS   9   6.635  -1.685   8.942
   57    HB2  LYS   9           HB2      LYS   9   7.070  -1.368  11.456
   58    HB3  LYS   9           HB3      LYS   9   8.781  -1.516  11.051
   59    HG2  LYS   9           HG2      LYS   9   8.563   0.762  10.799
   60    HG3  LYS   9           HG3      LYS   9   8.082   0.268   9.175
   61    HD2  LYS   9           HD2      LYS   9   5.684   0.137  10.143
   62    HD3  LYS   9           HD3      LYS   9   6.324   1.087  11.485
   63    HE2  LYS   9           HE2      LYS   9   6.375   1.861   8.553
   64    HE3  LYS   9           HE3      LYS   9   5.377   2.592   9.811
   65    HZ1  LYS   9           HZ1      LYS   9   8.040   3.186   9.109
   66    HZ2  LYS   9           HZ2      LYS   9   8.002   2.639  10.717
   67    HZ3  LYS   9           HZ3      LYS   9   7.044   3.960  10.242
   68    HA   PRO  10           HA       PRO  10  10.357  -3.414   6.802
   69    HB2  PRO  10           HB2      PRO  10   8.871  -3.320   4.334
   70    HB3  PRO  10           HB3      PRO  10   9.453  -4.744   5.209
   71    HG2  PRO  10           HG2      PRO  10   6.806  -4.017   4.901
   72    HG3  PRO  10           HG3      PRO  10   7.433  -5.137   6.118
   73    HD2  PRO  10           HD2      PRO  10   6.601  -2.291   6.431
   74    HD3  PRO  10           HD3      PRO  10   6.550  -3.622   7.610
   75    HN1  NH2  11           HN1      NH2  11  10.418   0.113   6.657
   76    HN2  NH2  11           HN2      NH2  11   8.757  -0.218   6.546
   77    H1   A2G 101           H1       A2G  12   2.687 -16.155   8.940
   78    H2   A2G 101           H2       A2G  12   1.915 -16.243  11.271
   79    HN2  A2G 101           HN2      A2G  12   3.559 -18.607  10.577
   80    H3   A2G 101           H3       A2G  12   1.033 -19.067  10.613
   81    HO3  A2G 101           HO3      A2G  12   0.051 -18.039  12.859
   82    H4   A2G 101           H4       A2G  12  -1.239 -18.244  10.864
   83    HO4  A2G 101           HO4      A2G  12  -0.742 -16.598  12.375
   84    H5   A2G 101           H5       A2G  12  -0.272 -18.064   8.615
   85    H6   A2G 101           H6       A2G  12  -1.577 -15.423   8.735
   86    H8   A2G 101           H8       A2G  12   5.340 -18.584  12.957
   87    H8A  A2G 101           H8A      A2G  12   6.254 -17.219  12.312
   88    H8B  A2G 101           H8B      A2G  12   5.726 -18.514  11.236
   89    H14  A2G 101           H14      A2G  12  -2.042 -16.865   7.833
   90    H15  A2G 101           H15      A2G  12  -3.583 -16.666   9.346
   91    H1   A2G 102           H1       A2G  13   6.505 -12.555   5.671
   92    H2   A2G 102           H2       A2G  13   6.084 -11.498   3.491
   93    HN2  A2G 102           HN2      A2G  13   4.038 -13.541   4.129
   94    H3   A2G 102           H3       A2G  13   5.803 -14.328   2.448
   95    HO3  A2G 102           HO3      A2G  13   5.809 -11.816   1.136
   96    H4   A2G 102           H4       A2G  13   7.860 -13.924   1.225
   97    HO4  A2G 102           HO4      A2G  13   8.916 -11.989   1.366
   98    H5   A2G 102           H5       A2G  13   8.157 -14.801   3.495
   99    H6   A2G 102           H6       A2G  13  10.281 -12.763   3.567
  100    H8   A2G 102           H8       A2G  13   1.576 -11.806   3.604
  101    H8A  A2G 102           H8A      A2G  13   1.886 -11.054   5.168
  102    H8B  A2G 102           H8B      A2G  13   2.124 -12.789   4.961
  103    H14  A2G 102           H14      A2G  13  10.412 -14.516   3.431
  104    H15  A2G 102           H15      A2G  13  10.198 -14.393   1.286
  105    H1   A2G 103           H1       A2G  14   6.499 -10.423  11.406
  106    H2   A2G 103           H2       A2G  14   8.395 -10.410  12.971
  107    HN2  A2G 103           HN2      A2G  14   8.882 -12.219  10.678
  108    H3   A2G 103           H3       A2G  14   8.214 -13.432  12.834
  109    HO3  A2G 103           HO3      A2G  14   9.986 -11.561  13.906
  110    H4   A2G 103           H4       A2G  14   7.479 -13.344  15.144
  111    HO4  A2G 103           HO4      A2G  14   7.791 -11.625  16.280
  112    H5   A2G 103           H5       A2G  14   5.688 -13.172  13.479
  113    H6   A2G 103           H6       A2G  14   4.676 -11.082  15.256
  114    H8   A2G 103           H8       A2G  14  11.671 -11.089   9.941
  115    H8A  A2G 103           H8A      A2G  14  10.765  -9.807   9.138
  116    H8B  A2G 103           H8B      A2G  14  10.185 -11.472   9.071
  117    H14  A2G 103           H14      A2G  14   4.157 -12.761  15.097
  118    H15  A2G 103           H15      A2G  14   6.094 -11.631  16.762
  119    H1   A2G 104           H1       A2G  15   5.182  -5.855   8.244
  120    H2   A2G 104           H2       A2G  15   3.005  -4.713   8.298
  121    HN2  A2G 104           HN2      A2G  15   2.867  -7.395   9.550
  122    H3   A2G 104           H3       A2G  15   1.895  -7.302   7.181
  123    HO3  A2G 104           HO3      A2G  15   0.498  -6.170   8.549
  124    H4   A2G 104           H4       A2G  15   1.471  -6.065   5.137
  125    HO4  A2G 104           HO4      A2G  15   1.123  -4.028   5.772
  126    H5   A2G 104           H5       A2G  15   3.691  -7.092   5.285
  127    H6   A2G 104           H6       A2G  15   4.474  -4.456   4.197
  128    H8   A2G 104           H8       A2G  15   1.502  -6.582  12.115
  129    H8A  A2G 104           H8A      A2G  15   3.033  -5.920  12.688
  130    H8B  A2G 104           H8B      A2G  15   3.010  -7.435  11.785
  131    H14  A2G 104           H14      A2G  15   4.471  -6.037   3.417
  132    H15  A2G 104           H15      A2G  15   2.877  -4.415   2.678
  Start of MODEL    4
    1    H1   ACE   1           H1       ACE   1  -3.291 -23.524   7.066
    2    H2   ACE   1           H2       ACE   1  -3.177 -24.520   8.516
    3    H3   ACE   1           H3       ACE   1  -3.235 -25.281   6.926
    4    HA   PRO   2           HA       PRO   2   1.091 -25.451   6.293
    5    HB2  PRO   2           HB2      PRO   2   1.331 -23.436   4.247
    6    HB3  PRO   2           HB3      PRO   2   1.322 -25.196   4.055
    7    HG2  PRO   2           HG2      PRO   2  -0.827 -23.266   3.626
    8    HG3  PRO   2           HG3      PRO   2  -0.665 -24.927   3.037
    9    HD2  PRO   2           HD2      PRO   2  -2.467 -24.192   4.965
   10    HD3  PRO   2           HD3      PRO   2  -1.763 -25.822   4.862
   11    HA   PRO   3           HA       PRO   3   3.307 -22.491   8.648
   12    HB2  PRO   3           HB2      PRO   3   5.285 -21.820   6.663
   13    HB3  PRO   3           HB3      PRO   3   5.455 -22.895   8.059
   14    HG2  PRO   3           HG2      PRO   3   5.006 -23.550   5.248
   15    HG3  PRO   3           HG3      PRO   3   5.610 -24.568   6.564
   16    HD2  PRO   3           HD2      PRO   3   3.129 -24.884   5.446
   17    HD3  PRO   3           HD3      PRO   3   3.499 -25.318   7.130
   18    H    THR   4           H        THR   4   3.912 -20.190   8.755
   19    HA   THR   4           HA       THR   4   2.888 -18.505   6.583
   20    HB   THR   4           HB       THR   4   1.489 -17.198   8.090
   21   HG21  THR   4          HG21      THR   4  -0.295 -18.718   8.283
   22   HG22  THR   4          HG22      THR   4   0.776 -20.069   8.658
   23   HG23  THR   4          HG23      THR   4   0.698 -19.436   7.014
   24    H    THR   5           H        THR   5   3.954 -16.589   6.382
   25    HA   THR   5           HA       THR   5   6.166 -16.123   8.279
   26    HB   THR   5           HB       THR   5   7.269 -14.926   6.475
   27   HG21  THR   5          HG21      THR   5   6.933 -17.602   6.545
   28   HG22  THR   5          HG22      THR   5   7.880 -16.797   5.294
   29   HG23  THR   5          HG23      THR   5   6.210 -17.265   4.972
   30    H    THR   6           H        THR   6   6.778 -13.778   8.533
   31    HA   THR   6           HA       THR   6   4.426 -12.000   8.484
   32    HB   THR   6           HB       THR   6   4.787 -11.293  10.742
   33   HG21  THR   6          HG21      THR   6   5.248 -14.249  10.997
   34   HG22  THR   6          HG22      THR   6   3.776 -13.669  10.219
   35   HG23  THR   6          HG23      THR   6   4.129 -13.216  11.887
   36    H    THR   7           H        THR   7   5.043  -9.697   8.831
   37    HA   THR   7           HA       THR   7   7.817  -9.091   8.055
   38    HB   THR   7           HB       THR   7   7.098  -7.583   6.300
   39   HG21  THR   7          HG21      THR   7   6.532  -9.183   4.702
   40   HG22  THR   7          HG22      THR   7   5.433 -10.028   5.791
   41   HG23  THR   7          HG23      THR   7   7.176 -10.199   5.990
   42    H    LYS   8           H        LYS   8   8.187  -6.652   8.162
   43    HA   LYS   8           HA       LYS   8   6.454  -5.155   9.927
   44    HB2  LYS   8           HB2      LYS   8   7.789  -6.674  11.456
   45    HB3  LYS   8           HB3      LYS   8   9.232  -5.809  10.923
   46    HG2  LYS   8           HG2      LYS   8   8.211  -3.676  11.672
   47    HG3  LYS   8           HG3      LYS   8   6.804  -4.568  12.252
   48    HD2  LYS   8           HD2      LYS   8   8.863  -5.951  13.430
   49    HD3  LYS   8           HD3      LYS   8   9.481  -4.300  13.452
   50    HE2  LYS   8           HE2      LYS   8   6.827  -5.250  14.564
   51    HE3  LYS   8           HE3      LYS   8   8.212  -4.673  15.490
   52    HZ1  LYS   8           HZ1      LYS   8   6.470  -3.125  13.665
   53    HZ2  LYS   8           HZ2      LYS   8   7.976  -2.545  14.198
   54    HZ3  LYS   8           HZ3      LYS   8   6.742  -2.867  15.319
   55    H    LYS   9           H        LYS   9   6.514  -3.149   9.167
   56    HA   LYS   9           HA       LYS   9   8.411  -2.236   7.282
   57    HB2  LYS   9           HB2      LYS   9   7.292   0.050   8.398
   58    HB3  LYS   9           HB3      LYS   9   6.663  -0.845   7.015
   59    HG2  LYS   9           HG2      LYS   9   5.218  -2.159   8.418
   60    HG3  LYS   9           HG3      LYS   9   5.982  -1.540   9.882
   61    HD2  LYS   9           HD2      LYS   9   5.119   0.680   9.479
   62    HD3  LYS   9           HD3      LYS   9   4.524   0.211   7.886
   63    HE2  LYS   9           HE2      LYS   9   2.835  -1.181   8.804
   64    HE3  LYS   9           HE3      LYS   9   3.587  -1.175  10.399
   65    HZ1  LYS   9           HZ1      LYS   9   3.182   1.304  10.372
   66    HZ2  LYS   9           HZ2      LYS   9   1.807   0.318  10.537
   67    HZ3  LYS   9           HZ3      LYS   9   2.166   1.036   9.039
   68    HA   PRO  10           HA       PRO  10  11.941  -0.704   9.338
   69    HB2  PRO  10           HB2      PRO  10  11.553   2.086   8.732
   70    HB3  PRO  10           HB3      PRO  10  12.646   0.936   7.946
   71    HG2  PRO  10           HG2      PRO  10  10.033   1.908   7.080
   72    HG3  PRO  10           HG3      PRO  10  11.316   1.129   6.144
   73    HD2  PRO  10           HD2      PRO  10   8.948  -0.106   6.752
   74    HD3  PRO  10           HD3      PRO  10  10.468  -0.991   6.496
   75    HN1  NH2  11           HN1      NH2  11   9.017   0.908  11.481
   76    HN2  NH2  11           HN2      NH2  11   9.217   1.757  10.025
   77    H1   A2G 101           H1       A2G  12   2.596 -16.267   9.805
   78    H2   A2G 101           H2       A2G  12   2.528 -16.097  12.257
   79    HN2  A2G 101           HN2      A2G  12   4.107 -18.436  11.360
   80    H3   A2G 101           H3       A2G  12   1.754 -19.026  12.195
   81    HO3  A2G 101           HO3      A2G  12   1.426 -18.479  14.476
   82    H4   A2G 101           H4       A2G  12  -0.425 -18.314  12.992
   83    HO4  A2G 101           HO4      A2G  12   0.396 -16.455  14.109
   84    H5   A2G 101           H5       A2G  12  -0.170 -18.341  10.555
   85    H6   A2G 101           H6       A2G  12  -1.630 -15.806  11.347
   86    H8   A2G 101           H8       A2G  12   6.468 -18.180  12.864
   87    H8A  A2G 101           H8A      A2G  12   7.052 -16.649  12.210
   88    H8B  A2G 101           H8B      A2G  12   6.413 -17.885  11.126
   89    H14  A2G 101           H14      A2G  12  -1.985 -16.863   9.981
   90    H15  A2G 101           H15      A2G  12  -2.093 -17.651  12.701
   91    H1   A2G 102           H1       A2G  13   6.127 -13.041   5.848
   92    H2   A2G 102           H2       A2G  13   5.352 -11.966   3.779
   93    HN2  A2G 102           HN2      A2G  13   3.309 -13.794   4.901
   94    H3   A2G 102           H3       A2G  13   4.598 -14.767   2.901
   95    HO3  A2G 102           HO3      A2G  13   3.257 -13.496   1.855
   96    H4   A2G 102           H4       A2G  13   6.369 -14.553   1.250
   97    HO4  A2G 102           HO4      A2G  13   6.074 -12.043   1.604
   98    H5   A2G 102           H5       A2G  13   7.035 -15.459   3.432
   99    H6   A2G 102           H6       A2G  13   9.356 -13.717   3.068
  100    H8   A2G 102           H8       A2G  13   0.954 -11.841   4.852
  101    H8A  A2G 102           H8A      A2G  13   1.668 -11.091   6.279
  102    H8B  A2G 102           H8B      A2G  13   1.698 -12.845   6.096
  103    H14  A2G 102           H14      A2G  13   9.215 -15.457   2.815
  104    H15  A2G 102           H15      A2G  13   8.896 -15.133   0.772
  105    H1   A2G 103           H1       A2G  14   6.821 -10.168  10.804
  106    H2   A2G 103           H2       A2G  14   8.774 -10.071  12.293
  107    HN2  A2G 103           HN2      A2G  14   9.112 -12.119  10.182
  108    H3   A2G 103           H3       A2G  14   8.475 -13.080  12.477
  109    HO3  A2G 103           HO3      A2G  14  10.104 -12.572  14.177
  110    H4   A2G 103           H4       A2G  14   7.850 -12.716  14.797
  111    HO4  A2G 103           HO4      A2G  14   8.224 -10.881  15.719
  112    H5   A2G 103           H5       A2G  14   6.014 -12.674  13.167
  113    H6   A2G 103           H6       A2G  14   5.394 -10.357  14.968
  114    H8   A2G 103           H8       A2G  14  11.636 -11.573   9.174
  115    H8A  A2G 103           H8A      A2G  14  11.409  -9.930   8.573
  116    H8B  A2G 103           H8B      A2G  14  10.193 -11.165   8.245
  117    H14  A2G 103           H14      A2G  14   4.417 -11.778  14.603
  118    H15  A2G 103           H15      A2G  14   6.297 -12.902  15.719
  119    H1   A2G 104           H1       A2G  15   5.781  -5.915   7.243
  120    H2   A2G 104           H2       A2G  15   3.671  -4.775   6.709
  121    HN2  A2G 104           HN2      A2G  15   3.224  -7.145   8.427
  122    H3   A2G 104           H3       A2G  15   2.662  -7.530   5.953
  123    HO3  A2G 104           HO3      A2G  15   1.523  -4.936   5.934
  124    H4   A2G 104           H4       A2G  15   2.610  -6.709   3.667
  125    HO4  A2G 104           HO4      A2G  15   2.235  -4.533   4.095
  126    H5   A2G 104           H5       A2G  15   4.721  -7.726   4.398
  127    H6   A2G 104           H6       A2G  15   5.441  -5.244   2.831
  128    H8   A2G 104           H8       A2G  15   1.646  -6.207  10.458
  129    H8A  A2G 104           H8A      A2G  15   2.634  -4.918  11.147
  130    H8B  A2G 104           H8B      A2G  15   3.359  -6.482  10.776
  131    H14  A2G 104           H14      A2G  15   6.113  -6.866   2.673
  132    H15  A2G 104           H15      A2G  15   4.470  -7.450   1.490
  Start of MODEL    5
    1    H1   ACE   1           H1       ACE   1  -3.287 -21.297   9.350
    2    H2   ACE   1           H2       ACE   1  -3.536 -22.404   7.999
    3    H3   ACE   1           H3       ACE   1  -3.061 -20.733   7.695
    4    HA   PRO   2           HA       PRO   2   0.550 -23.962   7.861
    5    HB2  PRO   2           HB2      PRO   2   1.438 -22.708   5.425
    6    HB3  PRO   2           HB3      PRO   2   0.901 -24.378   5.664
    7    HG2  PRO   2           HG2      PRO   2  -0.553 -22.096   4.565
    8    HG3  PRO   2           HG3      PRO   2  -0.886 -23.828   4.416
    9    HD2  PRO   2           HD2      PRO   2  -2.427 -22.131   5.916
   10    HD3  PRO   2           HD3      PRO   2  -2.248 -23.862   6.283
   11    HA   PRO   3           HA       PRO   3   3.501 -21.252   9.642
   12    HB2  PRO   3           HB2      PRO   3   5.636 -21.717   7.764
   13    HB3  PRO   3           HB3      PRO   3   5.440 -22.392   9.388
   14    HG2  PRO   3           HG2      PRO   3   4.882 -23.603   6.790
   15    HG3  PRO   3           HG3      PRO   3   5.117 -24.370   8.368
   16    HD2  PRO   3           HD2      PRO   3   2.685 -24.243   7.113
   17    HD3  PRO   3           HD3      PRO   3   2.865 -24.309   8.881
   18    H    THR   4           H        THR   4   2.831 -19.171   9.307
   19    HA   THR   4           HA       THR   4   3.213 -17.937   6.674
   20    HB   THR   4           HB       THR   4   1.911 -16.063   7.624
   21   HG21  THR   4          HG21      THR   4   0.362 -18.468   8.462
   22   HG22  THR   4          HG22      THR   4   0.945 -18.424   6.797
   23   HG23  THR   4          HG23      THR   4  -0.110 -17.144   7.397
   24    H    THR   5           H        THR   5   4.045 -15.638   6.701
   25    HA   THR   5           HA       THR   5   6.169 -15.262   8.714
   26    HB   THR   5           HB       THR   5   7.725 -14.580   6.927
   27   HG21  THR   5          HG21      THR   5   7.011 -17.149   7.621
   28   HG22  THR   5          HG22      THR   5   8.410 -16.724   6.635
   29   HG23  THR   5          HG23      THR   5   6.894 -17.192   5.862
   30    H    THR   6           H        THR   6   6.557 -13.163   9.300
   31    HA   THR   6           HA       THR   6   4.682 -11.164   8.211
   32    HB   THR   6           HB       THR   6   5.073  -9.937  10.309
   33   HG21  THR   6          HG21      THR   6   3.625 -11.243  11.506
   34   HG22  THR   6          HG22      THR   6   4.619 -12.689  11.322
   35   HG23  THR   6          HG23      THR   6   3.565 -12.169  10.006
   36    H    THR   7           H        THR   7   5.413  -9.461   7.097
   37    HA   THR   7           HA       THR   7   8.327  -9.134   6.836
   38    HB   THR   7           HB       THR   7   7.831  -7.928   4.775
   39   HG21  THR   7          HG21      THR   7   7.757 -10.509   4.921
   40   HG22  THR   7          HG22      THR   7   7.049  -9.755   3.492
   41   HG23  THR   7          HG23      THR   7   6.007 -10.330   4.794
   42    H    LYS   8           H        LYS   8   9.192  -7.653   8.137
   43    HA   LYS   8           HA       LYS   8   9.369  -5.804   9.516
   44    HB2  LYS   8           HB2      LYS   8   8.106  -4.551   7.065
   45    HB3  LYS   8           HB3      LYS   8   8.999  -3.688   8.318
   46    HG2  LYS   8           HG2      LYS   8  10.929  -4.162   7.267
   47    HG3  LYS   8           HG3      LYS   8  10.608  -5.886   7.463
   48    HD2  LYS   8           HD2      LYS   8   9.271  -5.886   5.398
   49    HD3  LYS   8           HD3      LYS   8   9.557  -4.157   5.204
   50    HE2  LYS   8           HE2      LYS   8  11.734  -6.265   5.289
   51    HE3  LYS   8           HE3      LYS   8  11.103  -5.532   3.815
   52    HZ1  LYS   8           HZ1      LYS   8  11.666  -3.356   5.198
   53    HZ2  LYS   8           HZ2      LYS   8  12.802  -4.117   4.189
   54    HZ3  LYS   8           HZ3      LYS   8  12.830  -4.394   5.865
   55    H    LYS   9           H        LYS   9   7.994  -6.153  11.229
   56    HA   LYS   9           HA       LYS   9   5.181  -5.927  11.146
   57    HB2  LYS   9           HB2      LYS   9   5.865  -5.285  13.741
   58    HB3  LYS   9           HB3      LYS   9   5.634  -6.919  13.119
   59    HG2  LYS   9           HG2      LYS   9   7.969  -7.199  12.708
   60    HG3  LYS   9           HG3      LYS   9   8.287  -5.480  12.940
   61    HD2  LYS   9           HD2      LYS   9   7.753  -5.638  15.300
   62    HD3  LYS   9           HD3      LYS   9   7.232  -7.313  15.110
   63    HE2  LYS   9           HE2      LYS   9   9.499  -7.259  16.029
   64    HE3  LYS   9           HE3      LYS   9   9.538  -7.918  14.393
   65    HZ1  LYS   9           HZ1      LYS   9   9.770  -5.155  14.183
   66    HZ2  LYS   9           HZ2      LYS   9  10.954  -6.328  13.849
   67    HZ3  LYS   9           HZ3      LYS   9  10.846  -5.640  15.399
   68    HA   PRO  10           HA       PRO  10   4.022  -1.719  11.100
   69    HB2  PRO  10           HB2      PRO  10   2.869  -1.623  13.738
   70    HB3  PRO  10           HB3      PRO  10   2.034  -1.752  12.183
   71    HG2  PRO  10           HG2      PRO  10   2.653  -3.828  14.139
   72    HG3  PRO  10           HG3      PRO  10   1.468  -3.831  12.824
   73    HD2  PRO  10           HD2      PRO  10   3.755  -5.340  12.782
   74    HD3  PRO  10           HD3      PRO  10   2.955  -4.744  11.310
   75    HN1  NH2  11           HN1      NH2  11   5.473  -0.688  14.729
   76    HN2  NH2  11           HN2      NH2  11   5.077  -2.331  14.574
   77    H1   A2G 101           H1       A2G  12   2.808 -15.057   9.468
   78    H2   A2G 101           H2       A2G  12   2.126 -14.444  11.748
   79    HN2  A2G 101           HN2      A2G  12   3.331 -17.147  11.649
   80    H3   A2G 101           H3       A2G  12   0.762 -17.150  11.801
   81    HO3  A2G 101           HO3      A2G  12   0.783 -16.817  13.854
   82    H4   A2G 101           H4       A2G  12  -1.331 -15.917  11.839
   83    HO4  A2G 101           HO4      A2G  12  -1.286 -13.655  11.622
   84    H5   A2G 101           H5       A2G  12  -0.438 -16.455   9.616
   85    H6   A2G 101           H6       A2G  12  -1.289 -13.669   9.111
   86    H8   A2G 101           H8       A2G  12   5.265 -16.769  13.986
   87    H8A  A2G 101           H8A      A2G  12   6.301 -15.882  12.868
   88    H8B  A2G 101           H8B      A2G  12   5.440 -17.320  12.320
   89    H14  A2G 101           H14      A2G  12  -1.994 -15.181   8.538
   90    H15  A2G 101           H15      A2G  12  -2.688 -13.645  10.656
   91    H1   A2G 102           H1       A2G  13   6.798 -12.908   5.539
   92    H2   A2G 102           H2       A2G  13   6.681 -12.551   3.112
   93    HN2  A2G 102           HN2      A2G  13   4.297 -13.983   4.128
   94    H3   A2G 102           H3       A2G  13   6.000 -15.499   2.949
   95    HO3  A2G 102           HO3      A2G  13   6.602 -13.678   0.879
   96    H4   A2G 102           H4       A2G  13   8.166 -15.791   1.894
   97    HO4  A2G 102           HO4      A2G  13   8.072 -13.510   1.103
   98    H5   A2G 102           H5       A2G  13   8.170 -15.940   4.342
   99    H6   A2G 102           H6       A2G  13  10.569 -14.287   3.512
  100    H8   A2G 102           H8       A2G  13   2.187 -12.576   2.990
  101    H8A  A2G 102           H8A      A2G  13   2.441 -10.980   3.698
  102    H8B  A2G 102           H8B      A2G  13   2.557 -12.422   4.707
  103    H14  A2G 102           H14      A2G  13  10.508 -15.579   4.711
  104    H15  A2G 102           H15      A2G  13  10.072 -15.859   1.923
  105    H1   A2G 103           H1       A2G  14   7.302  -9.375  10.667
  106    H2   A2G 103           H2       A2G  14   8.901  -9.543  12.526
  107    HN2  A2G 103           HN2      A2G  14   9.028 -11.905  10.743
  108    H3   A2G 103           H3       A2G  14   7.761 -12.320  12.938
  109    HO3  A2G 103           HO3      A2G  14   9.141 -11.659  14.965
  110    H4   A2G 103           H4       A2G  14   6.828 -11.470  15.010
  111    HO4  A2G 103           HO4      A2G  14   8.209  -9.141  14.231
  112    H5   A2G 103           H5       A2G  14   5.402 -11.189  13.035
  113    H6   A2G 103           H6       A2G  14   5.391  -8.727  14.813
  114    H8   A2G 103           H8       A2G  14  11.709 -12.217  10.268
  115    H8A  A2G 103           H8A      A2G  14  12.144 -10.678   9.523
  116    H8B  A2G 103           H8B      A2G  14  10.695 -11.534   8.998
  117    H14  A2G 103           H14      A2G  14   4.043  -9.273  13.814
  118    H15  A2G 103           H15      A2G  14   3.884 -11.108  15.044
  119    H1   A2G 104           H1       A2G  15   6.723  -6.022   5.109
  120    H2   A2G 104           H2       A2G  15   4.704  -4.807   4.404
  121    HN2  A2G 104           HN2      A2G  15   4.161  -6.591   6.705
  122    H3   A2G 104           H3       A2G  15   3.351  -7.519   4.458
  123    HO3  A2G 104           HO3      A2G  15   2.487  -4.915   3.745
  124    H4   A2G 104           H4       A2G  15   3.206  -7.329   2.043
  125    HO4  A2G 104           HO4      A2G  15   4.785  -5.365   1.437
  126    H5   A2G 104           H5       A2G  15   5.270  -8.353   2.881
  127    H6   A2G 104           H6       A2G  15   6.453  -6.599   0.821
  128    H8   A2G 104           H8       A2G  15   2.708  -4.591   8.419
  129    H8A  A2G 104           H8A      A2G  15   4.253  -3.852   8.842
  130    H8B  A2G 104           H8B      A2G  15   4.119  -5.606   8.723
  131    H14  A2G 104           H14      A2G  15   6.264  -8.353   0.830
  132    H15  A2G 104           H15      A2G  15   4.111  -6.555   0.467
  Start of MODEL    6
    1    H1   ACE   1           H1       ACE   1  -3.474 -22.786   5.127
    2    H2   ACE   1           H2       ACE   1  -2.716 -23.686   3.813
    3    H3   ACE   1           H3       ACE   1  -2.562 -21.931   3.883
    4    HA   PRO   2           HA       PRO   2   1.075 -24.460   5.857
    5    HB2  PRO   2           HB2      PRO   2   2.779 -22.715   4.325
    6    HB3  PRO   2           HB3      PRO   2   2.599 -24.471   4.184
    7    HG2  PRO   2           HG2      PRO   2   1.444 -22.344   2.550
    8    HG3  PRO   2           HG3      PRO   2   1.646 -24.064   2.188
    9    HD2  PRO   2           HD2      PRO   2  -0.791 -22.915   2.674
   10    HD3  PRO   2           HD3      PRO   2  -0.434 -24.621   3.024
   11    HA   PRO   3           HA       PRO   3   1.956 -21.569   9.033
   12    HB2  PRO   3           HB2      PRO   3   4.795 -21.359   8.588
   13    HB3  PRO   3           HB3      PRO   3   3.947 -22.295   9.829
   14    HG2  PRO   3           HG2      PRO   3   5.113 -23.179   7.302
   15    HG3  PRO   3           HG3      PRO   3   4.666 -24.121   8.732
   16    HD2  PRO   3           HD2      PRO   3   3.285 -24.241   6.369
   17    HD3  PRO   3           HD3      PRO   3   2.532 -24.540   7.952
   18    H    THR   4           H        THR   4   2.030 -19.364   9.270
   19    HA   THR   4           HA       THR   4   2.508 -17.800   6.834
   20    HB   THR   4           HB       THR   4   1.318 -16.007   7.987
   21   HG21  THR   4          HG21      THR   4  -0.640 -16.985   7.453
   22   HG22  THR   4          HG22      THR   4  -0.516 -18.091   8.820
   23   HG23  THR   4          HG23      THR   4   0.237 -18.505   7.279
   24    H    THR   5           H        THR   5   3.566 -15.643   7.118
   25    HA   THR   5           HA       THR   5   5.674 -15.682   9.181
   26    HB   THR   5           HB       THR   5   7.328 -14.976   7.500
   27   HG21  THR   5          HG21      THR   5   6.195 -17.369   6.179
   28   HG22  THR   5          HG22      THR   5   6.419 -17.509   7.923
   29   HG23  THR   5          HG23      THR   5   7.792 -17.124   6.885
   30    H    THR   6           H        THR   6   6.424 -13.647   9.830
   31    HA   THR   6           HA       THR   6   4.636 -11.420   9.097
   32    HB   THR   6           HB       THR   6   5.207 -10.434  11.221
   33   HG21  THR   6          HG21      THR   6   5.037 -13.106  12.335
   34   HG22  THR   6          HG22      THR   6   3.961 -12.938  10.948
   35   HG23  THR   6          HG23      THR   6   3.818 -11.832  12.314
   36    H    THR   7           H        THR   7   5.409  -9.590   8.191
   37    HA   THR   7           HA       THR   7   8.271  -9.549   7.500
   38    HB   THR   7           HB       THR   7   7.365  -7.631   5.950
   39   HG21  THR   7          HG21      THR   7   6.658 -10.544   5.494
   40   HG22  THR   7          HG22      THR   7   8.228  -9.810   5.167
   41   HG23  THR   7          HG23      THR   7   6.813  -9.316   4.237
   42    H    LYS   8           H        LYS   8   9.272  -7.334   7.389
   43    HA   LYS   8           HA       LYS   8   8.916  -6.027   9.946
   44    HB2  LYS   8           HB2      LYS   8  10.852  -5.765   7.666
   45    HB3  LYS   8           HB3      LYS   8  10.770  -4.513   8.906
   46    HG2  LYS   8           HG2      LYS   8  11.161  -6.193  10.656
   47    HG3  LYS   8           HG3      LYS   8  11.203  -7.468   9.436
   48    HD2  LYS   8           HD2      LYS   8  13.014  -5.266   8.797
   49    HD3  LYS   8           HD3      LYS   8  13.396  -6.020  10.345
   50    HE2  LYS   8           HE2      LYS   8  14.541  -7.106   8.387
   51    HE3  LYS   8           HE3      LYS   8  13.526  -8.209   9.316
   52    HZ1  LYS   8           HZ1      LYS   8  13.340  -8.126   6.743
   53    HZ2  LYS   8           HZ2      LYS   8  12.370  -6.763   7.034
   54    HZ3  LYS   8           HZ3      LYS   8  11.938  -8.271   7.685
   55    H    LYS   9           H        LYS   9   6.863  -5.069   9.811
   56    HA   LYS   9           HA       LYS   9   5.990  -3.410   7.699
   57    HB2  LYS   9           HB2      LYS   9   4.736  -2.444   9.982
   58    HB3  LYS   9           HB3      LYS   9   4.142  -3.737   8.939
   59    HG2  LYS   9           HG2      LYS   9   5.172  -5.426  10.303
   60    HG3  LYS   9           HG3      LYS   9   6.060  -4.216  11.232
   61    HD2  LYS   9           HD2      LYS   9   3.904  -3.295  12.055
   62    HD3  LYS   9           HD3      LYS   9   3.047  -4.563  11.177
   63    HE2  LYS   9           HE2      LYS   9   3.226  -5.500  13.310
   64    HE3  LYS   9           HE3      LYS   9   4.639  -6.178  12.500
   65    HZ1  LYS   9           HZ1      LYS   9   5.290  -3.658  13.569
   66    HZ2  LYS   9           HZ2      LYS   9   5.947  -5.176  13.953
   67    HZ3  LYS   9           HZ3      LYS   9   4.583  -4.601  14.788
   68    HA   PRO  10           HA       PRO  10   7.956   0.478   7.944
   69    HB2  PRO  10           HB2      PRO  10   5.649   2.023   8.711
   70    HB3  PRO  10           HB3      PRO  10   6.383   1.877   7.108
   71    HG2  PRO  10           HG2      PRO  10   4.021   0.553   8.198
   72    HG3  PRO  10           HG3      PRO  10   4.517   0.772   6.515
   73    HD2  PRO  10           HD2      PRO  10   4.573  -1.652   7.789
   74    HD3  PRO  10           HD3      PRO  10   5.673  -1.227   6.458
   75    HN1  NH2  11           HN1      NH2  11   8.863   2.006   9.885
   76    HN2  NH2  11           HN2      NH2  11   7.581   2.486  10.890
   77    H1   A2G 101           H1       A2G  12   2.532 -15.311   9.817
   78    H2   A2G 101           H2       A2G  12   2.139 -14.802  12.189
   79    HN2  A2G 101           HN2      A2G  12   2.879 -17.641  11.778
   80    H3   A2G 101           H3       A2G  12   0.364 -17.259  12.164
   81    HO3  A2G 101           HO3      A2G  12   0.070 -16.767  14.285
   82    H4   A2G 101           H4       A2G  12  -1.492 -15.724  12.485
   83    HO4  A2G 101           HO4      A2G  12   0.218 -14.134  13.419
   84    H5   A2G 101           H5       A2G  12  -0.875 -16.196  10.156
   85    H6   A2G 101           H6       A2G  12  -1.377 -13.223  10.299
   86    H8   A2G 101           H8       A2G  12   4.869 -18.043  13.694
   87    H8A  A2G 101           H8A      A2G  12   6.080 -16.893  13.128
   88    H8B  A2G 101           H8B      A2G  12   5.251 -17.939  11.975
   89    H14  A2G 101           H14      A2G  12  -2.031 -14.393   9.153
   90    H15  A2G 101           H15      A2G  12  -3.637 -14.596  10.458
   91    H1   A2G 102           H1       A2G  13   6.607 -13.073   6.320
   92    H2   A2G 102           H2       A2G  13   6.562 -12.409   3.954
   93    HN2  A2G 102           HN2      A2G  13   4.028 -13.709   4.770
   94    H3   A2G 102           H3       A2G  13   5.600 -15.237   3.436
   95    HO3  A2G 102           HO3      A2G  13   6.470 -13.519   1.445
   96    H4   A2G 102           H4       A2G  13   7.738 -15.591   2.336
   97    HO4  A2G 102           HO4      A2G  13   9.059 -13.431   3.190
   98    H5   A2G 102           H5       A2G  13   7.677 -16.055   4.746
   99    H6   A2G 102           H6       A2G  13  10.255 -14.574   4.204
  100    H8   A2G 102           H8       A2G  13   2.132 -12.094   3.754
  101    H8A  A2G 102           H8A      A2G  13   2.434 -10.524   4.498
  102    H8B  A2G 102           H8B      A2G  13   2.394 -11.978   5.495
  103    H14  A2G 102           H14      A2G  13  10.021 -16.050   5.140
  104    H15  A2G 102           H15      A2G  13  10.754 -16.744   3.217
  105    H1   A2G 103           H1       A2G  14   7.448  -9.803  11.151
  106    H2   A2G 103           H2       A2G  14   9.388  -9.925  12.654
  107    HN2  A2G 103           HN2      A2G  14   9.219 -12.289  10.878
  108    H3   A2G 103           H3       A2G  14   8.411 -12.724  13.283
  109    HO3  A2G 103           HO3      A2G  14  10.285 -11.538  14.866
  110    H4   A2G 103           H4       A2G  14   7.911 -11.878  15.506
  111    HO4  A2G 103           HO4      A2G  14   9.567  -9.991  14.831
  112    H5   A2G 103           H5       A2G  14   6.116 -11.668  13.844
  113    H6   A2G 103           H6       A2G  14   5.877  -9.012  15.117
  114    H8   A2G 103           H8       A2G  14  12.059 -12.246   9.810
  115    H8A  A2G 103           H8A      A2G  14  11.608 -10.858   8.820
  116    H8B  A2G 103           H8B      A2G  14  10.475 -12.193   9.037
  117    H14  A2G 103           H14      A2G  14   4.808 -10.410  15.227
  118    H15  A2G 103           H15      A2G  14   7.339 -10.276  16.486
  119    H1   A2G 104           H1       A2G  15   5.739  -6.521   7.197
  120    H2   A2G 104           H2       A2G  15   3.385  -5.856   6.963
  121    HN2  A2G 104           HN2      A2G  15   3.646  -8.555   8.155
  122    H3   A2G 104           H3       A2G  15   3.003  -8.568   5.667
  123    HO3  A2G 104           HO3      A2G  15   1.362  -7.032   6.963
  124    H4   A2G 104           H4       A2G  15   2.589  -7.346   3.607
  125    HO4  A2G 104           HO4      A2G  15   2.319  -5.257   3.594
  126    H5   A2G 104           H5       A2G  15   4.930  -7.935   4.057
  127    H6   A2G 104           H6       A2G  15   5.147  -5.116   3.079
  128    H8   A2G 104           H8       A2G  15   1.869  -8.307  10.413
  129    H8A  A2G 104           H8A      A2G  15   2.874  -7.162  11.301
  130    H8B  A2G 104           H8B      A2G  15   3.616  -8.535  10.480
  131    H14  A2G 104           H14      A2G  15   5.834  -6.592   2.401
  132    H15  A2G 104           H15      A2G  15   4.149  -6.760   1.191
  Start of MODEL    7
    1    H1   ACE   1           H1       ACE   1  -1.951 -23.053   3.987
    2    H2   ACE   1           H2       ACE   1  -2.647 -24.101   5.223
    3    H3   ACE   1           H3       ACE   1  -1.749 -24.801   3.877
    4    HA   PRO   2           HA       PRO   2   2.164 -24.825   5.839
    5    HB2  PRO   2           HB2      PRO   2   3.440 -22.721   4.341
    6    HB3  PRO   2           HB3      PRO   2   3.623 -24.472   4.146
    7    HG2  PRO   2           HG2      PRO   2   2.023 -22.585   2.596
    8    HG3  PRO   2           HG3      PRO   2   2.569 -24.215   2.177
    9    HD2  PRO   2           HD2      PRO   2  -0.044 -23.609   2.732
   10    HD3  PRO   2           HD3      PRO   2   0.665 -25.214   3.022
   11    HA   PRO   3           HA       PRO   3   2.489 -21.905   9.094
   12    HB2  PRO   3           HB2      PRO   3   5.214 -21.099   8.618
   13    HB3  PRO   3           HB3      PRO   3   4.602 -22.225   9.840
   14    HG2  PRO   3           HG2      PRO   3   5.877 -22.777   7.270
   15    HG3  PRO   3           HG3      PRO   3   5.662 -23.831   8.675
   16    HD2  PRO   3           HD2      PRO   3   4.290 -24.167   6.329
   17    HD3  PRO   3           HD3      PRO   3   3.646 -24.661   7.911
   18    H    THR   4           H        THR   4   2.397 -19.669   9.501
   19    HA   THR   4           HA       THR   4   2.240 -18.009   7.089
   20    HB   THR   4           HB       THR   4   1.016 -16.430   8.499
   21   HG21  THR   4          HG21      THR   4  -0.197 -18.973   9.414
   22   HG22  THR   4          HG22      THR   4   0.104 -18.858   7.680
   23   HG23  THR   4          HG23      THR   4  -0.911 -17.657   8.480
   24    H    THR   5           H        THR   5   3.581 -16.338   6.674
   25    HA   THR   5           HA       THR   5   5.783 -15.885   8.585
   26    HB   THR   5           HB       THR   5   7.038 -15.022   6.654
   27   HG21  THR   5          HG21      THR   5   6.534 -17.618   7.191
   28   HG22  THR   5          HG22      THR   5   7.570 -17.107   5.858
   29   HG23  THR   5          HG23      THR   5   5.886 -17.532   5.553
   30    H    THR   6           H        THR   6   6.267 -13.852   9.315
   31    HA   THR   6           HA       THR   6   4.250 -11.775   8.754
   32    HB   THR   6           HB       THR   6   4.987 -10.764  10.879
   33   HG21  THR   6          HG21      THR   6   4.614 -13.670  11.511
   34   HG22  THR   6          HG22      THR   6   3.335 -12.821  10.642
   35   HG23  THR   6          HG23      THR   6   3.840 -12.260  12.236
   36    H    THR   7           H        THR   7   4.845  -9.720   8.130
   37    HA   THR   7           HA       THR   7   7.589  -9.474   7.093
   38    HB   THR   7           HB       THR   7   6.708  -7.731   5.645
   39   HG21  THR   7          HG21      THR   7   5.465  -9.103   4.236
   40   HG22  THR   7          HG22      THR   7   4.553  -9.815   5.568
   41   HG23  THR   7          HG23      THR   7   6.224 -10.302   5.283
   42    H    LYS   8           H        LYS   8   9.005  -8.114   7.991
   43    HA   LYS   8           HA       LYS   8   8.235  -6.574  10.316
   44    HB2  LYS   8           HB2      LYS   8  10.347  -7.634  10.488
   45    HB3  LYS   8           HB3      LYS   8  10.852  -7.060   8.898
   46    HG2  LYS   8           HG2      LYS   8  11.211  -4.876   9.651
   47    HG3  LYS   8           HG3      LYS   8  10.138  -5.074  11.037
   48    HD2  LYS   8           HD2      LYS   8  11.727  -6.385  12.219
   49    HD3  LYS   8           HD3      LYS   8  12.699  -6.653  10.772
   50    HE2  LYS   8           HE2      LYS   8  13.634  -4.928  12.382
   51    HE3  LYS   8           HE3      LYS   8  13.414  -4.360  10.726
   52    HZ1  LYS   8           HZ1      LYS   8  12.442  -3.138  12.923
   53    HZ2  LYS   8           HZ2      LYS   8  11.093  -4.028  12.397
   54    HZ3  LYS   8           HZ3      LYS   8  11.845  -2.922  11.350
   55    H    LYS   9           H        LYS   9   7.451  -4.580  10.207
   56    HA   LYS   9           HA       LYS   9   8.668  -2.485   8.751
   57    HB2  LYS   9           HB2      LYS   9   7.323  -3.964   6.992
   58    HB3  LYS   9           HB3      LYS   9   5.969  -3.009   7.598
   59    HG2  LYS   9           HG2      LYS   9   7.615  -0.985   7.258
   60    HG3  LYS   9           HG3      LYS   9   8.436  -2.089   6.153
   61    HD2  LYS   9           HD2      LYS   9   6.265  -2.460   4.977
   62    HD3  LYS   9           HD3      LYS   9   5.525  -1.250   6.025
   63    HE2  LYS   9           HE2      LYS   9   6.917   0.490   5.155
   64    HE3  LYS   9           HE3      LYS   9   7.964  -0.667   4.334
   65    HZ1  LYS   9           HZ1      LYS   9   5.322  -1.086   3.496
   66    HZ2  LYS   9           HZ2      LYS   9   6.653  -0.574   2.575
   67    HZ3  LYS   9           HZ3      LYS   9   5.664   0.569   3.351
   68    HA   PRO  10           HA       PRO  10   5.464  -1.951  12.337
   69    HB2  PRO  10           HB2      PRO  10   7.553  -0.445  13.626
   70    HB3  PRO  10           HB3      PRO  10   6.807  -1.959  14.159
   71    HG2  PRO  10           HG2      PRO  10   9.356  -1.516  12.806
   72    HG3  PRO  10           HG3      PRO  10   8.794  -2.918  13.726
   73    HD2  PRO  10           HD2      PRO  10   9.103  -2.941  11.004
   74    HD3  PRO  10           HD3      PRO  10   7.924  -3.963  11.858
   75    HN1  NH2  11           HN1      NH2  11   4.456   1.075  12.029
   76    HN2  NH2  11           HN2      NH2  11   5.549   0.964  13.324
   77    H1   A2G 101           H1       A2G  12   2.413 -15.619  10.175
   78    H2   A2G 101           H2       A2G  12   2.256 -15.225  12.597
   79    HN2  A2G 101           HN2      A2G  12   3.322 -17.923  11.993
   80    H3   A2G 101           H3       A2G  12   0.857 -17.912  12.695
   81    HO3  A2G 101           HO3      A2G  12   1.639 -17.739  14.636
   82    H4   A2G 101           H4       A2G  12  -1.148 -16.678  13.284
   83    HO4  A2G 101           HO4      A2G  12  -0.512 -14.198  12.737
   84    H5   A2G 101           H5       A2G  12  -0.779 -16.971  10.879
   85    H6   A2G 101           H6       A2G  12  -1.631 -14.244  10.574
   86    H8   A2G 101           H8       A2G  12   5.726 -17.745  13.912
   87    H8A  A2G 101           H8A      A2G  12   6.523 -16.846  12.621
   88    H8B  A2G 101           H8B      A2G  12   5.495 -18.225  12.230
   89    H14  A2G 101           H14      A2G  12  -2.614 -15.708  10.540
   90    H15  A2G 101           H15      A2G  12  -3.377 -14.629  12.250
   91    H1   A2G 102           H1       A2G  13   5.984 -13.210   5.670
   92    H2   A2G 102           H2       A2G  13   5.379 -12.498   3.397
   93    HN2  A2G 102           HN2      A2G  13   3.195 -14.028   4.685
   94    H3   A2G 102           H3       A2G  13   4.556 -15.384   2.978
   95    HO3  A2G 102           HO3      A2G  13   4.695 -13.187   1.194
   96    H4   A2G 102           H4       A2G  13   6.429 -15.526   1.435
   97    HO4  A2G 102           HO4      A2G  13   7.704 -13.803   1.020
   98    H5   A2G 102           H5       A2G  13   6.925 -16.050   3.782
   99    H6   A2G 102           H6       A2G  13   9.289 -14.388   3.078
  100    H8   A2G 102           H8       A2G  13   0.942 -12.226   4.143
  101    H8A  A2G 102           H8A      A2G  13   1.513 -11.009   5.285
  102    H8B  A2G 102           H8B      A2G  13   1.610 -12.721   5.698
  103    H14  A2G 102           H14      A2G  13   9.201 -16.103   3.482
  104    H15  A2G 102           H15      A2G  13   8.851 -14.815   1.034
  105    H1   A2G 103           H1       A2G  14   7.273 -10.280  10.765
  106    H2   A2G 103           H2       A2G  14   9.222 -10.580  12.233
  107    HN2  A2G 103           HN2      A2G  14   8.871 -12.876  10.395
  108    H3   A2G 103           H3       A2G  14   8.067 -13.324  12.793
  109    HO3  A2G 103           HO3      A2G  14   9.823 -13.246  14.351
  110    H4   A2G 103           H4       A2G  14   7.658 -12.516  15.048
  111    HO4  A2G 103           HO4      A2G  14   8.976 -10.250  14.039
  112    H5   A2G 103           H5       A2G  14   5.857 -12.134  13.425
  113    H6   A2G 103           H6       A2G  14   5.980  -9.531  14.900
  114    H8   A2G 103           H8       A2G  14  11.506 -13.162   9.337
  115    H8A  A2G 103           H8A      A2G  14  11.561 -11.628   8.467
  116    H8B  A2G 103           H8B      A2G  14  10.105 -12.622   8.412
  117    H14  A2G 103           H14      A2G  14   4.642 -10.669  14.750
  118    H15  A2G 103           H15      A2G  14   5.269 -11.240  16.672
  119    H1   A2G 104           H1       A2G  15   6.019  -5.936   6.956
  120    H2   A2G 104           H2       A2G  15   4.081  -4.428   7.051
  121    HN2  A2G 104           HN2      A2G  15   3.704  -6.803   8.780
  122    H3   A2G 104           H3       A2G  15   2.431  -6.921   6.552
  123    HO3  A2G 104           HO3      A2G  15   1.219  -4.547   6.230
  124    H4   A2G 104           H4       A2G  15   1.910  -5.949   4.387
  125    HO4  A2G 104           HO4      A2G  15   3.750  -3.903   5.049
  126    H5   A2G 104           H5       A2G  15   3.924  -7.350   4.482
  127    H6   A2G 104           H6       A2G  15   5.109  -5.300   2.800
  128    H8   A2G 104           H8       A2G  15   2.941  -5.207  11.364
  129    H8A  A2G 104           H8A      A2G  15   4.689  -5.020  11.506
  130    H8B  A2G 104           H8B      A2G  15   4.010  -6.542  10.928
  131    H14  A2G 104           H14      A2G  15   4.364  -6.828   2.328
  132    H15  A2G 104           H15      A2G  15   3.324  -4.292   2.361
  Start of MODEL    8
    1    H1   ACE   1           H1       ACE   1   0.298 -25.344   3.164
    2    H2   ACE   1           H2       ACE   1   1.995 -25.024   3.522
    3    H3   ACE   1           H3       ACE   1   1.082 -23.906   2.510
    4    HA   PRO   2           HA       PRO   2  -1.195 -23.479   6.833
    5    HB2  PRO   2           HB2      PRO   2   0.541 -24.764   8.736
    6    HB3  PRO   2           HB3      PRO   2  -1.139 -25.160   8.348
    7    HG2  PRO   2           HG2      PRO   2   1.328 -26.444   7.460
    8    HG3  PRO   2           HG3      PRO   2  -0.330 -27.061   7.461
    9    HD2  PRO   2           HD2      PRO   2   1.010 -26.378   5.172
   10    HD3  PRO   2           HD3      PRO   2  -0.760 -26.289   5.327
   11    HA   PRO   3           HA       PRO   3   3.066 -21.936   8.919
   12    HB2  PRO   3           HB2      PRO   3   4.860 -21.968   6.662
   13    HB3  PRO   3           HB3      PRO   3   5.031 -22.802   8.214
   14    HG2  PRO   3           HG2      PRO   3   4.112 -23.834   5.636
   15    HG3  PRO   3           HG3      PRO   3   4.724 -24.705   7.050
   16    HD2  PRO   3           HD2      PRO   3   2.102 -24.774   6.290
   17    HD3  PRO   3           HD3      PRO   3   2.617 -24.933   7.986
   18    H    THR   4           H        THR   4   3.710 -19.761   8.798
   19    HA   THR   4           HA       THR   4   3.091 -18.248   6.375
   20    HB   THR   4           HB       THR   4   1.744 -16.591   7.663
   21   HG21  THR   4          HG21      THR   4   0.780 -18.749   6.488
   22   HG22  THR   4          HG22      THR   4  -0.269 -17.793   7.534
   23   HG23  THR   4          HG23      THR   4   0.470 -19.273   8.142
   24    H    THR   5           H        THR   5   3.747 -15.870   6.753
   25    HA   THR   5           HA       THR   5   6.095 -15.685   8.537
   26    HB   THR   5           HB       THR   5   7.404 -14.611   6.790
   27   HG21  THR   5          HG21      THR   5   8.035 -16.569   5.817
   28   HG22  THR   5          HG22      THR   5   6.409 -16.913   5.229
   29   HG23  THR   5          HG23      THR   5   6.837 -17.278   6.899
   30    H    THR   6           H        THR   6   6.407 -13.694   9.473
   31    HA   THR   6           HA       THR   6   4.280 -11.713   8.974
   32    HB   THR   6           HB       THR   6   4.806 -10.855  11.209
   33   HG21  THR   6          HG21      THR   6   4.727 -13.817  11.614
   34   HG22  THR   6          HG22      THR   6   3.412 -13.065  10.712
   35   HG23  THR   6          HG23      THR   6   3.749 -12.558  12.367
   36    H    THR   7           H        THR   7   4.747  -9.723   8.221
   37    HA   THR   7           HA       THR   7   7.573  -9.126   7.646
   38    HB   THR   7           HB       THR   7   6.750  -7.586   5.973
   39   HG21  THR   7          HG21      THR   7   6.655 -10.158   5.611
   40   HG22  THR   7          HG22      THR   7   5.786  -9.127   4.474
   41   HG23  THR   7          HG23      THR   7   4.908  -9.962   5.756
   42    H    LYS   8           H        LYS   8   8.608  -7.451   8.577
   43    HA   LYS   8           HA       LYS   8   7.302  -6.058  10.751
   44    HB2  LYS   8           HB2      LYS   8  10.099  -6.184   9.670
   45    HB3  LYS   8           HB3      LYS   8   9.647  -4.903  10.796
   46    HG2  LYS   8           HG2      LYS   8   8.845  -7.689  11.498
   47    HG3  LYS   8           HG3      LYS   8  10.552  -7.270  11.656
   48    HD2  LYS   8           HD2      LYS   8  10.006  -5.397  13.111
   49    HD3  LYS   8           HD3      LYS   8   8.281  -5.675  12.874
   50    HE2  LYS   8           HE2      LYS   8   9.643  -8.095  13.748
   51    HE3  LYS   8           HE3      LYS   8   9.864  -6.775  14.896
   52    HZ1  LYS   8           HZ1      LYS   8   7.510  -6.459  15.007
   53    HZ2  LYS   8           HZ2      LYS   8   7.841  -8.101  15.297
   54    HZ3  LYS   8           HZ3      LYS   8   7.240  -7.606  13.786
   55    H    LYS   9           H        LYS   9   7.797  -3.623  10.943
   56    HA   LYS   9           HA       LYS   9   6.387  -2.265   8.907
   57    HB2  LYS   9           HB2      LYS   9   7.893  -1.482  11.354
   58    HB3  LYS   9           HB3      LYS   9   7.573  -0.224  10.160
   59    HG2  LYS   9           HG2      LYS   9   5.754  -0.359  11.834
   60    HG3  LYS   9           HG3      LYS   9   5.173  -0.762  10.218
   61    HD2  LYS   9           HD2      LYS   9   4.830  -2.969  10.740
   62    HD3  LYS   9           HD3      LYS   9   6.197  -3.023  11.854
   63    HE2  LYS   9           HE2      LYS   9   3.543  -1.662  12.406
   64    HE3  LYS   9           HE3      LYS   9   4.046  -3.219  13.062
   65    HZ1  LYS   9           HZ1      LYS   9   5.087  -0.532  13.656
   66    HZ2  LYS   9           HZ2      LYS   9   6.091  -1.888  13.860
   67    HZ3  LYS   9           HZ3      LYS   9   4.635  -1.768  14.727
   68    HA   PRO  10           HA       PRO  10   9.140  -1.226   5.683
   69    HB2  PRO  10           HB2      PRO  10   8.962   1.631   6.004
   70    HB3  PRO  10           HB3      PRO  10   8.150   0.611   4.807
   71    HG2  PRO  10           HG2      PRO  10   7.114   1.754   7.286
   72    HG3  PRO  10           HG3      PRO  10   6.243   1.124   5.882
   73    HD2  PRO  10           HD2      PRO  10   6.309  -0.159   8.301
   74    HD3  PRO  10           HD3      PRO  10   6.119  -1.013   6.753
   75    HN1  NH2  11           HN1      NH2  11  11.224   0.829   8.571
   76    HN2  NH2  11           HN2      NH2  11   9.749   0.060   8.913
   77    H1   A2G 101           H1       A2G  12   2.877 -15.907   9.544
   78    H2   A2G 101           H2       A2G  12   2.453 -15.690  11.980
   79    HN2  A2G 101           HN2      A2G  12   3.706 -18.271  11.246
   80    H3   A2G 101           H3       A2G  12   1.150 -18.407  11.669
   81    HO3  A2G 101           HO3      A2G  12   0.678 -18.024  13.887
   82    H4   A2G 101           H4       A2G  12  -0.936 -17.286  12.178
   83    HO4  A2G 101           HO4      A2G  12   0.239 -15.650  13.481
   84    H5   A2G 101           H5       A2G  12  -0.343 -17.270   9.809
   85    H6   A2G 101           H6       A2G  12  -1.194 -14.444  10.084
   86    H8   A2G 101           H8       A2G  12   5.870 -18.293  13.356
   87    H8A  A2G 101           H8A      A2G  12   6.754 -17.094  12.410
   88    H8B  A2G 101           H8B      A2G  12   5.910 -18.412  11.596
   89    H14  A2G 101           H14      A2G  12  -1.960 -15.769   9.208
   90    H15  A2G 101           H15      A2G  12  -2.443 -16.598  11.410
   91    H1   A2G 102           H1       A2G  13   6.434 -12.688   5.931
   92    H2   A2G 102           H2       A2G  13   5.991 -11.736   3.742
   93    HN2  A2G 102           HN2      A2G  13   3.775 -13.522   4.581
   94    H3   A2G 102           H3       A2G  13   5.288 -14.541   2.832
   95    HO3  A2G 102           HO3      A2G  13   5.304 -11.975   1.700
   96    H4   A2G 102           H4       A2G  13   7.340 -14.508   1.534
   97    HO4  A2G 102           HO4      A2G  13   7.532 -11.911   2.617
   98    H5   A2G 102           H5       A2G  13   7.491 -15.345   3.848
   99    H6   A2G 102           H6       A2G  13   9.992 -13.773   3.714
  100    H8   A2G 102           H8       A2G  13   1.453 -11.790   3.595
  101    H8A  A2G 102           H8A      A2G  13   1.689 -10.845   5.066
  102    H8B  A2G 102           H8B      A2G  13   1.853 -12.601   5.109
  103    H14  A2G 102           H14      A2G  13   9.765 -15.521   3.751
  104    H15  A2G 102           H15      A2G  13   9.674 -15.579   1.639
  105    H1   A2G 103           H1       A2G  14   7.029 -10.125  11.257
  106    H2   A2G 103           H2       A2G  14   8.924 -10.364  12.828
  107    HN2  A2G 103           HN2      A2G  14   8.945 -12.421  10.697
  108    H3   A2G 103           H3       A2G  14   8.028 -13.254  12.981
  109    HO3  A2G 103           HO3      A2G  14   9.716 -12.944  14.776
  110    H4   A2G 103           H4       A2G  14   7.467 -12.763  15.296
  111    HO4  A2G 103           HO4      A2G  14   9.082 -11.132  15.550
  112    H5   A2G 103           H5       A2G  14   5.685 -12.340  13.675
  113    H6   A2G 103           H6       A2G  14   5.422  -9.871  15.281
  114    H8   A2G 103           H8       A2G  14  11.819 -12.290  10.094
  115    H8A  A2G 103           H8A      A2G  14  11.666 -10.786   9.186
  116    H8B  A2G 103           H8B      A2G  14  10.457 -12.054   8.999
  117    H14  A2G 103           H14      A2G  14   4.349 -11.268  15.186
  118    H15  A2G 103           H15      A2G  14   5.694 -12.375  16.569
  119    H1   A2G 104           H1       A2G  15   5.706  -5.835   7.037
  120    H2   A2G 104           H2       A2G  15   3.637  -4.529   6.833
  121    HN2  A2G 104           HN2      A2G  15   3.266  -6.878   8.597
  122    H3   A2G 104           H3       A2G  15   2.304  -7.186   6.239
  123    HO3  A2G 104           HO3      A2G  15   1.090  -4.734   5.811
  124    H4   A2G 104           H4       A2G  15   1.972  -6.332   3.987
  125    HO4  A2G 104           HO4      A2G  15   2.155  -4.050   4.986
  126    H5   A2G 104           H5       A2G  15   4.076  -7.531   4.395
  127    H6   A2G 104           H6       A2G  15   5.044  -5.239   2.765
  128    H8   A2G 104           H8       A2G  15   1.971  -5.570  10.863
  129    H8A  A2G 104           H8A      A2G  15   3.440  -4.747  11.387
  130    H8B  A2G 104           H8B      A2G  15   3.514  -6.423  10.841
  131    H14  A2G 104           H14      A2G  15   5.010  -6.958   2.376
  132    H15  A2G 104           H15      A2G  15   3.272  -6.547   1.308
  Start of MODEL    9
    1    H1   ACE   1           H1       ACE   1   2.078 -23.999   2.606
    2    H2   ACE   1           H2       ACE   1   1.427 -25.541   3.162
    3    H3   ACE   1           H3       ACE   1   3.019 -25.011   3.700
    4    HA   PRO   2           HA       PRO   2  -0.662 -23.955   6.665
    5    HB2  PRO   2           HB2      PRO   2   1.007 -25.058   8.736
    6    HB3  PRO   2           HB3      PRO   2  -0.562 -25.644   8.166
    7    HG2  PRO   2           HG2      PRO   2   2.115 -26.619   7.557
    8    HG3  PRO   2           HG3      PRO   2   0.550 -27.414   7.347
    9    HD2  PRO   2           HD2      PRO   2   2.085 -26.510   5.254
   10    HD3  PRO   2           HD3      PRO   2   0.315 -26.669   5.179
   11    HA   PRO   3           HA       PRO   3   3.114 -21.930   9.214
   12    HB2  PRO   3           HB2      PRO   3   5.139 -21.700   7.176
   13    HB3  PRO   3           HB3      PRO   3   5.241 -22.538   8.732
   14    HG2  PRO   3           HG2      PRO   3   4.747 -23.621   6.059
   15    HG3  PRO   3           HG3      PRO   3   5.312 -24.437   7.525
   16    HD2  PRO   3           HD2      PRO   3   2.818 -24.832   6.495
   17    HD3  PRO   3           HD3      PRO   3   3.166 -24.944   8.235
   18    H    THR   4           H        THR   4   3.651 -19.681   9.077
   19    HA   THR   4           HA       THR   4   2.917 -18.270   6.612
   20    HB   THR   4           HB       THR   4   1.427 -16.742   7.831
   21   HG21  THR   4          HG21      THR   4   0.457 -19.494   8.528
   22   HG22  THR   4          HG22      THR   4   0.697 -19.059   6.837
   23   HG23  THR   4          HG23      THR   4  -0.438 -18.145   7.829
   24    H    THR   5           H        THR   5   4.073 -16.413   6.302
   25    HA   THR   5           HA       THR   5   6.057 -15.754   8.384
   26    HB   THR   5           HB       THR   5   7.369 -14.750   6.565
   27   HG21  THR   5          HG21      THR   5   7.117 -17.376   7.057
   28   HG22  THR   5          HG22      THR   5   8.155 -16.763   5.770
   29   HG23  THR   5          HG23      THR   5   6.540 -17.361   5.391
   30    H    THR   6           H        THR   6   6.280 -13.703   9.163
   31    HA   THR   6           HA       THR   6   4.132 -11.808   8.457
   32    HB   THR   6           HB       THR   6   4.577 -10.780  10.649
   33   HG21  THR   6          HG21      THR   6   4.521 -13.695  11.308
   34   HG22  THR   6          HG22      THR   6   3.243 -13.074  10.265
   35   HG23  THR   6          HG23      THR   6   3.473 -12.396  11.877
   36    H    THR   7           H        THR   7   4.621  -9.616   8.058
   37    HA   THR   7           HA       THR   7   7.375  -9.173   7.117
   38    HB   THR   7           HB       THR   7   6.428  -7.328   5.796
   39   HG21  THR   7          HG21      THR   7   5.503  -8.690   4.180
   40   HG22  THR   7          HG22      THR   7   4.472  -9.538   5.333
   41   HG23  THR   7          HG23      THR   7   6.188  -9.932   5.227
   42    H    LYS   8           H        LYS   8   8.682  -7.753   8.076
   43    HA   LYS   8           HA       LYS   8   7.841  -6.477  10.528
   44    HB2  LYS   8           HB2      LYS   8  10.048  -7.499  10.401
   45    HB3  LYS   8           HB3      LYS   8  10.487  -6.439   9.062
   46    HG2  LYS   8           HG2      LYS   8  10.737  -4.600  10.416
   47    HG3  LYS   8           HG3      LYS   8   9.486  -5.129  11.542
   48    HD2  LYS   8           HD2      LYS   8  12.047  -6.687  11.333
   49    HD3  LYS   8           HD3      LYS   8  12.004  -5.203  12.287
   50    HE2  LYS   8           HE2      LYS   8  10.596  -6.096  13.871
   51    HE3  LYS   8           HE3      LYS   8   9.787  -7.149  12.710
   52    HZ1  LYS   8           HZ1      LYS   8  11.342  -8.208  14.416
   53    HZ2  LYS   8           HZ2      LYS   8  12.606  -7.592  13.463
   54    HZ3  LYS   8           HZ3      LYS   8  11.495  -8.693  12.797
   55    H    LYS   9           H        LYS   9   7.586  -4.314  10.930
   56    HA   LYS   9           HA       LYS   9   6.798  -2.621   8.808
   57    HB2  LYS   9           HB2      LYS   9   7.240  -2.311  11.735
   58    HB3  LYS   9           HB3      LYS   9   7.170  -0.843  10.759
   59    HG2  LYS   9           HG2      LYS   9   5.001  -1.526   9.842
   60    HG3  LYS   9           HG3      LYS   9   5.073  -3.035  10.754
   61    HD2  LYS   9           HD2      LYS   9   4.125  -1.990  12.505
   62    HD3  LYS   9           HD3      LYS   9   5.534  -0.932  12.606
   63    HE2  LYS   9           HE2      LYS   9   3.113  -0.467  10.838
   64    HE3  LYS   9           HE3      LYS   9   3.454   0.379  12.348
   65    HZ1  LYS   9           HZ1      LYS   9   4.862   1.725  11.319
   66    HZ2  LYS   9           HZ2      LYS   9   4.311   1.090   9.843
   67    HZ3  LYS   9           HZ3      LYS   9   5.690   0.437  10.589
   68    HA   PRO  10           HA       PRO  10  10.298  -0.687   7.053
   69    HB2  PRO  10           HB2      PRO  10   9.675   1.992   7.913
   70    HB3  PRO  10           HB3      PRO  10   9.432   1.271   6.315
   71    HG2  PRO  10           HG2      PRO  10   7.516   1.683   8.490
   72    HG3  PRO  10           HG3      PRO  10   7.228   1.446   6.760
   73    HD2  PRO  10           HD2      PRO  10   6.634  -0.459   8.608
   74    HD3  PRO  10           HD3      PRO  10   7.146  -0.868   6.955
   75    HN1  NH2  11           HN1      NH2  11  10.134  -0.466  10.720
   76    HN2  NH2  11           HN2      NH2  11  10.571   1.169  10.609
   77    H1   A2G 101           H1       A2G  12   2.231 -15.702   9.688
   78    H2   A2G 101           H2       A2G  12   1.739 -15.401  12.058
   79    HN2  A2G 101           HN2      A2G  12   3.349 -17.846  11.613
   80    H3   A2G 101           H3       A2G  12   0.841 -18.293  12.017
   81    HO3  A2G 101           HO3      A2G  12   0.678 -18.069  14.126
   82    H4   A2G 101           H4       A2G  12  -1.397 -17.404  12.423
   83    HO4  A2G 101           HO4      A2G  12  -1.326 -14.929  11.903
   84    H5   A2G 101           H5       A2G  12  -0.708 -17.708  10.087
   85    H6   A2G 101           H6       A2G  12  -2.082 -15.050  10.035
   86    H8   A2G 101           H8       A2G  12   5.226 -17.554  13.795
   87    H8A  A2G 101           H8A      A2G  12   6.125 -16.228  13.058
   88    H8B  A2G 101           H8B      A2G  12   5.607 -17.596  12.074
   89    H14  A2G 101           H14      A2G  12  -2.483 -16.533   9.169
   90    H15  A2G 101           H15      A2G  12  -3.673 -17.151  10.777
   91    H1   A2G 102           H1       A2G  13   6.142 -13.032   5.531
   92    H2   A2G 102           H2       A2G  13   5.702 -12.367   3.193
   93    HN2  A2G 102           HN2      A2G  13   3.597 -14.137   4.287
   94    H3   A2G 102           H3       A2G  13   5.284 -15.334   2.738
   95    HO3  A2G 102           HO3      A2G  13   4.266 -13.291   1.534
   96    H4   A2G 102           H4       A2G  13   7.289 -15.230   1.368
   97    HO4  A2G 102           HO4      A2G  13   7.844 -13.372   0.620
   98    H5   A2G 102           H5       A2G  13   7.661 -15.680   3.745
   99    H6   A2G 102           H6       A2G  13   9.829 -13.722   3.368
  100    H8   A2G 102           H8       A2G  13   1.215 -12.489   3.837
  101    H8A  A2G 102           H8A      A2G  13   1.699 -11.294   5.041
  102    H8B  A2G 102           H8B      A2G  13   1.928 -13.013   5.362
  103    H14  A2G 102           H14      A2G  13   9.918 -15.474   3.551
  104    H15  A2G 102           H15      A2G  13   9.276 -15.662   1.375
  105    H1   A2G 103           H1       A2G  14   6.798 -10.027  10.711
  106    H2   A2G 103           H2       A2G  14   8.640 -10.135  12.347
  107    HN2  A2G 103           HN2      A2G  14   8.738 -12.371  10.410
  108    H3   A2G 103           H3       A2G  14   7.776 -13.017  12.705
  109    HO3  A2G 103           HO3      A2G  14  10.062 -11.738  13.105
  110    H4   A2G 103           H4       A2G  14   7.086 -12.372  14.937
  111    HO4  A2G 103           HO4      A2G  14   7.222 -10.186  15.557
  112    H5   A2G 103           H5       A2G  14   5.380 -12.080  13.208
  113    H6   A2G 103           H6       A2G  14   5.158  -9.530  14.765
  114    H8   A2G 103           H8       A2G  14  11.377 -12.155   9.343
  115    H8A  A2G 103           H8A      A2G  14  11.191 -10.556   8.623
  116    H8B  A2G 103           H8B      A2G  14   9.901 -11.750   8.467
  117    H14  A2G 103           H14      A2G  14   3.939 -10.770  14.472
  118    H15  A2G 103           H15      A2G  14   4.537 -11.728  16.225
  119    H1   A2G 104           H1       A2G  15   5.459  -5.753   7.254
  120    H2   A2G 104           H2       A2G  15   3.346  -4.480   7.361
  121    HN2  A2G 104           HN2      A2G  15   3.204  -7.033   8.854
  122    H3   A2G 104           H3       A2G  15   2.023  -7.096   6.618
  123    HO3  A2G 104           HO3      A2G  15   0.882  -5.595   7.957
  124    H4   A2G 104           H4       A2G  15   1.548  -6.179   4.449
  125    HO4  A2G 104           HO4      A2G  15   2.396  -3.827   5.666
  126    H5   A2G 104           H5       A2G  15   3.767  -7.144   4.530
  127    H6   A2G 104           H6       A2G  15   4.338  -4.535   3.182
  128    H8   A2G 104           H8       A2G  15   2.066  -6.003  11.392
  129    H8A  A2G 104           H8A      A2G  15   3.604  -5.266  11.843
  130    H8B  A2G 104           H8B      A2G  15   3.577  -6.860  11.088
  131    H14  A2G 104           H14      A2G  15   4.589  -6.177   2.592
  132    H15  A2G 104           H15      A2G  15   2.822  -5.036   1.590
  Start of MODEL   10
    1    H1   ACE   1           H1       ACE   1   1.169 -24.647   3.809
    2    H2   ACE   1           H2       ACE   1   0.356 -23.470   2.778
    3    H3   ACE   1           H3       ACE   1  -0.541 -24.842   3.425
    4    HA   PRO   2           HA       PRO   2  -1.945 -22.841   7.054
    5    HB2  PRO   2           HB2      PRO   2  -0.347 -24.244   8.996
    6    HB3  PRO   2           HB3      PRO   2  -2.049 -24.504   8.584
    7    HG2  PRO   2           HG2      PRO   2   0.316 -26.000   7.755
    8    HG3  PRO   2           HG3      PRO   2  -1.389 -26.471   7.718
    9    HD2  PRO   2           HD2      PRO   2   0.068 -25.913   5.461
   10    HD3  PRO   2           HD3      PRO   2  -1.694 -25.694   5.566
   11    HA   PRO   3           HA       PRO   3   2.375 -21.583   9.207
   12    HB2  PRO   3           HB2      PRO   3   4.238 -21.832   7.023
   13    HB3  PRO   3           HB3      PRO   3   4.281 -22.640   8.597
   14    HG2  PRO   3           HG2      PRO   3   3.382 -23.652   6.008
   15    HG3  PRO   3           HG3      PRO   3   3.857 -24.537   7.464
   16    HD2  PRO   3           HD2      PRO   3   1.269 -24.393   6.586
   17    HD3  PRO   3           HD3      PRO   3   1.700 -24.579   8.301
   18    H    THR   4           H        THR   4   3.307 -19.493   8.973
   19    HA   THR   4           HA       THR   4   2.741 -18.018   6.502
   20    HB   THR   4           HB       THR   4   1.628 -16.211   7.738
   21   HG21  THR   4          HG21      THR   4   0.407 -18.338   6.845
   22   HG22  THR   4          HG22      THR   4  -0.468 -17.254   7.927
   23   HG23  THR   4          HG23      THR   4   0.229 -18.749   8.551
   24    H    THR   5           H        THR   5   3.675 -15.750   6.663
   25    HA   THR   5           HA       THR   5   6.039 -15.670   8.424
   26    HB   THR   5           HB       THR   5   7.459 -14.970   6.587
   27   HG21  THR   5          HG21      THR   5   6.625 -17.499   6.951
   28   HG22  THR   5          HG22      THR   5   7.749 -17.058   5.666
   29   HG23  THR   5          HG23      THR   5   6.032 -17.252   5.309
   30    H    THR   6           H        THR   6   6.609 -13.666   9.155
   31    HA   THR   6           HA       THR   6   4.720 -11.488   8.541
   32    HB   THR   6           HB       THR   6   5.310 -10.552  10.690
   33   HG21  THR   6          HG21      THR   6   5.168 -13.483  11.304
   34   HG22  THR   6          HG22      THR   6   3.830 -12.729  10.437
   35   HG23  THR   6          HG23      THR   6   4.283 -12.146  12.038
   36    H    THR   7           H        THR   7   5.764  -9.247   8.866
   37    HA   THR   7           HA       THR   7   8.485  -9.154   7.753
   38    HB   THR   7           HB       THR   7   7.566  -7.221   6.271
   39   HG21  THR   7          HG21      THR   7   6.788  -8.971   4.558
   40   HG22  THR   7          HG22      THR   7   7.103 -10.169   5.813
   41   HG23  THR   7          HG23      THR   7   8.418  -9.164   5.201
   42    H    LYS   8           H        LYS   8   9.593  -7.184   8.127
   43    HA   LYS   8           HA       LYS   8   8.820  -5.894  10.599
   44    HB2  LYS   8           HB2      LYS   8  11.188  -5.499   8.755
   45    HB3  LYS   8           HB3      LYS   8  10.975  -4.664  10.293
   46    HG2  LYS   8           HG2      LYS   8  10.555  -7.506  10.633
   47    HG3  LYS   8           HG3      LYS   8  12.128  -7.203   9.894
   48    HD2  LYS   8           HD2      LYS   8  11.128  -5.763  12.363
   49    HD3  LYS   8           HD3      LYS   8  12.165  -7.188  12.414
   50    HE2  LYS   8           HE2      LYS   8  13.994  -5.945  11.988
   51    HE3  LYS   8           HE3      LYS   8  13.235  -5.242  10.559
   52    HZ1  LYS   8           HZ1      LYS   8  12.580  -4.338  13.299
   53    HZ2  LYS   8           HZ2      LYS   8  12.262  -3.551  11.828
   54    HZ3  LYS   8           HZ3      LYS   8  13.854  -3.660  12.409
   55    H    LYS   9           H        LYS   9   7.082  -4.566  10.304
   56    HA   LYS   9           HA       LYS   9   7.495  -2.003   9.186
   57    HB2  LYS   9           HB2      LYS   9   7.091  -3.675   7.153
   58    HB3  LYS   9           HB3      LYS   9   5.404  -3.410   7.595
   59    HG2  LYS   9           HG2      LYS   9   5.774  -0.958   7.467
   60    HG3  LYS   9           HG3      LYS   9   7.438  -1.251   6.961
   61    HD2  LYS   9           HD2      LYS   9   5.639  -2.815   5.335
   62    HD3  LYS   9           HD3      LYS   9   5.147  -1.121   5.309
   63    HE2  LYS   9           HE2      LYS   9   6.812  -1.639   3.533
   64    HE3  LYS   9           HE3      LYS   9   7.412  -0.441   4.679
   65    HZ1  LYS   9           HZ1      LYS   9   8.925  -2.389   4.050
   66    HZ2  LYS   9           HZ2      LYS   9   7.940  -3.316   5.079
   67    HZ3  LYS   9           HZ3      LYS   9   8.794  -1.979   5.690
   68    HA   PRO  10           HA       PRO  10   3.956  -3.212  12.255
   69    HB2  PRO  10           HB2      PRO  10   5.082  -1.166  13.943
   70    HB3  PRO  10           HB3      PRO  10   4.961  -2.903  14.261
   71    HG2  PRO  10           HG2      PRO  10   7.248  -1.332  13.348
   72    HG3  PRO  10           HG3      PRO  10   7.202  -2.941  14.083
   73    HD2  PRO  10           HD2      PRO  10   7.812  -2.516  11.446
   74    HD3  PRO  10           HD3      PRO  10   7.061  -4.014  12.042
   75    HN1  NH2  11           HN1      NH2  11   1.916  -0.527  11.607
   76    HN2  NH2  11           HN2      NH2  11   2.232  -1.472  12.982
   77    H1   A2G 101           H1       A2G  12   2.973 -15.440   9.433
   78    H2   A2G 101           H2       A2G  12   2.794 -14.938  11.850
   79    HN2  A2G 101           HN2      A2G  12   3.684 -17.713  11.313
   80    H3   A2G 101           H3       A2G  12   1.202 -17.511  11.968
   81    HO3  A2G 101           HO3      A2G  12   1.125 -15.853  14.097
   82    H4   A2G 101           H4       A2G  12  -0.713 -16.125  12.497
   83    HO4  A2G 101           HO4      A2G  12  -0.401 -14.205  13.224
   84    H5   A2G 101           H5       A2G  12  -0.329 -16.473  10.107
   85    H6   A2G 101           H6       A2G  12  -0.916 -13.537  10.246
   86    H8   A2G 101           H8       A2G  12   5.818 -18.014  13.249
   87    H8A  A2G 101           H8A      A2G  12   6.904 -16.877  12.450
   88    H8B  A2G 101           H8B      A2G  12   5.964 -18.020  11.490
   89    H14  A2G 101           H14      A2G  12  -1.759 -14.804   9.354
   90    H15  A2G 101           H15      A2G  12  -1.960 -14.065  12.044
   91    H1   A2G 102           H1       A2G  13   6.671 -12.970   5.643
   92    H2   A2G 102           H2       A2G  13   6.324 -12.103   3.379
   93    HN2  A2G 102           HN2      A2G  13   3.884 -13.429   4.405
   94    H3   A2G 102           H3       A2G  13   5.224 -14.854   2.735
   95    HO3  A2G 102           HO3      A2G  13   4.279 -13.120   1.607
   96    H4   A2G 102           H4       A2G  13   7.193 -15.135   1.338
   97    HO4  A2G 102           HO4      A2G  13   8.392 -12.853   2.382
   98    H5   A2G 102           H5       A2G  13   7.407 -15.827   3.688
   99    H6   A2G 102           H6       A2G  13  10.032 -14.563   3.468
  100    H8   A2G 102           H8       A2G  13   2.001 -10.857   4.315
  101    H8A  A2G 102           H8A      A2G  13   2.929 -10.522   5.778
  102    H8B  A2G 102           H8B      A2G  13   2.437 -12.174   5.404
  103    H14  A2G 102           H14      A2G  13   9.605 -16.273   3.380
  104    H15  A2G 102           H15      A2G  13  10.224 -15.901   1.371
  105    H1   A2G 103           H1       A2G  14   7.554  -9.881  10.618
  106    H2   A2G 103           H2       A2G  14   9.507 -10.040  12.101
  107    HN2  A2G 103           HN2      A2G  14   9.350 -12.334  10.234
  108    H3   A2G 103           H3       A2G  14   8.557 -12.869  12.626
  109    HO3  A2G 103           HO3      A2G  14  10.680 -12.909  12.880
  110    H4   A2G 103           H4       A2G  14   8.084 -12.112  14.888
  111    HO4  A2G 103           HO4      A2G  14   8.680 -10.196  15.580
  112    H5   A2G 103           H5       A2G  14   6.263 -11.855  13.264
  113    H6   A2G 103           H6       A2G  14   6.042  -9.244  14.636
  114    H8   A2G 103           H8       A2G  14  12.077 -12.376   9.207
  115    H8A  A2G 103           H8A      A2G  14  11.911 -10.855   8.330
  116    H8B  A2G 103           H8B      A2G  14  10.595 -12.029   8.317
  117    H14  A2G 103           H14      A2G  14   4.967 -10.641  14.698
  118    H15  A2G 103           H15      A2G  14   6.699 -11.644  15.978
  119    H1   A2G 104           H1       A2G  15   5.906  -6.121   7.475
  120    H2   A2G 104           H2       A2G  15   3.557  -5.488   7.283
  121    HN2  A2G 104           HN2      A2G  15   3.837  -8.226   8.378
  122    H3   A2G 104           H3       A2G  15   3.210  -8.149   5.879
  123    HO3  A2G 104           HO3      A2G  15   1.148  -7.772   6.085
  124    H4   A2G 104           H4       A2G  15   2.705  -6.812   3.901
  125    HO4  A2G 104           HO4      A2G  15   3.633  -4.452   4.865
  126    H5   A2G 104           H5       A2G  15   5.055  -7.425   4.228
  127    H6   A2G 104           H6       A2G  15   5.462  -4.611   3.460
  128    H8   A2G 104           H8       A2G  15   2.256  -7.986  10.859
  129    H8A  A2G 104           H8A      A2G  15   3.424  -6.882  11.584
  130    H8B  A2G 104           H8B      A2G  15   3.984  -8.270  10.651
  131    H14  A2G 104           H14      A2G  15   5.756  -6.082   2.533
  132    H15  A2G 104           H15      A2G  15   3.936  -4.531   1.943
  Start of MODEL   11
    1    H1   ACE   1           H1       ACE   1  -0.981 -20.173  13.258
    2    H2   ACE   1           H2       ACE   1  -0.448 -18.719  12.414
    3    H3   ACE   1           H3       ACE   1   0.618 -19.503  13.581
    4    HA   PRO   2           HA       PRO   2   0.208 -22.875  10.032
    5    HB2  PRO   2           HB2      PRO   2  -0.853 -21.440   7.770
    6    HB3  PRO   2           HB3      PRO   2  -1.541 -22.848   8.595
    7    HG2  PRO   2           HG2      PRO   2  -2.239 -20.023   8.839
    8    HG3  PRO   2           HG3      PRO   2  -3.169 -21.460   9.288
    9    HD2  PRO   2           HD2      PRO   2  -2.055 -19.765  11.128
   10    HD3  PRO   2           HD3      PRO   2  -2.326 -21.495  11.440
   11    HA   PRO   3           HA       PRO   3   4.044 -21.757   8.217
   12    HB2  PRO   3           HB2      PRO   3   3.404 -22.516   5.513
   13    HB3  PRO   3           HB3      PRO   3   4.367 -23.406   6.702
   14    HG2  PRO   3           HG2      PRO   3   1.588 -23.792   5.896
   15    HG3  PRO   3           HG3      PRO   3   2.687 -24.898   6.730
   16    HD2  PRO   3           HD2      PRO   3   0.554 -23.691   7.958
   17    HD3  PRO   3           HD3      PRO   3   2.026 -24.186   8.826
   18    H    THR   4           H        THR   4   3.912 -19.501   8.383
   19    HA   THR   4           HA       THR   4   3.453 -18.125   5.838
   20    HB   THR   4           HB       THR   4   2.149 -16.338   6.967
   21   HG21  THR   4          HG21      THR   4   0.101 -17.461   6.814
   22   HG22  THR   4          HG22      THR   4   0.749 -18.938   7.528
   23   HG23  THR   4          HG23      THR   4   1.162 -18.507   5.869
   24    H    THR   5           H        THR   5   4.181 -15.781   6.028
   25    HA   THR   5           HA       THR   5   6.376 -15.482   7.971
   26    HB   THR   5           HB       THR   5   7.885 -14.708   6.236
   27   HG21  THR   5          HG21      THR   5   7.189 -17.294   6.600
   28   HG22  THR   5          HG22      THR   5   8.428 -16.793   5.450
   29   HG23  THR   5          HG23      THR   5   6.788 -17.119   4.892
   30    H    THR   6           H        THR   6   6.713 -13.430   8.710
   31    HA   THR   6           HA       THR   6   4.736 -11.408   7.868
   32    HB   THR   6           HB       THR   6   5.044 -10.398  10.041
   33   HG21  THR   6          HG21      THR   6   3.747 -12.667   9.710
   34   HG22  THR   6          HG22      THR   6   4.029 -12.048  11.337
   35   HG23  THR   6          HG23      THR   6   5.056 -13.328  10.690
   36    H    THR   7           H        THR   7   5.433  -9.160   7.803
   37    HA   THR   7           HA       THR   7   8.311  -8.766   7.323
   38    HB   THR   7           HB       THR   7   7.827  -7.515   5.254
   39   HG21  THR   7          HG21      THR   7   8.082 -10.155   5.447
   40   HG22  THR   7          HG22      THR   7   7.699  -9.392   3.904
   41   HG23  THR   7          HG23      THR   7   6.417 -10.124   4.866
   42    H    LYS   8           H        LYS   8   9.033  -6.639   7.633
   43    HA   LYS   8           HA       LYS   8   9.096  -4.684   8.857
   44    HB2  LYS   8           HB2      LYS   8   7.674  -4.250   6.673
   45    HB3  LYS   8           HB3      LYS   8   6.360  -4.042   7.832
   46    HG2  LYS   8           HG2      LYS   8   7.184  -1.876   7.756
   47    HG3  LYS   8           HG3      LYS   8   8.145  -2.531   9.082
   48    HD2  LYS   8           HD2      LYS   8   9.840  -1.633   7.790
   49    HD3  LYS   8           HD3      LYS   8   9.757  -3.248   7.086
   50    HE2  LYS   8           HE2      LYS   8   8.104  -2.322   5.404
   51    HE3  LYS   8           HE3      LYS   8   8.490  -0.715   6.019
   52    HZ1  LYS   8           HZ1      LYS   8  10.657  -2.525   5.195
   53    HZ2  LYS   8           HZ2      LYS   8  10.633  -0.827   5.239
   54    HZ3  LYS   8           HZ3      LYS   8   9.796  -1.659   4.018
   55    H    LYS   9           H        LYS   9   6.596  -3.261   9.677
   56    HA   LYS   9           HA       LYS   9   5.860  -3.046  11.930
   57    HB2  LYS   9           HB2      LYS   9   4.063  -3.819  10.218
   58    HB3  LYS   9           HB3      LYS   9   4.169  -5.369  11.053
   59    HG2  LYS   9           HG2      LYS   9   3.717  -4.220  13.207
   60    HG3  LYS   9           HG3      LYS   9   3.545  -2.695  12.338
   61    HD2  LYS   9           HD2      LYS   9   1.416  -3.185  11.801
   62    HD3  LYS   9           HD3      LYS   9   1.914  -4.717  11.083
   63    HE2  LYS   9           HE2      LYS   9   0.339  -5.123  12.921
   64    HE3  LYS   9           HE3      LYS   9   1.934  -5.750  13.338
   65    HZ1  LYS   9           HZ1      LYS   9   1.802  -3.065  14.118
   66    HZ2  LYS   9           HZ2      LYS   9   1.955  -4.442  15.102
   67    HZ3  LYS   9           HZ3      LYS   9   0.415  -3.843  14.705
   68    HA   PRO  10           HA       PRO  10   8.449  -6.772  13.365
   69    HB2  PRO  10           HB2      PRO  10   9.334  -4.977  15.439
   70    HB3  PRO  10           HB3      PRO  10  10.284  -5.684  14.124
   71    HG2  PRO  10           HG2      PRO  10   9.129  -3.014  14.357
   72    HG3  PRO  10           HG3      PRO  10  10.416  -3.599  13.295
   73    HD2  PRO  10           HD2      PRO  10   7.918  -2.927  12.392
   74    HD3  PRO  10           HD3      PRO  10   8.950  -4.135  11.593
   75    HN1  NH2  11           HN1      NH2  11   7.566  -4.943  16.526
   76    HN2  NH2  11           HN2      NH2  11   5.984  -4.917  15.911
   77    H1   A2G 101           H1       A2G  12   3.033 -15.474   8.832
   78    H2   A2G 101           H2       A2G  12   2.508 -15.094  11.203
   79    HN2  A2G 101           HN2      A2G  12   3.771 -17.736  10.765
   80    H3   A2G 101           H3       A2G  12   1.221 -17.836  11.102
   81    HO3  A2G 101           HO3      A2G  12   0.513 -16.846  13.240
   82    H4   A2G 101           H4       A2G  12  -0.894 -16.678  11.406
   83    HO4  A2G 101           HO4      A2G  12   0.520 -14.801  12.367
   84    H5   A2G 101           H5       A2G  12  -0.156 -16.982   9.084
   85    H6   A2G 101           H6       A2G  12  -1.134 -14.169   9.017
   86    H8   A2G 101           H8       A2G  12   5.720 -17.675  12.936
   87    H8A  A2G 101           H8A      A2G  12   6.755 -16.490  12.142
   88    H8B  A2G 101           H8B      A2G  12   6.031 -17.797  11.205
   89    H14  A2G 101           H14      A2G  12  -1.754 -15.593   8.181
   90    H15  A2G 101           H15      A2G  12  -2.982 -16.053   9.835
   91    H1   A2G 102           H1       A2G  13   7.281 -12.866   4.925
   92    H2   A2G 102           H2       A2G  13   7.017 -12.263   2.595
   93    HN2  A2G 102           HN2      A2G  13   4.524 -13.493   3.612
   94    H3   A2G 102           H3       A2G  13   5.957 -15.069   2.175
   95    HO3  A2G 102           HO3      A2G  13   5.219 -13.140   0.905
   96    H4   A2G 102           H4       A2G  13   7.993 -15.435   0.877
   97    HO4  A2G 102           HO4      A2G  13   9.587 -13.552   1.498
   98    H5   A2G 102           H5       A2G  13   8.056 -15.971   3.282
   99    H6   A2G 102           H6       A2G  13  10.698 -14.722   3.099
  100    H8   A2G 102           H8       A2G  13   2.572 -11.524   2.856
  101    H8A  A2G 102           H8A      A2G  13   3.162 -10.254   3.928
  102    H8B  A2G 102           H8B      A2G  13   3.057 -11.917   4.506
  103    H14  A2G 102           H14      A2G  13  10.271 -16.432   3.160
  104    H15  A2G 102           H15      A2G  13  11.255 -15.544   1.148
  105    H1   A2G 103           H1       A2G  14   7.203  -9.552  10.165
  106    H2   A2G 103           H2       A2G  14   9.030  -9.520  11.809
  107    HN2  A2G 103           HN2      A2G  14   9.236 -11.845   9.987
  108    H3   A2G 103           H3       A2G  14   8.297 -12.417  12.310
  109    HO3  A2G 103           HO3      A2G  14  10.337 -12.329  12.845
  110    H4   A2G 103           H4       A2G  14   7.552 -11.683  14.503
  111    HO4  A2G 103           HO4      A2G  14   7.687  -9.001  13.867
  112    H5   A2G 103           H5       A2G  14   5.872 -11.608  12.714
  113    H6   A2G 103           H6       A2G  14   5.324  -9.017  14.057
  114    H8   A2G 103           H8       A2G  14  12.080 -11.594   9.224
  115    H8A  A2G 103           H8A      A2G  14  11.758 -10.178   8.224
  116    H8B  A2G 103           H8B      A2G  14  10.635 -11.538   8.214
  117    H14  A2G 103           H14      A2G  14   4.333 -10.473  13.978
  118    H15  A2G 103           H15      A2G  14   5.732 -11.421  15.504
  119    H1   A2G 104           H1       A2G  15   6.256  -5.844   5.696
  120    H2   A2G 104           H2       A2G  15   4.202  -5.021   4.602
  121    HN2  A2G 104           HN2      A2G  15   3.648  -7.058   6.679
  122    H3   A2G 104           H3       A2G  15   3.565  -7.964   4.254
  123    HO3  A2G 104           HO3      A2G  15   1.680  -6.938   4.445
  124    H4   A2G 104           H4       A2G  15   3.827  -7.560   1.873
  125    HO4  A2G 104           HO4      A2G  15   4.975  -5.120   2.017
  126    H5   A2G 104           H5       A2G  15   5.876  -8.178   3.060
  127    H6   A2G 104           H6       A2G  15   7.008  -5.997   1.436
  128    H8   A2G 104           H8       A2G  15   1.304  -5.655   7.870
  129    H8A  A2G 104           H8A      A2G  15   2.368  -4.585   8.783
  130    H8B  A2G 104           H8B      A2G  15   2.767  -6.295   8.621
  131    H14  A2G 104           H14      A2G  15   7.192  -7.742   1.255
  132    H15  A2G 104           H15      A2G  15   5.958  -7.328  -0.421
  Start of MODEL   12
    1    H1   ACE   1           H1       ACE   1  -1.882 -23.383   6.702
    2    H2   ACE   1           H2       ACE   1  -2.704 -21.880   6.282
    3    H3   ACE   1           H3       ACE   1  -3.209 -22.795   7.703
    4    HA   PRO   2           HA       PRO   2  -0.613 -20.742  10.567
    5    HB2  PRO   2           HB2      PRO   2   1.266 -22.865  11.078
    6    HB3  PRO   2           HB3      PRO   2  -0.099 -22.347  12.078
    7    HG2  PRO   2           HG2      PRO   2   0.109 -24.606  10.241
    8    HG3  PRO   2           HG3      PRO   2  -1.042 -24.319  11.554
    9    HD2  PRO   2           HD2      PRO   2  -1.733 -24.205   8.906
   10    HD3  PRO   2           HD3      PRO   2  -2.563 -23.266  10.169
   11    HA   PRO   3           HA       PRO   3   3.870 -21.605   8.587
   12    HB2  PRO   3           HB2      PRO   3   3.207 -22.420   5.905
   13    HB3  PRO   3           HB3      PRO   3   4.141 -23.306   7.118
   14    HG2  PRO   3           HG2      PRO   3   1.350 -23.625   6.321
   15    HG3  PRO   3           HG3      PRO   3   2.416 -24.746   7.183
   16    HD2  PRO   3           HD2      PRO   3   0.324 -23.447   8.384
   17    HD3  PRO   3           HD3      PRO   3   1.786 -23.957   9.261
   18    H    THR   4           H        THR   4   3.676 -19.319   8.739
   19    HA   THR   4           HA       THR   4   3.334 -18.004   6.142
   20    HB   THR   4           HB       THR   4   1.968 -16.199   7.188
   21   HG21  THR   4          HG21      THR   4  -0.055 -17.324   6.895
   22   HG22  THR   4          HG22      THR   4   0.533 -18.790   7.680
   23   HG23  THR   4          HG23      THR   4   1.065 -18.391   6.046
   24    H    THR   5           H        THR   5   4.593 -16.180   5.883
   25    HA   THR   5           HA       THR   5   6.553 -15.697   8.035
   26    HB   THR   5           HB       THR   5   7.983 -14.765   6.244
   27   HG21  THR   5          HG21      THR   5   8.744 -16.853   5.859
   28   HG22  THR   5          HG22      THR   5   7.311 -17.259   4.914
   29   HG23  THR   5          HG23      THR   5   7.296 -17.451   6.667
   30    H    THR   6           H        THR   6   6.904 -13.666   8.834
   31    HA   THR   6           HA       THR   6   4.934 -11.616   8.048
   32    HB   THR   6           HB       THR   6   5.341 -10.627  10.248
   33   HG21  THR   6          HG21      THR   6   4.044 -12.146  11.364
   34   HG22  THR   6          HG22      THR   6   5.116 -13.493  10.981
   35   HG23  THR   6          HG23      THR   6   3.965 -12.913   9.778
   36    H    THR   7           H        THR   7   5.579  -9.793   7.083
   37    HA   THR   7           HA       THR   7   8.471  -9.345   6.766
   38    HB   THR   7           HB       THR   7   7.870  -7.954   4.856
   39   HG21  THR   7          HG21      THR   7   7.850 -10.550   4.761
   40   HG22  THR   7          HG22      THR   7   7.122  -9.666   3.420
   41   HG23  THR   7          HG23      THR   7   6.097 -10.383   4.663
   42    H    LYS   8           H        LYS   8   9.440  -7.768   7.860
   43    HA   LYS   8           HA       LYS   8   9.715  -6.006   9.323
   44    HB2  LYS   8           HB2      LYS   8   8.602  -5.101   6.914
   45    HB3  LYS   8           HB3      LYS   8   7.699  -4.273   8.183
   46    HG2  LYS   8           HG2      LYS   8   9.883  -3.639   9.244
   47    HG3  LYS   8           HG3      LYS   8  10.710  -4.333   7.850
   48    HD2  LYS   8           HD2      LYS   8   9.725  -2.742   6.356
   49    HD3  LYS   8           HD3      LYS   8   8.594  -2.187   7.591
   50    HE2  LYS   8           HE2      LYS   8  10.402  -0.567   7.400
   51    HE3  LYS   8           HE3      LYS   8  10.542  -1.397   8.951
   52    HZ1  LYS   8           HZ1      LYS   8  12.488  -1.185   7.042
   53    HZ2  LYS   8           HZ2      LYS   8  11.922  -2.779   6.873
   54    HZ3  LYS   8           HZ3      LYS   8  12.500  -2.233   8.375
   55    H    LYS   9           H        LYS   9   8.272  -4.181  10.523
   56    HA   LYS   9           HA       LYS   9   5.647  -4.857  11.313
   57    HB2  LYS   9           HB2      LYS   9   7.579  -6.549  12.447
   58    HB3  LYS   9           HB3      LYS   9   7.154  -5.403  13.719
   59    HG2  LYS   9           HG2      LYS   9   5.182  -7.030  12.087
   60    HG3  LYS   9           HG3      LYS   9   5.650  -7.361  13.754
   61    HD2  LYS   9           HD2      LYS   9   4.938  -4.721  13.910
   62    HD3  LYS   9           HD3      LYS   9   3.811  -5.314  12.690
   63    HE2  LYS   9           HE2      LYS   9   4.241  -6.512  15.443
   64    HE3  LYS   9           HE3      LYS   9   2.840  -5.573  14.930
   65    HZ1  LYS   9           HZ1      LYS   9   2.518  -8.016  14.842
   66    HZ2  LYS   9           HZ2      LYS   9   3.707  -8.095  13.630
   67    HZ3  LYS   9           HZ3      LYS   9   2.264  -7.241  13.355
   68    HA   PRO  10           HA       PRO  10   7.984  -0.770  12.436
   69    HB2  PRO  10           HB2      PRO  10   5.806   0.538  11.079
   70    HB3  PRO  10           HB3      PRO  10   7.522   0.532  10.644
   71    HG2  PRO  10           HG2      PRO  10   5.318  -1.033   9.541
   72    HG3  PRO  10           HG3      PRO  10   6.914  -0.691   8.858
   73    HD2  PRO  10           HD2      PRO  10   6.181  -3.163   9.785
   74    HD3  PRO  10           HD3      PRO  10   7.862  -2.583   9.785
   75    HN1  NH2  11           HN1      NH2  11   4.127  -1.324  13.060
   76    HN2  NH2  11           HN2      NH2  11   4.359   0.315  12.685
   77    H1   A2G 101           H1       A2G  12   2.761 -15.341   9.114
   78    H2   A2G 101           H2       A2G  12   2.073 -14.954  11.440
   79    HN2  A2G 101           HN2      A2G  12   3.333 -17.613  11.102
   80    H3   A2G 101           H3       A2G  12   0.770 -17.684  11.248
   81    HO3  A2G 101           HO3      A2G  12   0.726 -17.534  13.324
   82    H4   A2G 101           H4       A2G  12  -1.350 -16.506  11.401
   83    HO4  A2G 101           HO4      A2G  12  -1.456 -14.374  11.702
   84    H5   A2G 101           H5       A2G  12  -0.452 -16.819   9.137
   85    H6   A2G 101           H6       A2G  12  -1.420 -13.986   9.077
   86    H8   A2G 101           H8       A2G  12   5.105 -17.881  12.911
   87    H8A  A2G 101           H8A      A2G  12   6.089 -16.424  13.047
   88    H8B  A2G 101           H8B      A2G  12   5.901 -17.219  11.484
   89    H14  A2G 101           H14      A2G  12  -1.919 -15.360   8.089
   90    H15  A2G 101           H15      A2G  12  -2.489 -15.007  10.845
   91    H1   A2G 102           H1       A2G  13   6.864 -13.023   5.151
   92    H2   A2G 102           H2       A2G  13   6.488 -12.356   2.815
   93    HN2  A2G 102           HN2      A2G  13   4.310 -14.095   3.814
   94    H3   A2G 102           H3       A2G  13   6.001 -15.304   2.310
   95    HO3  A2G 102           HO3      A2G  13   6.394 -13.596   0.222
   96    H4   A2G 102           H4       A2G  13   8.059 -15.259   1.020
   97    HO4  A2G 102           HO4      A2G  13   9.317 -13.185   1.408
   98    H5   A2G 102           H5       A2G  13   8.300 -15.749   3.413
   99    H6   A2G 102           H6       A2G  13  10.553 -13.843   2.912
  100    H8   A2G 102           H8       A2G  13   1.996 -12.598   3.079
  101    H8A  A2G 102           H8A      A2G  13   2.282 -11.216   4.135
  102    H8B  A2G 102           H8B      A2G  13   2.540 -12.853   4.737
  103    H14  A2G 102           H14      A2G  13  10.604 -15.515   3.472
  104    H15  A2G 102           H15      A2G  13  10.069 -16.175   1.374
  105    H1   A2G 103           H1       A2G  14   7.547  -9.953  10.562
  106    H2   A2G 103           H2       A2G  14   9.241 -10.198  12.325
  107    HN2  A2G 103           HN2      A2G  14   9.430 -12.363  10.313
  108    H3   A2G 103           H3       A2G  14   8.282 -13.068  12.503
  109    HO3  A2G 103           HO3      A2G  14  10.487 -11.690  13.332
  110    H4   A2G 103           H4       A2G  14   7.423 -12.476  14.698
  111    HO4  A2G 103           HO4      A2G  14   8.175  -9.814  14.100
  112    H5   A2G 103           H5       A2G  14   5.891 -12.124  12.811
  113    H6   A2G 103           H6       A2G  14   5.294  -9.630  14.231
  114    H8   A2G 103           H8       A2G  14  12.390 -12.182   9.763
  115    H8A  A2G 103           H8A      A2G  14  12.101 -10.712   8.832
  116    H8B  A2G 103           H8B      A2G  14  10.975 -12.065   8.717
  117    H14  A2G 103           H14      A2G  14   4.365 -11.128  14.160
  118    H15  A2G 103           H15      A2G  14   6.700 -10.765  15.723
  119    H1   A2G 104           H1       A2G  15   6.684  -6.129   5.588
  120    H2   A2G 104           H2       A2G  15   4.637  -4.902   5.001
  121    HN2  A2G 104           HN2      A2G  15   4.104  -7.057   6.960
  122    H3   A2G 104           H3       A2G  15   3.422  -7.641   4.550
  123    HO3  A2G 104           HO3      A2G  15   2.214  -5.658   5.346
  124    H4   A2G 104           H4       A2G  15   3.346  -7.043   2.195
  125    HO4  A2G 104           HO4      A2G  15   4.581  -5.056   1.655
  126    H5   A2G 104           H5       A2G  15   5.409  -8.130   2.965
  127    H6   A2G 104           H6       A2G  15   6.410  -5.926   1.196
  128    H8   A2G 104           H8       A2G  15   2.484  -5.635   8.857
  129    H8A  A2G 104           H8A      A2G  15   3.771  -4.599   9.473
  130    H8B  A2G 104           H8B      A2G  15   4.083  -6.309   9.174
  131    H14  A2G 104           H14      A2G  15   6.666  -7.666   1.064
  132    H15  A2G 104           H15      A2G  15   5.065  -7.668  -0.265
  Start of MODEL   13
    1    H1   ACE   1           H1       ACE   1  -1.117 -19.485  11.550
    2    H2   ACE   1           H2       ACE   1  -0.217 -20.334  12.807
    3    H3   ACE   1           H3       ACE   1  -1.721 -21.013  12.188
    4    HA   PRO   2           HA       PRO   2   0.046 -23.447   9.010
    5    HB2  PRO   2           HB2      PRO   2  -0.723 -21.865   6.727
    6    HB3  PRO   2           HB3      PRO   2  -1.470 -23.352   7.329
    7    HG2  PRO   2           HG2      PRO   2  -2.297 -20.570   7.693
    8    HG3  PRO   2           HG3      PRO   2  -3.235 -22.061   7.864
    9    HD2  PRO   2           HD2      PRO   2  -2.497 -20.534  10.002
   10    HD3  PRO   2           HD3      PRO   2  -2.706 -22.297  10.108
   11    HA   PRO   3           HA       PRO   3   4.055 -22.079   7.863
   12    HB2  PRO   3           HB2      PRO   3   3.864 -22.665   5.051
   13    HB3  PRO   3           HB3      PRO   3   4.668 -23.608   6.314
   14    HG2  PRO   3           HG2      PRO   3   2.079 -24.031   5.048
   15    HG3  PRO   3           HG3      PRO   3   3.068 -25.149   5.996
   16    HD2  PRO   3           HD2      PRO   3   0.706 -24.062   6.896
   17    HD3  PRO   3           HD3      PRO   3   2.010 -24.614   7.969
   18    H    THR   4           H        THR   4   3.911 -19.846   8.109
   19    HA   THR   4           HA       THR   4   3.670 -18.330   5.611
   20    HB   THR   4           HB       THR   4   2.255 -16.621   6.745
   21   HG21  THR   4          HG21      THR   4   1.421 -18.714   5.381
   22   HG22  THR   4          HG22      THR   4   0.257 -17.707   6.241
   23   HG23  THR   4          HG23      THR   4   0.796 -19.231   6.946
   24    H    THR   5           H        THR   5   4.750 -16.312   5.654
   25    HA   THR   5           HA       THR   5   6.741 -16.107   7.821
   26    HB   THR   5           HB       THR   5   8.082 -14.805   6.205
   27   HG21  THR   5          HG21      THR   5   7.520 -17.555   6.146
   28   HG22  THR   5          HG22      THR   5   8.927 -16.755   5.448
   29   HG23  THR   5          HG23      THR   5   7.498 -17.049   4.456
   30    H    THR   6           H        THR   6   7.012 -14.230   8.959
   31    HA   THR   6           HA       THR   6   4.919 -12.187   8.582
   32    HB   THR   6           HB       THR   6   5.269 -11.593  10.919
   33   HG21  THR   6          HG21      THR   6   4.332 -13.487  11.879
   34   HG22  THR   6          HG22      THR   6   5.429 -14.584  11.039
   35   HG23  THR   6          HG23      THR   6   4.079 -13.851  10.172
   36    H    THR   7           H        THR   7   5.446 -10.181   7.932
   37    HA   THR   7           HA       THR   7   8.310  -9.561   7.644
   38    HB   THR   7           HB       THR   7   7.549  -7.821   6.059
   39   HG21  THR   7          HG21      THR   7   6.093 -10.352   5.339
   40   HG22  THR   7          HG22      THR   7   7.850 -10.351   5.483
   41   HG23  THR   7          HG23      THR   7   7.061  -9.301   4.307
   42    H    LYS   8           H        LYS   8   9.116  -7.489   8.239
   43    HA   LYS   8           HA       LYS   8   7.967  -6.497  10.704
   44    HB2  LYS   8           HB2      LYS   8  10.528  -6.317   9.305
   45    HB3  LYS   8           HB3      LYS   8  10.034  -4.787  10.029
   46    HG2  LYS   8           HG2      LYS   8   9.940  -7.394  11.555
   47    HG3  LYS   8           HG3      LYS   8  11.371  -6.362  11.539
   48    HD2  LYS   8           HD2      LYS   8  10.438  -4.875  12.963
   49    HD3  LYS   8           HD3      LYS   8   8.915  -4.864  12.073
   50    HE2  LYS   8           HE2      LYS   8   9.724  -7.150  13.881
   51    HE3  LYS   8           HE3      LYS   8   8.795  -5.766  14.458
   52    HZ1  LYS   8           HZ1      LYS   8   7.376  -7.619  13.774
   53    HZ2  LYS   8           HZ2      LYS   8   8.006  -7.525  12.200
   54    HZ3  LYS   8           HZ3      LYS   8   7.099  -6.235  12.834
   55    H    LYS   9           H        LYS   9   6.654  -4.803  10.917
   56    HA   LYS   9           HA       LYS   9   5.554  -3.450   8.695
   57    HB2  LYS   9           HB2      LYS   9   4.052  -2.816  10.232
   58    HB3  LYS   9           HB3      LYS   9   5.028  -3.630  11.455
   59    HG2  LYS   9           HG2      LYS   9   6.393  -1.558  11.700
   60    HG3  LYS   9           HG3      LYS   9   5.322  -0.750  10.555
   61    HD2  LYS   9           HD2      LYS   9   4.101  -2.127  12.918
   62    HD3  LYS   9           HD3      LYS   9   4.889  -0.569  13.166
   63    HE2  LYS   9           HE2      LYS   9   2.710  -1.119  11.130
   64    HE3  LYS   9           HE3      LYS   9   2.480  -0.291  12.670
   65    HZ1  LYS   9           HZ1      LYS   9   2.760   1.369  11.038
   66    HZ2  LYS   9           HZ2      LYS   9   4.112   0.595  10.361
   67    HZ3  LYS   9           HZ3      LYS   9   4.222   1.312  11.897
   68    HA   PRO  10           HA       PRO  10   8.191  -0.164   7.560
   69    HB2  PRO  10           HB2      PRO  10   6.362   1.970   8.194
   70    HB3  PRO  10           HB3      PRO  10   6.741   1.287   6.605
   71    HG2  PRO  10           HG2      PRO  10   4.446   0.796   8.343
   72    HG3  PRO  10           HG3      PRO  10   4.640   0.488   6.610
   73    HD2  PRO  10           HD2      PRO  10   4.539  -1.508   8.486
   74    HD3  PRO  10           HD3      PRO  10   5.413  -1.663   6.946
   75    HN1  NH2  11           HN1      NH2  11   9.957   1.117   9.788
   76    HN2  NH2  11           HN2      NH2  11   9.070   2.299   8.952
   77    H1   A2G 101           H1       A2G  12   2.780 -15.869   8.813
   78    H2   A2G 101           H2       A2G  12   1.903 -15.731  11.081
   79    HN2  A2G 101           HN2      A2G  12   3.287 -18.313  10.655
   80    H3   A2G 101           H3       A2G  12   0.717 -18.469  10.558
   81    HO3  A2G 101           HO3      A2G  12  -0.108 -18.184  12.626
   82    H4   A2G 101           H4       A2G  12  -1.445 -17.340  10.689
   83    HO4  A2G 101           HO4      A2G  12   0.122 -15.350  11.636
   84    H5   A2G 101           H5       A2G  12  -0.394 -17.514   8.479
   85    H6   A2G 101           H6       A2G  12  -1.406 -14.708   8.458
   86    H8   A2G 101           H8       A2G  12   4.973 -18.366  13.030
   87    H8A  A2G 101           H8A      A2G  12   6.031 -17.070  12.470
   88    H8B  A2G 101           H8B      A2G  12   5.489 -18.314  11.343
   89    H14  A2G 101           H14      A2G  12  -1.861 -16.072   7.437
   90    H15  A2G 101           H15      A2G  12  -2.819 -15.298   9.919
   91    H1   A2G 102           H1       A2G  13   6.828 -12.947   5.445
   92    H2   A2G 102           H2       A2G  13   6.401 -11.918   3.253
   93    HN2  A2G 102           HN2      A2G  13   4.333 -13.922   3.943
   94    H3   A2G 102           H3       A2G  13   6.086 -14.767   2.269
   95    HO3  A2G 102           HO3      A2G  13   5.537 -13.844   0.404
   96    H4   A2G 102           H4       A2G  13   8.123 -14.379   1.001
   97    HO4  A2G 102           HO4      A2G  13   7.927 -12.168   0.679
   98    H5   A2G 102           H5       A2G  13   8.427 -15.245   3.276
   99    H6   A2G 102           H6       A2G  13  10.563 -13.187   3.225
  100    H8   A2G 102           H8       A2G  13   1.907 -12.294   3.499
  101    H8A  A2G 102           H8A      A2G  13   2.218 -11.316   4.933
  102    H8B  A2G 102           H8B      A2G  13   2.498 -13.057   4.976
  103    H14  A2G 102           H14      A2G  13  10.698 -14.944   3.268
  104    H15  A2G 102           H15      A2G  13  10.699 -13.243   1.143
  105    H1   A2G 103           H1       A2G  14   7.424 -10.696  11.123
  106    H2   A2G 103           H2       A2G  14   9.284 -10.910  12.714
  107    HN2  A2G 103           HN2      A2G  14   9.518 -12.862  10.498
  108    H3   A2G 103           H3       A2G  14   8.642 -13.871  12.686
  109    HO3  A2G 103           HO3      A2G  14  10.216 -13.109  14.660
  110    H4   A2G 103           H4       A2G  14   7.924 -13.576  14.989
  111    HO4  A2G 103           HO4      A2G  14   9.018 -11.066  14.554
  112    H5   A2G 103           H5       A2G  14   6.205 -13.228  13.270
  113    H6   A2G 103           H6       A2G  14   5.534 -10.948  15.013
  114    H8   A2G 103           H8       A2G  14  12.435 -12.292   9.862
  115    H8A  A2G 103           H8A      A2G  14  11.895 -10.875   8.960
  116    H8B  A2G 103           H8B      A2G  14  10.972 -12.375   8.881
  117    H14  A2G 103           H14      A2G  14   4.687 -12.478  14.792
  118    H15  A2G 103           H15      A2G  14   6.275 -13.453  16.117
  119    H1   A2G 104           H1       A2G  15   6.103  -6.349   7.151
  120    H2   A2G 104           H2       A2G  15   3.925  -5.305   6.723
  121    HN2  A2G 104           HN2      A2G  15   3.612  -7.898   8.120
  122    H3   A2G 104           H3       A2G  15   3.105  -8.008   5.622
  123    HO3  A2G 104           HO3      A2G  15   1.507  -6.694   6.687
  124    H4   A2G 104           H4       A2G  15   3.029  -6.927   3.447
  125    HO4  A2G 104           HO4      A2G  15   2.544  -4.826   4.326
  126    H5   A2G 104           H5       A2G  15   5.188  -7.901   4.102
  127    H6   A2G 104           H6       A2G  15   5.969  -5.275   2.891
  128    H8   A2G 104           H8       A2G  15   1.813  -6.942  10.164
  129    H8A  A2G 104           H8A      A2G  15   3.032  -6.140  11.153
  130    H8B  A2G 104           H8B      A2G  15   3.357  -7.737  10.477
  131    H14  A2G 104           H14      A2G  15   6.424  -6.908   2.405
  132    H15  A2G 104           H15      A2G  15   4.682  -7.063   1.230
  Start of MODEL   14
    1    H1   ACE   1           H1       ACE   1  -4.283 -23.644   8.161
    2    H2   ACE   1           H2       ACE   1  -3.911 -21.926   8.016
    3    H3   ACE   1           H3       ACE   1  -4.043 -22.669   9.610
    4    HA   PRO   2           HA       PRO   2   0.070 -24.288   7.731
    5    HB2  PRO   2           HB2      PRO   2   0.660 -22.837   5.312
    6    HB3  PRO   2           HB3      PRO   2   0.338 -24.567   5.501
    7    HG2  PRO   2           HG2      PRO   2  -1.308 -22.757   4.217
    8    HG3  PRO   2           HG3      PRO   2  -1.793 -24.350   4.816
    9    HD2  PRO   2           HD2      PRO   2  -2.296 -21.660   6.003
   10    HD3  PRO   2           HD3      PRO   2  -3.277 -23.141   6.096
   11    HA   PRO   3           HA       PRO   3   2.819 -21.342   9.475
   12    HB2  PRO   3           HB2      PRO   3   4.863 -21.472   7.448
   13    HB3  PRO   3           HB3      PRO   3   4.852 -22.239   9.043
   14    HG2  PRO   3           HG2      PRO   3   4.254 -23.383   6.421
   15    HG3  PRO   3           HG3      PRO   3   4.689 -24.191   7.935
   16    HD2  PRO   3           HD2      PRO   3   2.177 -24.301   6.857
   17    HD3  PRO   3           HD3      PRO   3   2.486 -24.411   8.606
   18    H    THR   4           H        THR   4   3.602 -19.178   9.237
   19    HA   THR   4           HA       THR   4   3.107 -17.832   6.680
   20    HB   THR   4           HB       THR   4   1.797 -16.047   7.797
   21   HG21  THR   4          HG21      THR   4   0.830 -18.274   6.770
   22   HG22  THR   4          HG22      THR   4  -0.232 -17.182   7.660
   23   HG23  THR   4          HG23      THR   4   0.409 -18.625   8.446
   24    H    THR   5           H        THR   5   4.513 -16.198   6.292
   25    HA   THR   5           HA       THR   5   6.462 -15.594   8.423
   26    HB   THR   5           HB       THR   5   8.005 -14.993   6.651
   27   HG21  THR   5          HG21      THR   5   8.485 -17.168   6.318
   28   HG22  THR   5          HG22      THR   5   7.071 -17.366   5.281
   29   HG23  THR   5          HG23      THR   5   6.919 -17.566   7.027
   30    H    THR   6           H        THR   6   6.895 -13.510   9.026
   31    HA   THR   6           HA       THR   6   5.015 -11.470   8.026
   32    HB   THR   6           HB       THR   6   5.381 -10.311  10.128
   33   HG21  THR   6          HG21      THR   6   4.283 -11.822  11.555
   34   HG22  THR   6          HG22      THR   6   5.148 -13.212  10.899
   35   HG23  THR   6          HG23      THR   6   3.881 -12.434   9.951
   36    H    THR   7           H        THR   7   5.795  -9.301   7.700
   37    HA   THR   7           HA       THR   7   8.700  -9.043   7.309
   38    HB   THR   7           HB       THR   7   8.381  -8.069   5.090
   39   HG21  THR   7          HG21      THR   7   6.850 -10.676   5.223
   40   HG22  THR   7          HG22      THR   7   8.602 -10.583   5.406
   41   HG23  THR   7          HG23      THR   7   7.844 -10.079   3.895
   42    H    LYS   8           H        LYS   8   9.402  -7.244   8.250
   43    HA   LYS   8           HA       LYS   8   9.500  -5.054   8.965
   44    HB2  LYS   8           HB2      LYS   8   8.094  -4.794   6.708
   45    HB3  LYS   8           HB3      LYS   8   6.821  -4.377   7.856
   46    HG2  LYS   8           HG2      LYS   8   8.322  -2.692   8.887
   47    HG3  LYS   8           HG3      LYS   8   9.560  -3.085   7.694
   48    HD2  LYS   8           HD2      LYS   8   8.268  -2.235   5.901
   49    HD3  LYS   8           HD3      LYS   8   6.786  -2.241   6.858
   50    HE2  LYS   8           HE2      LYS   8   8.155   0.009   6.453
   51    HE3  LYS   8           HE3      LYS   8   7.341  -0.301   7.986
   52    HZ1  LYS   8           HZ1      LYS   8  10.051  -1.333   7.691
   53    HZ2  LYS   8           HZ2      LYS   8   9.281  -0.675   9.054
   54    HZ3  LYS   8           HZ3      LYS   8   9.889   0.349   7.842
   55    H    LYS   9           H        LYS   9   8.341  -3.551  10.473
   56    HA   LYS   9           HA       LYS   9   7.245  -4.988  12.643
   57    HB2  LYS   9           HB2      LYS   9   7.669  -2.117  11.975
   58    HB3  LYS   9           HB3      LYS   9   6.528  -2.491  13.268
   59    HG2  LYS   9           HG2      LYS   9   8.238  -3.826  14.420
   60    HG3  LYS   9           HG3      LYS   9   9.381  -3.509  13.114
   61    HD2  LYS   9           HD2      LYS   9   9.140  -1.053  13.583
   62    HD3  LYS   9           HD3      LYS   9   8.156  -1.466  14.987
   63    HE2  LYS   9           HE2      LYS   9  11.002  -2.409  14.528
   64    HE3  LYS   9           HE3      LYS   9  10.536  -1.087  15.598
   65    HZ1  LYS   9           HZ1      LYS   9   8.980  -3.391  16.132
   66    HZ2  LYS   9           HZ2      LYS   9  10.008  -2.528  17.174
   67    HZ3  LYS   9           HZ3      LYS   9  10.629  -3.780  16.208
   68    HA   PRO  10           HA       PRO  10   2.960  -5.519  12.006
   69    HB2  PRO  10           HB2      PRO  10   2.093  -3.921  14.241
   70    HB3  PRO  10           HB3      PRO  10   2.196  -5.684  14.130
   71    HG2  PRO  10           HG2      PRO  10   4.027  -3.788  15.388
   72    HG3  PRO  10           HG3      PRO  10   3.865  -5.534  15.630
   73    HD2  PRO  10           HD2      PRO  10   6.001  -4.390  14.348
   74    HD3  PRO  10           HD3      PRO  10   5.427  -6.038  14.003
   75    HN1  NH2  11           HN1      NH2  11   1.563  -2.891  10.313
   76    HN2  NH2  11           HN2      NH2  11   2.773  -4.042  10.012
   77    H1   A2G 101           H1       A2G  12   2.781 -15.180   9.663
   78    H2   A2G 101           H2       A2G  12   2.229 -14.720  12.003
   79    HN2  A2G 101           HN2      A2G  12   3.339 -17.445  11.687
   80    H3   A2G 101           H3       A2G  12   0.799 -17.393  11.959
   81    HO3  A2G 101           HO3      A2G  12   0.440 -15.553  13.978
   82    H4   A2G 101           H4       A2G  12  -1.260 -16.120  12.168
   83    HO4  A2G 101           HO4      A2G  12   0.562 -14.017  12.413
   84    H5   A2G 101           H5       A2G  12  -0.476 -16.551   9.879
   85    H6   A2G 101           H6       A2G  12  -1.342 -13.692   9.738
   86    H8   A2G 101           H8       A2G  12   5.351 -17.623  13.295
   87    H8A  A2G 101           H8A      A2G  12   6.412 -16.231  13.078
   88    H8B  A2G 101           H8B      A2G  12   5.947 -17.209  11.686
   89    H14  A2G 101           H14      A2G  12  -1.954 -15.092   8.858
   90    H15  A2G 101           H15      A2G  12  -3.011 -13.989  10.958
   91    H1   A2G 102           H1       A2G  13   7.206 -13.135   5.549
   92    H2   A2G 102           H2       A2G  13   6.900 -12.368   3.236
   93    HN2  A2G 102           HN2      A2G  13   4.501 -13.791   4.232
   94    H3   A2G 102           H3       A2G  13   5.974 -15.198   2.674
   95    HO3  A2G 102           HO3      A2G  13   6.376 -12.926   1.025
   96    H4   A2G 102           H4       A2G  13   8.000 -15.430   1.354
   97    HO4  A2G 102           HO4      A2G  13   9.175 -13.764   0.847
   98    H5   A2G 102           H5       A2G  13   8.190 -16.007   3.734
   99    H6   A2G 102           H6       A2G  13  10.730 -14.553   3.487
  100    H8   A2G 102           H8       A2G  13   2.527 -11.645   3.208
  101    H8A  A2G 102           H8A      A2G  13   2.849 -10.821   4.735
  102    H8B  A2G 102           H8B      A2G  13   2.713 -12.580   4.692
  103    H14  A2G 102           H14      A2G  13  10.436 -16.291   3.561
  104    H15  A2G 102           H15      A2G  13   9.960 -14.680   1.278
  105    H1   A2G 103           H1       A2G  14   7.578  -9.618  10.226
  106    H2   A2G 103           H2       A2G  14   9.427  -9.616  11.844
  107    HN2  A2G 103           HN2      A2G  14   9.435 -12.061  10.170
  108    H3   A2G 103           H3       A2G  14   8.494 -12.415  12.539
  109    HO3  A2G 103           HO3      A2G  14  10.806 -11.711  12.624
  110    H4   A2G 103           H4       A2G  14   7.842 -11.488  14.689
  111    HO4  A2G 103           HO4      A2G  14   8.308  -9.482  15.248
  112    H5   A2G 103           H5       A2G  14   6.142 -11.409  12.919
  113    H6   A2G 103           H6       A2G  14   5.926  -8.709  14.207
  114    H8   A2G 103           H8       A2G  14  12.149 -12.271   9.580
  115    H8A  A2G 103           H8A      A2G  14  12.364 -10.848   8.559
  116    H8B  A2G 103           H8B      A2G  14  10.967 -11.900   8.324
  117    H14  A2G 103           H14      A2G  14   4.695  -9.958  14.019
  118    H15  A2G 103           H15      A2G  14   6.203 -11.191  15.491
  119    H1   A2G 104           H1       A2G  15   7.038  -6.262   5.222
  120    H2   A2G 104           H2       A2G  15   5.027  -5.295   4.186
  121    HN2  A2G 104           HN2      A2G  15   4.339  -7.072   6.454
  122    H3   A2G 104           H3       A2G  15   3.992  -8.142   4.143
  123    HO3  A2G 104           HO3      A2G  15   2.657  -6.388   2.649
  124    H4   A2G 104           H4       A2G  15   4.166  -7.994   1.723
  125    HO4  A2G 104           HO4      A2G  15   4.786  -6.171   0.730
  126    H5   A2G 104           H5       A2G  15   6.171  -8.784   2.897
  127    H6   A2G 104           H6       A2G  15   7.064  -6.833   0.763
  128    H8   A2G 104           H8       A2G  15   3.311  -6.079   8.221
  129    H8A  A2G 104           H8A      A2G  15   3.111  -4.327   8.238
  130    H8B  A2G 104           H8B      A2G  15   4.688  -5.038   8.582
  131    H14  A2G 104           H14      A2G  15   7.761  -8.404   1.152
  132    H15  A2G 104           H15      A2G  15   6.386  -8.417  -0.712
  Start of MODEL   15
    1    H1   ACE   1           H1       ACE   1  -1.651 -25.746   5.236
    2    H2   ACE   1           H2       ACE   1  -2.047 -24.081   5.665
    3    H3   ACE   1           H3       ACE   1  -2.032 -25.332   6.908
    4    HA   PRO   2           HA       PRO   2   2.677 -25.174   5.554
    5    HB2  PRO   2           HB2      PRO   2   2.931 -22.771   3.986
    6    HB3  PRO   2           HB3      PRO   2   3.277 -24.438   3.500
    7    HG2  PRO   2           HG2      PRO   2   0.936 -22.785   2.943
    8    HG3  PRO   2           HG3      PRO   2   1.504 -24.251   2.130
    9    HD2  PRO   2           HD2      PRO   2  -0.733 -24.188   3.709
   10    HD3  PRO   2           HD3      PRO   2   0.259 -25.646   3.489
   11    HA   PRO   3           HA       PRO   3   3.660 -22.038   8.495
   12    HB2  PRO   3           HB2      PRO   3   6.202 -21.232   7.402
   13    HB3  PRO   3           HB3      PRO   3   5.887 -22.372   8.719
   14    HG2  PRO   3           HG2      PRO   3   6.899 -23.028   6.234
   15    HG3  PRO   3           HG3      PRO   3   6.157 -24.157   7.376
   16    HD2  PRO   3           HD2      PRO   3   5.001 -22.948   4.908
   17    HD3  PRO   3           HD3      PRO   3   4.660 -24.521   5.664
   18    H    THR   4           H        THR   4   2.999 -19.988   8.806
   19    HA   THR   4           HA       THR   4   2.870 -18.182   6.500
   20    HB   THR   4           HB       THR   4   1.344 -16.857   7.886
   21   HG21  THR   4          HG21      THR   4  -0.423 -18.279   7.579
   22   HG22  THR   4          HG22      THR   4   0.358 -19.597   8.453
   23   HG23  THR   4          HG23      THR   4   0.796 -19.270   6.776
   24    H    THR   5           H        THR   5   3.929 -16.255   6.386
   25    HA   THR   5           HA       THR   5   5.950 -15.755   8.478
   26    HB   THR   5           HB       THR   5   7.213 -14.571   6.781
   27   HG21  THR   5          HG21      THR   5   6.287 -16.916   5.198
   28   HG22  THR   5          HG22      THR   5   6.888 -17.241   6.824
   29   HG23  THR   5          HG23      THR   5   7.924 -16.438   5.644
   30    H    THR   6           H        THR   6   6.108 -13.783   9.471
   31    HA   THR   6           HA       THR   6   3.854 -11.935   9.016
   32    HB   THR   6           HB       THR   6   4.174 -11.187  11.288
   33   HG21  THR   6          HG21      THR   6   3.081 -13.478  10.791
   34   HG22  THR   6          HG22      THR   6   3.574 -13.157  12.454
   35   HG23  THR   6          HG23      THR   6   4.574 -14.175  11.417
   36    H    THR   7           H        THR   7   4.307  -9.617   9.279
   37    HA   THR   7           HA       THR   7   7.080  -8.846   8.663
   38    HB   THR   7           HB       THR   7   6.401  -7.465   6.805
   39   HG21  THR   7          HG21      THR   7   6.731  -9.958   6.442
   40   HG22  THR   7          HG22      THR   7   5.744  -9.150   5.223
   41   HG23  THR   7          HG23      THR   7   4.975 -10.116   6.483
   42    H    LYS   8           H        LYS   8   7.496  -6.558   9.001
   43    HA   LYS   8           HA       LYS   8   5.506  -4.949  10.346
   44    HB2  LYS   8           HB2      LYS   8   6.774  -4.728  12.448
   45    HB3  LYS   8           HB3      LYS   8   6.235  -6.389  12.196
   46    HG2  LYS   8           HG2      LYS   8   8.404  -6.942  12.574
   47    HG3  LYS   8           HG3      LYS   8   8.671  -6.386  10.922
   48    HD2  LYS   8           HD2      LYS   8  10.247  -5.126  12.098
   49    HD3  LYS   8           HD3      LYS   8   8.874  -4.020  12.048
   50    HE2  LYS   8           HE2      LYS   8   8.173  -4.775  14.287
   51    HE3  LYS   8           HE3      LYS   8   9.535  -5.893  14.339
   52    HZ1  LYS   8           HZ1      LYS   8  10.232  -3.986  15.482
   53    HZ2  LYS   8           HZ2      LYS   8   9.602  -2.934  14.305
   54    HZ3  LYS   8           HZ3      LYS   8  10.974  -3.876  13.962
   55    H    LYS   9           H        LYS   9   5.913  -2.845  10.002
   56    HA   LYS   9           HA       LYS   9   6.994  -1.215   8.637
   57    HB2  LYS   9           HB2      LYS   9   7.160  -0.760  11.128
   58    HB3  LYS   9           HB3      LYS   9   8.798  -1.410  11.053
   59    HG2  LYS   9           HG2      LYS   9   9.327   0.264   9.268
   60    HG3  LYS   9           HG3      LYS   9   7.725   0.965   9.503
   61    HD2  LYS   9           HD2      LYS   9   8.820   2.295  11.001
   62    HD3  LYS   9           HD3      LYS   9   8.601   0.910  12.072
   63    HE2  LYS   9           HE2      LYS   9  10.819   0.039  11.356
   64    HE3  LYS   9           HE3      LYS   9  11.042   1.479  10.363
   65    HZ1  LYS   9           HZ1      LYS   9  11.108   1.191  13.267
   66    HZ2  LYS   9           HZ2      LYS   9  10.448   2.630  12.647
   67    HZ3  LYS   9           HZ3      LYS   9  12.039   2.184  12.253
   68    HA   PRO  10           HA       PRO  10  10.473  -3.839   7.075
   69    HB2  PRO  10           HB2      PRO  10   9.353  -3.595   4.430
   70    HB3  PRO  10           HB3      PRO  10   9.495  -5.049   5.430
   71    HG2  PRO  10           HG2      PRO  10   7.131  -3.795   4.748
   72    HG3  PRO  10           HG3      PRO  10   7.346  -4.940   6.080
   73    HD2  PRO  10           HD2      PRO  10   7.129  -1.966   6.169
   74    HD3  PRO  10           HD3      PRO  10   6.646  -3.174   7.383
   75    HN1  NH2  11           HN1      NH2  11   9.871  -0.619   7.072
   76    HN2  NH2  11           HN2      NH2  11  11.409  -0.304   6.429
   77    H1   A2G 101           H1       A2G  12   2.473 -16.062   9.784
   78    H2   A2G 101           H2       A2G  12   1.968 -15.903  12.185
   79    HN2  A2G 101           HN2      A2G  12   3.381 -18.424  11.535
   80    H3   A2G 101           H3       A2G  12   0.853 -18.704  11.882
   81    HO3  A2G 101           HO3      A2G  12   1.449 -16.995  13.998
   82    H4   A2G 101           H4       A2G  12  -1.323 -17.711  12.306
   83    HO4  A2G 101           HO4      A2G  12  -1.172 -15.941  13.433
   84    H5   A2G 101           H5       A2G  12  -0.612 -17.783   9.958
   85    H6   A2G 101           H6       A2G  12  -1.818 -15.047  10.342
   86    H8   A2G 101           H8       A2G  12   5.457 -18.546  13.240
   87    H8A  A2G 101           H8A      A2G  12   6.310 -17.019  13.015
   88    H8B  A2G 101           H8B      A2G  12   5.823 -17.971  11.613
   89    H14  A2G 101           H14      A2G  12  -2.194 -16.258   9.115
   90    H15  A2G 101           H15      A2G  12  -2.790 -17.539  11.154
   91    H1   A2G 102           H1       A2G  13   6.081 -12.685   6.087
   92    H2   A2G 102           H2       A2G  13   5.506 -11.590   3.963
   93    HN2  A2G 102           HN2      A2G  13   3.394 -13.481   4.819
   94    H3   A2G 102           H3       A2G  13   4.917 -14.391   2.965
   95    HO3  A2G 102           HO3      A2G  13   3.838 -12.242   2.255
   96    H4   A2G 102           H4       A2G  13   6.848 -14.109   1.518
   97    HO4  A2G 102           HO4      A2G  13   7.282 -11.653   2.860
   98    H5   A2G 102           H5       A2G  13   7.298 -15.039   3.745
   99    H6   A2G 102           H6       A2G  13   9.554 -13.119   3.480
  100    H8   A2G 102           H8       A2G  13   1.042 -11.750   4.528
  101    H8A  A2G 102           H8A      A2G  13   1.478 -10.756   5.918
  102    H8B  A2G 102           H8B      A2G  13   1.680 -12.507   5.988
  103    H14  A2G 102           H14      A2G  13   9.582 -14.880   3.558
  104    H15  A2G 102           H15      A2G  13   8.747 -14.881   1.410
  105    H1   A2G 103           H1       A2G  14   6.170 -10.076  11.408
  106    H2   A2G 103           H2       A2G  14   8.158  -9.974  12.850
  107    HN2  A2G 103           HN2      A2G  14   8.461 -11.995  10.706
  108    H3   A2G 103           H3       A2G  14   7.894 -12.989  13.007
  109    HO3  A2G 103           HO3      A2G  14   9.677 -11.108  14.153
  110    H4   A2G 103           H4       A2G  14   7.324 -12.656  15.346
  111    HO4  A2G 103           HO4      A2G  14   8.334 -10.845  15.942
  112    H5   A2G 103           H5       A2G  14   5.447 -12.614  13.763
  113    H6   A2G 103           H6       A2G  14   4.827 -10.322  15.587
  114    H8   A2G 103           H8       A2G  14  11.046 -11.404   9.751
  115    H8A  A2G 103           H8A      A2G  14  10.728  -9.806   9.076
  116    H8B  A2G 103           H8B      A2G  14   9.586 -11.123   8.801
  117    H14  A2G 103           H14      A2G  14   3.884 -11.776  15.260
  118    H15  A2G 103           H15      A2G  14   5.305 -12.954  16.509
  119    H1   A2G 104           H1       A2G  15   5.041  -5.833   7.576
  120    H2   A2G 104           H2       A2G  15   2.884  -4.760   7.090
  121    HN2  A2G 104           HN2      A2G  15   2.570  -7.101   8.877
  122    H3   A2G 104           H3       A2G  15   1.923  -7.558   6.429
  123    HO3  A2G 104           HO3      A2G  15   0.610  -5.104   5.996
  124    H4   A2G 104           H4       A2G  15   1.771  -6.789   4.128
  125    HO4  A2G 104           HO4      A2G  15   1.653  -4.737   3.811
  126    H5   A2G 104           H5       A2G  15   3.933  -7.735   4.809
  127    H6   A2G 104           H6       A2G  15   4.924  -5.425   3.262
  128    H8   A2G 104           H8       A2G  15   0.854  -5.793  10.983
  129    H8A  A2G 104           H8A      A2G  15   2.283  -4.961  11.596
  130    H8B  A2G 104           H8B      A2G  15   2.401  -6.638  11.064
  131    H14  A2G 104           H14      A2G  15   4.942  -7.140   2.853
  132    H15  A2G 104           H15      A2G  15   3.542  -5.984   1.491
  Start of MODEL   16
    1    H1   ACE   1           H1       ACE   1  -1.254 -24.776   3.478
    2    H2   ACE   1           H2       ACE   1  -1.532 -23.047   3.690
    3    H3   ACE   1           H3       ACE   1  -2.135 -24.192   4.889
    4    HA   PRO   2           HA       PRO   2   2.719 -24.724   5.312
    5    HB2  PRO   2           HB2      PRO   2   3.850 -22.493   3.883
    6    HB3  PRO   2           HB3      PRO   2   4.104 -24.220   3.593
    7    HG2  PRO   2           HG2      PRO   2   2.370 -22.333   2.193
    8    HG3  PRO   2           HG3      PRO   2   2.972 -23.913   1.674
    9    HD2  PRO   2           HD2      PRO   2   0.356 -23.456   2.343
   10    HD3  PRO   2           HD3      PRO   2   1.144 -25.040   2.529
   11    HA   PRO   3           HA       PRO   3   3.030 -21.960   8.700
   12    HB2  PRO   3           HB2      PRO   3   5.699 -21.007   8.180
   13    HB3  PRO   3           HB3      PRO   3   5.179 -22.220   9.359
   14    HG2  PRO   3           HG2      PRO   3   6.387 -22.583   6.727
   15    HG3  PRO   3           HG3      PRO   3   6.268 -23.715   8.080
   16    HD2  PRO   3           HD2      PRO   3   4.831 -23.995   5.765
   17    HD3  PRO   3           HD3      PRO   3   4.264 -24.596   7.340
   18    H    THR   4           H        THR   4   2.716 -19.788   9.184
   19    HA   THR   4           HA       THR   4   2.523 -17.998   6.871
   20    HB   THR   4           HB       THR   4   1.135 -16.601   8.311
   21   HG21  THR   4          HG21      THR   4   0.176 -19.345   8.998
   22   HG22  THR   4          HG22      THR   4   0.377 -18.950   7.291
   23   HG23  THR   4          HG23      THR   4  -0.710 -17.992   8.295
   24    H    THR   5           H        THR   5   3.765 -16.225   6.602
   25    HA   THR   5           HA       THR   5   5.855 -15.733   8.625
   26    HB   THR   5           HB       THR   5   7.126 -14.690   6.804
   27   HG21  THR   5          HG21      THR   5   6.212 -17.159   5.453
   28   HG22  THR   5          HG22      THR   5   6.694 -17.358   7.137
   29   HG23  THR   5          HG23      THR   5   7.832 -16.693   5.968
   30    H    THR   6           H        THR   6   6.174 -13.714   9.478
   31    HA   THR   6           HA       THR   6   4.035 -11.753   8.954
   32    HB   THR   6           HB       THR   6   4.619 -10.816  11.155
   33   HG21  THR   6          HG21      THR   6   4.476 -13.761  11.650
   34   HG22  THR   6          HG22      THR   6   3.168 -13.006  10.739
   35   HG23  THR   6          HG23      THR   6   3.535 -12.457  12.374
   36    H    THR   7           H        THR   7   4.517  -9.597   8.544
   37    HA   THR   7           HA       THR   7   7.248  -9.122   7.553
   38    HB   THR   7           HB       THR   7   6.277  -7.304   6.255
   39   HG21  THR   7          HG21      THR   7   4.246  -9.479   5.935
   40   HG22  THR   7          HG22      THR   7   5.945  -9.878   5.687
   41   HG23  THR   7          HG23      THR   7   5.179  -8.630   4.703
   42    H    LYS   8           H        LYS   8   8.595  -7.870   8.667
   43    HA   LYS   8           HA       LYS   8   7.685  -6.491  11.042
   44    HB2  LYS   8           HB2      LYS   8   9.892  -7.742  10.811
   45    HB3  LYS   8           HB3      LYS   8  10.447  -6.385   9.830
   46    HG2  LYS   8           HG2      LYS   8  11.138  -5.964  12.104
   47    HG3  LYS   8           HG3      LYS   8   9.814  -4.858  11.737
   48    HD2  LYS   8           HD2      LYS   8   8.446  -5.808  13.272
   49    HD3  LYS   8           HD3      LYS   8   8.907  -7.443  12.793
   50    HE2  LYS   8           HE2      LYS   8   9.599  -6.940  15.123
   51    HE3  LYS   8           HE3      LYS   8  10.986  -7.259  14.082
   52    HZ1  LYS   8           HZ1      LYS   8  10.196  -4.817  15.406
   53    HZ2  LYS   8           HZ2      LYS   8  10.663  -4.613  13.785
   54    HZ3  LYS   8           HZ3      LYS   8  11.731  -5.329  14.897
   55    H    LYS   9           H        LYS   9   6.261  -5.221   9.321
   56    HA   LYS   9           HA       LYS   9   6.089  -3.348   7.863
   57    HB2  LYS   9           HB2      LYS   9   5.529  -2.895  10.362
   58    HB3  LYS   9           HB3      LYS   9   7.032  -1.972  10.363
   59    HG2  LYS   9           HG2      LYS   9   6.212  -0.626   8.466
   60    HG3  LYS   9           HG3      LYS   9   4.706  -1.546   8.465
   61    HD2  LYS   9           HD2      LYS   9   3.879  -0.122   9.996
   62    HD3  LYS   9           HD3      LYS   9   5.113  -0.675  11.129
   63    HE2  LYS   9           HE2      LYS   9   6.702   0.982  10.114
   64    HE3  LYS   9           HE3      LYS   9   5.366   1.600   9.143
   65    HZ1  LYS   9           HZ1      LYS   9   4.255   2.364  11.013
   66    HZ2  LYS   9           HZ2      LYS   9   5.876   2.740  11.354
   67    HZ3  LYS   9           HZ3      LYS   9   5.144   1.389  12.078
   68    HA   PRO  10           HA       PRO  10  10.797  -3.162   7.193
   69    HB2  PRO  10           HB2      PRO  10  10.094  -3.042   4.402
   70    HB3  PRO  10           HB3      PRO  10  10.946  -4.334   5.262
   71    HG2  PRO  10           HG2      PRO  10   8.146  -4.171   4.452
   72    HG3  PRO  10           HG3      PRO  10   9.112  -5.583   4.901
   73    HD2  PRO  10           HD2      PRO  10   7.119  -4.568   6.484
   74    HD3  PRO  10           HD3      PRO  10   8.529  -5.439   7.132
   75    HN1  NH2  11           HN1      NH2  11  11.729  -1.268   5.345
   76    HN2  NH2  11           HN2      NH2  11  11.296   0.074   6.289
   77    H1   A2G 101           H1       A2G  12   2.434 -15.780  10.081
   78    H2   A2G 101           H2       A2G  12   2.157 -15.514  12.505
   79    HN2  A2G 101           HN2      A2G  12   3.406 -18.111  11.823
   80    H3   A2G 101           H3       A2G  12   0.919 -18.278  12.435
   81    HO3  A2G 101           HO3      A2G  12   1.450 -16.379  14.462
   82    H4   A2G 101           H4       A2G  12  -1.181 -17.191  12.981
   83    HO4  A2G 101           HO4      A2G  12  -0.068 -14.665  12.570
   84    H5   A2G 101           H5       A2G  12  -0.687 -17.368  10.586
   85    H6   A2G 101           H6       A2G  12  -1.699 -14.659  10.417
   86    H8   A2G 101           H8       A2G  12   5.670 -18.067  13.701
   87    H8A  A2G 101           H8A      A2G  12   6.512 -16.810  12.794
   88    H8B  A2G 101           H8B      A2G  12   5.690 -18.114  11.938
   89    H14  A2G 101           H14      A2G  12  -2.554 -16.178  10.146
   90    H15  A2G 101           H15      A2G  12  -2.702 -16.334  12.471
   91    H1   A2G 102           H1       A2G  13   5.915 -12.877   5.945
   92    H2   A2G 102           H2       A2G  13   5.367 -12.024   3.706
   93    HN2  A2G 102           HN2      A2G  13   3.276 -13.862   4.716
   94    H3   A2G 102           H3       A2G  13   4.849 -14.924   2.995
   95    HO3  A2G 102           HO3      A2G  13   4.077 -12.579   1.971
   96    H4   A2G 102           H4       A2G  13   6.814 -14.773   1.578
   97    HO4  A2G 102           HO4      A2G  13   6.697 -12.090   2.390
   98    H5   A2G 102           H5       A2G  13   7.254 -15.433   3.897
   99    H6   A2G 102           H6       A2G  13   9.409 -13.426   3.295
  100    H8   A2G 102           H8       A2G  13   0.867 -11.733   4.284
  101    H8A  A2G 102           H8A      A2G  13   1.476 -11.340   5.892
  102    H8B  A2G 102           H8B      A2G  13   1.398 -13.022   5.364
  103    H14  A2G 102           H14      A2G  13   9.565 -15.089   3.860
  104    H15  A2G 102           H15      A2G  13   9.137 -15.829   1.855
  105    H1   A2G 103           H1       A2G  14   6.868 -10.145  11.149
  106    H2   A2G 103           H2       A2G  14   8.773 -10.367  12.686
  107    HN2  A2G 103           HN2      A2G  14   8.684 -12.582  10.722
  108    H3   A2G 103           H3       A2G  14   7.820 -13.221  13.057
  109    HO3  A2G 103           HO3      A2G  14   9.673 -12.059  14.730
  110    H4   A2G 103           H4       A2G  14   7.256 -12.567  15.329
  111    HO4  A2G 103           HO4      A2G  14   8.277 -10.913  16.076
  112    H5   A2G 103           H5       A2G  14   5.498 -12.241  13.646
  113    H6   A2G 103           H6       A2G  14   5.074  -9.713  15.045
  114    H8   A2G 103           H8       A2G  14  11.686 -12.354   9.895
  115    H8A  A2G 103           H8A      A2G  14  11.090 -11.083   8.827
  116    H8B  A2G 103           H8B      A2G  14  10.133 -12.543   9.081
  117    H14  A2G 103           H14      A2G  14   4.178 -11.226  15.181
  118    H15  A2G 103           H15      A2G  14   6.729 -10.851  16.337
  119    H1   A2G 104           H1       A2G  15   5.453  -5.678   7.707
  120    H2   A2G 104           H2       A2G  15   3.415  -4.316   7.888
  121    HN2  A2G 104           HN2      A2G  15   3.193  -6.845   9.412
  122    H3   A2G 104           H3       A2G  15   1.942  -6.866   7.168
  123    HO3  A2G 104           HO3      A2G  15   1.260  -4.565   8.369
  124    H4   A2G 104           H4       A2G  15   1.391  -5.779   5.070
  125    HO4  A2G 104           HO4      A2G  15   3.119  -3.661   5.705
  126    H5   A2G 104           H5       A2G  15   3.508  -7.015   5.073
  127    H6   A2G 104           H6       A2G  15   4.654  -4.882   3.572
  128    H8   A2G 104           H8       A2G  15   2.337  -5.381  12.170
  129    H8A  A2G 104           H8A      A2G  15   4.100  -5.352  12.236
  130    H8B  A2G 104           H8B      A2G  15   3.265  -6.754  11.568
  131    H14  A2G 104           H14      A2G  15   3.756  -6.271   2.960
  132    H15  A2G 104           H15      A2G  15   2.935  -3.669   3.408